#METABOLOMICS WORKBENCH nicolofp_20210610_125247 DATATRACK_ID:2682 STUDY_ID:ST001827 ANALYSIS_ID:AN002963 VERSION 1 CREATED_ON 03-03-2022 #PROJECT PR:PROJECT_TITLE The pregnancy metabolome from a multi-ethnic pregnancy cohort PR:PROJECT_TYPE cohort study PR:PROJECT_SUMMARY The PRogramming of Intergenerational Stress Mechanisms (PRISM) study is an PR:PROJECT_SUMMARY urban, ethnically diverse pregnancy cohort that was designed to study a range of PR:PROJECT_SUMMARY chemical and non-chemical stressors in relation to maternal health, pregnancy PR:PROJECT_SUMMARY outcomes, and child development. Pregnant women were enrolled from Boston and PR:PROJECT_SUMMARY New York City hospitals and affiliated prenatal clinics beginning in 2011. PR:PROJECT_SUMMARY Eligibility criteria included English or Spanish-speaking, over 18 years of age PR:PROJECT_SUMMARY at enrollment, and singleton pregnancy. Exclusion criteria included HIV+ status PR:PROJECT_SUMMARY or self-reported drinking ?7 alcoholic drinks per week before pregnancy or any PR:PROJECT_SUMMARY alcohol after pregnancy recognition. PR:INSTITUTE Icahn School of Medicine at Mount Sinai PR:LAST_NAME Wright PR:FIRST_NAME Rosalind J PR:ADDRESS 5 E 98st FL 10th floor PR:EMAIL rosalind.wright@mssm.edu PR:PHONE (212) 241-5287 PR:FUNDING_SOURCE R01 HL095606, R01 HL114396, UG3 OD023337, P30 ES023515, UL1 TR001433 PR:DOI http://dx.doi.org/10.21228/M8J97M PR:CONTRIBUTORS Robert O Wright, Elena Colicino, Megan M Niedzwiecki #STUDY ST:STUDY_TITLE The pregnancy metabolome from a multi-ethnic pregnancy cohort ST:STUDY_SUMMARY The PRogramming of Intergenerational Stress Mechanisms (PRISM) study is an ST:STUDY_SUMMARY urban, ethnically diverse pregnancy cohort that was designed to study a range of ST:STUDY_SUMMARY chemical and non-chemical stressors in relation to maternal health, pregnancy ST:STUDY_SUMMARY outcomes, and child development. Pregnant women were enrolled from Boston and ST:STUDY_SUMMARY New York City hospitals and affiliated prenatal clinics beginning in 2011. ST:STUDY_SUMMARY Eligibility criteria included English or Spanish-speaking, over 18 years of age ST:STUDY_SUMMARY at enrollment, and singleton pregnancy. Exclusion criteria included HIV+ status ST:STUDY_SUMMARY or self-reported drinking ≥7 alcoholic drinks per week before pregnancy or any ST:STUDY_SUMMARY alcohol after pregnancy recognition ST:INSTITUTE Icahn School of Medicine at Mount Sinai ST:LAST_NAME Wright ST:FIRST_NAME Rosalind J ST:ADDRESS 5 E.98st FL 10th floor ST:EMAIL rosalind.wright@mssm.edu ST:PHONE (212) 241-5287 ST:SUBMIT_DATE 2021-06-10 #SUBJECT SU:SUBJECT_TYPE Human SU:SUBJECT_SPECIES Homo sapiens SU:TAXONOMY_ID 9606 #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS - id_358 gestage_serum:11 SUBJECT_SAMPLE_FACTORS - id_292 gestage_serum:14 SUBJECT_SAMPLE_FACTORS - id_378 gestage_serum:14 SUBJECT_SAMPLE_FACTORS - id_367 gestage_serum:16 SUBJECT_SAMPLE_FACTORS - id_217 gestage_serum:18 SUBJECT_SAMPLE_FACTORS - id_343 gestage_serum:18 SUBJECT_SAMPLE_FACTORS - id_127 gestage_serum:19 SUBJECT_SAMPLE_FACTORS - id_317 gestage_serum:19 SUBJECT_SAMPLE_FACTORS - 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id_212 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_23 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_272 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_297 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_300 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_333 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_340 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_348 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_359 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_36 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_371 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_376 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_381 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_401 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_42 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_7 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_95 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_99 gestage_serum:37 SUBJECT_SAMPLE_FACTORS - id_102 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_122 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_134 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_220 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_24 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_241 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_278 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_311 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_34 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_377 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_404 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_48 gestage_serum:38 SUBJECT_SAMPLE_FACTORS - id_11 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_26 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_27 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_316 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_363 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_391 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_394 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_43 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_52 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_67 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_80 gestage_serum:39 SUBJECT_SAMPLE_FACTORS - id_277 gestage_serum:40 SUBJECT_SAMPLE_FACTORS - id_398 gestage_serum:40 SUBJECT_SAMPLE_FACTORS - id_78 gestage_serum:40 SUBJECT_SAMPLE_FACTORS - id_81 gestage_serum:40 #COLLECTION CO:COLLECTION_SUMMARY At the time of metabolomics profiling (March 2018), 843 women had delivered a CO:COLLECTION_SUMMARY live born infant. The analytic sample includes a random subset of 410 CO:COLLECTION_SUMMARY mother-child pairs with maternal metabolomics measured during pregnancy (week of CO:COLLECTION_SUMMARY serum collection: 25th, 50th, 75th percentiles: 26, 29, 33 weeks). CO:SAMPLE_TYPE Blood (plasma) #TREATMENT TR:TREATMENT_SUMMARY Maternal blood was collected by venipuncture (mean ± standard deviation TR:TREATMENT_SUMMARY (SD): 29.6 ± 4.90 weeks) and serum aliquots were stored at −80℃ until TR:TREATMENT_SUMMARY assayed. Untargeted metabolomics analysis was conducted on 100µl of serum at TR:TREATMENT_SUMMARY Metabolon, Inc (Durham, NC, USA) with ultrahigh performance liquid TR:TREATMENT_SUMMARY chromatography-tandem mass spectroscopy (UPLC-MS/MS). The method utilized an TR:TREATMENT_SUMMARY ultra-performance liquid chromatography (UPLC) and a Thermo Scientific TR:TREATMENT_SUMMARY Q-Exactive high resolution/accurate mass spectrometer interfaced with a heated TR:TREATMENT_SUMMARY electrospray ionization (HESI-II) source and Orbitrap mass analyzer operated at TR:TREATMENT_SUMMARY 35,000 mass resolution. One aliquot was analyzed using acidic positive ion TR:TREATMENT_SUMMARY conditions, chromatographically optimized for more hydrophilic compounds; the TR:TREATMENT_SUMMARY extract compound was gradient eluted from a C18 column using water and methanol, TR:TREATMENT_SUMMARY containing 0.05% perfluoropentanoic acid (PFPA) and 0.1% formic acid (FA). TR:TREATMENT_SUMMARY Another aliquot was analyzed with the prior approach but it was TR:TREATMENT_SUMMARY chromatographically optimized for more hydrophobic compounds and operated at an TR:TREATMENT_SUMMARY overall higher organic content. A third aliquot was analyzed using basic TR:TREATMENT_SUMMARY negative ion optimized conditions using a separate dedicated C18 column. The TR:TREATMENT_SUMMARY basic extracts were gradient eluted from the column using methanol and water, TR:TREATMENT_SUMMARY however with 6.5mM Ammonium Bicarbonate at pH 8. The fourth aliquot was analyzed TR:TREATMENT_SUMMARY via negative ionization following elution from a HILIC column using a gradient TR:TREATMENT_SUMMARY consisting of water and acetonitrile with 10mM Ammonium Formate, pH 10.8. The MS TR:TREATMENT_SUMMARY analysis alternated between MS and data-dependent MSn scans using dynamic TR:TREATMENT_SUMMARY exclusion. The scan range between methods covered 70-1000 m/z. Raw data was TR:TREATMENT_SUMMARY extracted, peak-identified and QC processed using Metabolon’s hardware and TR:TREATMENT_SUMMARY software. Peaks were quantified using area-under-the-curve. Batch adjustment to TR:TREATMENT_SUMMARY correct variation resulting from instrument inter-day tuning differences was TR:TREATMENT_SUMMARY performed for each compound in run-day blocks by dividing by the median of the TR:TREATMENT_SUMMARY values for the experimental samples for each instrument run day, then TR:TREATMENT_SUMMARY multiplying these values by the original median. In one serum sample with a TR:TREATMENT_SUMMARY lower volume (65µl instead of 80µl), metabolite intensities were scaled TR:TREATMENT_SUMMARY accounting for the volume of serum available, under the assumption that TR:TREATMENT_SUMMARY metabolite signal intensities scale linearly with the sample volume. We TR:TREATMENT_SUMMARY normalized all metabolomic data using first the natural base for log-scaling, TR:TREATMENT_SUMMARY thus removing skewness of the data. We then used a Pareto scaling approach, TR:TREATMENT_SUMMARY which incorporates a scaling factor equal to the square root of the standard TR:TREATMENT_SUMMARY deviation of individual metabolites so that larger fold changes were scaled more TR:TREATMENT_SUMMARY than smaller fold changes (Grace and Hudson, 2016). A total of 1,110 TR:TREATMENT_SUMMARY biochemicals were detected across all four assays. Potential sample outliers TR:TREATMENT_SUMMARY were examined using principal component analysis (PCA), though none were TR:TREATMENT_SUMMARY identified. Final data were presented as normalized levels to facilitate both TR:TREATMENT_SUMMARY linear and non-linear analyses and to harmonize all variables on a common scale. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Following receipt, samples were inventoried and immediately stored at -80℃. SP:SAMPLEPREP_SUMMARY Each sample received was accessioned into the Metabolon LIMS system and was SP:SAMPLEPREP_SUMMARY assigned by the LIMS a unique identifier that was associated with the original SP:SAMPLEPREP_SUMMARY source identifier only. This identifier was used to track all sample handling, SP:SAMPLEPREP_SUMMARY tasks, results, etc. The samples (and all derived aliquots) were tracked by the SP:SAMPLEPREP_SUMMARY LIMS system. All portions of any sample were automatically assigned their own SP:SAMPLEPREP_SUMMARY unique identifiers by the LIMS when a new task was created; the relationship of SP:SAMPLEPREP_SUMMARY these samples was also tracked. All samples were maintained at -80℃ until SP:SAMPLEPREP_SUMMARY processed. #CHROMATOGRAPHY CH:INSTRUMENT_NAME Thermo Scientific Q-Exactive CH:COLUMN_NAME SeQuant ZIC-HILIC (150 x 4.6mm, 3.5um) CH:CHROMATOGRAPHY_TYPE HILIC #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:MS_COMMENTS Untargeted metabolomics analysis was conducted on 100µl of serum at Metabolon, MS:MS_COMMENTS Inc (Durham, NC, USA) with ultrahigh performance liquid chromatography-tandem MS:MS_COMMENTS mass spectroscopy (UPLC-MS/MS). The method utilized an ultra-performance liquid MS:MS_COMMENTS chromatography (UPLC) and a Thermo Scientific Q-Exactive high MS:MS_COMMENTS resolution/accurate mass spectrometer interfaced with a heated electrospray MS:MS_COMMENTS ionization (HESI-II) source and Orbitrap mass analyzer operated at 35,000 mass MS:MS_COMMENTS resolution. One aliquot was analyzed using acidic positive ion conditions, MS:MS_COMMENTS chromatographically optimized for more hydrophilic compounds; the extract MS:MS_COMMENTS compound was gradient eluted from a C18 column using water and methanol, MS:MS_COMMENTS containing 0.05% perfluoropentanoic acid (PFPA) and 0.1% formic acid (FA). MS:MS_COMMENTS Another aliquot was analyzed with the prior approach but it was MS:MS_COMMENTS chromatographically optimized for more hydrophobic compounds and operated at an MS:MS_COMMENTS overall higher organic content. A third aliquot was analyzed using basic MS:MS_COMMENTS negative ion optimized conditions using a separate dedicated C18 column. The MS:MS_COMMENTS basic extracts were gradient eluted from the column using methanol and water, MS:MS_COMMENTS however with 6.5mM Ammonium Bicarbonate at pH 8. The fourth aliquot was analyzed MS:MS_COMMENTS via negative ionization following elution from a HILIC column using a gradient MS:MS_COMMENTS consisting of water and acetonitrile with 10mM Ammonium Formate, pH 10.8. The MS MS:MS_COMMENTS analysis alternated between MS and data-dependent MSn scans using dynamic MS:MS_COMMENTS exclusion. The scan range between methods covered 70-1000 m/z. Raw data was MS:MS_COMMENTS extracted, peak-identified and QC processed using Metabolon’s hardware and MS:MS_COMMENTS software. Peaks were quantified using area-under-the-curve. Batch adjustment to MS:MS_COMMENTS correct variation resulting from instrument inter-day tuning differences was MS:MS_COMMENTS performed for each compound in run-day blocks by dividing by the median of the MS:MS_COMMENTS values for the experimental samples for each instrument run day, then MS:MS_COMMENTS multiplying these values by the original median. In one serum sample with a MS:MS_COMMENTS lower volume (65µl instead of 80µl), metabolite intensities were scaled MS:MS_COMMENTS accounting for the volume of serum available, under the assumption that MS:MS_COMMENTS metabolite signal intensities scale linearly with the sample volume. MS:ION_MODE UNSPECIFIED #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS pmoles/l MS_METABOLITE_DATA_START Samples id_358 id_292 id_378 id_367 id_217 id_343 id_127 id_317 id_374 id_366 id_379 id_237 id_329 id_356 id_15 id_164 id_312 id_324 id_107 id_112 id_136 id_140 id_196 id_197 id_198 id_204 id_210 id_225 id_243 id_247 id_261 id_285 id_355 id_360 id_405 id_69 id_124 id_129 id_145 id_150 id_156 id_157 id_165 id_170 id_171 id_172 id_173 id_175 id_178 id_181 id_185 id_200 id_216 id_229 id_270 id_271 id_273 id_28 id_280 id_283 id_293 id_294 id_305 id_325 id_331 id_351 id_389 id_53 id_56 id_66 id_83 id_90 id_91 id_94 id_1 id_123 id_137 id_142 id_153 id_163 id_166 id_176 id_180 id_183 id_188 id_190 id_195 id_199 id_2 id_22 id_226 id_235 id_245 id_253 id_257 id_259 id_260 id_262 id_274 id_279 id_281 id_286 id_289 id_303 id_307 id_308 id_330 id_341 id_357 id_369 id_383 id_397 id_41 id_45 id_46 id_59 id_60 id_71 id_77 id_79 id_85 id_97 id_108 id_113 id_125 id_128 id_135 id_138 id_143 id_144 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gestage_serum:19 gestage_serum:19 gestage_serum:20 gestage_serum:21 gestage_serum:21 gestage_serum:22 gestage_serum:22 gestage_serum:22 gestage_serum:23 gestage_serum:23 gestage_serum:23 gestage_serum:23 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:24 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 gestage_serum:25 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gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:33 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:34 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:35 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:36 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:37 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:38 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:39 gestage_serum:40 gestage_serum:40 gestage_serum:40 gestage_serum:40 10-heptadecenoate (17:1n7) -0.1327 -0.4097 1.1318 1.8479 0.5631 1.3377 -0.6351 -0.1741 1.0916 0.2927 1.5574 0.4178 1.8749 -0.5958 -1.2482 -1.5277 1.0372 1.5041 -0.6625 0.5185 -0.4647 -0.7586 -0.6615 -1.3204 0.6046 -0.2422 0.1639 -0.0570 -0.8300 -0.1587 -1.5397 -1.3135 -0.8099 0.4969 1.3092 0.8050 -0.7545 -0.6490 -1.1543 0.0392 -0.6897 -1.6981 -0.5010 1.2787 1.5195 0.2237 -0.6213 -1.7719 -1.3100 0.1468 -0.6656 0.0322 -0.8370 2.2670 -0.4573 0.3472 -1.2517 2.4000 -0.4979 1.4770 -1.4097 -0.0743 -1.0636 -0.7061 -0.3584 -0.1670 0.4732 0.5246 0.1297 -1.4907 1.9567 -1.1432 0.0606 -0.4577 1.0121 0.7221 -2.1094 -0.7542 0.5708 -1.6959 0.5100 -0.1118 -0.4482 1.9704 0.7788 -1.4285 -0.9714 1.0636 0.2591 -1.8640 0.3814 -1.1030 -0.6075 -0.6277 -0.0159 -1.0711 -0.2536 -0.4086 -0.9928 0.2563 -0.9915 -0.6406 -1.6020 -1.1749 -0.6713 -0.1912 0.5512 -0.2650 1.5782 -1.4308 -0.9595 -1.0055 -1.2985 1.6902 1.0025 -0.7879 -0.8696 -1.3160 0.6202 1.3318 -0.4022 1.7612 -0.8526 3.6474 0.0501 0.1980 -0.0187 0.0487 0.1059 0.5388 0.7145 0.3338 -0.1671 -1.2478 -0.9953 -0.3113 0.0956 -0.2936 -0.4559 -2.1410 0.4743 -0.9829 0.1598 -0.4966 0.3530 0.1916 1.5645 0.2569 -0.9405 -0.9753 -1.0350 0.2346 -0.3953 0.0796 -0.1464 -1.2675 1.4673 0.0170 -0.4134 0.6256 -0.7826 0.0284 -0.1055 1.4940 -0.1821 -0.2078 -0.9478 -1.7374 0.4230 0.0133 0.0798 -0.1240 -0.0499 -0.8218 0.2714 1.4780 1.1515 -1.1114 0.2170 -1.8561 -1.0083 -0.0153 -0.6740 0.5915 -1.9386 -0.1972 -1.4343 0.2376 -1.1615 -1.3109 0.1192 0.8705 -1.0715 0.7115 0.0707 1.2770 0.7766 -0.1082 1.2694 0.9614 -0.8360 -1.2926 -0.7413 -1.3017 0.2472 1.4260 1.1239 -0.7650 -0.2497 -2.2549 -0.7559 -1.1701 -1.3608 -1.7992 1.0367 -1.2056 -0.1622 0.1755 0.7713 0.2443 1.5950 0.4977 0.2408 -0.0305 -0.5573 0.2442 0.5381 0.2385 -1.2459 1.3142 -0.6750 -0.3463 -0.8748 -0.1743 0.4494 -0.2779 -0.7328 1.7650 -0.8498 0.4371 1.5310 0.1992 0.2025 -0.2215 -0.5504 -0.1398 0.7614 -0.4022 -0.5814 -0.0077 1.7360 0.7585 -1.5193 0.7733 0.3334 -1.5422 -0.1507 0.4499 1.6174 -0.3042 -0.0439 -1.7595 -0.0041 0.5502 0.9096 1.2301 -0.0285 -0.6476 -0.0009 0.1966 -0.0050 -1.2308 -0.1696 0.8685 0.1947 -0.6221 2.5939 -0.6041 0.5491 0.8275 -0.1842 -0.8560 -0.0435 -0.7125 2.1247 -1.4122 0.4859 -1.0235 1.1635 -0.8247 -0.5156 -0.0933 -1.4039 0.6453 -0.0479 0.2385 0.2433 -0.3736 0.9167 0.5717 -0.3148 -1.4286 -0.3030 0.3221 -0.7384 -1.6623 0.3810 -1.0592 1.7735 0.3296 1.9985 -0.8745 1.0612 0.2360 1.2948 -0.1919 0.0879 -1.0666 -0.6991 -0.0880 -0.0716 1.0691 0.6243 0.2499 -0.5561 1.3192 0.0660 0.5896 0.1178 0.2818 -0.9315 -0.8115 1.7288 1.2989 -0.4142 0.2052 0.2411 0.7471 -1.2707 -0.1689 0.5997 0.9482 -0.0190 -0.2279 1.7665 -0.0328 -0.2051 -1.1383 1.6636 -0.9658 0.6227 0.8381 -0.0004 0.9387 1.4603 -0.9882 1.2286 0.1277 1.9491 0.2959 -0.1877 0.0203 -0.0379 0.4384 1.6182 -1.4542 0.2746 -1.1351 1.0110 -0.1225 -0.0050 -0.0155 0.5868 0.5465 -0.0170 2.4398 0.8264 -0.6999 -1.3358 -0.5772 1.6023 -2.0148 -1.3089 1.5789 -0.8350 1.0369 0.5676 1.1678 1.0174 2.5062 -0.1707 -1.2538 1.7076 -0.6003 0.2180 2.1092 -0.1793 -1.0133 -1.8400 -2.1805 -0.2608 0.3885 -0.0206 0.6354 0.7866 1.9241 2.0860 0.0542 1.4649 1.7219 10-nonadecenoate (19:1n9) -0.2113 -0.5078 1.3007 1.7955 0.6650 1.5042 -0.3499 -0.0723 0.9153 0.2220 1.4908 0.2102 1.6829 -0.5404 -0.7929 -1.5763 1.0499 1.4669 -0.5315 0.3713 -0.8527 -0.5831 -1.1576 -1.1044 0.4172 -0.4322 -0.3257 0.5942 -1.1042 -0.4254 -1.3111 -1.4923 -0.2483 1.5590 1.2849 -0.2029 -0.8227 -0.8583 -1.0534 -0.3517 -0.8680 -1.5589 -0.0670 1.0546 1.6372 0.5152 -0.4989 -1.4133 -1.4475 0.3234 -0.4420 0.2956 -0.4405 1.8818 -0.3237 0.2953 -1.5455 2.3685 -0.3717 1.6004 -1.5006 -0.5093 -0.8971 -0.4523 -0.5695 -0.0654 -0.1220 0.5432 -0.0902 -1.4119 2.0728 -1.4576 0.6761 -0.8049 0.6554 0.6218 -2.4924 -0.8117 0.4808 -1.5093 0.6862 0.3123 -0.2128 1.7965 0.3808 -1.2288 -0.5227 1.6167 0.1000 -2.0621 0.4083 -1.0668 -0.7895 -0.4322 -0.7182 -0.8522 0.1956 -0.2241 -1.2056 0.7412 -0.9634 -0.6161 -1.6127 -0.9134 -0.7220 -1.0943 0.4261 0.1906 1.3755 -1.6338 -0.8509 -1.3350 -0.9441 2.2070 1.0666 -0.8697 -0.5726 -1.1427 0.4350 1.0354 -0.4704 1.5533 -0.7131 2.9915 0.2426 0.6626 0.0860 -0.1088 -0.2393 1.3772 0.5725 0.4003 -0.0633 -1.2070 -1.1631 -0.1269 0.1213 0.1632 -0.0559 -2.0656 1.0829 -0.9240 0.6877 -0.0425 0.2402 -0.2344 1.5092 0.6372 -0.4713 -0.7306 -0.6027 0.2241 -0.0844 0.2353 0.2300 -0.9190 1.3548 0.3319 -0.8975 0.3758 -0.8322 0.2338 -0.6973 1.4566 -0.0362 0.2456 -0.9551 -1.7879 0.0922 0.1652 0.7803 -0.7027 0.4609 -0.9958 -0.0211 1.2175 1.4674 -1.0886 0.4171 -1.6954 -0.8524 0.2454 -0.6595 -0.6733 -2.3832 0.0187 -1.9392 0.5567 -1.1373 -1.1955 0.0974 0.6416 -1.1531 0.4387 0.4672 1.2254 0.6167 -0.1596 1.2253 1.3460 -0.8799 -1.3598 -0.7721 -0.9222 0.9033 1.7973 1.8784 -0.8135 -0.5052 -1.8853 -0.4719 -0.5783 -0.7377 -1.1653 1.1033 -1.1800 -0.2662 0.0504 0.7825 0.3006 1.6962 0.7214 0.0318 -0.1040 -0.0065 0.4001 0.4093 0.1137 -1.4319 0.9696 0.1998 -0.1741 -0.3476 0.1449 0.8324 -0.5434 -0.7273 1.5299 -0.4522 0.3765 1.3257 0.3878 -0.0096 0.1828 -0.1412 -0.0933 0.6378 -0.3186 -0.0908 0.3940 1.6326 0.9873 -1.2606 0.6692 0.5263 -1.9783 -0.5613 0.8007 1.8729 -0.2509 0.6191 -1.5824 0.2924 0.3783 1.0860 0.9136 -0.3580 -0.4151 -0.1243 -0.2240 0.0469 -1.1155 -0.3152 0.8571 0.2535 -0.6512 2.2861 -0.1089 0.0227 0.9151 -0.0536 -1.2623 0.2089 -0.1055 1.9389 -1.3717 0.1996 -0.8900 0.8621 -0.7688 -0.0776 -0.2772 -0.7851 0.7191 0.3801 0.4322 0.1405 0.2646 0.7144 0.1885 -0.1339 -1.1975 -0.4914 0.7129 -0.3065 -1.7790 -0.0771 -0.5357 1.7070 0.4323 1.8217 -0.8708 1.3607 -0.1202 1.4739 0.1850 0.0181 -1.0732 -0.5786 -0.0748 0.3457 1.0021 0.4030 0.5590 -0.6186 1.2169 0.1943 0.7630 -0.0609 0.8243 -0.8466 -3.3374 1.3590 1.0187 -0.4161 -0.2140 -0.2688 0.8114 -2.1602 -0.6201 0.5509 0.8375 0.0850 -0.7286 1.5142 0.1002 0.0520 -1.1909 1.5711 -1.4985 0.6322 0.6477 -0.1702 0.6594 1.3303 -1.3308 1.4312 -0.2968 1.1216 0.3900 -0.3197 -0.5132 0.3125 -0.1357 1.5499 -3.7262 -0.1827 -0.6120 1.2126 -0.2978 0.4306 -0.0179 0.5785 0.7789 -0.2263 1.4834 0.8268 -0.8850 -1.4828 -0.2717 1.6558 -2.3532 -1.6595 1.4208 -0.0688 0.7652 0.3753 0.7439 0.9908 1.7363 0.0245 -1.1905 1.0480 -1.0032 0.4595 1.5497 -0.5408 -0.4516 -1.5279 -2.0437 -0.5067 0.2280 -0.0506 0.3746 0.9564 1.6438 2.1832 -0.1015 1.0549 1.0162 10-undecenoate (11:1n1) 0.7556 -0.0960 1.6917 1.1632 0.5964 0.2128 1.4742 -1.7025 0.5296 0.3740 0.7826 0.0066 0.6565 -0.4950 -0.0018 -0.6741 1.1867 0.2745 0.2887 -0.0464 1.2697 -0.4146 0.0124 -1.3270 1.3523 1.2338 0.6797 1.8603 -0.3819 0.6318 -2.2424 -1.1813 -0.5514 0.9793 0.9462 0.1391 -0.2704 1.3499 -0.4105 1.4460 0.0821 -0.4252 1.9103 1.4351 0.6416 0.4366 -0.5082 -0.3613 -1.5305 -1.1853 0.6313 0.0608 -0.0852 1.8747 -0.7700 0.8464 -0.4502 2.2775 -0.1956 0.9717 -1.8886 -0.7399 -0.0287 -1.1422 -1.4342 -0.7623 -1.7985 -0.6259 0.3494 -0.2645 1.1478 -0.5089 0.4182 -0.7342 -0.8041 -0.3625 -0.9443 0.6043 -1.2208 -1.3160 0.5594 -0.4340 -0.5803 0.9312 -0.3447 -0.0496 0.7013 1.3022 -1.4185 -1.1299 -0.8953 -0.0745 -0.1184 -1.7925 -0.4312 0.1592 1.3383 1.1650 -1.8264 0.9767 0.3385 -1.3492 -1.8270 -0.5142 0.3862 -2.2686 0.2782 0.8668 0.3991 -0.9958 -0.2427 0.1889 1.3964 3.2916 0.3601 -1.5072 -2.3777 -0.2113 0.3028 0.3362 -0.2672 0.2987 1.4042 -1.7575 0.5227 0.2910 0.0434 -1.5873 -0.7683 0.6719 0.7297 0.5869 1.3048 -0.9149 -2.2285 0.0053 0.2153 0.3614 -0.1964 0.9999 2.2783 -0.8262 1.4401 0.4253 0.8279 -0.1141 0.1266 1.1198 1.8493 0.8468 -0.3360 0.6491 0.9540 0.3562 -0.0665 -1.1297 1.3615 0.9964 -0.3598 0.9751 0.6808 1.5098 -0.5007 1.3333 -0.3831 0.9205 -1.6759 -2.5961 -0.2242 0.2288 -1.1276 0.4302 0.9198 0.3640 1.5185 1.2896 1.0656 -0.3123 1.8590 0.0097 -1.6997 0.3960 1.1007 -2.7631 -1.5654 -0.3193 -0.3498 -0.3302 0.2417 -1.5952 0.9825 -0.2690 1.0417 0.1113 0.6457 0.3309 0.9589 -0.0294 0.1787 0.8687 -0.4342 0.5968 -2.2575 -0.5294 -0.0599 0.6605 0.1102 0.4954 -2.1022 -1.8139 0.6010 -0.0818 -1.0310 -0.1780 -0.2771 -0.6822 -0.5481 0.1247 -0.2707 -0.9598 1.8550 0.0371 -0.1185 -0.3081 -0.8016 0.7168 -1.4232 0.9373 -0.6664 -0.3224 -0.4872 -1.2588 0.6229 -0.2224 0.9935 -0.8470 -0.8890 0.2611 0.1791 -0.7337 0.5081 -0.5793 -0.6666 0.5123 0.6834 0.5789 0.4468 0.5547 -0.5591 -0.2080 0.4849 1.0950 -0.7043 1.2379 1.0756 -1.0455 -1.3089 1.1602 0.5729 0.1942 -0.0158 -0.7188 0.5452 -0.4362 0.2134 1.2218 -1.5118 -0.5398 -0.7560 -0.4409 0.5805 -0.5168 -0.5877 0.6210 -1.7356 0.6308 1.0787 0.2070 0.5790 0.0024 0.2474 0.3660 0.0817 0.8094 1.4479 -1.5422 1.7246 -1.1590 -0.5481 0.7172 -0.1140 -0.0040 -0.0655 0.4460 -0.6698 -0.5081 -0.0687 2.1980 -1.3937 0.1239 -0.5178 -1.9586 0.3405 1.6001 1.0990 -1.3685 -1.2020 0.2199 0.1187 0.1087 0.9903 -1.6799 -1.4235 -0.7433 -0.0164 0.4126 0.0917 -1.0027 0.6106 0.3699 0.5897 0.9943 0.4631 -0.0230 -0.9706 1.2279 0.2404 -0.7571 -0.9240 0.3145 -2.4099 -0.3827 1.1132 -0.0295 1.4892 -0.8893 -2.7208 0.8396 -2.5467 -1.8349 -0.6707 1.2798 0.6863 0.1472 -1.3293 0.2742 0.4220 1.1098 -0.2405 -0.9458 1.0694 -0.0234 -0.5554 0.1105 0.3070 -0.7974 1.9014 -0.3592 0.7786 0.7376 -0.9506 0.2249 -0.3842 -1.0179 0.3911 0.2823 -0.7640 -0.0658 0.9343 0.3741 0.6033 1.5166 0.5085 1.9270 -0.3307 0.3942 -0.4781 -0.8661 -0.7996 -0.9903 0.5265 -1.9109 -2.5543 1.4898 -1.9147 0.2205 0.1673 0.1478 1.0393 0.5185 -0.0852 0.5007 0.2068 -0.2786 0.6585 0.4650 -0.4948 -0.6443 1.8519 -0.0982 0.5644 0.2018 -1.7482 -0.1000 0.6218 1.0329 -0.3965 -2.4102 0.3296 -0.5045 11beta-hydroxyandrosterone glucuronide 1.4530 1.3180 0.4140 0.3202 -3.3326 -0.2398 -0.8825 -0.0633 0.1532 0.5506 -3.8480 1.0856 0.4526 1.5705 -1.0347 0.9482 -0.3190 0.6735 0.0052 1.7300 0.0060 -0.5517 -0.1189 0.0510 -0.1504 0.3073 0.1674 -3.3831 0.0298 1.2585 0.7605 -0.3195 -1.1220 -0.0250 -0.3028 -2.1223 -0.5694 0.4933 2.0806 -0.9092 0.0667 1.3062 -0.1660 -0.7490 -0.2478 -0.7903 0.4105 0.0732 0.8355 1.6532 0.6382 1.2757 1.3769 -1.4015 2.0513 -0.7461 0.7101 -0.3937 1.6081 -0.4423 0.0196 0.6279 1.7525 -0.3596 0.0467 -0.4989 0.3666 -0.9891 -0.1033 1.1642 -0.5099 0.3850 1.4147 0.3585 -0.3329 -0.1652 -1.3369 -0.8709 0.6318 -0.3751 -0.1355 1.1473 1.7142 0.0729 -1.1686 -0.5757 0.6868 -0.4070 -0.2253 -0.0514 -0.2159 0.7573 0.9336 0.1172 -0.1703 -0.5428 -0.0733 2.2151 -0.3186 0.3585 1.2942 -0.1343 1.1595 -0.2417 -0.2432 -0.3780 -1.8391 -0.0933 0.8561 0.7674 0.3900 0.6721 0.4309 0.9201 -0.5601 1.4506 -0.1646 -0.4787 0.5980 -0.3630 -0.1159 0.1840 0.0023 0.9262 1.9084 -0.0915 -0.8164 0.4406 -0.3708 0.1485 0.1150 -0.4431 -0.8825 0.1443 -0.1213 -0.7798 -0.1875 2.2290 0.0908 1.8165 1.4305 0.9037 -0.1689 1.3869 1.4245 1.2446 -0.9847 0.0109 -0.1082 -0.6062 -0.1330 0.1112 -0.6267 -0.6518 0.3368 0.9298 0.5456 0.5060 -0.5888 0.7255 0.3863 -0.5108 -0.7985 1.5769 1.5432 -0.3433 1.1799 -0.3481 1.2784 0.3577 -0.0125 1.6052 -0.4928 1.8708 1.1030 -1.2423 -0.5398 1.8183 -0.5649 -0.0973 -0.3663 0.0853 0.1025 0.2976 -0.6636 -0.0154 0.4603 0.0044 1.5572 0.4274 -0.1883 -3.8130 0.4516 0.3697 -0.6142 1.1746 1.9367 -0.2655 -0.7348 0.2679 -0.3922 0.6099 -0.3020 -0.5291 -0.4301 -3.6130 -0.4719 0.8904 1.3676 -0.0231 -0.3612 -0.8359 0.6797 -1.0131 -0.1947 -0.4507 -1.0213 -0.0510 -0.4692 1.0152 0.5620 0.2925 -0.2009 1.3538 -0.0896 -0.6315 -0.4057 -0.3696 -0.5270 0.1169 -0.1337 -0.6310 -0.8706 0.1226 -0.5077 -1.4213 0.5569 0.2658 -0.5162 -0.6426 0.9522 -0.7665 -0.1701 0.2585 -0.6961 1.2090 1.4233 1.6666 -0.1669 0.1137 1.0008 -0.4436 1.2380 -0.5945 0.1374 -0.4553 1.5353 -0.1419 -0.1725 1.8672 -0.3127 1.0289 1.3743 0.0451 -0.3894 -0.3817 0.8300 0.0418 -0.2182 -1.0263 1.2149 -0.4592 -0.6351 -1.0001 -0.2412 1.5035 -1.6560 0.1721 1.5045 -0.1226 -0.7875 1.1720 -1.2099 -0.3574 -0.4372 -0.2421 0.2292 -0.1152 0.0998 -0.7929 0.9845 -0.2367 1.4660 1.3014 1.7193 0.2431 -1.1115 -1.6070 -0.7111 -0.7097 1.2611 0.2173 -0.9857 0.5861 -0.2323 -0.8018 -1.1093 0.0935 -0.6497 -0.4265 0.3683 -0.4917 0.3280 0.2105 -0.5383 1.2858 -0.1740 1.2212 -1.4049 0.0410 -1.0418 -0.3604 -1.1456 -0.8574 0.1006 -0.1438 -1.1179 0.2362 0.3961 -1.0473 0.5636 -1.1674 -0.3625 2.3477 -1.0501 0.0793 -2.3938 0.0195 -0.6507 1.7520 -0.4237 -0.8743 0.0685 -0.1625 0.0311 1.6490 1.9732 -0.4807 -0.5015 -0.3834 0.3251 -3.2166 -0.0011 -0.5949 -0.8866 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1.0382 -1.2809 -0.9936 -1.5817 -0.0127 -0.2534 -2.0461 -0.2939 -0.7045 -0.9835 0.6016 -1.9122 -0.5641 -1.9322 0.5360 0.9005 -0.1479 -0.4243 -0.5860 -1.5464 0.2372 -1.5800 -0.5093 -0.4929 1.5693 0.5777 -1.3549 -1.1416 -0.9675 -1.2779 -2.2375 0.7892 -0.9667 -0.0236 1.4909 1.1901 -0.2578 0.8516 1.4934 0.8488 -0.8430 -0.1825 -2.4188 0.1951 1.0849 -0.5154 1.2011 0.4007 -1.3265 -0.7779 -0.1218 0.0256 -0.7989 -0.7872 0.3942 -0.9138 -0.7158 -0.8390 -1.9678 -2.0619 0.5131 0.5880 -0.9675 1.0843 -0.6788 -0.0526 0.9533 -1.3870 1.4348 -1.7401 0.0457 -1.9993 -0.5656 -1.6780 -1.8042 1.2570 -1.6353 -0.6771 0.5398 -1.0788 0.0550 -1.9996 -0.1319 0.1314 0.0988 -0.2755 -0.1524 -0.1897 -0.6308 -1.1214 -0.0563 0.0600 0.0631 -1.2671 -0.4463 -0.8049 0.2649 1.2762 -1.6330 -0.3627 0.2904 0.2416 0.5379 0.4357 0.1728 0.8357 1.0554 -1.1043 -0.5069 -1.6391 0.7056 0.9419 2.4447 1.0968 0.4278 0.0441 1.4400 0.1438 0.9200 0.0409 -1.4796 -1.7983 -0.5764 1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)* 0.4061 2.5639 0.4966 1.0335 2.5161 0.4911 -0.6737 -1.4424 -0.5050 -0.3010 0.2561 -1.1371 0.5188 -1.1320 -0.0543 -1.1349 -0.9731 -1.6300 0.4198 -0.7764 -0.4013 -0.8989 0.3798 0.9781 -0.3448 1.2147 -1.4980 -0.7913 -0.7719 1.2998 -0.9384 -0.2430 0.0679 0.1993 2.2063 -0.4901 -0.1947 1.7052 2.7485 -1.3635 0.8316 -0.2464 -0.0088 0.2955 0.6794 -0.2832 0.8010 0.2814 0.3179 -2.0028 0.2142 -1.0274 -1.6329 -1.8126 0.8872 0.5574 0.6735 0.6217 -1.1734 -0.7504 0.7833 0.4042 1.3638 -0.1724 0.5857 0.3078 1.1162 -0.1995 0.3596 1.5402 -0.3768 -2.8283 0.3087 -0.8071 -1.0637 0.3539 0.1719 -0.0736 1.1338 1.2749 -0.8661 1.0056 2.4874 1.1031 1.8972 -0.8972 0.7298 -1.6594 0.3658 1.3192 -0.2622 0.0110 -1.5503 1.1354 0.6274 -0.4135 0.4741 -0.2102 2.2557 -0.7743 -0.8909 -0.6559 0.2493 -1.4058 0.2008 1.6550 0.0517 1.1830 -2.0770 0.0842 0.1586 -1.4218 1.6214 0.5896 -0.8873 0.3158 1.3809 0.6282 0.0163 0.7436 0.2091 -0.1132 0.8822 -1.2172 -1.4842 -0.0243 -0.6392 0.3613 -0.0263 -0.7796 -0.7699 0.6470 0.6461 1.9817 -0.5378 0.1351 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0.7943 -0.3620 2.6901 -0.2573 1.0174 -0.7468 0.6202 -1.2193 -0.9795 1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)* 0.6218 -1.3673 0.4422 1.2927 0.9130 0.8505 1.1524 0.6574 0.1320 0.8184 0.4317 -0.0021 0.9885 -0.8901 -0.0820 0.0479 -0.1450 -0.1626 1.4425 0.6393 -0.2579 0.1105 0.1866 1.4976 1.1410 1.2396 0.3890 0.1365 0.1643 0.7827 0.3597 1.7782 0.7581 1.1393 0.3625 0.8101 1.6236 1.1883 0.9967 -0.3386 1.9638 1.8339 1.7334 -0.8478 1.1799 -0.1707 -0.3624 0.1126 0.5737 0.5019 0.5786 -0.4488 -0.1152 -0.6176 1.8891 0.9714 1.2843 1.4278 0.4187 -0.3481 0.3179 -0.0528 1.2513 1.4088 0.0420 0.5045 0.4338 -0.7900 0.0295 0.9844 0.0936 -0.2102 1.7672 -0.2123 -1.1726 -0.1047 1.5425 0.4361 -0.2572 0.7880 0.2614 -0.3160 1.0002 0.7308 -1.2659 0.7174 1.3495 -0.5871 -0.4947 1.1247 -0.7222 0.6977 -0.1016 0.7583 1.5402 -0.5452 1.4729 -0.0076 1.4706 -0.7023 0.5674 0.6616 0.8138 -0.3114 2.7166 -0.5448 -0.3122 0.6997 -0.3355 0.1529 0.5247 -0.2909 0.6154 -0.3029 -0.4131 1.0122 1.6162 0.4995 -1.2842 1.8135 0.0006 -1.1363 1.4866 -2.0044 -0.7092 0.2159 -0.5179 0.2247 1.7780 -0.7574 0.4346 -0.6691 0.7092 0.0104 0.5367 -0.6068 -0.1944 -0.5622 1.0689 1.9161 0.8139 1.1714 0.9337 -0.0914 -1.4807 0.6828 -0.4214 -0.6527 1.5759 2.0524 1.7527 0.5443 0.7584 0.0008 -0.8018 -0.3248 0.6138 1.4494 -0.6423 0.1495 1.5161 0.0227 0.3468 0.1838 -1.6943 -0.9725 1.2388 -0.4861 0.1049 0.2319 -0.4481 0.6631 -0.1147 0.9046 -0.3984 1.8703 0.1381 0.7416 -0.5993 0.4296 0.6021 0.1088 0.8762 0.9938 0.7558 0.0719 -0.1567 1.2562 0.0510 2.0377 -1.0938 -1.6361 1.1374 1.2525 -0.3844 -1.3716 -0.9696 0.9473 -0.3949 1.1437 -0.1244 1.2690 0.8164 1.3022 0.1379 0.8086 0.0922 1.0608 -1.7706 0.7684 1.1864 0.3983 0.1956 0.6212 0.0550 1.7569 -1.1296 0.5818 0.0422 -1.6339 -0.2460 -0.0315 -0.7060 -1.5479 0.0290 -1.8151 0.0598 0.8337 -0.3044 0.2183 1.1619 0.0212 -0.0372 0.0151 -0.3711 -0.8858 -0.4862 -0.2326 0.8678 -0.9502 0.4046 -1.7276 -1.0773 0.5201 0.6031 -0.9802 -0.6217 -0.8671 -0.3988 -0.7834 -3.2810 -0.4094 0.2764 1.0061 0.3993 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-1.6712 0.0052 0.1653 -0.8185 -0.4593 0.4985 -0.0467 0.5220 0.4704 -0.2597 -0.5492 -1.7036 0.0951 1.2839 3.1016 1.2383 0.8390 0.5303 -1.3685 -0.0974 -1.7221 -0.8205 -2.2995 -1.9920 -0.8443 1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)* -0.5464 2.8425 1.4762 0.9378 3.2885 0.8634 -0.5002 -0.7840 0.1588 0.6966 0.5318 -0.7655 0.9120 -0.4800 -0.3761 -1.5651 -1.1365 -2.0782 0.1105 -0.8202 0.2460 -0.9749 0.3244 1.3026 -0.3154 0.9670 -1.1064 0.9552 0.1139 1.8739 -0.0750 0.6937 -0.8349 -0.1196 1.8137 1.0063 0.7949 1.4773 1.7113 -1.3888 1.3146 0.3880 0.3374 0.0992 0.9377 -0.6297 1.2647 -0.4706 0.4677 -1.5975 0.0060 -0.2662 -1.4005 -1.9466 1.8339 1.1851 0.9980 0.8636 -0.7189 -0.9364 0.7850 0.2162 1.3858 0.1446 0.1496 -0.3707 1.4829 -0.7120 0.5707 1.7100 0.1127 -1.5046 1.5347 -0.7939 -1.1056 0.4675 -0.5645 -0.0764 0.6183 1.0296 -0.8606 1.4474 2.2810 1.3712 1.3014 -0.8650 0.5661 -1.3722 0.5361 -0.2407 -0.4004 0.3557 -1.3481 1.2725 0.9882 -0.1473 0.7547 -0.0088 2.3175 -0.5529 -0.4810 0.2529 0.5308 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0.1440 -0.1170 -0.9330 0.6958 0.0232 -0.2475 1.2654 0.5005 1.1494 -0.4378 1.0079 0.8097 0.6785 1.2371 -0.4522 -2.1541 0.1758 0.3576 -1.3900 0.1392 0.6688 -0.2987 -0.4706 0.4400 -0.2189 1.8545 0.9233 -0.5353 -0.3154 -0.9968 0.5966 1.0011 1.4151 -0.0835 2.2253 0.5478 2.2229 -0.9301 -0.5115 -0.4987 0.4474 -0.9220 -0.8538 1-(1-enyl-palmitoyl)-2-palmitoleoyl-GPC (P-16:0/16:1)* 1.4583 -1.6360 0.0510 1.0362 1.4533 0.9695 1.2293 0.6039 0.4142 1.0625 0.1383 -0.5193 1.5333 0.6480 -0.0253 -0.0296 0.3649 -0.1292 1.4903 0.5401 -0.6548 0.0984 0.1168 0.8566 2.0344 1.5570 0.7475 -0.2366 0.2228 0.1448 -0.2939 1.1972 0.8478 0.1065 0.5371 -0.0869 1.6562 1.8478 1.8293 -0.0378 1.9644 1.9419 1.2351 -0.3375 0.6991 -1.0304 -0.4175 -0.4701 0.7658 0.9171 0.1055 -0.3798 0.4898 -1.0676 1.5236 -0.0106 0.9383 1.8716 0.1241 -0.6736 0.0272 -1.3521 0.5478 1.4490 0.2747 -0.8611 0.3310 -0.8652 0.0753 0.4953 -1.1776 -1.0626 0.8870 -0.0897 -0.2627 0.6900 1.0563 0.1810 0.9087 0.6240 0.4447 -0.7341 1.0622 0.4048 -1.2098 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0.3081 -0.5719 -0.8907 -0.4707 0.0153 -2.0376 -1.4904 -0.7159 0.0437 0.1773 0.1872 -1.2222 -0.6592 -2.1859 1.9660 2.0020 -0.9020 2.1212 1.0287 -0.2060 0.3531 0.8997 -0.5950 -1.5537 -1.1004 -1.3465 -0.8451 -1.7199 0.6073 0.8164 -2.1362 -0.2693 0.7063 -0.7074 -0.5692 -1.5791 -0.0038 -0.7794 -0.8947 0.4023 0.4559 -0.7306 -1.7402 0.2178 0.5963 0.0660 -0.4924 -2.3268 0.1301 -1.7522 -1.3023 1.7528 -0.5446 -0.4123 0.2500 -1.2584 -1.3016 0.8772 -0.0268 0.7733 0.1615 -0.3747 -0.9943 -1.8911 0.1858 1.2880 2.6380 1.6465 1.5211 -0.9049 -1.3097 -0.2428 -2.1209 -0.1524 -1.5715 -1.4057 -0.6149 1-(1-enyl-palmitoyl)-GPC (P-16:0)* 0.6037 0.2918 -0.5229 0.2258 0.8856 0.9484 -0.1825 -0.5576 -0.3651 1.4750 3.8202 -0.2435 3.3999 0.0321 -1.1399 0.1979 -0.9080 0.3197 1.5200 0.2633 0.4479 0.1665 1.2080 2.1608 0.1405 0.6312 0.0226 -0.4638 1.2269 -0.3347 -0.0329 1.5273 -0.6759 0.7951 -0.0121 2.6506 1.3656 1.0556 1.2515 0.3553 1.7386 0.8651 0.2962 -0.5934 1.1213 -0.8965 -0.1169 0.1073 0.7029 0.0170 0.1906 0.4339 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0.4141 1.1188 0.4225 -0.3734 -2.0859 -0.7330 0.2032 -0.9174 -1.3371 0.0868 -1.9357 -1.2689 -0.2576 -1.5094 -2.1966 -2.0258 0.6584 1.1611 -0.1116 -0.5990 -0.3707 -0.3692 0.5606 -1.1030 2.2945 -0.6582 0.4916 0.1807 -0.7716 0.0101 -2.2861 0.6577 -1.3668 0.0989 -0.4650 0.7246 0.0413 0.6410 -0.5477 -0.3086 0.8803 0.1703 -1.0081 -1.8069 -2.3820 0.4213 0.3373 -0.8375 1.0481 0.4196 -1.6005 -0.9916 -0.3334 -0.8567 0.1014 -0.0149 0.7387 -0.2528 0.2077 -2.3736 -1.0540 -0.7692 0.6862 -0.0826 -1.7224 0.4016 -0.0932 -0.6718 0.6705 -1.1926 1.0073 -2.4279 0.4650 0.6024 -1.1097 -0.9592 -1.7227 0.8470 -1.3584 -0.3659 -0.7883 -0.5165 -1.0700 -1.8701 -1.3195 -0.1052 0.1431 -0.7880 0.4081 -0.4701 0.0685 -1.7535 -0.1373 0.3624 0.6654 -0.4384 -0.6518 -1.5570 -0.2426 0.6400 -0.6075 -1.1161 0.7137 -0.8678 -0.6279 0.6726 0.2136 0.4232 1.7833 -0.6851 -0.9546 -1.9129 0.7504 0.6596 0.8314 -0.1667 1.4082 -0.8029 0.9525 -0.4447 0.6616 0.3773 -0.7705 -0.3529 -0.5850 1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2)* -0.3601 1.7238 0.6417 1.5321 2.3557 0.2711 -0.6331 -0.6370 -1.0975 -0.8447 -0.2190 -0.2951 0.5022 -1.6803 0.5475 -1.2548 -0.8017 -1.9544 0.3952 -0.9294 -0.2069 0.2277 0.4009 0.7931 -0.5005 0.6918 -1.1650 -0.7462 -0.3531 1.6907 0.3028 0.2736 -0.1028 1.0257 0.8590 -0.3158 -0.2749 0.8730 1.8535 -1.1486 1.2061 -0.6920 1.1915 0.3051 1.0455 0.0804 1.3168 0.3022 -0.3499 -2.2446 -0.0047 -0.1864 -2.3440 -2.7046 1.2246 0.7085 1.3844 1.2538 -0.6796 -0.5136 0.6295 0.5642 1.3154 0.0479 -0.2113 0.7588 0.0996 -0.4553 0.8949 1.3859 -1.0360 -2.0469 0.9398 -0.3578 -0.5334 0.5285 0.4465 0.3553 1.0315 1.5173 -0.7816 0.8346 1.9005 1.6543 1.2632 -0.8425 0.9978 -1.4006 0.2895 1.0039 -0.3090 0.1713 -1.8577 1.2703 0.4919 -0.7364 0.1474 -0.7898 3.0273 -0.4069 -0.0697 -0.1212 0.1695 -1.3204 0.5634 1.6541 -0.0600 1.0261 -2.9638 0.0491 0.5584 -1.2440 0.5837 -0.1131 -0.7246 0.8644 1.1543 0.1116 -0.7161 0.8857 -0.2833 -0.8278 1.7851 -1.7679 -0.9740 0.6334 -0.4618 1.6088 0.5991 -0.4054 -0.1107 -0.0473 0.0933 1.8235 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0.5870 0.6092 0.6180 -1.6248 -0.9184 -0.7147 -0.6779 2.6264 0.4305 -0.4274 0.0902 -0.5871 -2.2726 0.5692 -1.4769 0.8984 -0.8206 -1.2570 0.2897 0.2506 0.8771 -0.8086 -1.7512 -1.4222 -1.3915 0.3942 -0.4593 1.2580 -1.5679 -0.4272 0.4399 -1.4576 -0.7271 -1.3194 0.8053 -0.4746 -0.3614 -0.4770 -0.2086 0.5917 0.1733 -0.4793 0.9972 0.0513 1.9765 1.0757 -1.7115 -0.1049 -1.6549 -0.5943 -1.4927 0.1471 -0.4501 1.0995 0.0936 1.3586 -0.3426 -0.2916 1.4621 1.2068 -0.8802 -0.2927 -1.3075 0.7424 0.1285 -1.1830 0.5972 0.8160 -0.5747 -0.0144 -1.3722 -0.8239 1.7849 -0.2216 -0.0903 0.2614 -0.2610 -0.5688 -1.3372 -1.2314 -0.0815 -0.1026 -0.4557 -0.1244 -0.9291 -0.3140 1.6255 -1.9001 2.3409 -1.1677 0.8163 -1.0397 -0.5222 -0.5390 -1.3852 1.3252 -0.5037 -0.3958 0.0137 -0.1984 0.0497 0.0889 -1.4119 0.9907 0.4284 -0.6975 -0.1642 0.4851 -0.1315 -0.2206 0.6579 1.2562 1.4436 1.0097 -0.0819 -0.7239 0.8215 0.6501 -0.7152 -0.6328 0.8302 0.7584 -0.1677 0.0624 0.0267 1.2302 0.1841 -0.9026 0.2557 -0.8606 1.3053 1.2569 0.6772 -0.7032 1.1162 -0.2376 2.4516 0.1839 0.9304 -0.6205 -0.1264 -1.0631 -1.2323 1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1) -0.7754 1.4226 0.6892 0.8529 2.0330 0.7179 0.2508 -0.1232 -0.3224 0.5472 0.4450 0.0122 0.7372 -0.6200 0.4833 -0.5895 -0.1454 -1.7279 0.6853 -0.8150 0.2065 -0.8287 0.3782 0.9472 -0.2122 0.4125 -0.6094 0.0707 0.3019 1.5115 -0.0603 0.5380 -0.2882 0.7403 1.1440 0.8362 0.0034 -0.0490 1.2810 -0.5825 1.5950 0.1712 0.8604 -0.2286 0.9249 0.1443 1.3266 0.2423 0.4006 -1.1743 0.5759 -0.1307 -1.5754 -1.3388 1.3979 1.1925 1.2012 0.5644 0.2978 -0.8446 0.5872 0.6382 1.6534 0.1621 -0.9737 -0.1090 0.4958 -0.4923 0.8235 1.1778 -0.0085 -0.9917 1.3796 0.0803 -0.5024 0.2557 -0.3150 0.6112 -0.1446 0.8203 -0.3676 0.8261 1.3024 0.9424 0.8042 -0.5052 0.4345 -0.7928 -0.3130 -0.0542 -0.4904 0.3831 -0.8659 1.5435 0.6422 0.0472 -0.1003 0.3310 2.1298 0.0517 -0.1287 0.4656 -0.2123 -2.0056 0.7895 1.5739 0.3887 0.6355 -2.7240 0.4019 0.1563 -0.9058 1.3877 0.4222 0.0402 0.9430 1.6541 -0.4684 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-1.2931 -1.6007 -0.9097 0.1120 0.1856 1.7656 1.0013 -0.7949 0.3937 1.3653 (12 or 13)-methylmyristate (a15:0 or i15:0) 0.7937 0.6225 0.8946 1.9610 0.4459 1.2391 1.5796 0.9899 -1.2181 0.7882 1.1026 1.3632 0.7301 0.3625 -1.3430 0.4377 -1.3713 0.7701 0.1523 0.8382 -0.9384 -0.3965 -0.8310 0.1961 -1.1168 -1.1312 -1.2831 0.2792 -0.9420 0.5212 0.1052 -0.1386 -0.7095 -1.4423 1.2620 -1.1720 -1.1085 0.0208 -1.0736 0.3728 -0.8982 -0.7134 0.2038 0.6621 -0.9919 1.9052 -1.0727 -0.2093 -0.2169 -1.1711 -1.1004 0.6531 -0.0010 -1.3076 -0.8826 -1.2826 -1.1534 1.3112 0.3123 -1.3369 -0.2823 -1.3401 1.1140 0.7732 0.7020 -1.2472 0.3971 0.5541 0.7429 -0.9579 -1.1810 -0.1792 -1.2256 -0.1469 -1.1097 -0.0394 -0.9549 -0.3124 0.8728 -1.1913 0.9458 1.4959 0.7267 1.7589 0.8364 -0.0399 0.0178 0.3035 -1.2892 -0.8890 0.6587 0.1714 -1.1172 0.1883 0.6298 -0.3529 0.3492 0.6996 0.2635 1.7309 0.0177 0.2234 -0.2006 0.0694 -1.1042 -1.1158 0.2597 1.0299 1.0594 -1.0220 0.6251 -1.2465 -0.1595 1.6561 0.8603 0.2436 0.3749 -1.0813 0.4390 0.7653 0.5675 -1.1605 0.4170 -1.4103 -1.3836 1.5272 0.0572 0.6101 0.6531 2.4101 1.2394 -1.1261 0.3420 -1.2649 -1.2258 0.8763 0.5462 0.6564 -1.1777 -0.7214 -1.0542 -0.0138 1.0146 -0.1866 -1.1136 0.3483 -1.0983 0.6378 -0.2760 0.1835 0.6472 -0.9781 -0.9880 0.2629 -1.1546 -0.1430 0.7170 0.7295 0.2601 0.6412 -1.0871 0.7571 -0.9706 1.1747 -1.1857 -1.2993 -1.2915 -1.2281 0.3606 0.7673 -1.2993 -1.1912 1.8487 -1.0273 -1.4273 -0.8066 -0.9207 0.1553 1.2722 -0.8528 -0.1510 1.0054 -1.2178 0.6110 -0.9300 0.6944 -0.0215 -1.1405 0.5394 0.2454 1.2321 -1.0866 -1.0448 0.3892 -0.9405 0.7399 1.4107 1.0329 1.0317 0.3040 -1.2313 -0.8960 -1.0002 0.2717 -1.1168 -0.7942 -1.1897 0.3008 -1.1676 -1.0191 -0.4012 -0.2208 0.3176 -1.1996 0.9278 0.1776 -1.5068 1.1483 1.0801 -1.3468 0.5919 -1.2930 1.1844 1.3488 -1.4852 0.7047 -1.4228 0.4567 -0.1149 1.1554 0.0982 -1.0665 -1.0873 -1.2098 0.8415 0.1064 0.2113 -1.1758 0.2290 -1.0730 0.8266 0.7138 1.1005 1.7985 -1.2495 0.1181 -1.2400 0.4329 0.2009 1.2363 1.4778 1.4782 0.7415 0.7853 0.8896 -0.6481 -1.2415 1.6677 0.6803 0.6463 -1.2083 -0.9873 -1.3437 1.1308 -1.2654 1.0818 -1.2723 0.3835 0.6737 -1.3194 0.9844 -1.0729 -1.4030 1.0168 0.4296 -1.2231 2.4365 1.0032 0.8435 0.2127 1.1970 -1.4324 -1.3418 0.3766 0.6368 -0.3556 -0.2910 -1.1307 -1.4446 0.4188 -0.0785 0.5219 0.0917 1.7432 1.0215 1.8099 1.1453 0.8754 0.7764 0.6655 0.6250 -0.3159 -0.3276 -1.3901 0.2018 -0.7926 -1.3529 -0.3340 2.0883 -0.0914 1.0941 -0.7438 -1.3180 0.6891 0.4482 1.3218 -1.2238 0.3651 -1.1047 1.2738 -1.1128 -1.3818 -0.0185 0.3341 0.6713 1.1218 -1.1617 1.5129 0.2660 1.0711 -1.0669 -1.0866 1.4527 -1.0985 -1.2252 -1.4812 1.3473 0.2792 -1.3377 0.3256 0.4248 1.4371 1.5688 0.3804 1.5007 -1.1738 0.6574 0.3757 0.7259 -0.6843 -0.0407 0.4315 0.5670 0.9180 0.5858 -1.5427 0.9649 -1.2392 1.6247 1.1615 0.3162 0.3076 -1.1813 0.6942 0.7593 -1.3182 0.1811 0.2564 1.7751 0.6554 0.7719 -1.2970 0.4722 0.8096 0.2705 -1.3497 0.4326 -1.5124 0.0997 -1.3235 1.1362 -0.7275 -1.5257 1.2088 -1.5902 -1.7018 1.4552 -1.3027 1.2183 1.9336 -0.9886 -0.6140 1.3845 -1.2161 -1.4435 1.3288 -0.1813 0.3067 -0.7012 -0.5886 0.5136 -1.2896 0.9760 0.3918 1.7065 -1.5900 0.7826 -1.2666 1.1872 1.9428 1_3_7-trimethylurate -0.8329 -1.4365 1.2347 -1.0033 -0.6840 -1.1654 0.6624 -1.2151 -0.0581 -0.7875 -0.9617 1.1013 0.6823 0.5229 0.8202 0.0663 0.1821 -1.0676 -1.0475 0.1761 1.4962 -1.4436 -0.7795 0.3300 -1.0595 -1.0635 1.1229 0.0490 -0.0825 0.6945 -0.4373 -0.9485 0.1878 -1.3242 0.2495 -1.1002 -1.0407 -0.8685 -0.9886 1.8770 -0.8607 -0.6834 0.9420 1.1463 -0.9494 0.6719 -1.0865 -1.0642 0.5878 0.5698 -1.0628 0.0175 0.7745 1.7362 -0.0625 -0.1331 -1.0963 0.4249 -1.1313 0.8757 1.2157 -0.6112 0.9592 0.2900 1.4429 -0.6322 -1.1070 0.6388 0.0982 -0.9305 0.4513 0.9745 -0.8550 -1.2592 0.0956 1.5176 0.2350 0.8594 -0.2599 -1.1300 0.7199 -1.0259 -1.0828 1.1677 -0.9997 0.9594 -0.9515 0.0810 1.2944 -0.1652 0.4053 -1.0266 -1.0345 1.5244 -1.0504 -1.0168 -1.0671 -1.0441 -1.0228 0.8641 -0.5087 -1.3424 -0.9608 1.2030 1.0144 1.2221 0.5406 0.4125 0.7542 -0.9904 -0.3693 0.6446 -0.9416 -0.1019 0.2413 -1.0782 -0.9271 1.1754 1.6864 0.2319 -0.9785 0.0403 -1.1210 0.2280 0.7217 -1.1579 1.2265 0.9241 -1.1714 0.6442 0.7348 0.9990 -0.8366 1.1938 -1.1347 -1.2225 0.3851 -0.8017 -1.1137 -0.6882 1.0217 0.0080 1.6163 1.3062 -0.9779 0.0832 1.2399 1.0860 0.4351 0.3163 -0.9004 -0.9167 -0.9971 -1.4874 -1.1315 -0.9365 0.6436 -0.0818 1.3966 -0.7190 1.1005 0.2452 -0.9497 1.0135 -1.0295 0.6561 1.8643 -1.1767 -1.2286 0.2239 -0.0358 0.9320 1.6012 -0.3433 0.5620 -0.8425 -0.9051 0.6344 0.8074 1.2207 0.2684 1.7376 -1.1402 1.2152 -0.9345 -1.3039 -1.1181 -1.0274 -0.2802 -0.9953 -1.3419 -0.1771 -1.0064 -0.9598 0.7641 -1.1776 -0.1978 1.8728 -1.1114 -0.8439 -1.2143 -0.9218 0.2260 -1.0567 -0.0726 0.5661 -1.1427 -0.4940 -0.2535 -1.0759 1.0642 0.5529 0.6519 1.2062 1.1641 -1.1481 1.0584 -1.3000 -1.3497 1.3299 0.6822 0.8802 0.5955 0.5980 0.2133 0.8440 1.3049 0.9003 -0.5055 -1.0777 1.4724 -0.9738 -1.0563 0.4496 0.8400 0.5784 -1.1507 0.2224 0.3585 -1.0039 -1.1524 -0.6804 -0.1345 -1.3766 0.7565 0.4689 1.7112 1.7698 0.4745 1.1801 1.8062 1.6259 0.4188 -1.1436 0.9075 0.2505 0.4500 -1.1678 -1.0834 1.4869 1.1849 -0.9856 0.4674 -1.3542 0.6399 -0.3930 -1.2285 -1.2968 0.2497 -1.2114 0.0844 -1.0381 -1.2571 1.8333 -0.0542 -1.1708 0.8200 0.7240 -0.8543 -0.9076 0.5467 -1.2672 1.6165 -0.8552 0.9198 -1.0837 -0.2786 -1.1281 0.0515 0.7221 1.2383 1.1183 -1.1946 -0.1537 -0.0048 0.1548 0.5037 0.4897 2.0728 -1.2349 -0.1519 0.8011 1.4414 1.6016 -0.2605 0.8092 -1.2150 -0.9157 0.1203 -1.3199 0.8081 0.6463 0.7429 0.9746 1.6465 0.4140 -0.8043 -1.1365 -1.0556 0.0959 -1.1162 0.3002 -1.5157 1.0742 -1.1830 0.2066 -0.6068 0.5614 -1.1814 0.9980 -1.0346 0.2724 1.1337 -0.9629 0.0569 2.0720 1.9909 -0.3900 0.3785 -0.9710 1.2051 1.9282 -0.8428 -1.2591 0.6181 0.8178 -0.9918 0.5939 -0.0703 1.1899 -0.9437 1.3424 0.5449 -1.3914 -1.2145 -1.3639 1.9746 -1.2323 1.1282 1.5479 -0.5943 -0.5497 -1.1438 1.3440 1.0976 1.5479 1.0163 1.1271 0.7371 1.4238 0.4226 0.6564 -1.1101 -1.1072 1.5770 1.2798 1.7410 0.0526 0.9503 0.6570 -1.1416 1.6740 1.5882 -1.4278 -1.4898 -1.4730 -0.2725 -1.2018 1.8814 -0.2655 -0.9504 -1.1136 -0.7772 -1.2162 -1.2991 0.0744 -0.1282 -0.0681 -1.4667 -0.7627 0.0372 -0.5597 0.2176 1.4682 2.0975 0.2336 0.5265 0.5080 -1.1494 -0.1627 1_3-dimethylurate 0.2114 -1.1361 1.4300 -1.1614 -0.8287 -1.3213 0.4022 -1.3751 -1.2977 -0.9235 -1.0979 0.7719 1.1012 0.6495 0.2774 0.7047 0.0558 0.0800 -0.2850 -1.0439 0.9923 -1.6145 -0.9204 0.5652 -1.2158 -0.4470 1.5197 0.8521 0.3744 -0.1009 -0.2393 -1.0997 -0.8910 -1.4906 -1.5371 -0.3020 -1.1951 -1.0181 -1.1387 1.7807 -1.0074 -0.8205 0.5993 0.8690 -0.8168 0.4367 -1.2499 -1.2287 1.1967 0.3763 -1.2209 -1.4275 1.5145 1.5029 0.1326 0.0768 -1.2547 -0.9515 0.0572 0.9827 1.0315 -1.3966 0.9839 -0.0068 1.3408 0.0026 -1.2707 0.7072 1.0434 -1.0819 0.8395 1.5128 0.4060 -1.4179 -0.1507 1.2032 1.1856 -0.1371 0.4699 -0.5998 0.3294 -1.1832 -0.1467 1.6824 -1.1464 0.7184 -1.1009 0.4442 1.2424 0.4032 0.4066 -0.3308 -1.1873 2.0191 -0.3747 -1.1698 -1.2202 -1.1947 -1.1814 0.7770 -1.3821 -0.0372 0.1974 1.1579 1.3793 0.6126 0.9523 -0.5830 0.8712 -0.2153 0.2615 0.4425 -1.0933 0.7136 0.2450 -1.2367 -1.0817 0.6196 1.0734 -0.0275 -1.1280 -0.3215 -0.7528 0.6386 0.8030 -1.3143 1.4300 0.5588 -0.5519 0.4121 0.8883 1.2184 -0.9790 0.8060 -1.2926 -1.3868 0.4283 -0.9422 -1.2726 0.1345 0.2143 1.0230 0.8209 0.7428 -1.1233 0.9000 0.3393 1.4040 0.5433 0.3458 -1.0486 -1.0646 -1.1551 0.0846 -0.5057 -1.0880 0.3627 0.3909 0.5946 -0.8683 1.1462 -0.1474 -1.1027 0.9984 -1.1763 0.8945 0.9974 -1.3401 -1.3847 0.9407 0.0749 1.1398 1.5660 -0.0644 0.5416 -0.9939 -1.0559 0.5446 1.3604 1.0346 0.6474 1.3064 -1.2995 1.0324 -1.0886 -1.4706 -1.2740 -1.1775 -0.1604 -1.1494 -1.5186 -0.2296 -1.1612 -1.1058 0.8723 -1.3343 0.7443 1.5265 -1.2734 -0.4111 -1.3825 0.0255 0.6120 0.4722 -0.1568 0.8697 -1.3045 0.3844 -0.5558 -1.2422 1.0025 1.1798 1.1088 -0.0923 0.5189 -1.3144 0.9475 -1.4690 -1.5179 0.5881 0.6937 0.3338 0.2329 0.7871 0.4605 1.2220 0.8132 0.9739 -0.5678 -1.2317 1.2356 -1.1225 -0.3706 0.8334 0.6794 1.1753 -0.5245 0.6104 -0.1229 -1.1561 -0.5095 -1.4622 0.4881 -0.7048 0.4622 0.3905 1.3366 1.0635 0.4059 0.8997 1.6120 0.9871 0.2257 -1.3016 1.1283 -0.1798 0.6655 -1.3290 -1.2372 1.0494 1.3899 -1.1421 0.4829 -1.5266 0.7405 -0.9840 -1.3954 -0.5895 0.7152 -1.3723 0.8640 -1.1949 -1.4176 1.4816 0.4245 -1.3338 1.1880 0.1606 -0.2202 0.6182 -0.2116 -1.4267 1.1876 0.4002 0.6866 -1.2402 -0.0387 -1.2926 -0.2194 0.9999 0.7559 0.4947 -1.3578 0.3687 -1.2485 0.6698 0.1659 -0.3243 1.8789 -1.3967 0.5566 1.0623 1.4770 0.9418 -1.2858 -0.0947 -1.3737 -1.0706 0.4274 -1.4878 1.0635 0.5805 0.2974 0.8449 0.6808 0.3541 -1.2446 0.4232 -1.2123 0.5621 0.0427 0.5805 0.0050 0.7252 -1.3501 0.7496 -0.1351 0.3919 -1.3462 1.5555 -1.1914 -0.0842 1.2331 -1.1076 0.2338 1.5343 1.8454 0.4425 0.9682 -1.1128 0.5694 1.6833 -1.4500 -1.4205 1.2791 -0.0644 -1.1465 0.7591 0.3188 1.4646 0.1461 1.6078 1.0149 -1.5568 -1.3737 -0.8443 2.0102 -1.4023 1.0171 0.7518 -1.3921 0.4199 -1.3064 1.0386 1.2610 0.9182 0.9170 0.4671 0.8044 1.1552 0.4934 0.5126 -1.2655 -1.2590 1.3870 1.3921 0.7152 0.7798 0.7222 -0.2329 -0.6803 1.7632 1.1910 -1.6027 -1.6670 -1.6391 -0.2180 -0.1202 1.6564 0.1818 -1.1020 -1.2809 -0.9179 -1.3858 -1.4620 0.4911 0.1845 -0.2638 -1.6341 -1.4106 0.3939 -1.3965 0.5210 0.7833 2.1275 0.9653 1.1225 0.7219 -0.4376 0.4663 14-HDoHE/17-HDoHE -0.3422 -0.7165 0.7360 0.1436 -1.5859 1.0532 -0.1476 1.5843 0.8859 1.2880 1.4128 0.7416 -1.9547 -0.7672 0.6966 1.4880 0.5821 0.0482 0.9408 1.4463 0.1654 -1.1741 0.5809 -0.1748 0.6750 0.0547 0.6807 1.7733 1.0828 1.1170 0.2392 0.1336 -1.6495 -1.0318 -0.0858 0.6934 0.8697 0.8122 -1.9031 0.2472 0.2238 -1.5915 0.2342 0.3088 -0.0284 0.0768 0.2650 0.4697 0.1943 -0.6607 0.4580 1.1577 -0.1037 1.7682 0.6942 0.4986 -0.1105 -0.3066 -0.8492 1.0669 -1.8569 0.1766 -2.1317 0.4210 -1.9634 -1.3709 -0.9921 0.4050 0.3208 0.6840 1.4572 0.6414 0.7671 -0.2303 -0.6970 0.2352 -0.6918 -1.0968 0.1041 0.1428 -1.0227 0.7568 0.3221 0.6267 0.7496 0.9177 0.4830 0.2821 0.4689 0.7793 0.6209 -0.0180 -1.9491 0.3938 1.4324 0.1545 1.5224 0.7430 -1.3865 0.2741 0.8370 0.8810 -0.2361 0.5155 -0.7591 0.2284 0.7319 -2.0418 -0.2172 0.2849 0.9557 -1.1909 -0.1385 1.5462 1.4455 0.7074 0.2893 0.4297 1.0019 0.0415 1.4492 1.2939 0.4420 1.0004 -2.2096 1.4890 -0.0139 -0.5674 0.1504 -0.8629 0.4501 0.9582 1.7437 -0.7816 0.7428 0.5129 -1.1729 -0.6636 0.4299 -1.5966 1.8070 -0.7401 0.4501 0.5552 0.7951 0.1301 -1.9884 0.8423 -1.1368 -1.8662 -1.8114 -1.5381 -1.9054 -2.4128 -2.0430 -0.9105 0.3403 0.5249 -0.8269 -0.8300 -0.1809 -0.2928 -0.9192 0.0337 1.5057 0.0659 0.4393 0.0976 0.7484 -0.2905 0.4745 0.4193 0.9433 1.1075 1.2075 -0.4999 0.3180 -1.2568 0.1515 -0.3821 0.2686 0.5162 -1.0794 0.3352 -0.6606 -0.9155 -1.1742 -0.9373 -0.2204 -0.7216 1.4979 1.3571 0.4987 -1.8760 -1.1179 0.9387 -0.1664 0.0835 0.3942 -0.5708 0.3532 -0.3532 1.2140 -1.9593 0.8088 0.3983 -0.0169 0.0209 -0.3966 -1.9817 0.5035 -2.0102 -0.2452 -2.0659 -2.1681 1.1755 1.2051 0.9244 0.6667 1.1146 1.0785 0.4922 -0.1884 0.9785 -0.0032 -1.2877 1.7451 0.4169 0.3461 -0.0217 0.4977 -0.2762 -0.6693 0.1441 0.7175 0.7457 0.1021 -0.9792 -2.1643 0.4082 0.2345 -1.0690 1.3080 -2.2944 -0.9061 0.3790 0.1946 0.4537 0.9586 1.0750 0.8514 1.3834 -0.2284 0.8566 0.8267 -0.2626 -0.3582 0.3328 0.8228 -0.2217 0.4498 0.0331 1.2240 1.2538 0.2361 -1.7450 -0.5443 -0.5011 0.6601 -0.1042 0.1721 -0.3862 0.5119 -1.3236 0.2821 -0.1853 -0.2351 -0.4069 -0.2683 0.8544 -0.4247 0.5983 0.0039 -2.1727 -2.2873 -1.2898 -2.1313 -2.0382 1.2499 -1.2535 0.1942 0.4059 -2.1096 -0.9434 0.4605 0.0105 1.3454 -2.3848 -0.4493 1.5293 0.3010 -0.1650 -0.2298 -1.1205 -0.0239 -2.2508 1.0839 -1.8220 1.2957 1.2517 0.2704 -0.0967 0.1950 0.6226 -0.3526 0.8955 0.9474 0.2231 0.8132 1.0147 -2.0258 0.4627 -1.7922 -0.4825 -0.4035 0.0154 -0.2962 0.7712 -0.5021 -0.4719 0.6463 0.5172 1.1082 0.9953 -1.0750 0.4086 1.3043 -1.0102 -0.3848 1.0541 -2.0305 1.1043 0.7638 0.1965 0.5440 0.3612 -0.9257 -2.1773 -2.1297 0.4410 -1.8555 -0.9277 0.9796 -0.8026 1.0932 0.2389 0.2203 -0.0465 0.8453 0.3268 -0.4109 -0.1532 -0.5334 0.9093 -0.0291 0.2106 0.1276 0.0092 0.1697 0.9162 0.1464 -2.1376 -0.4332 -0.1683 0.8445 2.0063 -0.8153 0.7995 -0.4223 0.8509 -0.3952 -0.4021 -0.6781 0.9357 -0.1017 0.2094 0.0571 -0.3343 -0.5701 -0.4196 -1.8614 -0.0500 1.7211 -2.1269 0.3152 -0.5154 1.2386 0.1188 -0.9643 -2.1452 -0.4565 0.0896 1.6086 0.4305 0.2091 1.0968 0.4656 -2.1101 0.5935 1.7824 (14 or 15)-methylpalmitate (a17:0 or i17:0) -0.0160 -0.3025 1.5296 2.0374 0.6644 1.4556 0.3679 0.2108 0.8529 0.5206 1.3645 0.4550 1.7633 -0.7248 -0.7565 -0.6636 0.2758 1.3403 -1.0881 0.5630 -0.5827 -1.1420 0.0138 -0.5228 0.7689 -0.3004 0.0440 0.4325 -0.3791 -0.0633 -1.2038 -0.8742 -0.1521 0.5045 0.9000 1.5465 -0.9208 -0.4148 -1.4656 -0.2343 -0.5182 -1.4034 0.3057 0.3664 1.5475 1.3946 -0.2384 -1.1384 -1.1804 -0.4664 -0.7798 0.1700 -0.7533 2.0666 -0.0543 -0.0289 -1.0198 2.4570 -0.1092 1.3109 -1.2713 -0.0954 0.1585 -0.2315 0.0676 0.1620 -0.1992 0.5843 0.1234 -1.2675 2.4282 -0.7893 -0.4764 -1.3773 0.2477 -0.0558 -1.7281 -1.1299 1.3733 -1.6218 0.8474 0.6562 -0.1629 2.1412 0.4745 -0.9599 -1.0310 0.5833 -0.8021 -1.6136 0.4036 -0.4014 -0.9834 -0.0049 -0.4345 -1.5666 0.1651 -0.1437 -0.7400 1.2976 -0.9797 -0.6439 -1.1206 -1.0945 -0.0641 -0.8798 0.3325 0.4919 1.3168 -1.4105 -0.2414 -1.1484 -0.5978 2.3495 0.7906 -0.6376 -0.2627 -1.7418 0.2431 1.4243 -0.1200 1.4805 -0.3064 2.0784 0.6320 0.8747 0.2226 0.1101 0.1642 1.1593 0.9401 0.0532 -0.4400 -1.3865 -1.9151 0.0142 0.1644 0.0492 0.5853 -0.8038 0.6618 -0.0566 0.7651 -0.3199 -0.1193 -0.3824 1.4209 0.2126 -1.3826 -0.5051 -0.1173 -0.5524 -0.6228 -0.0336 -0.0354 -1.6937 1.3680 0.2563 -0.6145 0.3934 -1.0943 0.0499 -0.4194 1.4791 -0.4400 0.2206 -1.0731 -2.0221 0.4308 0.0349 -0.4965 -0.1005 1.1449 -0.5777 -0.1433 1.4907 1.4294 -0.6892 0.8208 -1.5953 -1.1287 0.4431 0.1302 -0.2579 -1.5942 0.0771 -1.5267 0.2238 -0.7633 -0.7497 0.5414 0.2792 -0.1932 0.7879 0.5083 1.0070 1.2505 0.6841 1.0850 0.8321 -0.8814 -1.3311 -1.1944 -0.7975 0.1451 1.7455 0.7707 0.2556 -0.9378 -2.0936 -1.1522 -1.1142 -0.9547 -1.4063 1.0516 -0.5109 -0.6380 0.5404 1.3489 0.0010 0.8926 0.4038 0.3327 0.3321 -0.3177 0.3728 -0.3971 0.4799 -1.0592 1.1700 -0.7451 -1.1948 -3.2447 0.0692 0.6940 -0.9750 -0.9982 1.3249 -0.3415 0.5440 0.9978 0.3161 0.7110 1.0670 -0.5067 -0.3865 0.8073 0.1714 -0.5782 0.0794 1.7219 1.0483 -0.6831 0.6689 0.5000 -2.5842 -1.1539 1.2746 1.3901 0.3702 -1.2579 -1.7236 0.1260 0.2915 1.3011 1.3514 -0.4447 -0.5613 -0.2806 -0.4224 0.1198 -1.0743 -0.5151 0.5744 0.0361 -0.4682 2.9646 -0.0193 0.2165 0.1776 0.1327 -1.3149 -0.1337 -0.0790 1.8133 -1.4464 -0.1354 -0.7108 0.9000 -0.6336 -0.9262 0.4237 -1.0358 1.2634 0.2064 0.8897 0.2609 0.1585 0.3705 0.1324 -0.3998 -1.1864 -0.2025 1.1988 -0.4892 -2.2736 -0.3366 -1.1471 2.0568 -0.3883 1.9057 -1.4446 1.4634 -0.1416 0.8752 0.4228 -0.3030 -0.9238 -0.7737 0.1144 0.3343 0.7331 0.7332 -0.0396 0.1755 1.8183 -0.3551 0.9168 -0.4476 0.9309 -1.2683 -0.9471 1.4502 0.8750 -0.2765 -0.1769 0.0493 -0.2023 -2.0935 -1.1080 0.1556 0.8949 0.4438 -0.7086 1.2856 0.2456 -0.1232 -0.4675 0.9899 -2.0904 -0.0863 -0.1626 -0.1968 0.5283 0.6543 -1.1469 1.1545 -0.2612 1.1470 0.3741 -0.6722 -0.8728 0.2736 -0.6078 0.7809 -1.7587 -0.5948 -0.4171 2.0694 -0.6281 0.2655 -0.2580 0.2740 0.4188 -0.3828 2.7775 0.5135 -1.1062 -1.2247 -0.9251 1.4601 -1.7985 -1.2718 1.5096 -1.8408 0.0605 1.0022 0.6555 0.9883 2.2140 0.4403 -1.0586 1.7935 -1.0899 -0.4437 2.2007 -1.5126 -0.8689 -1.6424 -1.8909 0.0657 0.0693 -0.0462 -0.7340 1.6819 1.7022 1.5709 -0.1479 0.8146 1.7167 1_5-anhydroglucitol (1_5-AG) 0.8680 -1.8238 1.1341 1.3194 0.1192 1.1230 -0.3417 -0.2220 -1.8452 -2.3747 -0.1761 -0.1359 -0.3808 1.1243 0.5948 0.1128 1.2814 -1.1424 -0.0874 0.4821 0.6270 0.2312 -0.5805 -0.1693 -0.4879 -0.1685 -0.5679 1.6810 -0.2148 -1.0969 0.9764 1.3885 -1.2046 1.1416 0.9226 -0.4596 0.7968 0.3584 0.9164 0.0896 -0.5093 0.5633 1.3281 0.0703 0.5043 -0.0717 -0.3344 -0.1203 0.6592 1.5373 0.1092 -0.2612 1.0755 0.0224 0.0411 -0.0236 -0.1849 -0.4041 -2.8603 -1.3435 1.3823 0.5796 -0.1633 -2.2530 1.4179 0.5900 1.3753 0.1751 0.2099 -0.2940 0.3702 0.7637 -2.0016 -0.8316 1.9734 0.7275 0.6939 1.3596 0.4816 1.2729 0.7142 0.4122 0.3942 1.0864 -0.3524 0.0772 -0.7380 0.0776 1.3531 -0.4893 0.7693 0.7797 1.1161 1.2380 0.1430 0.5526 0.7472 0.1922 0.5588 0.9289 -2.1492 0.3120 1.1371 1.0599 0.8126 -0.1021 -0.6661 0.7678 -0.5335 1.3089 1.1429 0.9375 -0.1672 -2.2061 0.8513 -0.8341 0.1756 1.3149 0.5768 -0.5332 0.8862 -0.8613 0.7440 0.6085 0.2481 -1.0383 0.3475 0.2134 1.9577 0.7672 0.5703 0.5908 -2.4443 0.6167 0.3679 0.5540 -3.9101 0.7120 0.7723 -0.2861 0.7047 0.5719 -0.5350 0.0517 -1.7024 0.3915 0.5138 0.0287 0.1300 0.5189 1.6431 0.3622 0.1514 0.7536 0.6093 0.4188 -0.0367 -0.4588 1.4708 0.2095 -0.5508 -0.1029 -0.1476 0.7082 0.3782 1.6108 0.2571 1.0697 -0.5309 -0.3099 -1.6603 -0.9552 0.6176 -1.8945 -1.4322 1.4794 1.4741 -0.2741 0.0658 2.1950 0.7631 0.1375 0.5978 0.1696 1.2764 0.9526 1.9521 0.4359 -2.3042 0.4796 -2.3902 -0.6921 0.7455 0.1501 0.5430 0.1859 0.2734 0.8344 0.5476 0.6023 0.5397 -0.1856 0.4082 1.0368 -0.5290 0.3985 -4.3294 0.7908 0.8854 1.4589 1.0090 -2.0487 0.8870 0.8093 0.8592 0.0719 -0.4932 -0.3917 0.0082 -1.1867 0.6010 -0.1143 -0.5518 0.1354 -2.2594 -2.7386 -0.5812 1.0019 0.5663 0.4391 0.0621 -1.5033 -2.2302 0.9680 -0.1959 1.0229 -0.2152 -0.1881 0.9554 0.2919 -0.7804 -1.0969 0.6726 -0.5780 -1.0321 -0.7064 -0.3305 -0.4464 1.1043 1.3309 -1.4360 -1.7566 1.3323 -0.8996 -1.1984 -0.7946 -0.3275 -1.4508 -0.8405 -1.0389 0.5549 0.7454 -0.6977 1.1714 -0.8114 -0.1645 1.2290 0.0390 0.5033 0.1557 -0.7598 0.9217 -0.6595 -0.5838 0.3038 -1.4636 0.6280 -0.1758 0.3393 1.4501 -0.4489 0.4410 0.4444 0.8325 0.9683 -0.4876 1.3858 -0.1440 0.0361 0.2898 0.8547 0.3404 0.1822 -0.0934 -0.3740 -0.1573 -1.1323 0.9902 -0.8260 0.8357 0.4181 -2.0398 1.6592 0.1421 0.5881 0.3452 0.0887 1.2115 -0.0893 0.1595 -0.6979 -0.8646 0.3924 -0.4194 -0.6986 -0.5001 -1.1572 0.1513 -1.1089 0.2763 -1.3568 -0.7537 1.2502 0.4616 0.2272 -0.2544 -1.3691 1.0909 -0.2790 0.8452 0.5800 0.8837 -2.4193 -2.7476 -1.7516 0.3360 -1.5818 -0.5322 1.1776 -0.2363 -1.4562 0.3453 0.9396 -2.2433 -0.1067 0.1086 -0.1329 -0.0697 1.0773 -1.0757 1.3094 -2.3671 -0.5358 -0.4073 -0.1196 -0.4673 -1.4396 0.3657 -0.4304 0.4328 0.5809 0.3823 -1.8702 -0.2564 -0.3626 0.0160 0.7997 -2.0866 -1.3725 0.3483 0.0879 0.7618 -0.2219 -0.0722 -0.7636 -1.7590 0.6207 0.5786 -0.0763 0.3283 -0.9080 0.3666 0.5519 -0.9423 1.2172 -0.2218 -0.4466 -0.2317 -0.9407 -0.1776 -0.2185 0.5909 -0.4382 0.6484 -1.6520 -0.3225 0.0493 -1.6636 0.0808 0.3410 -0.5697 -0.3172 -2.2360 -1.2411 -0.6526 -0.7177 0.2972 0.5302 0.1628 -2.2835 15-HETE 0.2368 0.4734 0.6770 0.6409 -0.8476 1.2996 -0.0106 1.1982 0.8720 1.5390 1.5843 0.4472 -1.1409 0.6596 -1.3612 0.2450 0.7483 0.6298 0.8202 1.2314 0.3524 -1.4929 0.7226 0.6318 -1.1647 -1.1670 0.7018 1.4769 1.1345 0.7061 0.2791 0.7107 -0.8982 -1.3911 -1.4299 1.6356 0.5711 0.8262 -1.0990 0.4854 0.5650 -0.8361 0.4178 -1.3386 -1.0693 0.6145 -1.1967 1.0369 0.0777 -1.1556 0.1083 0.8157 0.3756 -1.2548 -0.9478 0.7764 -1.1972 0.8605 0.1418 0.7420 -0.3621 0.5648 -1.2934 0.4939 -1.1673 -1.3598 -1.2135 1.3693 0.7612 0.6891 -1.1921 0.6386 -1.2320 0.4535 0.1616 0.5319 -1.0741 -1.1760 0.5825 0.4884 -1.2350 0.9508 0.2624 1.1439 1.3883 0.5333 1.0128 0.3349 1.1720 0.7202 0.3915 0.5576 -1.1397 -0.9407 1.2199 0.4159 1.2568 1.2087 -0.4103 0.3373 0.9413 0.9344 0.5692 1.1210 -1.1013 0.7805 1.2555 -1.2241 0.7454 0.2435 0.7872 -1.0857 0.6205 1.4948 1.7227 1.4769 -0.0284 -1.1400 1.4167 0.5141 1.4997 1.0290 0.6313 -1.2239 -1.3659 1.2528 -0.0869 -0.5429 0.1177 -1.3698 0.8097 2.0105 1.1180 -1.2998 1.0238 0.8919 -1.1626 -0.9355 0.5860 0.0337 -1.0186 -1.2412 0.5788 0.8091 -1.0836 0.0858 -1.1848 1.1140 -0.3294 -1.0849 -1.0257 -1.0383 -1.1173 -1.5274 -1.2321 -0.1497 -1.1770 0.6988 -0.0605 -0.8823 -1.1647 0.2828 -1.0721 0.2262 1.4223 -0.8270 0.3306 0.5885 0.7175 0.0276 0.6708 -1.2049 0.9907 1.1896 -1.3150 0.7286 -1.0333 -0.1797 -1.1465 0.1866 0.5900 0.4502 -1.2336 -1.2251 -1.0615 -1.3754 -0.1628 -1.1299 0.5119 -0.0230 1.2358 -1.0476 -1.1201 -0.1894 0.3093 1.0350 0.3523 0.1547 1.0986 0.3227 0.9312 -1.0529 -1.0866 -1.1805 -1.2424 -0.9703 -1.2392 -0.6757 0.4969 -1.1924 1.2906 -1.2051 0.3694 -1.2480 -1.3393 1.1674 1.6770 1.2152 1.1810 -1.3181 0.9483 0.7704 -1.0504 1.1551 -1.4574 -1.4013 0.9566 0.5227 0.9190 0.5268 0.7147 -1.0850 -1.1649 -1.2874 0.2948 0.8228 0.2480 -1.1327 -1.3395 1.1783 0.1639 -0.0391 1.2525 -1.4412 -1.3009 0.9796 -1.2396 -1.3626 1.2928 1.2253 1.3921 1.1496 -1.3357 1.1782 0.7529 0.2429 0.1856 -1.2584 0.9955 0.2677 0.4880 0.5237 -1.3504 1.1614 0.4907 -0.1749 -1.3153 0.4670 1.4142 0.5842 0.2912 -1.1484 0.9246 -1.2943 1.0155 -1.2634 -1.2651 -1.2653 -0.2725 1.0444 0.0178 -1.3354 0.2712 -1.3572 -1.4166 -1.1843 -1.3041 -0.4821 -1.3208 -1.4140 1.1137 0.8303 0.4715 -1.3558 0.9463 0.3998 0.8785 -1.5292 -1.3916 1.1107 0.6094 0.5312 0.0689 -1.3202 0.8916 -1.4051 1.5155 -1.0477 1.4756 1.3486 0.7964 0.7016 -1.2615 1.0207 -1.4179 1.0472 -1.1851 0.0804 -1.1621 0.9263 -0.2501 0.7500 -0.4501 0.8807 0.0601 0.6996 -1.2539 0.9712 -1.2745 0.2979 0.7210 -1.1503 0.4302 -1.0705 -1.2538 0.2585 1.7830 -0.5399 0.3531 1.4691 -0.3876 0.8388 0.5822 -0.4475 0.8177 -1.1650 -1.1082 -0.6636 -1.2958 0.4972 -1.0632 -0.7991 0.6992 0.0047 1.5145 0.8348 0.1437 -1.3229 1.0861 0.5648 0.6139 -0.2818 0.5126 0.0708 0.2302 -1.3723 -1.3785 0.2946 0.7361 0.7758 0.5375 -1.3058 -1.2039 -0.0175 -0.9417 2.3786 -1.5264 0.8648 0.1867 -1.3179 0.3399 0.4193 -1.4997 1.2694 0.4009 0.2125 -1.5135 -1.2852 -1.4631 0.4926 -1.0706 0.5031 2.4921 -1.3095 -1.3659 -1.3727 0.6715 0.5301 0.2251 -0.1927 -1.4551 0.0644 -1.1738 0.7887 -1.4196 1.3464 1.1499 -1.2824 0.9609 1.8635 16a-hydroxy DHEA 3-sulfate 0.4962 1.5104 -0.5425 -1.1243 0.6557 -0.0420 -2.2527 -0.7045 0.7491 1.6695 -1.3059 -1.6859 0.2782 1.2510 -0.6188 -0.2700 0.1476 1.8390 -0.8811 -1.2421 -0.7440 -1.0402 -2.4950 0.0969 -0.0109 -0.4043 -1.7214 0.7815 -0.6892 -0.8162 0.3892 -0.9937 0.2491 1.2489 0.5182 -2.1522 -1.1322 -1.0663 -0.7761 0.0381 -1.4888 -1.2081 -0.4288 1.3965 -0.4255 -0.4056 -0.8407 0.5157 -1.1770 -3.2817 -1.0694 -0.2149 -1.0629 -0.7898 -0.1383 -0.6959 -1.0705 -1.1258 -1.8758 1.3452 -0.9692 0.2589 -0.8596 -1.0957 -0.2737 -0.6698 0.8111 0.1582 -0.4932 0.2568 -0.6819 1.0370 -1.1958 -0.0052 0.5054 -0.2460 -0.4825 0.5440 -0.5748 -0.8437 -1.0024 -1.2380 -0.6446 0.8653 -1.0664 -0.4793 0.4823 0.9729 1.6310 -0.6169 -0.3051 -0.7757 -0.5981 -0.7589 -1.9038 -1.0360 -0.3170 -2.0642 -0.7845 0.1675 -0.5176 0.1675 -0.9833 0.4387 -2.1306 -2.0690 -0.8353 -0.6400 0.6234 0.4614 1.0870 0.7238 -0.8471 -0.6308 -1.0313 -2.0056 1.0209 0.5799 2.2891 0.7906 0.3037 -1.4970 0.4906 -1.1892 0.0570 -0.0818 -0.1988 -0.5348 1.4745 0.0957 -0.5280 -0.5683 0.4110 1.0941 -1.2706 -0.9623 -1.1974 -0.5762 -0.2597 -0.9971 0.5955 0.0859 1.1929 -1.0829 0.3201 -1.6140 0.7298 0.8756 -0.2041 -0.4192 -1.9652 0.5320 2.2603 0.2269 0.3514 0.2468 2.0631 -0.3117 2.3922 -0.4997 1.1324 -1.7508 -1.0350 -1.6297 -0.1037 0.2405 -1.3136 -0.3688 -0.8987 -1.3144 0.4388 -0.6183 -1.6874 -1.0932 0.0611 0.5307 -1.8517 -1.1108 -1.9482 -0.0049 0.2608 -1.2697 0.0615 1.3897 0.2732 -2.0397 0.5837 0.1068 -0.8632 -0.2009 -0.1139 0.1448 -0.0797 -0.1138 -1.4929 1.0942 0.6047 0.1403 -0.3924 0.3993 -0.0372 -0.3851 0.1390 0.8135 -0.2277 1.2333 -0.6324 -1.5666 -0.8751 -0.1673 0.8907 -0.6025 -1.6719 1.3546 0.9177 -0.8608 0.1367 -0.7662 0.0541 -1.0107 -0.9468 0.5147 -1.1079 1.0134 -0.3218 0.0566 -0.7558 -1.8766 -0.8324 -0.7380 -0.1513 -0.0298 -0.6288 -0.2981 0.4866 0.1654 1.1064 0.5927 -0.6561 0.2861 -0.5094 0.0420 0.9271 0.3480 0.0714 1.0366 1.7886 -0.2261 -0.1456 0.2441 -0.5771 -0.3840 -1.1980 0.3533 0.7143 -1.2483 1.4683 0.6348 -0.1900 -1.2041 1.3857 -0.8949 -0.3796 0.3856 1.0999 -0.2058 1.3415 0.6367 0.2783 1.1770 -0.3495 -0.9238 -1.1972 0.1353 -0.3663 0.6970 -0.0375 -0.0566 -1.1996 -1.1083 -0.1794 -0.3298 0.6153 0.4382 1.2574 2.2136 0.5623 -1.5477 0.3127 -0.6651 0.4877 0.3756 0.2878 0.9900 0.4403 -0.6008 -0.6578 0.5934 -2.5002 -0.8432 -1.0375 0.2652 1.2196 0.1801 0.7577 1.0216 0.5055 2.0256 0.3806 0.7697 2.0540 1.5337 1.0520 1.1185 -0.6213 0.1737 1.4441 -1.2569 -0.2333 -0.4284 1.7941 0.8251 1.3249 0.1119 0.3014 1.5899 0.7343 0.4455 1.8251 1.1287 0.0528 1.8828 -0.5069 0.6912 0.1199 -0.1835 -0.1110 0.4359 -0.8398 0.3120 1.6489 0.6957 -0.1349 -0.0440 0.3293 1.0776 0.0372 1.2740 2.1915 0.8706 -0.5332 0.3926 0.0720 0.8887 1.6667 0.0089 0.4575 1.1260 0.0616 -1.8122 0.6615 -0.1909 0.6096 -0.2690 0.3856 1.5060 0.5335 1.7478 0.6176 -0.3692 0.2433 2.2073 1.4470 1.5539 -0.2452 -1.9666 0.9035 -0.1653 0.0737 -1.1541 0.7287 1.4207 -1.1284 1.0801 0.8564 2.2374 0.7362 1.5750 1.2245 0.4015 0.3031 0.0987 1.1059 0.9097 1.0761 0.2952 1.2695 0.8391 1.2898 1.1097 1.6928 1.1782 -0.5886 0.5669 1.0089 -0.3691 0.8947 1.4749 0.0421 -0.1935 16-hydroxypalmitate 1.6328 0.4341 1.0894 2.7437 1.4600 2.7576 -0.5416 2.2089 0.9663 1.2919 2.1510 0.9887 0.9054 0.0730 -0.7489 -0.6718 0.6923 0.6487 -0.3953 1.0419 -1.4466 -0.5803 0.2716 -1.3713 0.4035 -0.3300 0.0756 -0.9134 -1.0813 -1.6614 0.3596 -0.2229 -0.4408 -0.4000 1.3419 3.8108 0.4612 -0.8530 0.0336 -0.8603 -0.0463 -0.2425 0.3714 -0.0520 0.5861 0.7937 -0.8301 -1.4794 -0.8700 0.1157 0.1252 0.3824 -0.9891 0.9383 -0.2114 0.2006 -2.1848 2.9551 -1.1929 0.6641 -1.3755 -0.4075 -0.8367 1.2956 -1.1478 -0.2401 0.8941 0.5584 0.5737 -0.3812 1.3387 -0.8369 -1.1821 0.0102 0.4030 -0.6063 -0.5115 -0.7449 -0.0250 -1.4435 -1.0008 0.8265 0.1772 1.7282 1.7506 -1.1002 -0.8818 0.7677 -0.1603 -1.0618 1.0076 0.3691 -0.8665 0.5066 0.8831 -0.9056 -0.5530 -0.4254 -0.6864 -0.4857 -0.3717 -0.1265 -0.1060 0.0943 -0.8898 1.1245 0.1019 -1.1578 1.2525 -0.9785 0.7917 -1.8473 -0.8887 2.4804 2.9562 0.2774 -0.0194 -1.1353 2.6292 -0.4248 1.4887 0.6106 -1.5193 0.6011 -0.3672 -0.6900 -0.2999 0.5918 0.3885 0.2410 0.4413 1.6360 -0.3324 -0.7417 0.3772 0.9206 -1.1662 -0.8238 -0.1567 -0.1624 1.7055 -0.6269 -0.7819 -1.0192 0.6169 -0.2488 1.1866 0.2897 -0.5263 -0.8675 -0.1935 -0.8879 0.0388 -0.8309 0.3451 0.1541 1.4969 -0.4363 0.1422 0.1851 1.4718 -0.2994 0.6399 0.8756 1.2418 -0.3324 -0.6269 -0.1332 0.3585 -0.2907 -0.0469 0.9434 -0.4047 -0.9287 -0.9672 0.1931 0.9008 -0.8793 -0.0251 -1.2100 0.0919 -0.4952 1.1803 0.0178 -0.4807 0.9743 0.0557 -0.5564 0.1973 -0.1503 -1.1053 2.0406 -1.7778 -0.5152 0.9117 1.1498 0.4568 -1.3072 1.0286 0.7160 -1.2084 -1.3123 0.8555 -0.8391 0.8102 0.7907 0.7835 0.2848 0.8262 -0.0170 -0.8028 -2.2029 -0.9509 -0.4488 0.5640 -0.9488 2.5408 1.0673 1.3942 -0.4918 0.9554 0.2813 0.5064 -0.3778 -0.1030 -0.8960 1.9919 -0.9272 -0.7333 -0.2595 -0.1649 -0.5785 0.1760 -1.3087 -1.0446 -0.4654 -0.1475 0.5269 -0.2819 1.0114 0.6213 0.4826 1.4718 -0.2142 -1.6931 1.0972 -0.0567 -0.3088 -0.5657 -0.6818 1.3082 0.7275 -1.7537 0.7257 -0.6238 -0.6611 -0.9055 0.6430 0.2376 -1.1395 -0.2881 -0.2029 -1.6140 0.9002 -0.4472 0.6972 0.2581 -0.6764 0.1036 -0.2299 -0.8646 -0.5488 -0.3449 -0.5691 -0.4367 -1.0463 2.0023 -0.5538 -0.5026 0.6103 0.3636 -0.1503 -0.7692 -0.5278 -0.1447 -0.9429 -1.0039 -0.4366 0.9519 -1.3682 -0.8721 -0.4939 -1.0587 0.8002 0.2401 1.6828 -0.1586 -0.9280 0.4348 1.0444 -0.6637 -0.1456 0.1907 -0.5248 -0.3018 -1.6066 1.0357 -1.0725 1.5955 -0.3051 0.9963 -1.8734 0.7720 -0.6880 0.6556 1.1272 -0.0695 -0.1551 -0.8061 0.5393 -0.8335 -0.3742 0.8115 -1.2446 -0.3147 0.4068 0.1104 0.6197 -0.2501 0.3783 -0.4624 -1.1353 1.4432 1.1357 -0.7404 -0.4385 1.8826 -0.8491 -1.2115 0.3380 0.7683 0.3032 0.4483 0.5135 0.7902 0.1139 -0.1436 -0.6227 0.8875 -0.9408 -0.7103 1.2820 0.3578 -0.0125 1.1635 -0.8472 0.1440 -0.4245 0.7925 -0.7834 -0.0133 -1.5200 -0.4167 0.4387 0.0372 -2.4534 -0.5408 -0.7475 0.9856 -0.5750 1.0816 -0.7707 0.0952 1.0865 -0.6979 2.0630 -1.0566 -0.3287 -0.1410 -1.7297 0.9549 -1.8066 -1.5592 0.4055 -0.5761 0.0001 0.1172 0.1381 -0.8378 1.3396 -1.0711 -2.3003 2.6533 -1.4015 -0.5617 0.5093 -1.4601 -1.5280 -1.9761 -1.3347 -1.8210 -0.1727 1.1362 -0.4989 1.1000 1.5466 2.1947 0.1829 1.0641 2.2027 (16 or 17)-methylstearate (a19:0 or i19:0) 0.6053 -1.0028 1.8017 1.8795 1.6095 1.2252 -0.0981 0.2118 -0.0321 1.1165 1.3671 0.0354 1.1350 -0.2839 -0.6165 -1.3282 0.5306 0.6990 -0.8839 1.3328 -0.0810 -0.9236 -0.0142 -0.3822 1.0094 -0.0562 -0.6646 0.8094 0.9940 0.3784 -1.4123 -0.7136 0.8334 1.5015 0.3317 0.4003 -0.3455 -0.2513 -0.6375 -0.5180 -0.4019 -1.0023 0.5173 0.3348 1.7650 0.9906 0.0165 -0.8158 -0.9171 -1.8081 0.2443 1.3032 -0.3162 1.1984 0.6053 -0.4438 -1.3051 2.6412 0.5533 0.9769 -1.4502 -0.6199 -0.2842 -0.3096 1.0902 0.8315 -0.5608 0.3453 -0.2657 -0.7723 2.0186 -1.9041 -0.1464 -1.0442 -0.0097 -0.2305 -2.0357 -0.4336 2.0083 -1.1584 0.9042 0.8370 -0.5438 1.0681 0.2476 -0.4665 -0.1970 1.0530 -0.9192 -1.4163 -0.1368 -0.6454 -0.7958 1.1336 -0.6240 -1.3830 0.7876 -0.0626 -0.4596 1.1617 -0.2889 -0.8639 -0.8913 -1.9402 -0.1359 -0.8836 -0.2224 0.8873 -0.0767 -1.3230 -1.5432 -1.6454 -0.6471 2.1466 1.1660 0.0077 0.4765 -0.8854 0.2926 1.3923 -0.3059 1.1904 -0.2639 -0.1394 0.6740 1.8891 0.1346 0.7724 -0.3795 1.3914 0.1949 0.2537 0.2030 -1.0466 -1.7449 0.0926 -0.4481 0.9442 1.4345 -0.2873 1.6205 0.3944 1.8444 0.4585 0.3227 -0.6596 0.2469 0.6431 -0.6101 -0.4896 -0.1932 -0.2504 0.2763 0.4786 0.3049 -1.3642 0.9756 0.6524 -1.4421 0.8991 -0.5358 0.3226 0.5169 0.9476 0.6863 0.3280 -1.3607 -2.3779 1.3800 0.0429 -0.0337 -0.3323 1.4589 -0.0151 0.0016 1.9397 1.3958 0.0635 0.5809 -1.2294 -0.7684 0.2752 -0.1363 -0.4472 -1.9202 0.6113 -1.5393 1.0244 -0.4704 -0.9403 0.1283 -0.0495 -0.7096 2.1530 0.8839 1.1634 1.3764 -0.0949 1.1637 1.2149 -0.4992 -0.7807 -0.3683 -0.5620 0.2672 1.8319 0.1938 1.1637 -0.3766 -1.9181 -0.1870 -0.7506 -1.4758 -1.6850 0.0674 0.1305 -1.0250 0.0157 0.7681 -0.5138 1.4520 1.0941 -0.0413 -0.3085 -0.5557 1.2707 0.5351 0.0852 -1.4587 2.1165 -0.5023 -0.7162 -2.9477 0.4354 1.0899 -0.2731 -1.0442 0.9025 0.6024 0.4137 0.1123 1.4792 0.9409 0.9352 0.1235 -0.4450 0.8281 -0.2302 -0.4838 0.4343 0.9421 0.7261 -1.0018 0.6372 -0.0366 -2.6712 -0.9471 1.4755 1.7074 0.1543 -0.1392 -0.7453 1.1667 0.7964 1.1151 0.5708 -0.4716 -0.2233 -0.5203 -0.5053 -0.4325 -0.8067 0.0952 0.4046 -0.0914 0.1402 1.9834 0.4164 -0.2153 0.8474 -0.3966 -1.5659 0.7017 -0.2534 1.3079 -1.4326 0.1859 -0.4704 1.2902 -1.1976 -0.3658 -0.4852 -0.5777 0.9403 -0.0293 0.0722 -0.2228 -0.0864 -0.6416 0.6008 0.6949 -1.1234 -0.4535 0.7860 -0.3505 -2.9975 -0.4689 -0.5740 0.7947 0.2923 1.9318 -1.1317 0.5689 -0.1567 0.5133 0.0445 -0.2241 -1.0253 -0.3296 -0.3192 1.6496 1.2855 -0.2539 0.3369 0.2528 1.6775 0.4182 0.4016 -1.0807 1.3064 -0.8747 -0.4546 0.6390 0.9813 -0.0724 -1.0852 -0.2496 -0.5249 -2.2171 -0.1689 0.1787 0.6532 -0.1784 -1.6934 0.2165 0.8475 -0.3359 -1.2510 0.2515 -2.4004 -0.0729 0.0176 -0.7110 -0.1875 0.7608 -1.3780 1.0041 -0.2617 -0.1919 0.4284 -0.6586 -1.8870 1.1035 -1.7859 0.4440 -1.4530 -0.6337 -1.0659 1.1136 -0.6558 0.8549 -0.7050 0.1670 0.3135 -0.8708 1.6337 -0.1936 -1.5203 -2.1247 -0.7435 1.0804 -1.9666 -2.0229 0.2054 -1.9234 -0.6110 -0.2995 0.1440 0.5542 0.5700 1.2289 -0.7902 1.2868 -1.3327 -0.5214 1.2195 -2.4921 -0.5125 -2.1311 -2.3909 -0.4639 0.0688 -0.1327 -0.8147 1.0170 1.3185 1.4073 -0.3685 1.0048 1.6181 17alpha-hydroxypregnanolone glucuronide 1.1993 0.5511 0.0192 -1.0652 -0.5718 -0.0726 -1.2330 -0.9175 -2.7113 0.2464 -2.5198 0.0215 -2.5981 0.9097 -0.3434 -0.7328 0.0600 -0.0012 -0.9361 0.2780 -2.4766 0.3043 -1.0220 0.2051 0.4372 -0.2239 -0.3017 0.6688 -2.4738 -0.1251 0.3820 0.1265 0.3032 -0.5907 -0.5298 -2.3285 0.0039 0.5877 0.3251 -0.4779 -2.3889 0.1754 -0.6403 -0.2659 -0.2631 -0.5056 1.0642 -0.5028 0.5347 -2.6197 0.3395 0.5843 0.1561 -0.2062 -2.3384 -0.3366 -2.6610 0.4602 -0.0071 -0.0198 -2.4870 -2.8231 -0.5805 0.5984 -0.1536 0.2397 -0.3792 0.1769 -0.0080 -0.8274 -0.1680 -0.7148 -2.7129 -0.4923 -0.2053 -0.3401 -2.4890 -0.0230 -0.9041 -1.5458 0.1778 -0.3356 -0.6628 0.6125 -0.0103 -0.1280 -0.9242 -0.0827 0.6858 -0.0143 0.7198 0.1599 0.0549 0.8454 -0.9949 0.8028 0.7795 0.6878 0.4126 -0.0767 -2.8081 0.9199 0.0801 0.1866 -0.1447 -0.8218 -1.1677 -0.5136 0.1507 1.1257 0.0460 0.3324 -1.3042 -0.3934 -1.0327 -0.4838 -0.2202 0.6915 -0.1795 -0.3553 -1.0504 -0.4626 0.0481 -0.0085 -2.8885 -0.5262 -0.3333 -0.1672 -0.1677 0.3014 -0.1698 -2.5284 -0.1640 0.0795 -1.2072 0.7423 0.3195 0.4051 0.7460 -2.1903 -2.4487 0.7987 -0.1719 -2.6847 -0.1348 -0.0364 -2.6367 1.3704 -0.5702 0.5269 -0.2708 0.4481 -2.5422 0.4011 -2.6989 -0.1036 -0.3518 -0.1765 0.5699 -2.2161 0.1513 -0.3452 -2.4899 0.0191 0.1924 -0.0274 -0.0995 0.4457 -0.1451 0.3993 -0.1262 -2.6768 0.1655 0.1763 1.0825 -0.3310 0.2767 -2.4652 -0.4167 -0.0597 -0.8258 -0.8299 -0.3237 0.3266 0.4563 0.7431 -0.0437 -0.8119 0.7984 1.1219 -0.0127 -0.1313 -2.5564 -0.3663 0.3755 0.6001 -0.6303 -0.3432 0.7233 0.4228 -0.5029 -0.0901 -2.0102 0.7102 0.2642 0.1916 1.0894 -1.9628 0.1431 -0.3177 0.5725 -0.4492 -0.2356 0.3938 -2.8414 -0.7544 -2.9266 -1.0459 0.4482 -1.0330 -0.6280 -0.0360 -0.5676 0.5490 -0.1898 0.7578 -0.3178 -0.4167 0.5982 0.6654 0.1847 0.6185 -0.0066 -0.2090 0.5959 0.2665 1.2015 0.9941 -0.1261 -0.0894 -0.1421 0.6437 0.1983 -2.9851 -0.3698 1.0300 0.6921 0.4211 0.1823 0.0653 0.3615 0.3403 -0.7864 -0.0673 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-0.2617 0.6606 -0.1453 -1.6692 -0.9270 -1.9756 0.6843 -0.1322 -0.6351 1.9017 -1.0784 1.0131 -0.1982 0.1465 -2.2005 1.0226 -0.7534 -0.2422 -0.8797 -0.2874 -0.7099 -0.5828 -0.5998 0.4741 -1.2481 -1.1128 -2.6262 -1.1790 -1.5704 0.1153 0.3459 -0.5586 -0.9166 -0.3659 -1.8838 2.5829 0.6726 -0.7945 1.5240 -2.0173 -0.2687 1.9718 0.3697 -0.3541 0.8353 -2.3104 -0.4585 -1.7294 -1.0314 0.0319 1.8322 1.8263 -1.0994 -1.8074 -0.3310 0.0025 -1.5156 0.8603 1.7333 1.8369 -1.2353 1-arachidonoyl-GPI* (20:4)* 0.3180 -0.2050 -1.1946 0.7032 0.9637 -1.5750 -0.7058 -3.8360 0.0269 -1.1547 -1.5089 -0.2325 2.5128 -0.7543 -1.5434 -0.3520 -1.5311 0.0152 1.2604 0.7797 0.4356 0.6718 2.0907 1.0113 0.8364 0.9308 -0.2808 -0.3406 0.3261 -0.0089 0.2864 1.2286 0.4880 0.3382 0.0167 -2.1929 0.1447 0.4096 0.6464 0.6202 0.2093 1.5257 0.5165 0.2687 2.0477 -0.5792 -0.4640 0.1752 1.6753 0.6046 0.9872 0.7111 -0.0682 -1.5720 0.7235 0.2202 -0.0894 2.1859 0.8910 0.9628 1.1482 0.9182 1.0481 -1.9532 1.4292 1.0898 0.0128 0.6010 -0.2322 0.1724 0.8267 0.8970 0.3599 0.5389 -0.4350 -0.6182 0.4428 0.2759 0.5516 -0.1634 0.3876 -0.4218 0.0410 0.8246 -2.5139 0.6840 0.9400 -0.4450 0.0659 1.1871 0.5828 2.2645 0.0408 1.4457 -1.0746 1.0441 0.9906 0.6042 0.7600 0.3603 -0.7913 -0.5042 0.8003 0.2062 0.8865 -0.3843 -1.6455 0.7386 0.6042 0.3922 -0.8498 -0.8284 1.1536 -0.2712 -1.3693 -0.0622 0.8026 0.3812 -2.2621 1.7108 0.1675 0.3786 0.9175 1.2715 0.4265 -0.9710 0.7866 0.0228 0.1311 -0.2209 -0.6438 -1.8769 -0.0921 1.4014 -0.7383 -0.9731 0.9637 -0.0068 1.1369 0.8651 -0.4762 0.6740 0.5798 -0.7948 0.5984 -0.1135 0.4353 -1.1790 0.6936 2.2378 1.4528 1.7424 0.3090 0.6417 0.5124 1.1816 0.0331 0.7755 0.1035 1.3297 -1.3645 -0.6830 0.7099 1.2524 -0.0940 -0.0161 0.6345 0.2136 -0.5207 -0.8463 -0.6893 1.3241 -0.1746 -0.5777 -0.2385 2.4720 0.1172 0.5188 0.3944 1.4022 0.2460 -0.4180 1.5474 -0.4302 0.7223 -0.0425 0.7077 1.3057 -0.0463 -0.0605 -0.3864 -2.6105 1.5697 0.2452 0.6794 0.9092 0.6947 0.5119 0.7202 1.0031 -1.0032 0.0523 -1.0574 0.0576 -0.5314 1.2410 0.0842 1.6524 0.6302 -0.0490 -0.8391 -0.9189 0.3218 0.3717 0.0256 0.7272 -2.1290 -0.8905 0.7355 -0.7039 0.5757 -0.2573 0.2593 -0.9067 0.4391 -0.9150 -0.8653 0.2499 0.2246 -0.1166 -0.3961 0.9401 0.7241 -0.2362 -1.6750 -1.1392 -0.0659 -0.0419 0.6926 0.0832 -0.1528 0.4817 -1.3459 -0.4100 -0.5829 -1.7532 0.1103 -1.1597 -1.3768 -0.8860 -0.9348 -0.6711 0.1961 0.8303 0.0915 -0.7405 -0.5309 -0.7762 0.4976 0.3072 -0.2496 0.7858 -1.1459 -0.5215 0.4624 1.5002 1.0392 -0.4176 -0.9132 1.3932 -0.2338 -0.7012 0.1384 -0.6625 -0.7661 -0.0060 1.6627 0.8758 0.8924 1.0606 0.0151 0.7034 0.4320 0.5373 0.6799 1.5744 0.6655 1.5625 -0.8924 -0.5666 0.0234 0.6194 -1.6700 -0.5839 -0.4755 -0.5730 -2.2628 -0.5978 -1.3790 0.5261 -0.1246 -0.7036 0.7151 0.9348 -0.1439 0.8204 -2.1278 1.0963 0.6965 -0.9652 0.7841 -0.8805 -1.5049 -0.0261 0.6286 -0.1709 0.7665 0.3567 -0.9274 -1.4351 -0.3337 -1.8989 0.7251 1.4892 0.1516 -0.0559 0.1039 -1.5401 -0.6229 -0.3073 -0.6030 -0.3017 -0.6860 -0.5422 0.8904 0.3396 -2.8874 -0.3592 0.1871 -1.2882 0.0405 -0.8775 -1.2896 -0.6902 0.4080 -0.9065 -0.4211 1.2155 1.3895 -0.8250 0.9197 -1.7201 -2.5762 -0.6674 -3.2146 0.4849 0.8222 0.7328 0.8813 -0.9912 -0.7547 0.5706 1.2556 -1.8908 -0.0919 -1.3683 0.1776 -0.6456 0.5632 -0.4083 -0.9695 -0.2265 -0.0694 -1.1110 -0.4161 -3.0862 -0.6701 -1.2730 -1.4505 -1.4215 0.5875 -0.4226 -0.4265 -0.4543 0.6158 -0.1784 0.4914 1.0544 -0.5501 0.9095 0.7775 0.5022 -1.5381 -0.1657 -1.2781 1.3118 -1.0170 -0.8022 0.8756 0.9405 0.6432 -2.3045 -1.0130 -1.8313 0.2534 -2.9336 0.1102 0.3609 0.0909 -1.7119 1-arachidonylglycerol (20:4) 0.1498 1.6286 -0.6523 0.0176 0.0916 -0.5675 -0.8939 -1.1019 0.8629 -1.7406 -0.3175 2.1357 1.6966 -0.5466 -1.3285 0.4867 -0.5214 1.6782 1.0906 -0.4162 0.0605 -0.3567 1.3690 -0.2233 -0.7949 -0.8606 -0.2407 0.5267 0.6467 -0.3357 0.0559 -0.5592 -1.9266 -0.5342 0.5873 -1.0220 -0.6567 0.0443 0.6625 1.2757 2.0931 0.8033 0.4068 1.0470 0.4620 -0.6952 1.3475 -0.3112 -0.6025 -0.5044 0.1620 0.3908 0.1553 -1.1254 0.8660 1.7936 0.5326 0.6889 0.9769 0.8062 0.5326 0.5758 -1.0532 -0.4800 -0.1858 -0.7256 0.4695 -0.2336 1.6858 -0.1827 1.8014 0.9106 -0.1613 -0.5071 -0.0297 -0.3100 -0.2460 -1.1104 0.5178 -1.0612 -1.3766 -0.9839 -0.4920 0.2908 -1.1042 0.0519 -0.2248 -0.5104 -0.5942 0.3261 0.1500 -0.2715 1.4747 -0.8742 -0.0369 0.6200 -0.1434 1.4756 -1.3725 0.7618 -0.8002 -0.2501 -0.6635 0.4690 -0.6572 1.2100 -0.3919 0.0697 1.6408 0.4327 -0.2442 -1.0849 -1.2843 -0.1967 -1.1549 -0.1645 -0.5623 -0.4650 -2.7750 -0.7460 -0.3542 -0.0748 -1.0622 3.8386 0.5317 -1.6488 -0.6466 -2.1244 -0.5592 0.1912 0.2398 -0.2226 -0.5566 -0.4221 -0.9624 0.2981 0.4494 -1.0749 0.3881 -0.2193 -2.2444 0.5070 -0.3519 0.4623 0.1250 1.2221 2.5486 0.1748 -0.8844 -0.0803 -0.1541 -0.0616 0.7186 1.5260 0.2538 0.8656 0.2612 0.6009 -0.1102 0.9473 -1.0575 0.6567 0.8795 0.4977 1.2990 0.4270 0.6483 0.7886 -1.2105 0.1610 -0.1206 -0.3355 -1.4966 0.1259 -0.4176 0.9017 -0.5702 -0.6721 -0.8322 1.5451 1.2051 -0.8045 0.5715 -0.2156 -0.7160 1.3734 -0.5192 0.8353 -0.5693 0.0101 0.1842 -0.6642 0.4146 1.5008 0.2967 0.4710 -0.6619 -1.0107 -0.9059 1.3030 -0.3556 1.1573 -1.5191 -1.2138 -1.2107 -1.3556 -0.3637 0.0687 0.0554 0.8659 0.0609 -1.9636 0.4009 1.8267 -0.6498 -0.7704 -0.6846 -1.4238 0.1222 0.7831 1.2807 -0.0639 2.7268 -0.5941 -0.7539 -0.6273 -0.2975 -0.0370 0.3287 -0.6484 1.7480 0.4577 -0.3850 1.0189 -0.9964 -0.0581 0.2912 0.5718 0.2231 1.0408 0.2510 0.3508 -1.3758 -1.2440 -1.1392 -0.8489 -1.3771 -0.1928 -1.3133 0.1048 -0.5157 1.5973 -1.7271 0.4666 0.2576 -0.0716 1.1651 -1.6878 -0.0333 0.3087 -1.0192 -0.2808 -3.0990 -0.3648 1.3978 1.3514 0.4626 -0.5387 0.2855 1.2347 0.1512 0.3146 -0.1726 1.0732 -1.0277 -0.5691 3.2400 -0.7128 -0.1992 0.5671 1.0789 0.1059 1.4283 -1.2976 0.5904 0.3719 -0.8407 0.3705 -0.3654 -0.3281 -0.1829 1.7208 -1.0710 0.3715 -1.3437 -0.1781 -0.7065 -1.2045 0.9169 0.7155 0.2672 -1.1435 1.7501 -1.3288 -0.4714 -0.5449 -1.7989 -0.3129 0.8381 -0.4251 -0.8668 -1.3476 -0.9727 0.7000 1.7003 -0.6524 -0.2286 -1.0282 -1.3694 -1.3465 -0.1019 0.5064 1.1463 -0.9310 -0.8275 0.9193 -0.3311 0.9837 -0.6208 -0.8786 0.8704 -1.4076 0.6766 -0.7548 0.8607 1.4962 -0.6777 0.4187 1.2190 -0.7384 -0.4060 -0.5536 0.1066 -0.0641 0.5913 -1.7812 1.8033 0.2780 0.7484 -0.0216 -0.1212 -1.7157 -0.1629 -0.3631 -1.7942 -0.1405 0.6264 0.5428 2.8214 0.8195 1.3081 1.0676 1.0887 -0.6991 1.3659 -1.3240 0.8295 0.5625 0.8732 0.0985 0.2316 -2.5274 0.4433 -1.7140 -0.0525 -0.1304 0.7084 0.0169 -0.7303 -0.3848 0.6291 -0.5327 0.7233 -0.7915 1.3901 1.3902 0.5898 1.3032 -0.9919 2.3302 1.2828 0.2449 -3.8622 1.7426 -1.6021 0.6766 -1.2381 -0.1445 -0.5517 -0.3968 1.5430 -0.1169 0.6362 -1.1320 0.5816 -0.5301 0.6917 1.0593 1.4817 -0.3444 1-carboxyethylisoleucine 0.5737 -1.3128 1.5818 -0.7055 -0.2523 1.7804 0.9134 2.2448 1.3822 2.7579 3.0351 0.2033 -0.7441 0.9929 0.5592 -0.9326 0.8219 -0.7972 -0.7652 -0.5451 -0.6131 -1.3221 -0.3769 -0.7951 -0.7794 -0.7839 0.2793 -0.6823 -0.6083 0.7475 -1.0654 -0.6212 -0.3371 -1.1535 -1.2168 2.8518 -0.7511 -0.5102 -0.6743 -1.0677 -0.4954 -0.2409 0.0832 0.0720 -0.6225 0.9226 -0.8260 -0.0497 -0.7872 0.3791 -0.7863 0.6586 -0.7203 -0.9325 -0.4261 0.2214 -0.8323 -0.4195 -0.8811 -0.2573 -0.6269 0.2504 -0.9940 1.9387 -0.3832 -1.0915 -0.8543 0.1400 -1.0438 -0.5970 0.1474 -0.9841 -0.8914 1.0453 0.0770 0.8669 -0.6274 -0.7994 0.6026 0.8824 -0.8856 1.0344 -0.8100 -1.0422 2.6235 -0.9667 -0.6228 -0.7286 -0.2136 -0.4528 -0.1721 0.6358 -0.7404 -0.4055 1.6368 -0.7166 -0.7852 0.3622 -0.7327 -0.9707 0.3258 0.7370 -0.6487 0.7345 -0.6798 0.9146 2.7758 -0.8767 -1.2723 0.4201 0.1853 -1.0372 -0.6125 1.1460 2.1472 1.0089 -0.5969 -0.7385 2.5147 -1.1209 1.2657 -0.7485 -0.8748 -0.8915 0.5282 1.9407 -1.0023 0.5972 -0.9523 0.5382 0.9400 1.9775 1.2445 -0.9994 1.0052 0.7159 0.4000 -0.4065 -0.8566 -0.2476 1.2380 -0.9038 -0.7519 -0.8556 -0.6531 -0.9039 -0.8093 0.9676 -0.6922 -0.6432 -0.5516 -0.5733 -0.6969 -0.5599 -0.8866 -0.6053 -0.7975 -0.5878 -0.3580 -0.3064 1.7702 -1.1334 -0.6253 -0.8160 0.4667 0.2429 -0.9994 0.9658 0.7473 -0.8213 0.6342 0.0658 -1.2011 0.6584 -1.0341 -0.4773 -0.5616 -0.5730 -0.7468 -0.5462 1.3826 1.1357 -0.8933 1.5789 -0.6062 -1.1264 -0.8584 -0.7269 -0.5715 -0.2486 0.4064 3.1919 -0.7050 -0.6293 -0.6099 -0.4699 -0.7344 -1.1479 -0.8579 -0.4756 0.8343 -0.5904 0.6637 0.4477 -0.9000 -0.4551 -0.9002 0.0253 0.6851 -0.8156 -0.7710 1.0005 -1.1405 0.0456 -1.0626 0.7957 3.3085 1.9843 -0.2009 1.8252 -0.9040 0.4870 0.1136 0.7343 0.9518 0.7184 1.7852 0.4268 -0.3448 0.7537 0.4743 -0.6520 -0.7776 -0.4144 0.2578 1.3430 0.7135 -0.7336 0.3741 0.9181 -0.9087 1.4750 2.0439 2.1469 0.5413 1.6905 -0.9042 0.3321 1.4370 0.9105 0.0769 1.1985 0.1318 0.5660 -0.9622 -0.2647 -0.9432 0.4543 0.0956 -1.0663 -0.9772 0.5067 0.6930 1.2445 0.5240 -0.4637 -1.0240 0.3467 1.0989 -0.9923 -0.9973 -0.0058 0.4461 -0.2018 0.1390 0.7110 -0.9403 -0.9428 0.2912 -0.5700 -0.0830 -0.4525 0.2547 -1.0856 -1.2007 0.4715 -1.0064 -0.8840 2.1487 -1.1856 -0.2259 -0.1623 0.4498 0.3680 0.4606 0.6154 1.8925 0.1116 1.9179 0.6055 1.0177 0.6215 -0.2025 -1.0398 0.0980 1.2861 2.0227 -0.5818 -1.0367 1.2471 -0.7977 0.3608 1.0515 0.0585 -1.2006 0.4631 -0.8183 -0.8887 1.4399 1.0298 -0.8676 1.8845 -1.4176 -1.1303 -0.9625 -1.2643 -0.9210 1.2536 -0.9570 -1.0895 -0.7462 -0.7549 -0.8542 -0.6316 -0.9252 0.3828 3.5499 -0.9448 -0.7336 0.9667 0.7381 -1.3124 0.3641 0.5142 0.9288 -0.7837 -0.6849 -1.0706 -0.9961 0.3571 -0.6132 -0.1694 1.3190 -0.0140 1.4560 0.3793 -1.1524 -1.0336 1.4278 0.5166 0.3792 0.2164 -0.9028 -0.0677 -0.9655 -0.0796 -1.1356 0.4666 1.1431 -0.0291 0.4508 -1.0109 -0.8469 -0.8379 -0.0497 2.9359 0.2291 1.3362 1.4873 -1.0316 -0.8881 0.9283 0.8827 0.4171 -0.0768 0.7872 -0.0199 -0.9793 -0.4652 -0.4648 -0.6243 -0.8683 1.3847 -1.0111 0.5925 -0.0234 0.9331 0.7264 -1.3486 -1.0450 -1.2636 0.0651 -0.7990 -1.0926 -0.2910 1.2711 -0.9479 1.2545 -0.8973 1.9900 1-carboxyethylleucine 1.0739 -1.6751 1.4136 -0.3244 -0.8786 2.0402 0.0315 1.9756 1.2615 2.3165 2.4164 0.3721 -1.2480 0.3334 0.6583 -0.8043 1.0855 -0.3584 -0.1409 -0.1197 -0.5329 -1.6821 0.1939 -1.2862 -1.2744 -1.2778 0.6847 0.4624 0.4936 1.2933 -1.4892 0.3276 -0.9423 -1.5555 -1.6030 2.6052 0.7232 0.6644 -1.1955 0.0064 0.1683 -0.8701 0.0431 0.2437 -1.1566 0.7081 -0.4568 0.5403 -1.2803 -0.1599 -0.0996 0.9070 -1.2301 2.4774 -1.0092 0.7039 -1.3142 -1.0041 -1.3508 0.3142 -1.1599 0.2297 -1.4356 1.8996 -1.2739 -1.5087 -1.3307 -0.2599 -1.4729 0.4429 0.6165 -1.4281 0.5945 0.3874 -0.0523 0.8908 -1.1602 -1.2895 0.3694 0.7040 -1.3541 1.6867 0.3459 0.0505 2.1204 -0.0767 0.1911 0.3460 0.5093 -0.2916 -0.2220 0.9305 -1.2452 -0.9936 1.9768 -0.1107 0.2595 0.6143 -1.2393 -1.4181 0.7858 0.8478 -1.1762 0.3493 -1.1998 1.0344 2.1355 -1.3475 -1.6448 0.1870 0.8496 -0.4518 -1.1491 1.4055 1.9092 0.8087 -1.1374 0.7490 2.0957 -0.4000 1.6178 0.5219 -0.4503 0.4172 -0.3953 1.6041 -0.4861 0.1120 -1.4042 0.1104 0.8103 1.8523 0.9027 -0.1532 0.9910 0.4757 -1.2715 -0.9945 -0.0608 -0.8751 1.1007 -1.3679 -0.5989 0.0052 1.2408 -1.3680 -0.5656 1.1809 -1.2090 -1.1721 -1.1034 -1.1197 -1.2124 -1.0963 -1.3550 -1.1437 0.7508 0.2598 0.2774 -0.9191 1.2947 -1.5402 0.7010 -0.3461 0.7169 -0.2975 0.3564 0.7790 0.5783 -1.3059 0.7047 0.0371 0.2855 1.0901 -0.0324 -1.0475 -0.0421 -1.1195 -1.2500 -1.0993 0.8410 0.3883 -0.8876 0.9017 -1.1443 0.3135 -0.1372 -1.2351 0.1142 -0.0966 0.6289 2.8040 -0.1239 0.2048 -1.1471 0.4773 -0.1452 -1.5512 0.1012 -1.0463 0.9880 -1.1324 1.1175 -0.3815 0.9379 -1.0308 -1.3651 -0.6701 0.1743 -1.3015 0.3807 0.1646 -1.5456 -0.3785 -1.4871 1.0552 2.4288 1.6282 0.2904 1.2990 0.4311 0.4860 -0.1295 0.9890 0.3579 -0.1254 1.7819 0.5353 -0.3047 0.3713 0.5802 -1.1789 -1.2731 -0.0933 0.4625 1.3057 0.6423 -1.2402 -0.2203 0.6308 0.3097 0.3521 1.9118 1.0141 -0.4355 1.4442 0.1817 0.0164 1.2643 1.1567 0.2494 0.9783 -0.1096 0.7956 0.1393 -0.3330 -0.9593 0.4782 0.4897 -1.4900 -0.1215 0.1623 0.2568 1.4449 0.3209 -1.0374 -0.5951 0.0316 0.8885 -1.4344 -1.4381 -0.0096 0.7744 -0.2265 0.3164 0.4124 -1.3952 -1.3972 -0.3618 -0.4092 -0.5161 -0.0896 0.1260 -1.5043 -1.5910 -0.2795 -1.4449 -1.3530 1.5824 -1.5794 -0.1995 -0.2641 -0.4175 -0.2043 0.4152 0.1140 1.5866 -0.5238 0.8073 0.7463 0.9639 0.3563 -0.1071 -1.4701 -0.5817 -0.0277 1.7714 -1.1260 0.4232 1.0385 -0.5776 0.0601 0.2820 0.0348 -0.8290 0.4244 -0.4523 -0.3894 0.6851 1.0793 -1.3406 1.7931 -1.7539 -1.5379 -1.4119 0.1363 -1.3807 1.0538 -0.2641 -0.1091 -0.1716 0.8648 -0.6183 0.6993 -1.0873 0.3813 3.0300 -1.3988 0.2000 0.8566 0.2140 -0.0754 0.1314 -0.2039 0.8749 -0.1126 -1.2035 -1.4931 -1.4372 0.1083 -1.1497 -0.1276 1.5689 0.0346 1.6473 0.3031 -0.1699 -0.2037 1.1477 0.4389 0.4447 -0.1778 -1.3671 -0.0480 -0.5978 0.2920 -0.8968 0.2723 1.3820 0.2317 0.8858 -0.7660 -1.3252 0.2660 -0.0722 2.5954 0.3691 1.5557 1.4770 0.1965 -1.3562 0.1192 0.0346 0.7531 0.1318 0.0356 -0.1450 -1.4246 -0.3963 -0.4155 -0.7990 0.0734 0.0698 -1.4484 0.3164 -0.7753 0.6918 0.1741 -0.7211 -1.4738 -0.0754 0.5317 1.3005 -0.1068 0.0707 1.5103 0.2198 0.0352 0.2125 1.7755 1-carboxyethylphenylalanine 0.7881 -0.4183 1.3405 -1.1079 -0.9769 1.9898 0.3700 2.1139 1.1774 3.3373 3.2056 -0.2822 -1.4466 0.6921 0.7751 -1.2579 0.5250 -0.7799 -1.0310 -0.8540 -1.4477 -0.9365 -0.4415 -0.4494 -1.3087 -0.8744 -0.4069 0.2632 -0.4979 0.7057 -0.7646 -0.7648 0.4018 -1.0791 -1.0044 3.3633 -0.1017 0.1872 -1.1269 -0.7430 -0.4185 -0.7732 -0.0989 -0.2860 -1.6931 0.6623 -0.8721 0.3032 -1.0487 0.2193 -0.5042 0.2425 -0.8158 2.4093 -0.6134 -0.0093 -0.2763 -2.5727 -0.9412 -0.4658 -1.0087 -0.4731 -0.6072 2.2189 -0.0890 -0.4617 -1.2359 -0.8083 -0.7119 -0.2651 -0.2684 -1.3069 0.0760 0.6587 -0.0037 0.7418 -1.3000 -0.4197 0.5328 0.9475 -2.1510 0.9188 -0.2591 -0.7144 2.3961 -0.4883 -0.1482 -0.2461 -0.1386 -0.5847 -0.8225 0.3644 -0.0213 -0.9241 1.6568 -0.3648 -0.1775 0.0153 -1.0146 -0.5578 0.0053 0.7740 -1.0686 0.6334 -0.9487 0.6986 2.6071 -0.3894 -1.6961 0.3800 0.5235 -0.1386 -0.2765 0.7719 1.9707 0.7223 -0.8920 0.4798 2.5634 -1.2195 1.3333 -0.1899 -0.8988 -0.2334 0.1104 1.5954 -0.4157 0.4941 -1.4363 0.3235 0.2317 2.0609 0.7276 0.5513 1.0299 -0.1630 -0.3663 -0.9938 -0.6376 -1.3253 0.4157 -0.7775 -1.3565 -0.3261 0.4904 -1.4289 -0.3998 0.7531 -0.6992 -1.3699 -0.7838 -2.7693 -0.7921 -0.4342 -1.5247 -0.5011 0.1141 -0.6374 0.0411 -1.4471 1.3396 -1.0751 0.2709 -1.4216 0.3230 0.2723 -0.6373 0.9330 0.0277 -0.8586 0.0485 -1.0946 0.3408 0.5688 -0.2114 -2.6376 -1.0247 -0.7067 -1.1180 -1.6514 0.9931 0.6046 -0.3149 0.5889 -0.3096 -0.2378 -0.1744 -0.9994 -0.1471 0.1969 0.5675 3.6577 -0.6165 -0.4015 -0.3686 -0.3414 -0.3852 -0.5921 -0.5196 -1.3965 0.8367 -0.5307 0.6109 0.3154 0.5421 -2.6116 -1.2232 -0.9169 0.4620 -0.5162 0.4561 0.7398 -1.3378 0.4690 -1.3368 0.6317 3.2689 1.6930 -0.2870 1.2052 -0.4764 0.1584 -0.0292 0.3019 0.4332 0.1593 1.6033 -0.3855 -0.3561 -0.0650 0.1740 -0.2176 -0.7456 -0.5261 -0.0810 1.2350 0.1180 -0.6391 0.2484 0.2567 0.0859 1.3058 1.7920 1.6448 -0.0811 1.0046 -0.1107 0.5879 1.2404 1.1772 -0.6414 0.4413 0.0851 0.0989 0.0474 0.0513 -0.6952 0.7540 -0.1544 -1.6417 -0.2522 -0.1337 0.0913 0.6557 0.3001 -2.6299 -0.6221 -0.0216 0.8454 -0.2454 0.0648 0.6577 0.5549 0.0646 -0.1796 0.4470 -1.3857 -0.2445 -0.3998 -0.6461 -0.5455 -0.1316 -0.0919 0.0369 -1.1527 0.2771 -0.7245 -0.4758 1.4737 -0.1067 0.0799 -0.5032 -0.2729 0.5014 0.4743 0.4360 2.0225 0.4701 1.3490 0.1309 1.0748 0.3609 -0.6144 -0.7380 0.0620 0.9709 2.1499 -0.4996 -0.5953 0.7266 -1.5164 0.7125 0.2211 0.2849 -1.0127 0.2708 0.4447 -0.0290 1.3775 0.9459 -0.9885 1.9182 -1.0352 -0.6567 -0.1971 -0.5525 0.5162 0.9539 -0.3462 -0.4260 -0.6765 0.5628 -0.7945 -0.2071 -0.6724 0.4203 3.7765 -0.3261 -0.2323 0.6996 0.4999 -0.5609 -0.2507 0.1340 1.1563 0.0415 -0.0227 -1.0203 -0.5129 0.1638 -2.3283 0.9198 1.4253 -0.7872 1.9664 0.1242 -0.8984 -0.8259 0.6166 0.2098 0.3421 0.0719 -0.8151 -0.2597 -0.6079 0.5005 0.1783 0.3207 1.0969 0.0106 0.4819 0.4128 -1.5456 -0.1749 -0.2089 3.8281 0.4571 1.8533 1.3876 -0.4854 -1.3920 0.8188 0.5160 0.4938 0.4682 -0.0571 -0.3554 -0.3026 -0.5337 -0.8449 -0.5664 -0.0729 0.7178 -0.1205 0.8002 -0.8624 0.7295 0.6381 0.0079 -0.0292 -0.3901 0.2387 0.6815 0.1107 0.0184 1.3164 -0.5121 1.0898 -0.2142 1.6893 1-carboxyethylvaline 0.9711 -0.7004 1.3284 -1.3731 -1.8892 1.8407 0.2902 1.9708 1.1423 2.7334 2.7160 0.2216 -2.3798 0.2629 0.6104 -0.8857 0.8475 -0.8806 -0.2840 -0.0734 -0.3546 -2.9442 -0.0520 -0.4689 -2.4103 -0.4312 0.3864 0.6608 0.1073 1.0687 -0.5848 0.0788 0.0590 -1.2542 -0.6833 2.8805 0.6996 0.4117 -1.1901 -0.3019 0.1294 -1.8857 -0.1161 -0.0672 -2.2569 0.2775 -0.2402 0.2190 -1.0586 0.1271 -0.3075 0.6753 -0.7359 2.4217 -0.6489 0.4098 -0.6222 -1.0613 -2.5101 -0.1217 -1.4913 0.2495 -0.5318 1.9636 -0.3647 -0.7834 -0.8284 -0.5168 -0.7027 -0.0128 0.4436 -0.5339 0.1789 0.5309 -0.0297 0.7243 -2.2586 -0.4769 0.1492 0.8461 -1.1668 1.3221 0.3419 -0.3816 2.4358 0.0514 0.0070 -0.1094 0.0195 -0.3041 -0.6882 0.8215 -0.4336 -0.3232 1.9825 -0.0789 0.4395 0.4302 -0.6547 -0.7404 0.6120 0.7663 -0.3812 0.0994 -0.9795 0.9373 2.3202 -0.5504 -1.5102 0.1618 0.5472 -0.4736 -0.5277 1.0444 2.0828 0.7332 -0.3254 0.4254 2.4509 -0.4386 1.3632 0.3358 -0.8961 -0.2523 0.0327 1.7804 -0.3468 0.0897 -0.8926 0.0816 0.5320 2.2070 1.2591 0.2102 0.9226 0.3993 -0.5601 -1.2403 -0.5847 -1.8924 1.1907 -0.4476 -0.7058 -0.5273 0.7955 -1.1253 -0.3475 0.9818 -0.8708 -2.2719 -0.7895 -1.7902 -1.1064 -1.1310 -2.5116 -0.4769 0.6729 0.1794 -0.1129 -1.9389 1.4897 -1.0294 0.1956 -0.5498 0.5518 -0.0412 0.1629 0.5048 0.2045 -0.2413 0.2379 -0.3823 0.4551 0.9703 -0.3006 -2.1097 -1.1366 -0.2001 -2.3759 -1.7849 0.8133 0.5460 -0.7828 1.0340 -0.9170 0.0251 -0.3071 -0.5837 -0.1234 0.0730 0.5977 3.2565 -0.0215 -0.4377 -0.5294 0.1285 0.3807 -0.1438 -0.0463 -2.1107 1.0290 -0.8043 1.0346 -0.3067 0.5623 -2.0884 -0.7013 -0.4314 0.0877 -0.2615 0.2094 0.5797 -0.9211 -0.2549 -0.9491 0.6601 2.8591 1.8449 0.1172 1.4750 -0.0571 0.4715 -0.0304 0.6235 0.5421 0.0035 1.7858 0.4602 -0.2511 0.4191 0.1754 -0.2188 -2.4065 -0.3177 0.0900 1.2697 0.2148 -0.7390 -0.5283 0.6589 -0.0767 0.6438 1.9039 1.1431 -0.1689 1.3203 -0.3460 0.0523 1.1990 0.9741 -0.0221 0.8813 -0.1848 0.6665 -0.0335 -0.1890 -0.9841 0.1987 -0.0102 -1.2755 -0.2039 0.1250 0.3436 1.2030 -0.2108 -2.1004 -0.4454 -0.0639 0.8476 -2.6209 -0.1893 -0.2381 0.4116 -0.1295 0.2139 0.6194 -0.9881 -0.8586 0.2203 -0.8119 -0.0963 -0.0386 -0.0587 -0.7455 -0.6872 -0.0339 -1.0965 -0.6381 1.5742 -0.3511 -0.2964 -0.4724 -0.2788 0.0158 0.5800 0.2991 1.7346 -0.3989 0.8804 0.3773 0.7371 -0.0061 -0.4766 -0.4476 -0.1963 0.4828 1.9462 -2.2117 0.1729 1.0930 -0.2278 -0.0342 0.2666 0.2542 -1.1554 0.4256 0.0069 -0.1871 0.7573 0.8180 -1.3970 1.7588 -0.9618 -1.0827 -0.2792 0.1023 0.0572 0.7477 -0.6023 -0.7619 -0.1264 0.3154 -0.3316 0.2227 -1.6642 0.1809 3.2912 -0.6541 -0.1319 0.9576 0.1025 -0.3196 0.0312 -0.1146 0.6455 0.0840 -0.1018 -0.5790 -0.9759 -0.0345 -1.5169 0.0549 1.4423 -0.1701 1.7205 0.1621 -0.8155 -0.9376 1.2616 0.3408 -0.1526 -0.1930 -0.9324 -0.2730 -0.8960 0.2402 -0.3506 0.0617 1.1586 0.1341 0.6018 -0.4225 -2.4796 0.1504 0.1092 3.1513 0.0521 1.4568 1.3441 0.2347 -1.2233 0.3270 0.0347 0.7396 -0.2913 0.2205 -0.1405 -0.1301 -0.7639 -0.2602 -0.9110 0.0703 0.3229 -0.4048 -0.0190 -0.6477 0.5970 0.1890 -0.9941 -0.5830 -0.3411 -0.3179 0.9575 0.4318 -0.2005 1.5561 0.2029 0.5713 0.1544 1.9483 1-dihomo-linolenylglycerol (20:3) 1.4758 0.5838 -1.5286 -0.0473 -0.0526 -2.6667 -1.1693 -2.1588 -0.0856 -3.7281 0.0555 1.3918 1.8438 -0.4584 -2.2567 -0.5262 -0.4997 -0.1225 1.2599 0.3652 -0.2903 0.2529 0.8672 -0.2233 0.6005 0.1042 -0.5545 -0.1299 -0.1944 0.3051 0.4922 0.3849 -0.4966 -0.8422 0.4178 -1.6417 -0.1890 -0.3244 -0.1104 1.3898 0.4346 0.9660 0.4008 1.0889 1.4520 -0.9215 1.1650 -0.8458 0.1942 0.0022 0.1118 0.4821 0.0462 -0.7165 0.0962 0.1843 -0.2347 0.6230 1.4658 1.2644 1.2105 -0.3639 -1.0407 -0.5098 0.8759 0.0623 0.2059 0.4457 0.9940 -0.3203 0.8646 0.8416 0.4943 1.6231 1.0479 -0.8043 0.2736 0.4511 0.5617 -0.5052 -0.6797 -0.8058 -0.1198 1.0109 -0.5095 0.0860 0.6553 -1.4851 -0.1937 -0.0134 0.3690 -0.2967 0.6917 -2.4482 0.0596 0.5688 0.2029 1.3367 -0.6883 -0.0407 -0.7091 0.1816 0.5150 0.4159 0.7663 0.3500 -1.1496 0.3839 0.9059 0.9235 0.1685 0.0057 -0.2624 0.1761 -0.3677 0.1294 -1.0532 -0.1129 -1.0650 -0.4879 -0.4534 0.7612 -0.2416 4.8695 -0.7941 -1.2866 1.4793 -4.3517 -0.6922 0.6760 1.0703 -0.5245 -0.5232 1.0094 -0.1854 0.0993 0.7572 -0.6976 -0.4431 -0.0280 -1.0176 -0.1597 -0.4554 -1.1735 1.1000 1.0210 0.8150 0.6658 -0.3978 0.0182 -0.2837 0.3334 -0.3409 0.6026 0.4837 1.8522 -0.3352 0.6424 0.3640 0.6381 0.0115 0.2260 0.8125 1.4238 0.4118 -0.5756 -0.2607 -1.5685 -0.2971 -0.1664 -1.1113 1.0188 -1.2106 0.1435 0.5084 0.2296 0.4383 0.3397 0.2831 -0.1410 -0.4819 -0.5470 0.4895 1.0886 -0.1307 -0.1708 -0.1302 1.1236 -2.1635 -0.4209 -0.4477 0.1221 -0.2170 0.5301 0.6216 1.5533 0.8735 -0.0458 0.8959 0.5222 -0.4057 -0.5570 -0.6180 -0.7883 0.5730 0.3369 0.5867 1.1493 1.7644 -0.0532 -0.0714 -0.4487 -0.1833 -0.1229 0.4087 -0.5231 -1.9584 -1.2809 1.2286 -0.3100 1.5750 -0.3030 1.5927 -0.2080 0.2972 -0.3723 -0.2639 -0.6068 -0.1542 -0.1152 0.8339 1.2434 0.2299 -0.7422 -0.8391 0.1064 -1.3732 1.3453 -0.0202 0.2332 1.3744 -0.1416 -1.7675 -2.9953 -0.8222 -1.6052 0.4704 -1.4459 -0.3744 0.7783 -1.6025 -0.6009 -1.2262 -0.1198 0.7224 0.2950 0.3335 -0.5525 0.4775 -0.0954 -0.6257 -0.1950 -3.4768 -0.9598 0.9102 1.4794 -0.3789 -0.5085 1.0941 0.0501 0.7016 0.1956 0.5527 0.6834 -0.4363 0.6552 2.0340 -0.0171 1.3373 0.1076 -1.1847 0.9595 0.2875 -1.5570 0.4842 0.3169 -0.6820 -0.2218 0.6109 0.2554 0.6879 1.0946 -1.0158 0.4310 0.1657 0.3723 -1.0092 -0.1655 1.3512 0.8944 1.3299 -1.2916 0.3788 -0.1473 -0.3154 0.7579 -1.9753 -1.7217 2.2558 0.3899 -0.8868 -0.3861 -1.2911 -0.1185 0.5547 0.1896 1.1429 -0.4483 -1.1534 -1.0424 0.0913 -2.0403 1.3683 0.0558 0.1710 -0.3020 -0.3779 0.6090 -0.8227 -0.3783 -0.8541 -0.9745 -0.2294 0.0105 -0.5957 0.0915 -0.9480 1.1629 -0.4147 0.2489 1.0612 -0.1006 -0.7037 -0.1400 2.2153 -0.0281 1.0461 0.2473 1.8165 0.8491 -0.0973 -2.4354 0.4448 -0.0783 -1.7803 -0.1173 1.0016 0.3620 1.3759 -1.3585 1.0545 -0.7501 0.1474 -0.3294 1.5091 -1.1630 1.4326 -1.0058 1.0210 0.2030 0.0154 -2.3063 -1.0122 -0.7495 -0.9306 0.8722 0.6446 0.5971 -1.3700 -1.9436 2.0289 -0.8876 -0.1074 -0.1390 1.1510 1.3224 -0.8527 1.4332 0.1425 2.0041 -0.1382 -1.2301 -2.4853 0.5107 -0.6832 0.7228 0.3412 -0.0968 -0.8968 -0.9816 0.7784 -2.4200 -0.6320 -0.9424 0.8843 -1.4559 0.2363 1.5003 1.8104 -1.1216 1-dihomo-linoleoylglycerol (20:2) -0.5197 0.7904 -1.5471 -1.7951 0.9833 -1.9925 -0.3538 -2.0584 -0.5440 -1.5045 0.2597 0.4574 0.9887 -1.9599 -2.1513 -1.9997 -0.3547 0.7695 0.1150 -1.6518 0.5104 0.9079 0.2324 -0.0028 0.5254 -0.6144 -0.1415 0.3395 0.1669 0.5109 0.2760 0.0050 -1.4632 -0.0449 0.0088 -1.5239 -0.1961 -1.6195 0.6531 0.9043 -0.6619 0.6582 -1.9039 1.3495 1.1573 -0.6811 0.7817 -0.9841 -1.8696 -1.8538 1.3888 0.3597 -1.8096 0.6749 0.6507 0.3869 0.3121 0.8748 1.0110 0.9727 0.5020 0.5463 0.7385 -1.7800 0.4658 0.2874 -0.5736 0.2377 1.2700 -1.6979 0.3702 -2.0463 0.1511 0.7447 0.5115 0.3076 0.1903 0.3077 -0.0137 -0.2011 -1.9568 -0.8022 -1.8903 0.4747 -0.1538 -0.0901 1.0778 -1.1942 -0.2926 -0.2486 0.3956 -0.0446 1.4510 0.3282 -1.8394 1.1833 -1.8683 1.0978 -1.8197 0.1328 -0.2644 -2.2318 0.4308 -0.0567 0.5784 -1.2357 -1.9609 0.8531 0.7968 0.6575 0.2552 0.0325 -0.1755 0.8432 -1.9020 0.1665 -1.6973 -0.0207 -0.5943 0.2217 0.3314 0.1964 -0.9280 2.9379 -0.0221 -1.1438 0.7464 -1.9587 -2.0168 1.2383 0.3024 0.4964 -0.1532 0.1640 -1.9569 0.1060 0.8088 -1.5270 0.5405 -1.3834 -1.6552 0.2362 0.1402 -0.6873 1.3497 -0.1095 0.5571 0.3643 1.2414 0.4487 0.6726 0.8405 0.5256 0.7945 0.9307 0.9214 -0.9823 0.1901 0.3962 0.6316 -1.0822 1.0182 0.3756 1.3418 1.5015 -0.1745 -0.6651 -2.0148 0.0547 0.6942 0.1567 0.5414 -0.6523 -0.1511 0.1647 0.4136 0.7711 0.4616 1.0110 0.1710 -1.8353 -1.0718 0.5964 0.3881 -1.7058 0.3099 -0.2528 1.1881 0.2222 -1.7808 -0.1119 0.5858 0.4837 0.3601 0.7419 1.1724 0.3409 -0.6545 1.0431 1.4124 -0.5104 0.7429 -1.7457 -1.8726 0.6082 0.5144 0.8074 0.1261 1.1693 -1.8937 0.8256 0.0694 0.6199 0.7489 0.4502 -0.9509 -0.5842 -2.1731 0.7242 0.4013 1.7813 0.6030 1.0391 0.1502 -0.7499 0.2064 -0.3595 -0.2871 0.3182 -1.8824 -0.7107 0.6911 0.4058 0.3686 0.5773 -0.2607 0.8007 1.9754 -0.1984 0.7912 0.7774 0.8428 -0.9841 -2.2709 0.3175 0.0713 0.5772 -0.6899 -2.1323 0.4430 0.2767 -0.3728 -0.1599 -0.1452 0.8869 -0.4618 0.6683 -2.0014 1.0851 0.2014 -0.1658 -0.2622 -2.1364 -0.4650 1.4074 0.7946 0.3687 -0.1847 0.5689 0.9003 0.6607 -0.5011 0.6651 1.0168 0.1046 0.3440 1.2889 -0.1380 0.6059 0.3592 0.6316 0.4500 0.5795 -0.5198 -0.1386 -0.5301 -0.2356 0.9379 0.6841 0.1620 0.4647 0.2038 -1.6025 0.6119 -0.1354 -0.8439 -1.0665 -0.0799 1.1258 0.0409 -0.2894 -1.1182 0.2381 -0.5779 -1.9479 0.4419 -0.8410 0.1076 1.2890 0.9498 1.1308 -0.1324 -0.1687 1.3657 1.4756 0.6772 0.4931 -0.8404 -0.5607 -0.3539 0.5340 -1.2137 0.7290 0.7289 -0.0816 0.5614 -0.5732 1.2088 -1.0970 0.1610 -0.2509 -0.5775 0.1284 -0.0970 0.6211 1.0467 -1.6892 1.1263 -0.5533 0.5358 1.0725 -0.6238 -2.1504 0.2153 1.9260 -0.1615 1.7961 0.6287 1.2315 1.1254 0.4553 -1.3113 0.2249 0.2128 -1.6796 -2.2462 1.0369 0.5729 1.2262 0.1808 1.8812 1.0243 0.3814 -0.5994 1.8140 -0.8134 0.1009 0.1887 0.5952 -0.1080 0.3061 -2.0712 1.1367 -0.5681 -0.2680 1.0477 1.2383 -2.1691 -2.1247 -0.6010 1.3979 -0.7125 0.2183 0.0128 1.0509 1.0572 -0.0124 0.8214 0.6147 0.7055 1.3185 -0.8056 -1.4970 -2.0704 0.0016 0.9407 0.7720 -0.7076 0.1989 -2.1004 0.1530 -2.0841 0.4049 1.6921 0.2643 -0.2345 0.3509 0.3588 1.6069 -0.7545 1-docosahexaenoylglycerol (22:6) -0.2702 0.3450 -0.8678 -0.0636 0.2015 -2.3803 0.4808 -2.4474 0.0318 -1.8539 0.1040 1.8264 1.3565 -2.3303 -2.5342 0.0754 -1.0731 0.0855 1.1709 0.7532 0.9910 0.6533 0.5510 -0.6717 0.7681 0.0077 0.4559 -0.2144 1.0026 0.4454 0.5623 -2.0683 -1.0149 0.1642 0.4785 -0.9336 0.5137 -0.4696 -0.2323 1.2445 0.8803 0.7232 0.1930 0.8195 1.2470 0.0235 -0.0939 -2.2192 0.8010 -1.0463 0.5345 0.9768 0.5801 0.6303 1.2625 0.7845 0.9597 0.4996 0.6210 1.1406 0.4797 0.2450 -0.1596 -0.6134 0.4272 -0.7329 0.5540 -0.1197 0.2654 0.1732 1.1201 0.5339 -0.8260 0.4272 0.2017 -0.2671 0.2912 0.4794 0.1585 -0.3827 0.0614 -1.3818 -0.7835 0.4740 -0.4007 1.1607 0.5444 -1.5104 -0.8396 0.6796 0.8432 -0.1793 0.6760 -0.7864 0.1496 0.4946 1.2744 1.4348 -2.1669 -0.0880 -0.0369 0.4744 -0.9650 -0.7206 0.4693 -0.2598 -2.3440 0.2907 1.0714 0.2301 -0.2877 -0.2480 0.8990 0.0853 -1.1922 -1.1474 -0.8770 -1.1815 -2.4030 0.5367 -2.1148 0.8038 -0.4871 3.3650 0.0370 0.2580 0.8711 -1.3549 0.2296 0.0320 0.5076 -0.8984 1.4896 -0.1998 0.2989 -0.3136 0.5099 -0.9386 0.7439 0.1218 -0.8107 0.2888 -0.2338 -0.6479 0.9376 0.6144 0.9252 0.2242 0.0726 1.0896 -0.3005 0.8589 0.6491 0.4577 0.0803 1.3855 -0.4526 0.8310 -0.0454 1.2988 -0.8818 0.6090 -0.1970 1.8995 1.6429 0.2200 1.3154 -1.0336 0.3737 0.3751 -0.1298 0.3039 -0.2056 0.9326 1.2403 0.1604 -0.0858 0.1499 0.2427 0.0194 -0.8616 -1.2865 0.9891 -0.0880 -0.1740 0.7588 -0.8236 1.7142 -0.3623 -0.5666 0.6016 -1.4454 0.0921 1.7772 0.8211 0.5818 -0.4239 0.4858 -0.4562 0.5912 -0.4192 0.5671 -2.0940 -2.2021 -0.2100 -1.4416 0.5603 -0.0394 -0.1540 -2.2339 -0.7365 -1.7094 -0.0263 0.1519 -0.8397 -0.0785 -0.7467 -0.4510 0.5128 0.0069 1.6277 -0.4543 1.1128 -0.4356 0.5817 -0.9095 0.5180 0.2158 0.5529 -0.1926 0.3782 0.8789 -0.1087 -0.2979 0.2148 -0.5095 0.5258 1.3861 -0.2325 -0.1022 0.4330 0.4498 -1.7216 -0.2054 -0.5604 -0.5281 -2.3521 -1.3856 -1.9297 -0.3525 -0.3944 0.1908 -0.9966 0.7345 0.2193 -0.5448 0.1167 -0.5724 1.2679 0.7382 -2.4055 -0.4174 -0.8470 0.0803 0.4882 0.7485 0.2339 -0.2325 -0.0402 0.7469 0.4790 -0.3141 0.1891 0.2983 -2.4201 -1.9600 1.8489 1.0448 0.8974 0.2396 0.2828 1.1572 0.4164 -1.2694 0.4297 0.0437 -0.5474 0.0899 0.3527 0.5963 0.1523 1.1372 -2.4128 0.2922 -2.2704 0.0079 0.1619 -1.2684 0.9224 1.4755 -0.0533 -2.4631 0.5536 0.7737 -1.3762 -0.1817 -2.4492 -0.0134 1.2843 0.2114 -0.0537 -2.4965 -1.1049 1.3980 0.9144 0.8293 1.6455 0.0835 -0.1476 -0.6948 -0.6259 -1.3665 1.2105 -0.8408 -0.1604 0.1936 -1.9001 0.3029 -1.2431 -1.1196 -0.5062 -2.1979 1.5239 -0.1699 -0.0577 1.3852 -2.4383 0.6483 0.0625 -0.0212 -0.0953 0.5805 0.0123 1.1331 1.1206 -0.7839 0.8030 0.0923 0.6821 0.2019 -0.2475 -1.5986 -0.4720 -0.3191 -2.4478 0.1724 1.1035 0.2064 2.2085 0.3364 0.8132 1.3180 -0.2733 0.8637 1.0644 -1.7614 0.8131 -0.2566 0.5497 0.4247 -2.1773 -1.9940 1.0709 -0.4843 -0.5126 0.3965 0.9512 0.5121 -2.5298 -0.1080 0.7916 0.1449 0.0466 -0.2510 0.7791 1.5078 1.0043 1.5024 1.3459 1.4702 0.5441 -0.8428 -1.8318 0.4311 -0.0096 1.2658 0.9909 -1.5167 -0.1949 0.0909 1.1169 -1.2252 1.1091 -0.8829 0.9721 -2.2394 -0.2993 0.2928 1.4020 0.0708 1-lignoceroyl-GPC (24:0) -0.3800 0.2132 0.2443 0.8903 0.8875 0.6963 1.2188 1.0330 -0.4451 0.6133 0.8127 0.4516 0.7869 -0.2322 0.6692 -1.8109 -2.0117 -1.6558 0.3265 1.0776 0.9534 1.0229 1.3848 -1.6472 0.8925 0.2602 1.8817 0.0053 1.1760 -1.7347 0.4248 1.2139 1.0859 0.0242 0.5245 1.2540 2.0166 1.0075 1.2572 0.0453 1.3364 2.0264 0.7148 -0.6203 0.4022 0.0594 -0.0062 -1.6388 0.8137 1.6754 0.7070 0.3367 -1.6003 -0.4603 1.3094 0.2093 1.5950 0.3786 0.3350 0.4246 0.7591 0.2972 0.5677 0.8423 0.5511 0.0657 0.4175 0.0145 0.5731 -1.4367 -0.6057 0.6096 0.1891 0.0773 -0.2262 0.5414 1.4120 1.5143 0.1252 -1.7741 0.8482 -1.5920 -1.7022 -1.9731 0.4103 1.0711 1.6589 -1.6021 -0.7078 1.6665 0.3806 1.0859 0.0687 -1.1883 1.3599 -0.2568 1.1185 1.1796 -0.0191 0.2195 0.9254 0.4036 1.2795 -0.5058 0.7458 0.0093 0.3157 -1.7709 -2.2857 0.7188 -1.9961 -0.9992 1.0221 -1.7288 -0.5366 -0.1777 1.3048 0.1178 0.6709 0.9409 0.7124 1.0303 0.3824 -0.3472 0.3555 0.4784 0.7342 0.4853 -1.8134 -0.3159 0.2954 0.3697 0.8536 0.3218 1.1202 -0.0062 -1.6503 -1.2363 1.1822 0.9993 0.4987 1.2225 -1.6127 0.4330 1.1444 0.0788 -0.0292 -1.7881 0.9659 1.1620 0.8315 1.4145 0.4089 -0.0302 -1.7668 -1.4472 0.6153 0.3418 -0.1378 0.8378 -1.6446 -1.3049 0.4036 0.2443 1.5288 1.3210 1.2252 -0.0047 0.1276 -0.7200 1.0087 0.7374 -0.0524 0.1521 -1.9964 1.0466 0.3336 1.3729 -1.6061 0.5567 0.2371 0.3714 0.7187 0.6077 1.3680 0.7354 1.3760 1.3897 -1.4244 -1.5466 -2.1078 -0.2021 1.6663 0.7762 -0.9354 -0.3251 0.1388 0.9106 0.5881 0.6810 0.8921 0.7977 0.4192 0.7302 0.2585 -1.2510 0.3279 1.0824 0.5039 0.4133 -0.0254 -1.7118 1.2828 0.4378 0.2176 0.6911 -0.4675 -0.7325 -0.7457 0.0998 -0.4349 -0.3474 0.2790 0.4102 0.4202 -0.9911 1.1245 0.4247 0.4945 -0.2298 0.2981 -1.5249 2.3919 0.2602 -2.0133 -0.5770 -0.6654 -1.6370 0.6373 0.5832 -1.8201 -0.6229 0.3772 -2.1867 -0.2562 0.6662 -0.3584 -0.1804 0.1708 0.0045 -1.8572 0.5047 0.6252 0.0418 -0.0384 -1.6488 -0.2758 0.1529 -0.6940 0.3229 -0.4190 1.2523 -2.0108 -2.1446 0.5117 0.8645 0.7634 -2.0448 0.1072 0.5851 -1.9311 0.3846 0.5189 -0.0289 -0.1729 0.4090 -0.4101 1.0812 0.2554 -1.3852 -2.0572 0.8924 0.3615 -1.9686 0.0696 0.9453 0.4203 0.7980 -0.2949 -0.3644 -0.2101 -0.1272 0.2458 -0.8907 0.0878 0.0981 0.4998 -2.3267 0.0368 1.5200 0.9385 -0.1038 0.5349 0.4363 -0.1357 0.3541 -0.0419 0.8445 -2.0052 0.0357 0.1517 1.1278 0.1111 -0.3003 0.4004 0.1820 0.3843 0.2279 -1.6484 -0.3464 -1.7347 0.0410 1.1335 -0.0176 0.5818 -0.2148 -1.8001 -0.2452 -0.7266 -0.0506 0.9540 -1.6243 0.2388 -0.8938 0.0621 0.4362 0.4469 -1.8893 0.4025 0.2911 -1.7495 -2.2826 -2.0506 0.1079 -0.3507 -1.6813 -1.5382 0.9417 0.0162 0.2132 -1.4647 -0.8936 -1.9128 -0.8670 -0.5592 0.1981 0.0756 -1.9288 -0.4477 0.1702 -0.7124 0.4051 0.6066 -0.5284 -0.4266 -0.8300 -0.1869 1.0050 0.3721 -0.3609 -1.5992 -1.9291 -1.7526 0.1456 -0.1717 0.4535 0.2323 -0.2355 0.8374 0.1356 0.6015 0.7257 -0.5260 -2.2712 -2.3772 0.1244 0.2532 0.1416 -0.9487 -0.5289 -1.4722 0.0269 1.2339 0.0784 -0.1803 -0.2944 0.1162 -1.8903 0.7785 0.6188 0.1895 0.2922 1.4111 -0.2728 -0.6333 -0.3142 -1.8466 -0.0030 -1.8314 -0.4432 1-linolenoylglycerol (18:3) -0.0537 0.2021 -1.6971 -2.0728 -0.1200 -2.3148 -0.3231 -0.2633 -0.5290 -1.8315 0.3267 0.4188 0.4598 -2.2582 -0.4161 -0.6864 -0.6165 -0.0098 -0.1431 -1.9624 1.0980 0.4500 0.8244 -2.1484 0.3941 -0.1384 -0.4904 0.6558 0.0024 0.6012 0.4686 -0.0780 0.5095 0.3768 0.2604 -0.8577 0.2645 -1.0004 0.3436 0.2991 0.1124 0.7996 -2.1999 1.2128 1.2460 -0.3294 0.2763 -0.3118 -0.0336 -0.7655 -2.1593 0.2563 0.3311 -0.6950 -0.2778 0.3012 0.1264 -1.8184 1.1294 -0.1025 0.9263 0.3171 0.2484 -2.0894 0.5217 0.7534 -2.2047 -0.2910 1.5523 -0.6993 -0.5141 0.5082 0.5720 1.4380 0.0994 0.5491 -0.7495 -0.3684 -1.9944 0.3476 -0.5285 -0.1749 -2.1963 0.0115 -0.3385 0.1960 0.8322 -0.7100 -0.4620 0.6052 0.1978 0.3698 1.3726 -1.7936 -0.3010 0.4794 0.9238 0.9300 -2.0995 0.8008 0.0536 0.9132 -0.0685 -0.0256 -0.0238 -0.2264 -0.8969 1.1712 -0.4138 0.4612 -0.9918 0.1207 0.6335 -0.2008 -2.2208 0.3407 -0.5685 -0.1006 -2.3369 -0.1256 -0.7065 0.8863 -1.2919 3.7412 0.9747 -0.5401 0.9744 -0.8753 -0.4812 0.4019 0.7766 -0.1417 0.2723 -0.1279 0.0387 0.3646 0.7729 -0.4547 0.5821 0.3456 -0.3692 -0.4814 -0.2264 -0.4213 1.1148 -0.0494 0.0582 0.0391 1.0323 0.3556 0.6216 0.5004 0.6194 1.0019 0.9167 0.9468 -0.3249 0.9881 0.4795 0.1638 -2.1490 0.3073 0.5207 1.1014 0.2924 1.2137 -0.4621 -2.3071 0.2885 0.4051 0.4016 0.3340 0.0705 -1.9859 0.3664 -0.2005 0.5693 0.5436 0.9710 0.4261 -1.5543 -0.9490 0.3900 0.2338 -0.0989 0.2791 -0.8132 1.1917 0.3238 -0.3316 0.4160 0.2266 -0.5130 0.4633 0.8104 0.7096 -2.1320 0.4154 0.9278 0.1848 0.1925 0.1438 -1.0252 -0.1282 0.8456 0.5225 1.4697 -1.4220 1.3476 -0.4455 -0.3258 0.2490 -1.0938 0.8661 0.9526 -0.2357 -0.5833 0.2967 0.3157 0.9476 1.8803 -0.0255 1.0711 -0.7368 0.3363 0.9614 0.2297 -0.0149 -0.7697 0.1089 -0.8134 1.2645 0.1693 0.1135 0.9961 -0.1331 0.3208 1.7710 -0.7874 0.2220 -0.3756 1.2778 -2.2521 -2.1554 0.3173 0.0403 0.5393 -0.5347 -1.6752 -0.1823 1.1178 0.1741 -1.1682 -0.5256 0.6312 -2.1527 0.2414 -0.9363 0.6449 -0.5147 -0.9356 0.4492 -0.0712 -0.6522 0.7381 1.3393 0.4873 0.0766 0.9570 0.9344 0.5164 -0.0623 0.5394 0.8569 -2.3371 0.1866 0.8790 0.5526 0.8133 -1.9463 0.9115 0.5569 0.6851 -0.4434 -2.5784 0.0989 0.8700 -0.0236 1.1324 0.8636 0.8143 -0.0443 -0.2976 0.3763 0.0013 -0.0607 -0.1548 0.6163 2.0352 -2.3967 -0.9233 -1.9099 -0.1208 0.3978 -2.2303 1.0725 -0.6599 0.4612 0.5702 0.5615 0.5005 1.1596 0.0564 0.9706 1.6398 0.8549 1.2684 -0.2350 -0.3279 -0.9562 0.1091 -0.9588 0.6978 -0.2440 0.2486 0.6906 0.0266 1.0018 0.2550 0.2686 -0.0127 -0.0212 0.8447 -0.2427 0.3897 0.7387 -2.3730 1.1731 0.1762 0.5622 1.2591 -0.7652 -0.2072 0.8485 1.9472 0.4484 1.1861 0.1633 0.9944 0.4776 -0.0805 -0.0997 0.5737 0.3756 -2.3755 0.0505 0.7833 -0.1447 1.3046 0.4833 1.5011 0.8497 -2.2618 0.3981 1.6653 -0.1672 0.7941 -2.5446 0.6373 -1.0173 -2.1147 -0.2259 1.0235 -2.2437 -1.3326 -2.1455 1.1844 -0.2055 -2.4571 0.3264 1.0433 -0.4816 0.0865 -2.6339 1.8086 0.5313 0.2879 0.8678 0.8157 0.1699 1.0368 -0.8574 -1.8011 -0.5000 -0.3130 0.8596 0.9513 0.3965 -0.2771 -2.3604 -0.1744 -2.3773 0.1197 1.1455 0.5486 -0.1655 -1.1337 1.2231 0.6763 -2.6480 1-linolenoyl-GPC (18:3)* 0.8582 0.7138 -0.7713 -2.2832 0.4482 -3.0473 0.0895 -1.4123 -1.0021 -2.8631 0.2120 0.0955 1.0829 -0.9589 0.1427 0.5662 -0.7837 -0.4766 0.5530 0.9623 2.6919 1.2633 1.3859 1.5883 0.6288 0.4270 -0.0495 -0.0668 0.5221 -0.2146 1.8608 1.7638 0.6258 -0.4129 0.0726 -1.6833 1.3726 -0.6349 0.9801 0.7175 0.5238 1.9969 -0.3394 0.2962 1.3439 -0.8467 0.1454 0.5049 1.3146 0.2080 -0.1008 0.4366 0.8086 -2.4075 0.9974 -0.2886 0.4811 0.0364 -0.0598 0.6483 2.3793 1.1368 0.3768 -0.8109 1.0624 0.6662 -0.0198 0.3968 0.8873 -0.4880 -1.1801 1.4276 0.3526 1.3431 0.2433 0.2720 1.9095 0.5603 -0.6365 0.6281 1.4132 -0.7730 -1.2487 0.4793 -0.0813 0.5996 1.8175 -1.4048 -0.4868 1.2807 0.5410 0.0207 0.5173 0.9371 0.1342 -0.3702 1.8369 0.7727 1.0581 0.4909 0.0749 -0.0226 0.9300 -0.2587 1.6063 0.4727 -1.4280 0.4949 -1.5201 -0.4697 -2.1608 -0.6532 1.8725 -0.5955 -0.8277 1.2018 1.0143 1.7939 1.1940 0.2586 0.2053 0.4002 -0.1373 0.2865 -0.3219 0.4971 1.2632 0.3497 -0.3226 -0.9384 0.6053 -1.6836 -0.0602 0.3595 -0.2833 -0.6332 0.3491 0.3577 -0.3183 1.1887 1.1815 -0.3695 -0.6257 -0.9085 -0.0792 0.7446 0.1407 -1.3255 1.3902 0.8529 0.9497 -0.0172 1.1988 -0.4599 0.4068 2.1656 -0.5109 0.2787 0.1148 0.2323 -0.3694 -1.2424 0.2252 0.9406 -0.4828 1.3767 0.0575 -1.1523 -0.1905 -1.3815 -0.3898 1.4863 1.1434 -0.3682 0.6282 0.0475 0.3083 0.8729 -0.0862 0.4341 -0.3787 -0.6753 0.9415 0.4751 0.9089 -0.3571 0.0506 0.3515 0.0753 0.5727 -0.7100 -1.5539 0.8974 0.6566 -0.3085 0.8591 -0.0112 0.9749 1.6649 0.4572 0.7944 0.8211 0.1870 0.0615 0.6409 1.3322 0.0072 -0.0817 0.3145 0.9632 -1.1899 -1.0527 -1.3008 1.1837 0.8285 0.7777 -0.9040 -0.1338 0.1783 0.7787 1.3576 -1.0259 0.9616 -1.2020 1.6139 -1.1782 0.7335 0.4159 1.6794 -0.1538 -0.2098 1.6390 0.9806 -0.0605 -1.7344 0.1767 -0.1351 -1.7110 0.6935 -0.3476 -1.6002 0.8640 -0.4682 0.7106 -0.0961 -0.6149 0.9564 -1.1925 -0.8856 -1.3283 -0.7809 1.1729 0.5444 -1.0623 -0.6684 0.1913 -0.0671 -0.1816 -0.9096 0.2377 -1.0741 -0.1550 -0.8938 -0.9945 -0.2703 1.3655 1.4096 -0.0138 0.4923 0.6798 -0.6483 -0.5825 -0.2212 -0.2425 -1.3102 0.0393 0.8172 0.7891 0.5428 -0.9919 0.3466 0.2371 0.0147 -1.9659 -0.6743 1.1098 1.4835 1.4305 -0.4315 2.0874 -0.3142 0.4770 0.3102 -1.1725 -0.5682 -0.0545 -0.6072 -0.7851 -0.8568 1.9905 -0.0378 -0.8061 0.1639 0.0887 -0.7153 1.3727 -1.1609 0.6435 -0.6185 -0.0750 -0.7135 0.3441 -0.5584 0.0606 -1.1260 0.1257 1.3453 0.7424 -0.6619 -1.1897 -0.4057 -2.5336 0.3052 -1.2328 0.0757 -0.4776 -1.1495 -1.2794 -0.4862 0.1083 0.8743 -1.2132 -0.0689 -1.2273 0.6700 -0.3146 -1.3339 -0.4520 0.7391 -0.0563 0.1159 0.3510 -0.3007 -0.0380 -0.5237 -0.4163 -0.6750 0.9220 0.4245 -0.1082 -0.3342 -1.5869 -1.9092 -2.2692 -3.7077 0.9992 0.1337 -0.7946 -0.4064 -0.3882 -0.7545 0.0377 1.2650 -0.6158 -1.8533 -1.5207 0.3170 -1.1931 -0.1742 -0.8276 -0.3996 -1.1328 0.1060 -1.0027 -1.2736 -4.1466 0.0000 -0.5854 0.1162 -0.5574 0.0444 -0.0061 0.5724 -1.4463 1.5695 -0.6187 -0.4493 1.4181 -0.0856 -0.9296 1.7076 -1.6456 -2.1456 -1.1810 -1.4448 0.1138 -0.3540 0.2974 0.3294 1.0007 0.2133 -2.0352 -0.2393 -1.9913 0.0702 -1.9354 -0.1685 0.8391 -0.0090 -1.8198 1-linoleoyl-2-arachidonoyl-GPC (18:2/20:4n6)* -1.0090 0.0727 1.8408 0.0704 1.8666 0.3978 0.5779 1.0449 0.7892 -0.6454 -0.3317 -0.4557 -0.1591 -2.4878 0.2166 0.7707 -1.0749 -1.0144 0.6107 1.1551 1.2811 1.4702 1.8681 0.6460 0.2082 -0.3038 0.4519 1.0412 1.6628 0.1552 0.7690 1.4600 0.5375 1.0282 1.7991 0.9984 2.8184 -0.0519 1.5506 0.4830 1.5902 0.8449 1.6403 -0.6966 1.8350 -0.4169 0.7927 0.6688 0.9502 0.8805 0.4480 0.5893 -0.2369 -0.7829 2.3186 0.3451 2.1567 0.9115 0.9939 0.8621 0.2915 0.3690 -1.3787 0.3668 1.0354 -0.2067 0.2278 0.2375 1.1496 1.0142 0.0993 1.3342 1.2606 0.6116 -0.8666 0.8942 0.7889 -0.1345 0.2115 0.1184 0.3564 0.0489 1.0883 0.8417 0.5128 0.5400 -0.1090 -2.4894 -0.1822 0.7802 0.7162 0.2025 0.6020 0.4686 1.0490 0.2486 1.0970 0.0710 1.4497 1.2053 1.0001 0.7655 1.1070 -0.4925 0.9988 1.0280 -0.3340 -0.1485 -0.5014 -0.4132 0.4711 -0.7588 0.5891 -1.0062 -1.0705 -0.2518 1.0415 -1.4180 0.3728 1.8865 -0.0027 0.7515 1.0406 -2.0110 1.4035 0.4167 0.2400 -0.1445 0.7098 -1.0502 0.5509 -0.3841 1.0108 0.8160 0.7033 0.3458 0.0951 -0.1824 -0.0790 0.7832 -1.6021 0.1475 0.4827 -0.7172 -0.0536 0.4468 0.2220 -1.2328 1.2941 1.9352 1.5120 0.2328 1.4495 0.3004 0.8794 1.0775 -0.1726 0.6819 0.3351 0.1672 1.3314 -2.5704 0.7321 0.5477 -0.8072 -1.4904 1.9540 -0.3738 -0.8709 0.0024 -0.6340 -0.7792 0.2318 -0.4628 -0.0065 0.2042 0.0826 0.5619 -0.3309 0.6499 -0.5215 -0.2963 0.1702 0.4247 1.2735 0.2892 1.5875 0.1826 -0.1112 1.3501 -0.1285 -1.6327 1.0281 1.0971 -0.9792 -1.0651 -0.1687 1.3767 -0.0482 -0.8848 -0.1524 0.5791 1.0035 1.5075 -0.4921 0.3928 0.8444 0.7574 -1.3741 1.2121 -0.2103 -0.1972 -0.4189 0.8459 0.3518 0.9472 0.3094 0.5166 -0.9246 0.2764 -0.2581 -2.0057 -0.2736 -0.9332 0.2268 -1.3558 -0.9938 2.0764 -0.2897 0.0013 0.8825 0.8122 -0.8146 -1.0691 -0.1772 0.1568 0.8939 -3.0167 1.4142 0.2156 -0.9261 0.1303 -1.2123 1.3278 0.1769 -0.1094 -1.4174 -0.2731 -0.0521 -1.1354 -2.5208 0.4637 0.4158 -0.6132 -0.2309 -0.2922 -0.3292 -1.8356 -1.2391 0.0263 -1.1568 -0.1849 -0.4646 0.0687 -0.0234 0.9149 1.2283 -0.9535 -0.4822 0.7836 -1.8400 -0.2965 -0.2826 -0.6862 -0.8435 -0.5997 0.1693 0.9298 -0.1790 -0.7655 0.3584 -0.0143 0.1041 -1.2762 -0.0189 1.2979 0.0399 0.8451 -0.0192 -0.6629 -1.7068 0.5559 -0.7918 -2.0339 -1.5162 -0.1889 0.6731 -0.1674 -1.4135 0.8996 0.2850 0.8522 -0.4305 -0.4746 -0.7217 0.3359 -1.2153 -0.3676 -0.4570 -0.0030 -1.0766 1.4244 -0.8316 -0.1539 1.3858 -0.3190 0.5392 -0.5492 -0.5364 -1.0803 0.0125 0.4418 1.5038 -1.2972 -0.7374 0.2113 -2.1519 -0.5680 -1.1106 -1.5934 1.0891 -0.5459 0.4222 -1.7690 0.0827 -0.6333 -0.8592 -0.9223 -0.9758 -1.2257 -1.1212 -0.3577 0.0743 0.3003 -2.7206 -2.6147 -1.7087 0.2364 0.3215 -0.9593 -0.4013 0.5795 -0.0916 -1.0166 -1.4821 0.1042 0.1400 -2.7230 1.0976 -1.3076 -0.9674 0.3786 1.0924 -1.2333 -1.3873 -1.0287 -0.8450 -0.4712 -0.1408 -0.5867 0.0863 -2.7036 -0.8863 0.6527 -0.2777 -1.5345 -1.0342 0.9371 0.6638 -0.5428 -2.2123 0.1438 -2.1082 -1.6434 1.4529 -1.5313 -0.7904 0.5140 -1.4847 0.1964 0.9207 -1.1574 -0.5927 0.4425 0.0065 -0.7026 -1.1136 0.2089 0.2145 1.4117 0.5621 1.1510 -0.0418 -0.8349 -0.6310 -2.1897 -1.7236 -1.4777 -0.2073 -1.1080 1-linoleoyl-2-linolenoyl-GPC (18:2/18:3)* -0.3712 -0.4523 0.9084 -0.8261 0.7975 -1.2218 0.0175 2.2180 0.1914 -0.9625 0.3268 -0.2638 -0.1560 -2.0988 1.1057 0.1649 0.2181 -1.5564 -0.1582 -0.2005 0.6827 1.6255 1.3453 0.3296 0.1357 -0.6189 0.7968 1.2844 -0.0869 1.1924 1.1857 1.0599 1.0962 -0.4523 0.4462 0.6200 1.8064 -1.8666 1.9645 0.1414 -0.0357 0.8147 -0.8647 -0.3207 0.5161 -0.1535 0.0593 0.8671 0.6802 -0.8078 -0.3943 0.5363 -0.2610 -1.6179 0.6160 -1.0594 0.8204 -0.6622 -0.0732 0.5382 1.3778 0.7457 -0.3836 0.7476 0.4283 0.9566 0.2806 -1.2969 1.3972 0.5220 -1.8802 1.2411 0.4002 1.4579 -0.1233 1.5336 0.5482 -0.0053 -0.9979 0.8591 -0.0223 1.2214 -0.5359 0.6692 -0.6012 1.3920 1.4793 -0.8532 -0.5395 1.7521 0.3663 0.6587 -0.4304 0.2299 1.1508 -0.6586 1.7711 -0.0644 0.5263 -0.1984 0.3458 0.3313 1.0993 -0.8653 -0.2450 -0.5503 -0.6760 0.9760 -1.7617 -0.1949 0.3921 0.1667 1.5196 -2.5664 -0.4994 -0.1333 0.7105 0.2797 1.8860 0.5613 0.4200 0.0401 0.2057 -0.4290 0.8228 0.9967 1.6433 0.5026 0.4164 -0.6322 0.4325 -1.5891 0.4430 -0.2617 0.0726 0.6165 -0.0010 0.4535 0.5874 1.6578 0.2489 -0.0127 -0.4997 -1.7048 -0.0045 0.7857 -0.0009 -1.1740 2.2443 0.7405 1.7306 0.0133 0.7078 -0.8916 0.4919 0.8341 -0.7685 -0.3600 -0.6498 0.6012 -0.5741 -2.2687 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0.4455 0.4797 -2.0076 1.4197 1.2047 0.9923 0.5293 -1.0633 0.2683 -0.0553 -0.2021 -0.0419 0.4478 -0.7367 0.3858 -0.0720 0.9212 -0.7958 -0.8407 -0.3571 -1.1614 -0.7445 -1.0869 -1.2490 0.9675 0.8425 0.5207 0.9462 1.7267 1.7404 0.2194 -0.6703 0.8127 0.5604 0.2177 0.2704 1.1448 0.0070 -0.0362 -0.2498 0.8149 0.1388 0.6012 -1.1208 -0.5781 0.3838 0.1343 1.6375 1.0404 1.6724 -0.7992 -0.6892 0.9537 0.0990 0.3993 0.7253 -0.4982 0.0548 0.2005 0.8910 -0.2443 -0.1009 -0.9478 0.6521 -0.3122 2.0019 0.1852 0.1248 0.8046 -0.5115 1.1399 1.6578 0.7345 0.3275 0.3570 -0.1855 -0.0026 -0.7013 -0.4859 -0.6418 -0.2738 -2.6217 0.2564 0.4113 -0.2526 -1.0327 0.3096 0.1451 0.3832 0.7429 0.1380 0.3775 -0.3860 -0.7757 0.6319 0.5026 -2.6492 -0.8865 0.7385 0.6314 1.7093 -0.5379 0.1882 -0.8329 1.2356 -0.5404 0.4222 0.4082 1.0823 0.4308 0.3518 -0.9508 -1.4054 -0.4417 -2.6884 1.5034 0.1517 -0.4461 0.3164 -0.3825 1.1247 -0.6303 -0.1490 -1.7037 0.4042 -0.8392 0.0726 0.1289 0.8242 -0.8696 0.3501 -0.7978 0.7733 -1.7206 -0.8424 -3.7257 -0.2803 -1.5423 -0.2024 0.5049 -0.1560 0.1556 0.6101 -0.8080 1.7833 0.0714 -0.0780 1.0708 -0.4922 -0.2788 1.8078 -0.4347 -1.6214 -0.7508 -2.1981 0.9001 -0.1138 0.2067 -0.4946 1.1977 0.8409 -1.8279 -1.1475 -0.3111 0.2289 -0.7524 0.8157 2.2769 0.8437 -2.0575 1-linoleoyl-GPG (18:2)* -0.8576 0.0820 -1.3658 -1.1432 1.2324 -1.4288 0.7547 -1.5127 -1.3796 -0.7822 -1.0872 -0.3900 1.4991 0.3103 -1.6244 -1.4141 -1.6011 -1.2534 -0.4164 0.6694 -1.0345 0.8088 -0.7643 0.2019 -1.2431 -1.2504 -1.5559 0.2402 -1.0300 -0.1326 0.4121 1.0788 -0.7003 1.4815 -0.7111 -1.3134 -1.2115 0.5427 -1.1236 0.4098 -0.9022 -0.5988 -1.2973 0.7481 1.0212 0.1894 -1.2847 1.1337 -1.2546 -1.2417 0.7070 1.0292 -0.3617 -1.4399 0.0953 -1.5232 0.0649 -0.8024 1.1822 0.5165 -1.0501 0.0696 0.9660 -1.1395 1.3403 0.9262 1.0450 0.4476 0.0759 0.5109 -1.3045 0.4932 -1.3816 0.7683 1.5590 0.1441 -1.0526 -1.2710 1.3137 0.4273 0.9910 0.0735 0.2646 0.3104 0.4111 0.5075 0.6419 0.6988 0.8580 0.7178 0.4650 0.8030 1.3832 1.5114 -0.1067 0.7715 1.3347 -1.2204 1.2897 0.1677 -1.5220 -1.7243 0.7107 0.6609 -1.1350 -1.1577 0.0685 1.4096 1.0223 0.8920 -0.2151 1.1764 1.2465 -0.0279 1.1040 1.0142 1.8028 1.3926 0.3303 0.7079 0.7050 -1.2181 0.6856 2.1972 0.8213 -1.4152 0.7030 0.7430 1.0844 0.7666 0.0288 -1.1042 0.9574 -0.3209 -1.3736 0.0541 0.9268 0.8538 0.1509 -0.6073 -0.9859 -1.3896 1.1139 -1.3395 0.8886 -0.0942 -1.2715 -1.3803 0.4457 0.6455 1.8897 1.4225 1.3929 1.2099 -1.3638 1.0398 0.1418 0.5975 0.4467 1.2079 -1.2356 0.1606 -1.0533 0.5565 -1.1978 0.8011 0.7191 -0.0316 0.4339 0.4087 0.7742 -1.3281 0.7777 -0.5131 -1.5693 -0.8666 1.0504 -1.0114 -0.1961 0.4899 -0.2721 -0.1587 -1.3822 0.6480 -1.0256 -1.6630 0.6297 -1.1916 1.0022 0.5430 0.3374 -1.0420 0.4729 -1.0762 1.0263 0.6464 0.8216 1.0464 1.0252 1.3901 -0.9541 0.1281 -1.0847 0.4917 -1.3713 -0.8408 0.3354 -0.2718 1.2395 0.1672 0.1630 0.6451 0.4452 -1.4015 1.2448 0.9112 -1.6944 0.1986 0.3825 -1.5542 0.3177 -1.4847 -1.0284 0.1937 -1.8192 0.8757 -0.0119 -0.3931 -0.8466 -1.2766 -1.3957 -1.0988 0.4866 -1.4691 0.4240 -1.6350 1.0706 -1.2050 0.5324 0.4299 0.2524 1.0488 -0.0542 0.8143 0.6507 0.3541 -1.3977 -1.6372 0.7026 -1.4653 0.5957 -1.5441 0.6986 0.7824 0.2622 -0.5461 0.3639 0.1750 0.6871 0.0959 -0.1176 0.5014 -1.6068 0.8447 0.5967 1.2563 1.0081 0.4821 0.7391 1.4514 0.6850 -1.2051 0.4601 -0.0001 0.3581 -1.4328 0.8104 0.6373 -0.2352 1.1665 0.3343 1.2785 0.2253 0.5168 1.3160 1.1330 0.3211 1.5724 -1.5833 0.7706 0.6057 0.2535 0.4033 -1.6480 1.0304 0.1583 -1.4919 0.8939 0.7491 0.3400 0.5877 -0.0524 0.2819 -1.5686 0.9278 0.9486 0.5505 1.5822 0.5106 0.0485 0.2593 1.3821 0.2772 0.6693 0.8819 0.2891 -1.3035 0.7480 -1.2357 0.1798 0.6754 -1.5561 1.4799 0.6393 -0.0621 -1.8274 0.1135 0.2128 -1.4500 0.5345 0.3696 0.4248 1.0833 -1.0828 0.4573 -1.7776 -0.5908 0.8579 0.4958 0.9896 0.8240 0.2499 0.5566 -1.5886 1.1751 -1.2579 0.5758 0.6136 1.1313 0.4053 1.8945 -0.4866 0.2894 0.3923 -1.5124 0.2636 0.9331 -1.5351 1.3379 -1.7026 1.1544 0.5206 0.0618 -1.8839 1.1880 -0.5638 0.2652 -1.7649 0.4815 -0.1349 -1.1867 -1.5214 0.7027 -1.3300 -0.1753 -1.1364 -1.9902 -1.6735 0.1824 -0.0935 0.5532 0.5834 -0.4620 -1.8739 1.4749 0.0769 -1.9447 0.3914 -1.8593 0.7958 1.2334 -0.2367 -0.7604 -1.5071 -1.6576 -1.6731 0.2545 0.8146 0.9641 1.0844 0.6962 -1.5355 -1.2785 -1.6329 0.7526 -1.9402 0.5416 -1.4751 0.2419 -0.5976 1-linoleoyl-GPI* (18:2)* -0.4578 -0.2549 -1.9379 0.6067 1.2020 -2.4153 -0.6264 -3.3032 -0.5749 -1.9558 -1.9224 -0.2422 1.8669 -0.6830 -1.6190 -0.2270 -1.9063 0.3288 -0.2225 0.1506 0.9507 0.1920 2.2700 0.4874 0.5961 0.5904 0.0553 -0.9508 0.0712 -0.7957 0.6579 0.9187 0.1293 0.2205 -0.2054 -3.4067 0.4394 0.5944 0.8685 -0.0920 -0.8940 0.7130 -0.5971 0.5208 1.2914 -0.6303 -1.1473 0.2606 1.5243 0.7212 0.3719 0.5249 -0.3498 -2.0432 0.7188 -0.0758 0.1989 1.6583 0.1247 1.7834 1.2488 0.8278 0.6435 -1.4593 0.8392 0.6173 0.2108 0.5889 0.1901 -0.2136 -0.1836 0.3201 0.0186 0.1593 0.8842 -0.7992 0.7653 1.1409 0.0492 0.0452 0.3527 -0.4717 -0.8698 0.4802 -1.9308 0.7058 1.5754 -0.3314 -0.2015 1.4331 0.0703 2.0415 0.7988 1.3332 -1.0274 0.2582 1.6825 0.1125 0.6382 -0.9335 -0.4999 -0.8619 0.7376 0.4615 1.2132 -1.5469 -2.1762 0.7240 0.5173 0.1100 -0.7483 -0.5834 1.6147 -0.2236 -0.7303 -0.2913 0.8898 1.0740 -1.6039 0.9420 0.0593 -0.5055 0.9108 1.7271 -1.0028 -0.6548 1.2906 0.2634 0.3512 1.0521 -0.8541 -1.3914 0.2550 1.5268 -1.2227 -1.0376 0.3381 0.2390 0.5788 0.7693 -0.1754 0.3334 0.8602 -0.6334 1.1563 0.6982 0.3605 -1.0018 1.1333 1.4909 1.1845 1.6785 1.2696 0.5354 0.1216 1.2576 -0.3423 0.0777 0.3053 1.2493 -1.6790 0.4152 -0.0366 1.5232 0.4911 0.0427 0.1658 -0.3117 -0.3184 -1.3595 -0.3560 1.1645 0.2700 -1.2990 0.6565 1.7209 0.5118 0.1626 -0.1002 1.1013 -0.2122 -0.8150 0.9952 -0.1877 1.1350 -0.3365 0.7227 1.1372 0.2150 0.2209 -0.6607 -2.7624 1.5128 -0.1558 0.5473 0.7339 0.7359 0.2396 1.3248 1.4947 -1.5527 0.7245 -0.5534 0.0806 0.0654 1.8515 0.1298 1.1743 0.6343 -0.3067 -0.9582 -0.3146 0.4606 -0.0763 1.0879 0.2590 -2.4104 -1.2032 1.0754 -0.7817 0.1046 -0.1353 -0.0141 -0.7607 0.9045 -0.4218 -0.9621 -0.4000 0.0830 -0.5928 -0.4091 1.2550 0.6346 -0.7160 -1.2803 -0.9961 -0.2773 -0.6249 0.1275 0.4167 -0.3690 0.0720 -0.8603 -1.3328 -0.6909 -1.3571 0.9831 -1.4373 -0.0964 -0.1056 -0.4336 -0.3746 0.5384 0.5193 0.5909 -1.4204 -0.7792 -0.3412 -0.0098 -0.0462 -0.2808 0.6695 -0.2466 -0.1924 0.0655 1.4178 1.1930 -0.5887 0.2255 1.4277 0.0282 -1.2161 0.0473 -0.3603 -0.1532 -0.3900 1.0859 1.2671 0.6577 0.4592 -0.2442 0.5311 0.5918 -0.3592 0.0936 1.4229 0.0242 1.8419 -0.5490 0.0513 0.2943 0.1212 -0.4268 0.1368 0.5345 -0.4637 -1.7297 0.0787 -1.3878 1.5060 -0.0186 -0.7294 0.3194 0.3685 0.0349 0.4852 -0.4728 1.2529 0.7097 -0.7332 1.6440 -0.3193 -0.3585 0.0094 -0.0222 -0.0218 0.8144 0.2819 -0.0329 -1.0973 -0.4636 -1.9485 0.9153 1.2745 -0.0432 -0.4034 1.0564 0.2467 -0.1847 -0.4071 -0.5159 0.1652 -0.1356 -1.0998 0.7484 -0.2388 -3.0605 0.1756 0.5452 -0.2979 -0.1206 -1.5452 -1.8917 -0.5266 0.4243 -0.6317 0.9177 1.0305 1.2732 0.0017 1.8167 -1.8864 -2.0212 -1.1810 -3.1410 0.2660 0.9992 0.6687 0.9195 -1.3752 0.0644 0.3255 1.4943 -1.6777 0.4007 -1.0282 0.6360 -0.3311 0.1145 -0.7872 -0.2872 -0.1582 0.7586 -0.8516 -0.7743 -3.9025 0.6390 -0.9524 -1.7588 -1.5728 0.9316 -0.0715 -0.4428 -0.8244 0.8764 -0.4939 -0.3255 0.7258 0.0788 0.2743 1.3929 0.7508 -2.3948 -0.8233 -1.7132 1.3678 0.1178 -0.1632 0.4120 0.5213 0.8034 -1.9409 -1.0208 -0.5987 0.4758 -2.4054 0.5545 0.5908 0.0432 -2.6456 1-methyl-4-imidazoleacetate -0.8600 -0.9101 -0.0691 -1.1159 0.5608 0.2348 1.8079 -0.1566 -0.2863 -0.3480 0.0094 -0.6462 0.4837 -0.5504 0.9419 -0.5599 -0.6719 0.0972 -0.4604 0.0351 0.0079 -0.0733 0.4056 0.0784 -0.6826 -0.4650 -0.1513 0.1713 0.2814 -1.0825 -0.5357 -0.5204 1.6117 0.1382 0.0616 0.0299 -0.4987 0.2181 -1.0183 -1.2602 -0.7452 0.8226 -0.8158 0.8247 0.1835 0.4671 -1.2373 -0.8850 -0.1574 1.6604 -0.1307 -1.5133 1.5364 -0.2965 -0.6308 -0.9386 0.5713 1.2353 0.7907 -1.0468 -0.0244 1.3055 4.1958 -0.2927 0.1019 -0.0985 -0.3620 -0.2527 -1.0509 0.7053 0.7238 -0.1501 0.6126 0.5713 -0.6177 -0.8910 -0.0322 0.8262 0.4625 -0.6263 -0.8016 -0.4575 0.1461 -0.6655 -1.0897 1.6045 -0.3927 -0.8929 0.3070 0.7093 -0.9104 0.7942 -0.1996 0.2459 0.3081 -1.7324 -0.1034 0.4782 -0.2338 0.5880 -0.9770 0.2492 0.1084 1.4114 0.5409 -0.0583 -0.7099 -1.1733 0.1673 -0.8130 -0.9202 1.1113 -0.3136 -1.4220 -0.9569 -1.3295 0.0986 -0.6058 -0.9094 -0.7259 -0.5742 -0.4537 0.3442 -0.1297 -0.3012 0.2085 -0.5442 -0.2599 -0.0410 -1.0010 -0.1486 -0.5377 1.9108 -0.8200 -0.9656 0.3296 -1.5362 0.7526 0.0847 0.4863 0.4136 0.3590 -0.4178 -0.3082 0.3824 0.4985 -1.9551 0.5496 -1.4859 0.2239 0.4520 0.0433 0.2953 0.2570 -0.7986 1.0224 -0.7806 -0.6242 -0.3551 -0.4229 0.4641 0.2531 0.5847 0.0070 0.5745 0.3650 1.9425 -0.4690 -0.1081 -0.2892 0.0039 -0.3786 -0.0165 -0.5074 1.1038 1.8815 1.2418 0.5950 -0.2661 -1.3595 0.9793 0.2546 -0.6395 -0.6881 1.4035 0.8653 -0.4982 -0.1618 -0.1777 -0.3177 0.5021 -0.2296 -0.8592 0.8202 -0.7751 -0.3493 0.1774 0.0606 -0.6605 -0.4818 0.0673 0.5315 -0.1249 -1.0537 -0.0316 0.0670 0.0824 2.1337 -0.1777 1.2682 -0.2291 0.0404 0.0477 -0.8991 0.6288 -0.1699 -1.1142 1.2522 0.4351 1.1835 -1.4774 0.3440 -1.0479 -0.3205 -1.0426 7.6955 -0.5790 1.1973 0.9459 0.5018 -0.8129 -0.9504 0.2147 -0.0430 0.5628 -0.2453 -0.3004 0.2713 -0.2593 0.6255 -0.5198 -0.8258 -0.2069 1.0414 0.2676 -1.2787 -1.1359 0.0463 -0.2610 0.1516 0.6461 -1.1653 0.1818 -0.8053 0.0870 0.7007 -0.8586 -0.8553 -0.1197 -0.4801 0.9104 0.0563 0.2342 0.1842 -1.3668 0.0506 0.3847 -0.9073 -0.3929 -0.9435 0.1642 -0.4748 -0.1899 1.2004 0.3747 -0.0010 -0.2859 2.0224 1.1460 0.6547 -0.4490 0.4456 -1.7581 0.7474 -0.3524 0.3221 -0.3510 1.4400 5.3575 0.2944 1.6586 -0.7969 0.6024 -0.2522 -0.0881 0.3441 -0.1245 0.7293 0.5076 -0.5095 -0.8620 -0.8301 -0.6777 0.3563 -0.7814 -0.9751 0.3805 0.6707 0.7843 -1.7583 1.0831 0.7290 0.3797 0.0233 0.5519 -0.1973 0.3580 -0.0170 2.5473 -0.7537 -0.1783 -0.7086 0.2438 -0.9075 0.2246 0.1147 0.1999 -0.2704 -0.4179 -0.0729 -1.2791 -0.5240 4.3694 -0.1623 -0.7096 -1.2228 -0.1869 -1.0781 -0.1998 0.4408 -1.5319 -0.4292 -0.0793 0.5221 1.3169 0.1589 -0.7879 0.5258 0.6354 -0.5788 0.5747 1.5725 0.0812 0.1681 1.1450 0.3678 -2.2663 1.3611 1.8735 -0.0926 0.3697 -0.1441 0.7948 1.8186 0.3057 0.9338 5.9428 -1.9558 -1.8184 -0.0090 -0.2350 -0.0528 -0.5104 -1.0210 -0.9688 -0.3654 -0.4236 -0.1350 -1.2775 0.7130 0.3418 0.0627 0.2053 -1.1158 -0.9617 -0.4394 -0.4017 -1.2723 -0.8644 -0.7207 -0.4189 1.2058 0.5810 -1.0284 -0.0502 -1.0035 -0.9493 -1.2494 0.8980 0.0994 -0.6369 -0.3244 -0.4735 -0.4626 -1.0561 0.3711 0.3428 -0.1885 0.6382 0.7440 1-methyl-5-imidazoleacetate 0.8451 0.4417 0.9746 -0.0749 1.8629 -1.1550 0.5048 -0.6503 0.7066 -0.2443 0.2310 -0.3649 0.9835 1.5741 -0.5260 0.0273 0.3483 -0.5441 0.8681 0.7515 0.3646 -1.3876 -0.4898 1.1373 0.6069 0.6647 -1.6667 0.0117 -0.1578 -0.2090 -2.4071 -0.4517 -0.5052 -0.2153 1.3976 -0.7528 -0.6573 0.5121 0.4376 0.0552 -0.5053 0.6713 -1.6979 -1.9933 -0.2375 0.3930 0.1400 1.2359 0.0504 -1.9489 -1.2982 -0.9942 1.3577 1.2099 -1.2622 -0.1941 1.2269 -0.8748 -1.2183 -2.5841 -0.1482 1.1948 0.9957 -0.5929 0.7507 1.2949 0.9994 -1.6222 -0.9708 -0.4583 -0.4538 -2.7046 0.2125 -0.5497 -1.3146 -0.2168 1.5196 0.1038 -0.6154 0.7397 -1.8129 0.6997 1.9133 -1.6874 0.4009 0.0406 -1.7000 -1.6700 -0.2814 0.4756 1.0914 -0.9090 -0.5889 -0.0700 1.1275 -0.5651 1.0392 0.8882 1.8110 -1.5341 0.6225 1.0215 -2.2405 0.3010 2.0309 -0.0593 -1.3980 0.4237 1.3803 -0.4048 -1.0538 0.2476 -1.5284 -0.3674 -2.4381 -2.0119 -0.7156 0.1592 -0.5856 0.3415 0.2729 0.3239 -0.8413 1.0085 -0.6722 0.6731 0.4295 -1.0637 -0.3887 -0.2189 1.4295 0.3623 0.3626 0.0710 1.0378 1.2344 -0.0628 0.4113 -1.1356 -0.4581 0.5723 0.4934 0.7859 0.9801 -0.9401 0.6796 -0.1696 -0.4601 -1.5616 -0.3895 -0.4304 1.0538 1.2616 0.0067 0.9497 -0.9644 -1.4306 0.6847 -0.6328 -0.6764 -1.7975 1.2856 -0.1026 0.1679 -1.3363 -0.0767 0.8444 -0.1430 0.3395 0.7187 -0.0287 0.5895 -1.4171 -0.8405 1.0678 0.0552 -2.4333 0.4450 -0.1499 0.7383 0.2274 -1.7718 0.7401 -0.8795 0.9636 1.7092 -1.3727 0.5149 0.1598 1.3165 1.7569 0.3020 -1.7197 -0.7296 0.1163 -0.7361 -1.9694 0.1288 -0.0261 -0.6890 -0.6794 -0.3465 -0.0173 0.6785 0.4560 -1.0884 0.0954 -0.5466 0.2610 1.1148 -1.6339 1.1291 0.5864 0.9226 2.0918 0.8072 -1.7224 0.0811 -0.5722 0.9666 -0.3634 0.1556 0.1772 0.6768 0.2361 0.9835 -1.7478 1.6094 0.7823 -0.0876 0.4894 0.4696 -2.0086 -1.4129 -0.3541 0.3706 0.9708 0.4014 0.9789 -0.8916 -0.5363 -0.3447 -1.3161 1.2635 1.2155 -0.4435 0.2267 0.8164 0.0231 -0.9051 -1.5655 -1.1703 0.6289 -0.6998 -0.7733 1.5207 0.4880 -0.3011 0.4759 -0.1528 0.0009 0.3999 1.1544 1.5964 -0.8780 1.1621 -0.9043 1.5405 -1.5374 -2.1284 -1.2983 -0.5754 0.3204 -0.6824 0.8614 1.0001 -0.0061 -1.5084 -0.0358 0.8778 0.1214 -0.6151 -1.4873 -0.4146 1.2514 -0.0828 0.0111 0.3080 -0.5975 1.1011 0.3706 1.0604 1.0408 -0.2142 0.5987 0.9586 0.2374 0.8593 -0.7108 -2.4969 -2.2893 -1.2918 1.5711 0.2996 -1.2033 0.0670 -0.7314 1.2156 -0.5916 -1.5309 -0.9704 1.2955 0.1385 0.0638 -1.1386 0.4507 -0.1670 -0.1165 -0.5765 -0.0885 -0.0273 0.5083 1.2957 0.6456 -0.8347 -0.2817 0.1327 0.4839 0.3831 -1.8821 -0.5333 0.6445 1.3154 0.4687 0.4767 -0.3349 0.3095 -0.2359 1.8238 -1.3708 0.2934 0.3700 -0.9805 0.6472 -0.3926 0.1173 -0.7504 -0.3252 1.9588 -1.1683 0.4719 0.5427 0.8222 0.6666 1.1717 1.0238 -2.4549 1.4602 -1.1162 0.8343 0.0527 -0.1697 -0.7012 2.3595 0.2569 1.2366 0.9871 -0.1679 -2.7030 -0.0132 0.4255 1.2106 1.1318 0.5305 0.6643 -1.2504 -1.0872 -0.2744 0.6426 -0.3438 0.2312 2.2058 1.2358 0.3589 0.2170 -1.1341 1.2438 0.5291 -1.3992 1.8583 1.0906 1.4642 -0.0887 -0.3599 -0.2838 1.3471 0.6982 -0.6873 0.5680 0.4705 -0.0591 0.1350 -0.8146 0.6471 1.0916 -0.2274 0.0752 1.1230 -0.7594 -0.7143 1-methyladenosine -1.0206 0.2681 -1.7795 -1.6184 1.9161 -2.3595 -1.5296 -3.7232 -1.3494 -1.0981 -1.3195 -0.1145 0.3809 0.7202 -0.8493 1.4592 -0.6036 0.9281 0.3411 -0.2205 0.0623 2.2800 -0.3737 1.4825 0.0452 1.0622 0.0695 -0.0150 -0.5705 -0.1686 0.2781 -0.4902 0.3550 -0.2097 -1.0792 0.5548 -0.4933 0.9784 1.3728 -0.1436 1.4234 1.6590 -0.9283 0.1184 1.5032 -0.8717 -0.1043 0.7008 0.5215 0.6880 0.1258 -0.0614 0.8709 -2.8514 0.6443 0.4512 0.7592 0.4496 0.4001 -0.0945 1.0658 -0.2139 -1.3032 -2.3152 -2.5227 -0.0725 -0.9424 0.4920 0.3860 0.1924 -0.0426 0.6950 0.6833 -0.3686 0.7134 0.3100 1.7357 -0.3131 -0.3137 -0.3062 -0.0415 -1.1741 -0.5183 -0.3297 -1.6427 -0.0632 1.0811 1.1205 0.3973 0.7305 0.3896 -0.6112 0.6076 -0.3585 -0.2279 -0.1390 -0.9443 0.0971 0.5313 0.6298 0.0511 -2.1066 0.9814 0.6962 0.3674 -0.1064 0.3625 0.1026 0.1911 0.9292 -2.2751 0.3998 -0.0752 -1.1404 -1.8199 0.1526 1.2089 -1.0055 -0.9547 -0.9078 0.0140 0.2142 0.9858 -0.1477 -0.2584 -2.2285 0.1735 -0.3460 0.5793 -2.0184 -0.9851 -0.8189 -0.4153 -0.7190 -0.3252 -0.4336 0.3021 1.5627 1.3817 1.3989 -1.7423 0.7747 0.1855 0.1696 1.2427 -0.1296 -1.1951 -0.8555 0.0408 1.0689 0.0231 0.3340 0.7229 2.9031 0.1227 0.3854 -1.3739 -0.1632 -0.1555 -1.1447 -0.4962 0.0706 0.0659 -0.4012 0.6901 0.1256 -1.0109 1.0563 -1.0345 0.2960 -0.3834 -0.4143 -1.9609 -0.4407 -1.8804 1.1151 1.0441 0.7291 0.5592 0.8236 0.3959 -0.5561 -0.7919 0.6024 0.8639 2.3589 -0.1152 0.8511 0.1645 0.1457 -0.6823 -0.2169 0.0173 0.9437 0.4518 -0.8214 0.2810 -1.7996 0.7322 1.1510 0.2524 1.7180 -0.1133 -0.6653 1.5256 1.0161 1.1552 0.8092 1.2708 1.0675 0.1429 -0.0856 1.5843 0.7162 0.4868 0.5680 -1.2300 -0.7987 0.1433 -0.1094 -0.6907 0.2037 0.7434 -0.4289 -0.3085 -0.3641 -1.0208 -0.9915 1.4191 1.0940 0.4024 0.7048 0.5933 1.3009 -1.1766 -0.3657 -1.2108 0.5253 -0.8893 0.3101 -0.0704 1.6417 0.9504 0.2307 -0.1391 -1.1088 -0.0557 -0.6764 -1.4895 -0.1819 0.8122 -0.3863 0.6347 -0.0118 -0.5534 0.4433 0.5280 0.8256 0.1196 0.3690 1.0569 0.2616 -1.5312 -0.2372 -0.5287 0.5462 -0.0888 -1.5472 -1.4305 0.0564 1.7224 0.1005 0.4549 1.3244 0.4131 0.9356 0.0326 -0.5646 -0.7519 0.7020 -0.5498 -0.4362 -0.8321 1.8122 0.3183 0.7868 -0.0778 1.7559 -1.8228 0.0568 0.8414 1.2319 0.7045 -0.1223 -1.2285 -0.1602 -1.3287 0.6949 1.3142 -0.5257 0.2074 -0.3690 1.0168 0.3651 0.4408 -0.1455 -0.6795 1.5161 -1.4484 -0.4058 -0.6905 0.1737 -1.2047 -0.6173 0.4304 0.0091 0.3656 0.1364 0.6889 0.0310 0.2057 -1.2104 2.0703 0.2721 0.3577 -0.8981 0.5315 -0.4304 0.3361 0.9672 -0.0913 0.3729 0.4731 0.6258 1.1897 0.3844 0.3580 -1.0041 0.3862 -1.2396 -0.8738 -0.2415 -0.3027 -0.4748 -2.0251 0.2718 0.3575 3.3691 1.5861 0.3390 1.1180 2.9464 0.0891 -1.3200 -1.1220 -0.8078 -0.0071 0.8695 -1.2715 0.2077 -0.5884 0.3704 0.4104 0.6956 0.2499 0.2876 -0.9636 -0.2134 -1.5865 -0.8585 -1.2729 1.3139 -0.5777 -0.4260 0.1271 -6.0474 -1.9089 -1.5377 -0.0469 -0.2074 1.3054 -0.2333 0.2623 -0.7678 1.2811 0.3398 -0.8599 -0.3432 -0.0977 0.5477 0.6185 0.7570 1.3932 0.0170 0.3201 -0.8171 -0.3133 -0.4251 0.8897 0.5628 -0.8179 -0.4700 -1.0509 -2.2138 -1.1610 0.2575 0.2551 0.4210 0.2539 -0.4944 1-methylhistidine 0.2787 0.4085 -0.5535 0.0705 0.6999 0.5199 0.1810 -0.0758 -0.1381 -0.0588 -0.0754 -0.4032 1.4330 1.0213 -0.1627 -0.0687 -0.0735 0.1951 0.7015 -0.2298 -0.4068 0.2434 0.0671 0.7032 0.6427 0.6907 -0.4057 0.1699 -0.0896 -0.0076 -0.8240 -0.0910 -0.1498 0.1020 -0.0648 -0.7796 0.1107 0.5793 -0.3287 -0.1373 0.4690 -1.1354 0.3189 -0.1238 0.1758 0.0952 -0.0325 0.4248 0.2659 -0.0479 0.0985 -1.0518 0.4824 1.2758 -0.4553 -0.6187 0.8730 -0.0916 0.3004 -0.8343 0.6473 0.7618 0.0583 0.4113 0.2648 0.2969 0.1115 0.3400 0.1039 -0.1855 0.0707 0.0815 0.4555 -0.3441 0.4225 -0.6531 0.8844 -0.1832 0.2777 0.2004 0.2815 0.2272 0.6510 0.1501 0.1724 -0.2337 0.4201 0.0843 0.2801 0.5346 -0.0520 -0.7647 -0.2150 -0.0798 0.4659 0.3366 -0.3610 -0.1907 1.1842 0.1745 -0.0814 0.7289 0.0442 0.9540 1.0547 -0.0574 0.6336 0.1810 0.5844 0.4147 -0.2857 0.5882 -0.8588 -0.3715 -0.3603 -0.2998 0.1267 0.0121 0.0249 0.4319 0.2946 -1.2593 0.5050 0.2101 -0.5605 -0.3688 0.0426 0.1685 -0.5616 -0.5328 0.6034 -1.3197 -0.2473 0.8003 -0.3024 1.2886 -0.7159 0.0014 -0.2541 -0.2794 0.3397 0.2005 -0.1006 0.3113 0.1116 0.2590 -1.0573 -7.3086 0.3172 -0.4094 -0.1971 -0.1305 0.7296 0.3832 -0.0188 -0.5698 0.3640 -6.9878 -0.5258 -0.0479 0.1650 1.0037 0.7788 -0.1768 -0.6710 0.0127 -1.1185 0.8024 0.3227 0.0801 -1.0733 -0.0431 -0.5110 -0.6233 -0.3689 0.4258 0.5282 -0.1161 0.1448 0.1873 0.3583 -0.4743 0.1660 -0.1202 0.3296 0.1290 -0.0034 0.4107 -0.6809 0.5280 0.4242 -0.1170 -0.4488 0.0650 1.2281 -0.2987 -0.2116 -0.2934 -0.0628 -0.2524 0.2664 0.4545 0.1410 0.3258 0.2027 -0.2916 0.2430 -0.3896 -0.1000 0.3766 0.6335 0.4838 0.7191 -3.9457 0.7268 0.2558 -0.1033 0.0796 -0.3736 0.3214 -0.6951 0.0836 -2.1358 0.1198 0.1861 0.3632 -0.8691 1.2577 0.0848 0.7379 0.0998 0.2125 -0.5390 0.7824 0.2109 0.6618 0.6056 0.0357 0.4134 -0.0149 -6.8709 -7.6284 -0.2461 0.8712 0.8298 0.1314 -0.0414 -0.9016 0.4892 -0.4944 -0.1879 -0.3052 -0.2496 0.1104 0.1102 0.4214 0.0228 -0.3210 0.1764 -0.4541 0.6907 0.2557 0.5957 0.9439 -0.7111 0.8319 -0.1011 -0.2335 -0.3956 -0.1913 -0.5679 -0.2340 0.4162 -3.5986 0.8551 0.1998 0.0726 0.1543 -0.4218 0.9624 -0.1319 -0.1582 -0.6199 0.2024 1.2062 0.6826 0.0537 0.2318 -0.1190 -0.7335 0.0392 0.1153 1.2845 -0.4919 -0.3345 0.0073 -0.0247 1.5881 0.5494 -0.5291 -0.9420 -0.0873 0.6530 0.3391 0.2097 0.2968 0.0098 0.7464 0.6289 0.2995 0.0125 0.8026 -3.0168 0.3259 -0.3805 -0.7386 0.4138 -0.0907 0.5121 -0.0065 -0.0309 0.3238 0.7587 -0.1040 0.8093 -0.5988 0.0017 -0.1253 -0.4707 0.2363 -0.0886 0.4686 -1.5828 0.5534 0.0678 -0.5011 -0.0546 0.4410 0.2798 -0.2261 0.3755 0.6880 0.6965 0.0460 -0.5382 0.3047 -7.0975 0.0505 0.8424 -0.1126 0.6431 0.5454 0.2670 0.6160 0.5148 0.4711 -0.6236 1.0722 0.0832 -0.0626 0.0558 -0.3206 0.4607 1.0438 0.5935 0.8162 0.5342 -0.1964 -0.2194 0.3963 -0.0583 1.5534 0.7474 0.2223 0.1796 -0.1775 -0.6104 0.2015 0.2134 0.9036 0.7154 1.4420 -0.2766 0.8322 0.5155 0.1587 -0.6669 -0.2200 -0.0140 0.4570 0.0737 0.9324 0.2525 -0.0388 0.1423 0.0830 -0.5720 -0.1286 0.4932 0.8789 -0.4393 0.0459 -0.2636 0.9775 0.0824 1.2261 0.0826 0.7708 -0.2837 -0.1915 1-methylnicotinamide -0.7024 -0.0336 -0.1569 -1.4370 0.8155 -1.3047 -0.3052 -1.6747 -0.6035 -0.3290 -1.5499 -0.1838 -1.0106 0.5679 -1.4106 -0.9701 -0.2303 -0.8475 1.4226 0.7037 0.7646 -0.1777 -0.0470 1.0662 0.5018 0.5760 0.5649 -0.4907 0.6328 0.0637 -0.9936 0.4993 2.7153 -1.4671 0.8028 -1.5691 0.5038 -0.1969 -0.0273 0.9672 -0.1541 0.8891 -1.1520 0.9282 0.8603 -1.4251 -1.2418 -0.2171 1.0523 -0.6881 0.2715 0.2737 0.6529 -0.3404 -0.2392 1.5217 0.4817 0.2401 -0.1359 -0.0803 -0.9798 -1.0629 -0.0684 -1.4214 -1.0021 -0.0289 -0.0073 0.6055 0.1803 -0.6894 0.2397 0.2956 0.3194 1.6091 0.5324 0.6448 0.8705 1.6286 -2.2118 0.7356 2.8147 -0.0774 -1.3828 -0.3486 0.1862 -0.1698 2.1295 -1.2320 0.0046 1.1288 -0.1747 0.2953 0.0548 1.4914 0.8335 0.6591 0.0008 0.1386 1.1662 1.5928 -0.4794 0.3894 0.5321 -1.8312 0.7041 -0.8454 -1.3256 -0.5756 0.0224 0.3660 0.1772 -1.2226 0.4044 -0.5903 -0.6143 -0.4835 -0.9873 2.2331 -1.3553 0.7558 0.1672 -0.8497 1.2350 -1.0024 -1.7919 0.9925 -0.1890 -0.2784 -0.8636 -1.1684 -0.0873 -0.4574 -0.5215 0.3043 -0.1547 -0.5607 -0.1631 -0.3789 -0.7456 -0.4280 -1.8296 -0.8845 0.0207 -0.9651 0.4068 0.1286 -0.9174 0.6415 -0.3444 1.4461 0.2661 0.9033 0.1210 0.3875 0.7045 0.1820 0.3394 0.0854 -0.2404 -0.4710 -0.2267 0.0081 -2.0000 0.5142 -0.3886 2.4644 -0.9848 -1.7981 -1.4156 -0.0942 0.2176 0.3205 0.5144 -0.2123 0.1437 -1.1121 0.1085 0.7330 -0.0482 0.0591 -1.3011 -1.1040 -0.7246 -0.2181 -0.3538 -0.2773 -0.6835 0.0440 -0.8191 -0.2014 0.3087 -1.2094 0.1691 0.1957 0.5984 -0.3004 -1.1665 -1.3837 0.9201 0.4221 -1.3766 0.1599 0.3198 -0.4514 1.7867 -0.0608 1.0227 -0.3729 -0.4834 -0.3767 1.7504 2.3657 1.2166 -0.1162 2.1201 0.8435 -2.3046 -1.4188 -2.8018 -2.6552 -0.4222 -1.6063 -1.0835 -0.1261 0.5829 -0.5247 0.7002 -1.3170 1.7672 1.5041 0.2704 0.2330 0.1922 -0.0281 -0.2461 -0.6995 -0.0698 0.6619 -0.2599 -0.3643 0.7882 -0.5894 -0.2040 -1.0656 0.3753 -0.8616 -0.0086 -1.6692 -1.3765 -1.5496 1.3173 1.3337 0.2414 -1.0430 0.8021 1.5016 0.4833 2.8429 -0.0578 -0.0752 -1.0110 -0.7144 -1.0822 -0.2278 -0.0346 0.9432 0.1321 -1.2660 -0.6170 -0.0377 -1.1033 0.0484 -1.5347 -0.2007 -0.4423 1.5318 0.4698 1.6962 2.3337 -0.3569 1.1679 -0.2147 0.1402 -0.0608 -0.6372 -0.4183 1.0395 -0.2380 -0.7052 -0.5091 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0.2801 0.4229 -0.5977 1.3137 -0.4404 0.5848 0.5616 -3.0180 -0.7468 -0.3226 0.6440 -0.1105 -1.0445 -0.5174 0.1782 0.3721 -0.6799 0.9774 0.1829 -0.9341 -0.5861 -1.8895 -2.6915 0.2143 1.2174 0.3608 1-myristoyl-2-palmitoyl-GPC (14:0/16:0) 0.9854 -0.0767 0.3738 -0.8999 -0.6053 -1.0246 -0.4018 0.4492 -0.4368 -1.2680 -2.3977 0.8885 -2.1744 -0.4199 0.6555 1.7380 0.3601 -0.8361 0.1529 1.8224 0.8068 0.6246 -0.0405 0.7658 1.0317 1.1328 -1.0645 -0.3315 0.2490 -0.2925 1.0961 1.8201 1.7917 -2.5727 0.6131 -0.5062 1.3476 0.1422 -0.7072 0.0145 1.3584 1.3394 0.5189 -0.4060 1.3751 -1.3582 0.8134 -0.0885 1.0794 -1.0886 0.6355 0.1344 1.0266 -0.2683 1.4139 -1.0827 -0.0120 -0.2610 0.6835 0.1657 1.2946 -0.0432 -0.5178 0.0812 1.8433 -0.0952 0.5130 0.5433 -0.0587 -0.6330 -0.0235 0.1129 -1.0635 1.0174 -0.2171 0.6569 1.1558 0.6825 0.7118 0.4483 1.5474 0.2883 -0.2082 1.0927 0.4877 -0.5757 0.5769 -1.5029 -0.3100 -0.5538 0.2037 0.4900 0.1662 1.4699 1.7899 -0.6846 0.6959 -0.0168 2.1014 1.1370 0.3524 1.2701 1.3355 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-1.3805 0.0013 -1.9777 0.3865 2.1578 1.3044 -0.4378 -0.9758 1.4764 1.9157 -0.2464 1-oleoylglycerophosphate (18:1) -0.2844 -0.2813 0.1499 0.0317 -1.8540 0.3359 -2.5508 -0.3742 0.2938 1.0107 2.4874 0.0532 -0.5217 0.2288 -1.0830 -0.3083 0.6018 -0.3445 0.3600 0.2546 -0.3272 -2.7533 0.0242 -0.7108 -0.5091 -2.3041 0.5954 0.0164 -0.4069 -0.0461 0.2350 -1.0448 -1.9267 -2.6120 -0.0892 2.3530 0.5279 -0.8379 -0.7863 -1.1746 0.6889 -0.8166 0.0864 -0.3224 0.0497 -1.3406 0.3865 -0.1567 -0.3937 -0.6619 -0.2631 0.3882 0.1325 0.4944 -0.0612 0.0399 -0.9413 -0.3535 -2.3838 0.2213 0.0888 0.5474 -2.4817 1.1731 -2.2908 -0.6373 -0.4853 0.3827 0.2380 -1.0037 -0.2090 -0.3792 0.1576 0.0611 0.0574 1.1660 -0.7479 -1.6021 -2.1548 0.1982 -2.3722 0.6535 0.0812 0.6679 2.1246 -0.5936 0.4802 -0.2118 0.3286 -2.0327 -0.6532 -0.0812 -0.4468 -0.2813 0.8527 0.8346 0.3479 0.0262 -0.0940 -0.4304 0.3499 1.0242 -0.1577 0.3931 -0.2220 1.0017 1.8966 -2.3793 -2.7223 0.1076 0.4446 0.4380 -0.5131 0.4961 1.8823 0.3128 -0.2187 0.5551 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-1.8585 -2.4717 0.5561 0.0433 1.0204 1.5038 -0.1645 1.3005 0.8462 0.6342 0.7323 0.5562 -0.4669 0.0465 0.1362 0.0077 0.7694 0.3099 0.5072 0.0616 1.3410 0.4389 -0.2799 -0.6237 0.2495 -2.3535 0.4089 1.1165 0.5996 -0.2817 -0.1933 -2.3079 -0.4016 1.1655 -0.1094 0.5786 -0.2627 -0.1753 0.6073 1.6271 0.3025 0.0768 -0.2634 0.5036 0.4218 0.6186 0.2164 0.3140 0.3475 0.5398 0.2485 0.1229 0.6075 -0.6029 -0.3045 0.7458 0.6987 -0.1202 0.1007 0.3429 -0.4987 0.9512 0.3570 -0.5518 -0.8709 -2.2150 -2.1793 0.4404 0.1210 1.4804 0.7542 -0.0233 -1.8274 -0.1653 -1.0330 1.7558 -2.2962 0.9597 1.1513 0.9147 -0.2199 0.2685 -0.8147 0.9479 -0.2247 -0.0248 -0.0168 0.2907 -0.2199 0.4098 0.4183 -0.4033 -0.6277 -0.4128 0.3706 -0.9723 -0.2196 1.9115 -0.8273 0.9413 0.6134 0.2789 -2.8139 0.2068 -0.0899 0.0602 -2.6657 0.0849 -0.6061 -0.1649 -2.3663 -0.4347 -0.1157 -1.1100 -1.9050 0.9709 -0.1459 -0.5747 -0.5210 -0.0015 0.7205 -0.6026 -0.9645 0.5791 0.4635 0.0499 0.1864 -2.7896 0.1135 0.7509 -2.1230 2.2810 -0.8869 -2.5380 0.3355 -0.2564 0.6104 0.4260 -0.1955 0.9896 0.1075 -2.0684 -2.5078 0.1654 0.7583 -0.3748 1.2226 0.6608 0.9813 1-palmitoyl-GPI* (16:0) 0.1918 -0.4759 -1.3886 0.5869 0.7093 -2.9498 -0.8631 -3.0815 -0.3593 -2.6768 -1.8609 -0.2272 1.6657 -0.8389 -2.3231 -0.2858 -1.4524 -0.2817 0.9573 1.6020 0.0952 -0.2019 1.8586 -0.0315 0.6798 0.7836 -0.2261 -1.3674 -0.0674 -0.7693 0.9771 1.5050 0.1518 -0.3234 -0.0675 -2.1551 0.8779 0.5834 0.8176 0.0364 0.3848 1.7133 -0.3548 0.3717 1.6382 -0.9072 -0.6188 -0.0890 1.7203 0.6050 0.8197 0.5452 0.0421 -1.3046 0.9256 -0.2480 0.0698 1.1291 0.8845 1.5830 1.2747 -0.1231 0.4040 -1.3383 1.9428 0.2755 0.2758 0.8226 -0.2843 -0.8722 -0.3159 0.8973 0.4848 1.1255 0.6126 -0.6519 1.4855 1.1038 0.1370 -0.1245 0.4369 -0.9851 -0.0987 0.5535 -1.0940 0.7824 1.6481 -1.1921 0.1315 0.3178 0.5721 1.8513 -0.0382 1.9756 0.0819 0.1688 1.6615 0.8761 0.5795 -0.6091 0.4211 0.1179 1.0979 0.3806 1.9436 -0.1077 -1.9992 0.4248 -0.0909 -0.4925 -1.3999 -0.9154 1.0281 0.4602 -0.5396 0.7352 1.0690 0.4451 -1.6008 1.0331 -0.7601 -0.5719 0.6620 1.5093 -0.8609 -0.1058 1.7437 0.0203 -0.2167 -0.1775 -0.1499 -2.2011 0.4032 1.4402 0.0357 -0.9335 0.4462 0.3647 1.3352 0.1768 -0.5268 0.2570 0.5445 -1.3005 1.2791 0.5871 -0.6808 -0.4910 0.7078 1.3419 0.9365 0.6383 -0.5340 -0.2876 0.6692 1.3520 -0.8911 0.3603 -0.0803 1.0013 -0.7452 -0.2559 0.0977 0.9760 -0.3526 -0.3127 0.2862 -0.4520 -0.1064 -1.7722 -1.3672 1.1824 0.0364 -0.1794 0.2601 1.7990 0.4483 1.0157 0.5622 0.5510 -1.0848 -1.0520 1.4409 0.4984 1.3829 -0.3819 0.8829 0.8898 0.2130 0.1229 -1.3285 -2.6772 0.8221 0.1665 0.3947 0.5114 1.2794 0.6373 0.7627 0.6801 -1.3414 0.3310 -0.6360 -0.1910 0.5326 0.8769 -0.1557 1.4628 1.1992 -0.1538 -1.1245 -0.9069 0.0719 -0.3690 0.5145 0.5671 -2.9984 -0.7546 0.9501 -1.0541 -0.1919 -0.4075 0.0615 -0.3971 1.4360 -1.5954 0.0204 -1.6209 0.7952 -0.0193 -0.8555 1.1725 0.6168 -1.4605 -2.1917 -0.4948 -0.4215 -1.1391 0.6363 0.5603 -0.0892 0.3899 -1.0515 -2.0063 -1.0345 -2.0841 1.5414 -0.6982 -0.4871 0.0066 -0.8663 0.0389 0.4752 0.1029 0.0156 -0.9721 -0.9098 -0.0058 -0.0615 0.1719 -0.4887 0.3735 -0.7393 -0.7313 -0.1129 1.7458 1.2272 -0.7434 0.0889 0.6874 0.4178 -0.9517 0.0406 -0.3383 -0.8609 0.0582 0.8786 1.1931 0.9708 0.5366 0.4499 1.5124 0.6585 -0.7402 -0.7388 2.0955 -0.1165 2.0008 -1.5324 -0.0564 -0.1560 -0.2298 -0.7538 -0.1090 0.4086 0.3182 -1.5915 -0.4274 -1.8897 1.4642 1.4267 -0.2960 0.4901 0.4760 0.3250 0.6118 -1.9522 0.6500 0.9157 -0.6173 1.4149 -0.5883 -0.8515 0.4280 -0.2465 -0.6190 1.6855 0.8696 -0.4281 -0.6556 -0.1613 -1.4843 0.7016 1.2667 0.1836 -0.4811 0.2881 0.2356 -0.1571 -0.4343 0.2468 -0.3283 -0.4689 -1.0187 0.2969 0.0252 -2.0389 -0.4641 0.4732 0.7060 0.5053 -0.0802 -1.1746 -0.1773 0.6531 -0.8815 -0.5042 0.8286 0.6914 -0.0597 0.7804 -2.2712 -2.0981 -1.4902 -2.1605 0.1982 0.1996 0.8868 1.2029 -1.3582 -0.1026 1.1624 2.1580 -1.0867 -0.5676 -1.4582 1.0670 -0.9591 0.4833 0.2059 0.1647 -0.6427 0.0538 -1.1438 -0.8625 0.5229 -0.4373 0.2291 -1.9647 -2.4813 0.7060 0.4270 -0.2886 -0.9563 0.5476 -0.3164 -0.0706 0.9100 0.2412 0.2807 1.0214 -0.0635 -1.2217 -0.7729 -0.7629 1.1516 -0.0144 -0.5208 0.4667 -0.1334 0.8063 -3.0277 0.1144 -0.6818 0.1617 -2.8815 -0.2372 1.2561 0.9477 -1.5161 1-pentadecanoylglycerol (15:0) 0.3776 0.7528 -1.4738 -1.3320 -1.0012 -1.5120 -1.6163 -1.5608 0.2836 -1.1259 -0.0756 1.0745 -1.3795 -1.4737 0.6203 0.9454 0.1373 0.2158 0.4168 -1.2348 1.1652 -0.2802 0.5389 0.5492 0.1687 -1.4010 -0.1648 0.0984 0.1433 0.7604 0.6992 -1.2813 0.5139 -0.5819 0.1517 -1.4387 0.6536 -1.1960 -1.3267 0.1228 1.1658 -1.0105 -1.4280 0.9875 1.0752 0.5269 0.8706 -1.3900 0.7333 -1.3990 0.0886 0.5512 -1.3594 -1.5184 0.2583 0.8996 0.6826 -1.1286 1.1047 0.1185 0.0950 0.7396 0.6968 -1.3362 1.2669 -0.3293 -0.0090 -0.3452 1.3097 -0.2259 0.6238 -0.2234 0.0675 0.9731 -1.4213 -0.4061 -1.2789 -1.4140 0.3987 -1.4679 -1.4511 -1.3577 -1.4223 -1.5888 0.9700 -0.0279 -0.3031 -1.3615 -1.5980 0.1349 -0.0846 0.4745 0.9667 -1.1122 0.2468 0.2232 0.7726 1.1104 -1.3527 1.2315 -0.3690 0.1011 -1.2845 0.1113 1.0251 1.0624 -1.4851 0.0150 -0.3679 -1.3229 0.7084 -1.5696 0.6639 0.1726 -1.4382 -1.4133 -1.2533 -1.3658 -1.5288 -0.2757 0.2019 0.8138 -1.4516 2.6231 0.8611 -1.5031 -1.5503 -1.4765 -0.2086 1.4751 0.9642 -0.0954 -1.1708 -0.1899 -1.4759 0.7903 1.2865 -1.1354 0.2913 -1.0157 -1.2491 0.9712 0.5303 -0.1722 -1.3211 0.4872 -0.1912 0.2848 -1.3393 -1.2854 -1.2327 -1.2511 0.5746 1.2899 -1.4654 -1.2678 0.4762 0.8007 0.8628 -1.0331 0.0614 0.4736 -1.2803 1.1267 -0.0997 1.0835 1.0313 -1.5144 -0.0115 1.0050 -1.5955 0.0192 1.1682 -1.2501 0.7184 -1.1653 0.0290 0.9465 1.4524 -0.2792 0.1430 0.1703 0.0832 0.8977 0.0628 0.2090 -0.0849 1.0062 -1.2516 -1.3287 0.5301 -1.2825 -1.3398 1.0468 1.0098 0.4110 0.8513 0.5993 0.3425 0.1073 -0.0464 -0.0328 -0.9966 0.1435 0.9521 -1.1501 0.9715 0.8672 0.9384 -1.4004 0.0588 -1.4319 -0.1453 0.2953 -1.5920 -0.0334 0.6023 -1.6416 0.2136 1.2412 0.6434 0.4114 1.8219 0.4284 0.5816 0.8169 0.4804 -1.6901 -1.5291 -0.1056 -0.0363 0.6682 -1.3898 -0.0319 0.9274 0.3061 -1.4902 1.4324 -1.5874 1.2257 -0.0142 1.1634 -1.4693 -1.7212 0.4723 -0.2906 0.7543 0.5351 -1.6218 1.2492 0.8165 0.6756 0.8894 -1.4855 0.2084 -0.2328 0.9863 -1.5077 0.0846 -0.0269 -1.5278 -1.3148 -0.1096 0.3779 1.0123 0.9611 0.6100 0.3792 1.1768 0.7929 0.7686 0.6735 0.6663 1.4593 -1.5391 0.5985 0.6894 0.9169 1.0826 -1.2325 1.5669 -1.6184 0.2335 -0.2149 -1.7182 -0.4922 -1.5556 -1.4597 1.7066 0.9063 -0.0491 0.6067 -0.2151 1.2046 1.0221 0.7831 0.9479 0.3566 1.9318 -1.5801 -0.1011 0.3008 -0.2190 0.8057 -1.4561 0.2250 -1.5625 -1.2406 1.6056 0.8063 1.1806 -1.5945 0.9553 1.1931 0.9139 1.3524 0.5706 0.3005 -1.3909 0.5250 -0.3180 -0.4920 -0.1207 0.3578 0.5218 0.4594 -1.4868 1.4426 0.7392 0.9729 0.1677 -1.3763 1.0240 -1.3059 0.3740 1.3815 0.9520 -0.2006 -0.0742 0.8486 0.8476 -1.7797 1.1483 0.8120 1.9415 0.7495 1.0730 0.6022 0.3554 0.6719 -0.0411 -0.9338 0.1054 1.0215 -1.5613 0.4609 0.0793 0.2050 1.5646 1.2793 1.5136 1.2189 -1.4794 -1.7781 1.1669 -0.5931 -0.2444 0.7024 1.4345 0.6133 0.2350 -1.5627 -0.0091 -1.4539 -1.7961 0.6465 1.5254 -0.0247 -1.6224 0.4160 0.5372 0.3075 0.6072 -0.1376 -0.0851 1.0320 1.3778 0.6942 0.6390 0.8669 0.1721 0.3477 -1.1082 -0.2932 -1.6486 0.8764 1.0637 0.1397 -0.8337 0.0125 -0.1113 -0.3436 1.0901 1.1009 0.9435 0.1554 -1.5133 1.4014 1.8062 0.6519 1-ribosyl-imidazoleacetate* -0.3728 -0.7513 -0.0599 -1.1393 0.9047 -2.6090 0.1475 -0.8938 -1.1942 -2.4167 -1.0354 0.0408 -0.1804 -0.6866 -0.2282 1.3517 -1.3730 -0.8073 1.3611 0.3421 -0.1772 -1.5022 -0.7986 -0.3618 -0.0576 0.7521 0.1429 -0.7409 0.1541 -0.6170 0.0746 -0.3741 0.4187 -1.1837 -0.3243 0.0459 0.5224 0.0474 -0.7240 -0.7736 0.1220 0.2949 -1.4223 0.0651 -0.1311 -0.7288 -0.1436 -0.2359 0.2374 0.9403 -0.3424 -1.0480 0.9048 -0.8649 -0.3560 -0.3997 1.0308 0.7463 -0.1946 -0.6350 0.4950 1.3339 1.0371 -1.5577 1.0887 -0.5262 0.1381 0.4073 -0.1941 -0.7930 0.9203 -0.9521 -0.5182 0.8727 -0.7409 0.7112 1.2794 1.8341 -0.9615 -0.5725 0.3513 -0.3401 -0.1286 -1.1401 -0.1722 2.0559 -0.5346 -2.2024 -0.7205 1.1912 0.7697 -0.6286 -0.4559 0.6311 1.3846 0.1766 -0.0777 -0.0146 0.8545 0.9830 -0.1159 0.6750 0.3754 0.4059 1.2805 -0.6516 -1.6590 -1.3291 -0.2567 -1.0567 -0.6810 -0.0391 -0.8434 -1.2542 -0.1651 -1.7381 0.6660 1.0911 -1.3691 -0.3064 -0.5210 -0.5600 0.3425 1.3273 -0.3602 -0.7441 0.9552 0.0429 -0.4234 -0.7359 0.0315 -0.8261 0.3381 -0.9563 -0.2239 0.3608 -0.6063 -0.1448 -0.5094 -1.0583 -1.1853 -0.1346 -0.9499 -1.3036 0.8247 1.1001 -1.0681 0.1135 -1.3082 -0.4236 -0.2475 -1.5882 -0.7444 -0.1715 -0.6932 3.4982 0.1897 -0.5838 0.1176 -0.3823 -0.4388 -0.9978 0.2581 -0.2778 1.0894 -0.1392 -0.0156 0.6020 -0.0836 -0.3465 5.0180 1.1269 0.5479 0.6618 1.3832 -1.0267 -0.0221 0.4375 0.2501 -1.3144 -0.0100 0.7708 0.0724 1.5815 1.1637 -0.3296 -0.0502 -0.9421 -1.5428 0.6839 0.1683 -0.2414 -0.3336 -0.3170 -0.2012 -0.2799 -0.1637 0.3005 -0.6348 -0.1265 -0.7163 1.1859 0.1458 -1.1450 0.1844 0.2744 0.5027 0.5130 -0.7530 0.5959 -0.2399 -0.0397 0.6359 -0.4331 1.0296 0.5339 -1.2977 -0.0094 1.2537 -0.7814 -0.3630 -0.2987 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-0.7607 -0.2174 0.0029 -0.7473 -0.2938 -0.3274 -2.0026 0.4098 -0.4879 0.3930 -1.0022 0.4931 -1.3314 -1.3594 -1.1796 -1.2917 -1.5865 -0.5349 -0.2992 -0.1685 -0.4306 -0.4211 0.5507 0.6147 -0.0004 -0.3003 -0.8712 -0.8652 0.4797 0.2545 0.5136 -0.8256 0.1158 -0.4927 -1.3961 -0.3066 -2.4427 -1.4330 -0.1987 -0.3709 -0.3058 -0.4174 0.5018 -0.4270 -0.8534 0.0327 -1.6220 0.5396 1.0425 0.6758 -0.3539 -0.2606 -1.8770 -0.6233 -0.0182 -0.6416 -2.3961 -0.5622 -0.2825 1.1297 0.0450 0.0193 0.7571 -0.8099 -2.1550 -0.2425 0.1236 -0.6255 0.6122 -1.1281 -2.1616 -1.1951 -1.0777 -2.3244 1.4164 -1.7783 -2.3651 0.2084 -0.7278 0.4998 -0.0430 0.5411 -0.7848 -2.0835 -1.7287 -0.2125 0.5195 1.2661 0.0305 0.7266 -0.4016 0.2236 -2.1226 -1.2053 -0.2706 0.9448 0.8613 -0.3771 -0.5065 -0.7051 0.1886 1.1691 -0.0069 0.0209 -0.2633 -0.1444 0.6272 0.1005 -0.1101 0.1697 0.5226 1.5447 0.0340 -0.7590 0.4416 -0.3047 -0.6503 -0.1593 -0.1324 -2.4298 0.6096 -0.5022 -1.8271 0.4786 -0.0773 0.1393 -0.7374 -0.1964 -0.1495 -2.6447 -0.3755 0.5185 0.4362 -0.5252 0.4717 -0.2818 -0.1679 0.7434 0.7823 0.2037 -1.4698 0.1950 -0.1665 -0.3869 -0.3406 0.9550 -0.2379 -0.5477 0.2273 -0.3906 0.2932 0.7773 0.6910 0.4721 0.2941 0.1097 -2.7144 1.5166 0.4847 0.2603 0.8279 1.5862 0.2323 1.0450 0.2558 0.3598 -0.9098 0.4149 0.1212 0.6039 1.1499 -0.5010 -0.2228 0.7119 0.6233 0.1288 -1.1756 0.2278 0.7750 0.2308 -0.8217 0.5149 0.2530 0.6015 0.3871 -0.0739 -0.1235 -0.6893 1.6895 -0.2450 0.5076 0.3890 0.1342 0.5932 0.7289 0.5383 0.7757 0.3985 0.1468 0.8273 1.1549 0.1651 0.7479 0.7694 0.2195 0.8595 0.9462 1.2117 0.5527 0.7193 0.9384 0.0380 0.8392 1.1692 0.1583 0.4618 0.3040 0.9391 0.3890 0.4147 0.0235 0.8965 0.5216 0.2016 0.6609 0.5338 1.1526 -0.9962 0.7785 0.9785 0.0086 -0.3921 1.5130 0.8715 -0.1144 0.7708 2.4504 1.0473 0.0152 1.3604 0.9007 2.1936 0.1329 0.5367 -1.0849 0.8584 -0.3790 1.1026 0.7501 0.4548 -0.6246 1.5923 1.4485 -0.4313 0.6624 0.8539 0.6929 0.8439 0.4420 1.5061 0.7556 -0.2482 1.1393 -0.3961 1.1236 0.6702 1.3340 0.5460 1.1969 1.8356 -0.4859 0.7388 -0.1027 0.6646 1.3591 1.7366 0.5198 0.7536 0.7684 2.0351 0.8197 0.8474 1.6062 1.0134 2.4828 0.1910 -0.1387 1.3046 -1.4247 0.8628 0.4889 1.1225 0.3462 1.6067 -0.3658 1.2627 0.5924 -0.6322 1.5056 1.7537 0.8388 1.4654 0.6173 -0.0424 0.9427 2.4420 1.1628 0.9885 1.9420 1.6695 0.8047 2.8262 2.5095 2.0048 1.9514 -0.5679 1.0910 -0.5248 1.5057 -1.3126 0.7677 0.6624 1.8941 21-hydroxypregnenolone disulfate 0.1513 -0.1180 0.6927 -3.9564 -0.3060 0.7170 -1.8968 0.4030 -4.2027 1.9494 -1.7340 -1.4130 -0.1916 -0.1470 -1.0948 0.4790 -1.1282 0.6929 0.1256 0.1181 -0.2191 -0.1251 -0.6664 0.8179 0.4565 -0.3934 -0.3440 0.3459 -0.1348 -0.7074 0.3904 0.7307 0.4481 0.8056 0.3021 -0.1417 -0.4530 0.1850 0.8375 0.7451 0.2326 0.8046 -0.8359 -0.7199 -0.9402 0.5889 1.0499 0.2639 -0.0591 0.2828 0.3609 0.3916 0.2346 -0.5881 0.9832 -0.1879 0.5115 -0.9574 -0.3419 0.7406 -1.0292 -0.3457 -0.2811 0.7494 0.4819 0.7953 -0.1431 0.0602 0.9916 0.2003 -0.9544 0.7930 -0.0830 -0.3992 -1.0589 0.2416 0.2451 0.8883 -0.9879 -1.1837 0.9190 0.0133 0.0634 0.2651 -0.9578 0.5967 -0.1447 -0.9219 1.2413 0.0720 -0.7239 0.3978 0.3344 -0.2468 -1.4197 -1.3806 0.0712 -1.3249 0.0878 -0.7904 1.0592 -0.3543 -0.7475 -0.0797 -2.8899 -1.5910 -0.9504 -1.0077 -0.7228 -0.4398 0.2436 1.5468 -0.0742 -0.8957 -0.1966 -0.8583 0.5037 0.3990 0.3933 0.3731 -0.1783 -1.1722 0.2446 -0.4783 -0.5693 -0.2112 -0.5215 0.0535 0.3267 -0.0828 -0.4272 -3.9294 1.2569 0.6145 -0.6331 -0.1196 -0.1800 -1.1110 1.2472 -0.6273 0.2788 0.5589 0.1556 -1.1996 -1.1294 -0.5814 -0.0612 0.3878 -0.9874 0.5496 -0.9210 -0.0171 -0.0984 0.6350 -0.2809 1.0872 0.4943 -0.3068 1.2035 -1.5158 -0.5499 -0.3469 -3.8674 -1.0763 -0.5357 0.6936 0.2319 0.3847 0.9740 -0.0519 0.9557 0.2224 -0.5879 -0.7553 0.4203 -0.7204 0.4988 -0.2769 -0.9294 1.7752 -1.2911 0.2209 -0.2753 0.1650 0.2189 0.3510 0.0220 0.7880 0.5569 0.0417 0.5166 0.5471 -1.4620 0.4784 -0.7047 0.8766 0.2000 0.0251 0.2512 -0.7004 0.0527 -0.0829 0.1183 -0.3116 -4.1864 0.7906 0.4880 -0.7916 -0.2678 -0.7318 0.4721 -0.7238 0.3013 0.0971 0.3430 -1.1281 -0.8493 -1.5166 0.6028 -0.5668 -0.8308 1.3240 -1.2775 -0.5071 -0.2855 -0.6168 -1.6533 -1.8959 0.3705 -0.5634 -1.0297 -3.9192 -0.3979 0.0185 0.8577 -0.2312 -0.1639 0.9615 -0.8544 -0.0919 -0.7489 -0.2827 0.4323 0.0627 0.4123 -0.1485 0.7641 -0.2119 0.1362 0.4201 -0.2906 1.6438 -0.9761 0.6494 0.3161 -0.1746 1.7172 0.9682 -0.2248 0.6709 0.2300 0.6036 0.8388 -0.7510 0.8250 -0.7974 0.0094 0.5204 0.6522 1.2639 -0.1424 -0.9332 0.5262 0.2497 -0.3845 0.3525 -0.1156 -0.2555 0.3537 0.7406 0.2558 -0.1475 0.6405 0.3345 0.5653 1.0718 0.5557 -0.0964 -0.8691 -1.0049 0.9859 0.3972 0.2824 0.7107 0.5894 -0.4843 -0.0051 0.2712 -4.0652 -1.8325 -0.2336 -0.2640 0.3508 0.7423 0.6195 -0.7446 -0.3598 0.2298 0.7062 0.0626 1.0148 0.9031 0.6797 0.3452 0.1438 1.1489 0.4708 0.0926 -0.0938 0.3208 1.5891 1.1474 0.7706 0.4616 0.9892 0.7714 -0.0684 0.5066 1.8625 0.5016 0.9553 0.1686 0.5051 0.2742 -0.1753 -1.4956 0.1843 0.4825 -0.7317 0.3962 0.1201 0.7370 -0.5873 0.2434 0.5444 0.1464 0.0191 0.3397 0.6757 1.9047 0.2853 0.9353 0.2704 0.8813 1.3211 0.4922 0.3022 1.2418 -0.4275 -0.8036 0.2831 0.1489 0.4984 -0.0484 0.3257 1.1159 1.2881 0.9616 0.3437 1.1741 -0.3203 1.9081 1.3797 0.2228 -4.7422 -0.6183 1.0953 -0.0362 0.2751 0.1434 0.1599 -0.2862 -0.2916 -4.7041 0.8436 1.3407 0.9939 0.6400 0.9039 1.1668 0.5595 0.7962 1.7991 0.1604 0.2522 0.7417 0.9662 1.1318 0.0787 1.2681 1.7855 0.6061 0.2213 0.7336 -4.6064 0.1369 1.0375 1.4898 0.3640 0.3243 2_2^-Methylenebis(6-tert-butyl-p-cresol) 0.1577 -0.3455 0.2369 -0.0031 -7.2051 -0.0162 -0.4866 0.7094 0.4404 0.2048 1.1178 0.1679 -1.5475 -0.5215 -0.0775 -0.2236 0.2337 -0.0397 0.1073 0.1185 0.2232 -0.2173 0.3380 -0.2903 -0.0739 0.6195 0.5315 -7.2493 0.3879 0.0564 0.0707 0.3801 -0.6218 -0.5867 0.0252 1.6776 0.0612 0.3758 -0.4456 0.5724 0.4723 -0.2224 0.1736 0.2315 0.1240 0.7794 -0.1010 0.2872 -0.3120 -0.9127 0.5748 0.1954 -0.0031 0.1174 -0.1687 0.1578 0.2530 -0.7515 -0.0140 -0.0952 0.3060 0.3969 -0.5919 1.0063 -0.7201 1.8909 -0.0464 1.2846 -0.1580 0.4878 0.3041 0.8283 0.2678 -0.3688 0.7523 1.4807 0.5961 0.0990 1.1678 0.6980 0.0034 0.8774 -0.1943 0.3225 1.7274 0.4119 0.3714 -0.1151 0.8963 0.0188 -0.1171 0.4693 -0.6336 0.1536 0.1869 0.4046 0.1298 0.2844 0.5827 0.9010 0.6630 0.6758 0.0300 0.3675 0.0343 0.7093 0.5567 -1.4761 -0.2107 0.5720 0.1708 0.0050 -0.4852 0.0107 1.6743 0.2247 -0.1539 1.3118 0.9262 -0.3480 0.7792 -0.2186 -0.0498 -0.2559 -0.6450 0.6213 -0.2276 -0.4175 0.3420 0.1377 -0.0038 0.6990 0.5577 -0.2504 0.5122 0.1483 0.4462 -0.0957 0.0330 -0.3565 1.3546 -0.5554 0.1664 -0.1108 0.1583 -0.1776 -0.2813 0.3372 0.0506 -0.3469 -0.4950 -1.0697 -0.6453 -0.2162 0.9163 -0.1351 0.8244 -0.0791 -0.5416 -0.5662 -0.1904 -0.0210 -0.2465 -0.6277 0.2170 0.7496 0.3873 0.4708 -0.3837 0.1875 0.5266 0.0387 -0.2052 0.0703 0.0936 -0.7206 -0.3563 -0.4821 -0.3126 0.1012 0.4608 0.1102 -1.3016 0.1193 0.2260 0.2021 0.0414 -0.7709 -0.5161 -0.1923 0.6057 0.4008 0.1440 0.2524 0.6308 0.0770 -0.0530 -0.5026 0.2094 0.3756 0.0398 0.4639 0.8515 -0.5735 1.4805 -4.4176 -0.0379 0.3313 0.0488 0.0723 0.2647 -0.3269 0.0718 -0.8548 -0.9221 0.9092 1.4832 0.7660 0.9964 0.3274 0.4125 0.4763 0.0375 0.1805 0.0163 -0.0242 0.9518 0.6255 -0.0407 0.4229 0.5147 -0.5001 -0.3165 0.8646 -0.0996 0.3979 -0.2050 -0.3798 -0.9145 -0.4647 -0.1758 0.4003 1.3797 -0.5574 0.1641 0.5049 -0.3632 -0.4000 0.5194 0.5336 -0.0613 0.0448 0.1355 1.0131 0.4294 0.2172 -0.2943 0.6884 0.7770 -0.8653 0.4420 -0.1523 0.0026 0.6617 -0.5730 -0.8016 0.0874 -0.1706 0.3167 0.2935 -0.1852 -0.0104 0.1197 -0.1650 -0.1598 -0.2477 -0.6405 0.0441 0.0613 0.2900 -0.5536 0.0340 0.6209 -0.7342 -0.5483 -0.0385 0.4081 0.6903 1.3705 -0.0119 -0.2720 -0.2255 -0.5700 -1.1592 -0.4603 0.1118 0.7095 -0.8839 -0.0391 0.6569 0.1101 -0.4249 0.3621 0.2093 0.0068 -0.1563 1.2338 -0.4988 0.3077 0.3324 0.6603 0.2040 0.2142 0.2225 -0.4078 0.0874 -0.4258 0.1556 0.1591 0.1997 -0.4758 0.6334 -0.1992 -1.0125 -0.1438 -0.0493 0.5302 0.3627 0.5044 -0.5172 0.1441 0.1691 -0.5465 -0.2618 -0.0273 0.4275 1.2071 -0.4437 0.5404 -0.2231 -0.8231 0.0121 0.1539 0.0449 0.0691 -0.0166 -0.4861 -0.3261 -1.0328 -0.2264 -0.9519 -7.3065 0.2226 -0.0331 0.2029 0.4656 0.3762 -0.3131 0.3335 -0.2060 -0.4850 -0.3925 -0.2638 0.2429 -8.4927 0.3275 0.2567 0.3163 0.5066 -0.1649 0.2376 -1.0447 0.0279 -0.2518 -0.2813 -0.0587 0.8639 1.3333 1.0359 -0.0195 0.3739 -0.6314 0.3301 0.9194 0.3324 -0.1178 -0.0890 0.3304 -0.7195 0.0843 -0.5743 0.2393 -6.0613 -0.0335 0.4919 -0.3314 0.1937 0.0612 0.1399 -1.3727 -0.2177 -0.0092 -0.2342 -0.1212 0.2606 1.9970 0.2172 -0.5615 0.3299 0.9855 2_3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)* 1.2284 0.7603 0.5332 -1.8011 0.5919 0.9754 -0.4618 1.5619 -2.0877 2.1258 2.4733 -0.1923 0.3505 0.6859 1.9020 0.7995 -0.1088 0.0604 -0.4672 -3.3682 -0.8028 -0.1891 -0.3991 0.4534 0.3394 0.7246 0.8507 -0.1077 0.1622 0.0295 0.1890 -0.0294 0.6541 -1.3910 -0.4806 5.4805 0.6980 -0.0774 -1.9261 -0.4071 -1.8033 0.2773 -0.6606 -0.1237 -0.3458 -0.0564 -2.5564 0.0853 0.1337 1.3195 -0.4230 0.1595 0.2415 1.0972 -0.0940 0.4626 1.8200 -0.9643 -0.4085 -0.3492 -0.4582 -1.0526 -0.4644 0.9690 -0.5041 -0.3847 -1.4689 -0.1255 0.1150 0.8548 -1.9071 -0.6286 0.4911 -0.1235 -1.2046 0.2230 0.0029 0.2852 0.0417 -0.2519 -1.6089 -0.0084 -0.2349 -0.6428 1.5676 0.1564 0.7280 -0.0207 0.1197 -0.0661 0.9058 -2.0327 -0.6646 -0.1976 1.0776 0.4483 -1.1507 -0.6662 -2.9935 1.0312 0.3535 0.6245 -0.7263 -0.6027 0.4709 -1.5237 1.2155 -0.7585 -0.0638 0.2731 -0.7142 -0.2533 -1.6168 -0.6105 1.0802 -0.8934 0.1953 0.4434 2.1439 -0.5636 0.7632 -0.0140 0.4113 -0.3711 -2.2782 -1.4189 -0.8171 0.0690 -0.9573 -0.6572 0.1056 2.3093 -0.5114 -0.7195 0.0048 0.8897 -1.3720 0.1242 0.0013 0.3146 0.3899 0.0750 -0.9500 0.1995 0.4150 0.6515 0.0157 1.2830 -0.1993 -0.0232 -0.6489 -0.1490 -0.9584 0.3045 -0.8311 -0.6812 0.6964 -0.7714 -0.5588 -0.6650 -0.0856 -0.8642 1.2441 -0.9928 0.5263 0.1589 -3.3923 0.2846 -0.0070 -1.0996 -0.1029 -0.7559 -1.1509 0.9025 0.1361 0.1018 -1.1461 0.2912 -0.2024 -2.7736 1.2838 0.2864 -1.1780 0.9803 -0.1995 0.8958 -0.6428 -0.4851 -0.5678 -0.9239 -0.1183 2.6395 0.5879 0.3978 -0.5418 -0.4218 -2.6808 -0.5084 -0.6187 -1.3081 0.1081 -0.9117 1.0476 -1.0731 -0.0038 0.2476 -0.6059 0.7509 0.3379 0.7117 1.1236 0.0262 0.0907 -0.7984 -0.3928 0.2050 2.2495 1.1489 0.0367 0.0414 -0.7210 -0.2999 -0.7281 0.0864 0.7814 0.5685 0.0324 -1.7069 0.5150 0.8343 -0.2264 -0.9937 0.2573 0.2652 -0.5424 0.0428 -0.7814 0.1778 -0.1259 0.7818 -0.8992 -0.1893 1.0706 0.6080 -1.0476 0.0120 -0.1019 1.0364 0.4404 0.2106 -0.0207 0.1575 0.9609 -2.1124 -1.7048 -0.0785 0.4587 -0.7465 0.0500 -0.2380 0.4907 -0.4141 0.0135 0.2822 -2.2973 -0.3375 -2.2635 -1.0935 0.1107 -1.0911 -0.0843 0.8618 0.6806 -1.2261 0.4446 -0.0470 -0.2925 -0.8529 0.1611 1.1434 0.1200 1.3253 -1.3361 1.0260 -0.1373 -0.5961 -0.0605 -0.2170 1.7001 -0.3242 -0.2362 -0.7591 0.8006 0.8730 -0.7595 0.0717 0.0652 -1.5514 2.1734 -0.1671 -0.0102 -0.4960 0.0773 -1.0510 -0.7506 0.2957 -2.0924 0.3898 0.0749 0.9712 0.5241 0.0668 0.0604 0.0708 1.0653 -0.9244 0.5822 0.1529 1.6350 -0.4270 0.3304 0.2185 0.7935 -0.5880 0.2222 1.0570 0.0727 -0.4737 -0.8328 -0.0090 -1.5199 0.3301 0.9790 0.4688 0.0923 -0.2085 1.6756 -0.3759 1.5784 -0.4931 -1.2707 0.4320 -0.5743 -0.8013 0.1420 1.0729 0.1922 0.2424 1.0134 -0.4419 -0.5526 2.5379 0.9798 -0.5262 1.8247 0.7957 -0.9034 1.0271 0.9367 -0.0250 0.5971 0.0447 -0.2471 0.8002 1.3374 0.2346 0.7035 -0.8509 -0.6303 -0.0871 0.6449 1.5750 -0.2687 -0.5682 -0.6403 0.6776 0.5121 1.3152 0.1921 -1.7325 0.3711 1.3232 0.5657 0.8926 1.2661 1.0135 -1.8136 -0.1271 -0.1028 1.0145 -3.6432 1.0574 2.2621 1.8136 0.0608 -0.4373 1.3679 -0.4263 -0.4768 1.0044 -0.0962 0.8758 -0.2719 1.1731 -0.6727 2.0604 0.0625 1.3350 0.4691 1.0195 2_3-dihydroxyisovalerate 0.4459 1.2861 -0.5792 -0.3029 1.5544 -1.1193 1.8698 0.0629 0.8956 0.4246 -0.3143 -0.6458 1.5073 0.8762 1.9266 -0.4806 -2.0845 -1.2139 -1.8937 -1.7676 -0.3607 -0.7439 -0.4994 0.0055 -0.6335 -0.0370 -0.2522 -1.2193 -1.7981 0.0796 -0.2488 -0.3874 -0.2239 0.7350 1.0958 -1.9402 -1.8890 0.0800 -1.4736 -1.0528 -0.2424 -1.5815 1.3726 -1.2613 -1.8100 0.3137 -0.4379 -1.9061 -1.9106 2.2283 -0.8258 -2.0940 0.6833 -1.0261 -0.3413 -1.0439 -0.0826 -1.4204 -1.0083 -2.0150 -0.0801 0.0364 -0.1386 0.5016 1.2395 1.1739 -0.7373 -0.0282 0.3808 -0.6170 -0.6328 -1.2357 0.0425 0.7226 -0.6336 0.1215 -0.5293 0.8627 0.4556 1.3062 -1.9580 -0.7930 1.3551 -0.5481 -0.3537 -0.0920 -0.1921 -0.9205 -1.8215 -1.2710 -1.0427 -0.5036 -0.2517 -0.3291 -0.9241 -0.6283 1.4645 -1.4707 -0.3023 0.5449 -2.0448 1.2299 -0.2434 1.0395 -0.3976 0.1304 0.9412 1.1446 -0.8346 0.6203 0.3636 1.1516 0.3077 0.5441 0.7903 0.4860 -0.2228 1.6483 0.4718 0.6999 -1.8362 -1.8922 -1.9558 1.2534 0.2844 -0.5375 1.5012 -0.0216 0.4994 -0.5006 1.0823 0.5400 -0.0566 -0.0378 2.2278 -0.1291 1.6550 -1.6843 -0.4637 0.1824 -1.7756 -0.4975 -1.8854 1.4828 -0.0710 0.2996 -1.9193 -1.1046 -0.2761 -0.7574 0.4273 -0.1988 0.3015 0.1458 -0.4070 0.3062 0.1162 0.0324 0.6728 -0.1241 1.3839 -2.1117 0.8849 -1.9321 1.2545 0.6009 0.9915 1.1090 1.1652 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0.2378 0.8830 0.8155 -0.5615 0.3026 -2.1358 -0.5896 0.2957 -1.0673 1.1013 -0.5033 -0.2503 0.2929 0.4048 0.5683 1.0614 -0.9561 0.4558 -0.4909 -2.0306 -1.1774 -0.9344 -0.9968 -0.5793 -0.4607 -1.0180 0.9601 -0.6069 -0.1169 -1.6832 -0.1658 -1.0308 -0.8984 -0.5250 1.5053 -0.4126 0.3799 -0.4414 -1.1660 -0.2610 0.5885 0.3275 1.0712 -0.5215 -0.8636 0.7882 0.7252 -1.4484 -1.1439 1.1745 1.0428 1.1960 0.3466 -0.2064 1.3015 -0.6275 -1.4180 -0.5122 -0.6309 0.3733 1.0186 -0.9764 -2.2601 -0.3024 -0.1141 1.0307 -0.1222 -1.9120 0.2814 0.1260 0.1724 1.4321 -0.4134 -0.0853 0.3742 -1.5260 -0.8509 0.4276 0.3326 -1.2112 0.5284 -1.3575 -0.7984 0.3106 -0.3323 0.2764 0.4634 -1.3915 -1.6780 -0.4550 -2.1300 0.4763 1.6619 0.5063 1.2385 -1.4974 1.2066 0.6592 0.3643 0.1015 1.7045 -0.6474 0.5307 -0.0740 1.3794 -0.1816 0.0893 -0.3712 0.7675 -0.6228 -1.7686 2.2710 -1.6751 -0.5495 -0.2206 1.4752 0.1224 0.6827 -0.4514 0.2183 0.0542 0.0367 -0.8325 -0.2220 0.9491 0.5797 -1.8198 -1.1040 -0.9521 -2.2833 0.4064 -0.4384 -0.2022 -1.8353 1.4902 -1.2356 -0.0595 0.2686 -0.2991 0.1683 0.1294 -0.0652 -0.2354 0.3207 0.5067 1.5398 0.5149 -1.5051 -0.3111 3.2662 -0.2446 -0.3391 -1.4415 -0.9046 0.5725 -0.5834 1.0793 0.1321 0.0586 -0.1370 0.7670 0.1204 0.7078 0.5499 0.7086 0.3987 0.4148 1.1419 -0.2023 0.3710 -1.4848 -0.1992 1.8352 -0.4215 0.4755 -1.3799 1.3095 -0.3037 0.4214 -0.0353 -0.3338 0.8198 1.2238 1.7710 -0.4445 2.3525 0.0465 -0.0412 0.4138 -1.0912 -0.0347 1.0093 -0.1980 -0.8540 -0.1533 -0.0453 0.4731 0.4495 0.3942 0.0052 -0.5906 -1.1203 -0.3404 -0.1505 -0.5920 -2.2196 1.1772 1.6178 0.5724 1.6468 -0.3140 -0.7966 0.5090 0.0698 0.5805 -0.1857 0.5606 0.3048 -1.1550 0.1216 -0.7935 -0.3362 -0.5353 -0.8860 2.0017 -1.2129 0.1154 0.2856 0.8844 2.6390 -1.4599 1.4559 -0.6388 -0.8045 0.8754 0.1995 2.2516 1.4696 0.6793 0.5222 -1.9299 -1.6537 0.6867 -0.6738 -2.1348 1.3760 -0.3832 0.5200 -1.6617 2.9081 1.0715 0.3451 0.5803 1.0630 0.7917 -0.3070 1.6746 0.0832 -0.7286 -1.9546 -0.3575 -0.1942 1.0623 0.5461 1.2476 1.2586 0.6438 -0.6338 -0.5818 -0.3560 1.4095 1.0085 -0.0308 0.4782 -2.0515 0.2413 -0.2006 1.2206 2-aminoadipate 0.0862 0.7803 0.0308 -0.4642 1.0813 -0.6123 1.2366 -1.3458 0.4843 -1.5759 -0.0865 -1.0207 0.5000 1.2508 0.2751 -0.4174 -1.7020 -0.1561 0.4115 -0.4624 -0.0856 -0.3145 0.0946 -0.2118 0.1550 0.8848 -0.4546 -0.1092 0.4143 -0.3840 -4.1400 -0.0049 0.7802 -0.8077 1.2348 -1.1624 0.3111 1.0182 0.2081 0.3642 0.3328 0.2539 0.4515 -0.1371 0.5262 -1.5632 0.5218 -0.4904 -1.2719 -0.0898 0.1663 -0.4374 0.6016 -0.6244 -0.4742 -0.9109 -0.2483 -0.1972 0.7190 -1.1026 -0.1361 0.5572 -0.4131 -1.0367 1.1122 -0.0441 -0.7219 0.4019 -1.8373 -0.0369 0.3766 -0.5077 0.1103 0.7428 -0.0403 -0.1502 -1.2410 1.3551 1.1546 0.7724 0.3864 0.4810 1.6974 0.6905 1.3072 -2.0027 0.6274 0.4079 0.0644 -0.6531 -0.9533 -3.5928 -3.6274 -0.8136 0.0284 -0.2170 -0.0559 -0.0834 0.5745 -0.1758 0.0807 -0.2519 -0.5332 -0.7399 -0.2490 1.3034 -0.7721 0.1615 0.5150 -0.3341 -0.1979 0.4921 -0.9478 2.0849 1.1278 0.2132 0.4137 -0.2011 -0.5338 0.2454 -0.7846 1.1515 -3.0207 -0.1931 0.7762 -0.2287 -2.0430 0.7609 -0.5715 0.7551 -0.3528 0.5495 1.2702 -0.2836 0.3044 2.3027 0.3651 0.3960 0.1865 -2.7725 -0.2620 -0.6681 0.4582 0.1431 -0.3820 0.8650 -1.1135 0.6874 -1.3170 -0.4462 -0.4175 0.7491 1.2092 -0.2719 -1.2113 0.2481 -0.2369 0.1225 -0.9648 -1.0021 0.3586 -0.8151 1.2879 -0.6511 -1.5016 -0.0534 0.8853 -1.6664 1.0244 -0.7653 1.8117 -0.4375 -1.0244 -1.2458 -0.4185 -3.1105 0.3539 0.6718 -0.1027 -0.0954 -1.0886 0.2171 -0.7470 -0.8858 -0.4894 -0.3372 -0.3084 -0.1322 -3.3379 0.0186 1.2191 0.4762 -1.2618 0.1586 0.4759 -0.0245 -0.3139 -0.2944 1.0155 0.3237 0.1796 -0.5097 0.0114 0.1796 0.5501 0.4773 0.5272 -2.2776 0.1681 -0.0670 0.5840 0.6939 -0.6486 0.4780 2.1432 0.3889 1.8233 0.9280 0.1456 0.2986 0.2428 0.7682 0.2018 0.4654 -0.3852 0.9528 -0.2833 1.0227 -0.6818 1.2023 -0.1953 0.0629 0.4580 0.3073 1.1476 0.0156 0.4071 0.0266 0.9188 0.8039 -0.4568 -0.4842 -0.1820 1.6980 0.0269 0.4499 1.3012 0.2427 0.3020 -0.0030 1.2702 -0.9181 -1.4072 1.3440 0.4199 0.7416 1.0495 1.0161 -2.4942 -0.3592 -0.8004 -0.2809 1.3592 0.8056 0.1917 -0.1589 0.0212 -0.0154 1.5680 -1.5297 0.1877 0.5944 1.1290 1.3910 1.1986 0.5592 0.4914 -0.5541 0.3750 -0.7042 2.6700 0.1558 0.0919 -0.3209 1.6592 0.2033 -0.1838 -1.0140 1.6551 0.0208 0.2057 -0.2771 0.9178 1.2912 0.8777 0.4220 -0.4442 0.2399 2.0627 -1.1324 -0.0593 0.3231 -3.8529 -0.7088 -3.8093 1.3141 0.2227 0.3830 1.1449 1.5482 0.3748 -0.0073 1.9382 0.3142 0.3027 0.0404 0.8898 0.2181 2.2119 0.4182 -0.3486 -0.8590 0.7091 0.0544 -0.6567 -0.2350 -0.0509 0.0583 -1.1689 -1.0088 -0.0411 -0.4634 1.8393 1.2135 -0.1748 -0.4693 -0.2875 0.0661 -0.7796 -0.5543 0.3412 0.4806 0.0657 0.8839 1.4866 -0.0460 0.0331 -0.5649 0.6899 -1.7329 -0.7219 0.9067 -0.8934 -0.0680 0.5392 0.2654 -2.0519 0.4262 0.3873 0.3706 -0.0518 -0.9440 0.5135 -0.2872 0.3888 -0.8091 0.4163 0.0923 -4.3632 -0.5355 -0.0183 1.2263 -0.7087 0.6349 -0.9315 1.2353 -0.9869 -0.4839 -2.3627 0.2426 0.0506 0.4781 -0.2162 0.7186 0.1977 1.5065 0.1454 0.5640 0.8583 0.7220 -1.2527 -0.4851 0.1736 0.6424 0.3596 0.5305 0.7270 0.8819 -0.1208 -0.8768 -2.0232 -0.7648 -1.5148 0.9967 -1.4898 0.9529 0.3040 0.0599 0.0871 0.2145 2-aminobutyrate -0.4852 0.2439 0.3102 -0.0179 0.0953 0.5766 2.5076 -0.1833 1.2517 -0.2029 -0.9373 -1.1441 0.1706 -0.1266 -0.3801 -0.0105 0.5301 -0.5758 1.0504 -0.6360 -0.0078 -0.0626 0.3362 0.2514 1.2238 0.6046 1.6803 2.0974 0.0745 0.8047 -1.1100 0.1877 0.1561 0.6523 0.2032 -0.4352 -0.2556 -0.3169 0.5099 0.4626 -0.0112 -0.0852 2.4249 0.1847 -0.2398 0.5633 -0.5054 -0.2024 -0.7025 1.8892 -1.0645 -0.7721 -0.8632 0.6121 -0.2548 0.8554 0.2353 -0.5785 -0.6669 -1.2244 -0.2894 -1.1767 0.9890 -0.7305 -1.2797 0.5376 0.4261 0.1946 0.3306 0.8242 1.1501 1.3801 0.0466 -0.0494 -1.1236 0.0643 -0.8746 -0.4196 -0.8365 1.6814 1.3639 0.4933 0.0707 0.1413 1.2772 -1.2967 -0.9087 0.1978 0.2611 0.2581 -0.1628 -0.9140 -1.6737 -0.8939 -0.5439 -0.6724 0.0180 -0.8558 0.2368 0.1216 1.6560 -0.1835 0.1681 -1.3591 0.4999 -0.7903 -0.5613 2.3170 -0.6037 -2.4410 -0.9089 0.0367 0.3957 2.4312 -0.5382 -0.9457 0.3677 0.7983 -0.9263 1.0470 0.1875 0.4776 0.9958 -2.4866 0.9565 -0.0500 -0.1301 -1.5022 -0.1878 -0.7094 0.9447 0.0615 0.4205 0.1826 -0.5521 0.2500 0.8686 -0.4128 -0.8884 2.0014 -0.4478 0.3838 1.3009 1.8808 -0.3868 0.0324 0.1047 0.3472 0.9506 0.1201 0.2896 0.7783 1.4065 -1.4298 -0.7560 0.0197 0.2319 0.9757 -1.4707 -0.1322 0.1988 0.4024 0.2704 1.1922 -1.1022 0.3711 0.1032 -1.0089 -0.6969 1.1002 0.7545 0.5354 -0.0542 -0.8182 0.3587 0.2602 -0.5135 0.2380 -0.0389 1.9092 0.8364 0.8841 -0.4062 -2.1084 -0.0247 -0.1277 -1.2767 0.7640 -1.2446 -1.5511 0.9022 -0.3664 -0.7954 0.5423 0.8245 -0.3239 -0.2703 -0.7742 0.5013 -0.1205 2.0943 0.0473 -0.1815 1.6078 0.4544 1.2544 1.4199 -0.1409 -2.3289 -0.4155 0.4598 1.7796 0.5984 0.7692 -0.2578 -0.9875 -0.2671 0.4747 -1.0151 0.3083 -0.2550 0.3375 -0.3585 -0.7819 -0.2403 0.5530 -1.0485 2.2736 0.8108 0.5420 -0.6117 -0.4656 -1.0287 1.2579 2.9819 1.4578 1.0560 -1.5079 -0.0831 0.1092 -0.3610 -1.2548 -0.7891 2.2739 0.8631 -0.1516 0.1898 -0.3443 -0.4641 -1.7068 0.4510 -0.4181 -1.2246 1.4249 0.8725 0.1888 0.9561 -0.0235 0.8603 -0.3489 -0.4041 0.0678 0.7055 1.3505 0.9205 0.0267 0.2170 -1.1686 -1.0701 0.6211 -0.5507 -0.2994 -0.5423 -0.2092 0.5163 0.2242 0.8716 -0.0164 -0.4683 1.7789 0.8539 -0.6603 0.0770 0.8373 1.2711 -0.6678 -0.3155 0.1781 0.6760 -1.1005 0.0303 0.5002 1.3731 -1.1516 -0.6821 -1.7717 0.4384 -0.6283 0.9310 -1.1619 -0.6784 -0.7966 0.6847 0.9578 0.5003 0.8390 -1.4220 0.0402 0.0993 2.3885 0.9622 -0.7119 0.6331 0.3771 0.9125 -0.3359 -0.6889 -1.0424 0.4437 -2.2063 0.5466 1.3584 -1.7358 -1.0771 -0.8650 0.8438 1.2854 -0.6884 -0.6557 -1.3757 -1.0848 -1.1119 -0.7975 0.3783 -0.0768 -1.2432 -1.9768 -1.8242 -0.5880 -1.0030 0.3860 -1.0067 -1.1891 0.1665 -2.7345 -1.1840 0.5164 0.2784 0.8409 -1.1313 0.7437 0.3931 -0.5354 0.4554 -0.9774 -0.2526 -0.4500 1.6846 -0.0847 0.4791 -1.4481 -0.4582 -0.2555 -1.6825 1.3809 -0.4039 -2.2730 -0.2193 -0.1377 -1.1555 0.1912 1.5097 0.5482 1.6821 -0.3973 -1.0343 -2.1071 -1.7228 -0.5850 2.8108 0.6058 -2.8096 -1.3930 1.5696 -0.3588 -1.3655 -0.0500 -0.7139 0.6807 0.9593 -1.1202 2.8122 -0.3198 0.9692 1.7685 -0.5022 0.5656 1.8581 -0.7047 0.5353 -1.6081 0.7684 -1.6297 -1.4048 -1.4732 1.1488 1.3005 -0.3154 -1.3333 -2.0701 2-aminoheptanoate -0.4484 -0.8632 -0.3094 0.6138 0.7605 -0.9300 -0.5935 0.7432 -0.4466 0.7710 0.8329 0.3091 0.4002 -0.3135 -1.1727 -0.0990 -0.1484 0.5610 -1.7583 0.0568 0.9800 -0.0815 0.2003 0.4207 -1.4839 -1.6144 0.0812 -0.1419 -0.2798 -0.1102 0.6386 -0.4575 -0.4128 0.6737 -1.3389 -0.6911 0.9220 1.1423 0.4417 -1.8895 -2.3740 -0.8203 -1.2979 -1.0605 -1.0964 0.0665 0.6549 0.0833 1.9131 1.1022 0.4492 -1.0010 -0.2996 -1.5043 0.3171 0.1674 -2.2945 0.5211 -0.6715 0.1659 -0.1080 0.3483 0.0368 0.2156 -0.9354 0.8242 3.3440 0.4395 0.4816 -0.0963 -1.4297 2.1081 -0.8416 -2.5103 0.6158 -1.9090 -0.0100 -0.9254 0.2183 -0.4974 -1.5399 0.0729 -1.5454 -0.3507 -2.8612 -0.1648 -1.4653 0.7287 0.3876 -1.2048 1.8872 1.2914 0.6484 -0.1134 -2.3917 0.2546 -0.9378 0.0703 0.2819 -0.4841 -0.2868 0.1901 0.4805 -0.3405 0.1006 -0.9584 1.0590 0.1274 0.7408 0.9928 -0.0631 0.5839 0.8448 -1.2471 -0.0596 -0.4430 0.0475 -0.2486 -1.6610 -0.7022 0.0958 -0.0287 -0.1529 -0.0227 -0.4383 -1.6426 -0.0466 1.4394 1.9729 -1.0286 -1.4100 1.8225 -0.4518 0.4661 1.1168 1.5273 1.2940 1.0187 1.4981 1.6625 1.2624 0.8080 -0.2378 -0.4298 -0.2838 -0.4268 1.1652 -0.2852 0.4598 -1.3199 0.6959 1.7784 0.4980 0.2400 0.3158 -0.2509 -0.0366 -1.1039 -0.2505 0.7376 -0.6874 0.0353 1.8496 -1.7390 2.2431 1.1603 0.9973 1.8299 0.9785 1.6709 1.8732 -1.7031 -0.6793 -2.4975 -0.2702 1.6462 2.1609 0.5949 -0.8377 0.6615 1.9740 0.3188 -0.2992 0.5857 1.5393 1.1799 -1.1603 0.4069 0.8863 0.2867 -0.8487 0.5592 1.4080 0.0511 1.2104 -1.3536 -0.3902 0.5569 -1.2608 -0.2869 -1.3738 -0.4905 0.2087 2.0702 -0.2905 0.3283 0.1556 0.3231 -0.4398 0.9944 -0.0455 0.6063 -0.2070 -0.4858 0.2549 -1.0616 0.5929 0.8894 0.0256 -0.0593 -1.5788 0.0978 0.0425 -1.0352 0.0285 1.6563 0.2807 1.3701 -0.6306 0.1424 0.3421 -0.0655 0.3754 1.5376 0.4718 -0.1411 0.1878 0.7778 0.6322 -0.8361 0.6237 0.8951 0.9094 -1.0101 -0.1287 0.3050 -1.9332 -1.9926 0.0381 -1.1817 -1.4154 -0.5750 0.0528 -1.7578 -1.3719 -0.1255 -0.5944 -1.4071 -0.6878 1.7849 0.3533 1.4086 0.4649 0.0432 -0.2721 1.1009 0.8414 0.9928 -0.7509 0.2144 -2.8842 0.2830 -0.1840 -1.2165 0.6951 0.3681 -1.3870 0.9646 -0.3389 0.1029 -0.8701 0.9149 -1.2417 1.2926 -1.1023 -0.0868 2.0863 1.0674 0.6006 0.6433 -1.9522 -0.6090 0.3772 0.1597 -1.2689 -0.8811 0.0650 0.6856 -0.1079 0.2511 -1.0235 1.3266 -0.0582 -0.6178 1.3379 -0.0769 -0.9114 1.1792 -1.8785 -1.7951 0.1122 0.7986 -0.2410 -1.0307 -0.1422 -0.0300 -1.8476 0.1379 0.2152 -0.6900 0.4942 0.1484 0.3594 -0.3568 1.2644 -0.9920 1.6045 0.9466 1.0250 0.7030 0.3313 0.2705 -1.3510 1.6466 -0.5594 0.0857 -1.3032 -0.1776 1.1001 -1.8329 -0.7577 -1.5463 -0.0718 0.0017 -0.7184 0.5146 0.8432 0.1795 -0.3666 -0.1774 1.3830 1.7816 0.2568 -1.0415 -0.7632 0.6161 0.9389 -0.8723 -0.5381 -0.3599 -0.2879 -0.3405 1.0108 -0.1283 0.2518 0.2285 -1.2169 1.0705 0.2064 0.9379 0.7044 0.9859 0.5758 -0.1826 0.2528 -0.6741 -0.7481 0.0609 -0.4460 0.6313 -1.5124 -0.7273 0.2908 0.0413 1.6878 -0.9121 0.4448 -1.6522 -0.9874 0.1891 0.1080 -1.0229 0.8870 0.6098 0.5685 -1.8672 -0.0954 0.6334 1.8546 1.2394 1.3441 0.9811 -0.8591 -0.0173 -0.3382 -1.2627 1.1815 -1.2211 -1.0282 -1.5805 2-aminooctanoate -0.9426 -0.1829 0.2797 0.6737 -0.9174 0.8807 0.7052 0.6460 -0.6071 -0.7337 0.8313 -0.8390 -0.0113 -0.2944 0.0855 0.6538 0.6445 -2.8335 -3.4673 0.2921 1.5291 -1.1868 0.2626 0.5322 -0.8176 0.3752 1.6243 1.6068 -2.2894 -0.6400 0.5061 0.9760 0.0503 1.5176 -0.0561 -0.0082 0.8699 1.2560 0.1027 0.1547 -0.5956 -0.0092 -0.5097 -1.5953 -0.5935 -0.5830 -1.5205 -0.1611 0.8827 1.6274 -0.3442 -0.6947 1.1957 0.3607 0.0720 1.0566 0.9748 0.4945 -0.9667 -3.7316 1.5960 0.5730 0.0114 -0.0303 -1.3099 0.6452 1.4627 0.3907 0.2744 -0.0536 -0.1620 2.1671 -0.3436 -1.3036 0.2549 -1.0506 -0.0439 -0.6638 -1.8606 -0.6858 -0.5714 1.0060 0.8427 0.6965 -0.9837 0.6915 0.2553 0.1713 -0.0797 0.0221 0.8278 0.4651 -0.6878 -0.3332 -0.5078 0.0568 0.0386 -1.2780 1.5253 0.7763 0.4489 -0.0382 0.0478 0.6506 0.1881 -2.1918 0.0751 -0.3863 0.6191 -1.2687 1.1402 0.0799 1.1853 -1.3160 -0.0296 -2.3989 -0.9124 -0.8959 -0.1996 -0.5753 1.6056 -0.5849 1.2512 -1.2652 0.5140 -0.7220 0.8508 0.6546 2.1690 -0.9343 0.5622 1.2275 -0.6342 -0.4004 0.6096 1.2255 1.3911 0.7973 0.8318 2.1033 0.8130 0.9962 0.1581 0.2142 -1.6360 0.3983 -0.0059 -0.6508 0.9968 0.5689 1.0757 -0.8429 0.7590 -0.7774 -0.0867 -0.1186 -0.3183 -1.9770 -0.7843 1.1290 -0.0997 0.2969 0.0727 -0.6563 1.3753 0.9458 0.7814 0.5429 0.5078 1.2841 0.3113 -0.7483 0.9400 -2.3078 -0.0037 -0.6104 0.6285 0.5428 -0.4679 0.7491 1.3433 0.3350 0.0753 -1.3707 1.3936 0.7301 -0.2288 -0.3192 1.4858 -0.5640 -0.0726 0.2218 2.2680 0.5923 0.8725 -0.4933 0.0854 0.1605 -0.7241 -2.5450 -0.2976 -1.8904 -0.0986 1.3890 -0.6195 -0.5868 -0.1549 0.8318 -1.5190 0.0940 0.2686 0.0892 2.0746 0.1064 0.7915 0.4090 0.3220 0.5119 0.1671 0.5909 -0.2897 0.1103 -1.0683 -1.3795 0.6555 -0.5562 0.0015 1.1138 0.6771 -0.1507 -1.2863 0.5480 1.0967 1.1569 0.5242 -0.2808 -0.3430 -0.7466 0.5338 -0.7810 0.0583 -0.2740 -0.6560 0.5443 0.2877 -0.0238 -1.1449 -0.0525 -0.1657 -1.0543 -1.7734 1.2292 -0.1585 1.0041 -0.7772 0.8340 -0.6096 -1.0667 0.4012 0.2530 -1.8991 -0.4732 -0.4157 -2.0521 -0.1819 1.1161 0.1276 -0.4849 -1.3105 0.3318 -1.3741 -0.3902 -0.8735 -0.8474 0.7014 0.9237 0.0554 0.8876 0.6458 0.9013 -0.6831 0.7611 -1.6376 0.5331 -1.4197 -2.0751 1.4283 -0.3730 0.5953 0.3465 -0.8276 -1.3202 1.1796 -0.4597 -1.7455 -0.3277 0.1873 0.0983 -0.3432 1.2745 -3.5721 0.5047 -0.1678 0.7158 1.5054 -1.5595 -1.4237 -0.1236 -1.3233 -0.1423 0.1447 0.7950 0.3562 -1.6648 0.5387 -0.4086 -0.6358 -0.2957 0.0079 -0.5327 0.6962 -0.6471 0.1671 -0.6698 0.4781 0.7426 0.6563 -0.3409 -0.8068 -1.1333 -0.6262 2.3067 -1.4546 -0.8080 -0.0644 -0.0326 -2.2553 -1.4937 0.6740 -1.8433 -0.0929 -0.5052 0.0945 1.1585 -1.1528 -0.4408 0.6909 1.9243 0.4619 0.6669 1.5659 0.9212 0.3727 0.7882 -1.2044 1.5570 -0.1699 5.0333 0.0403 0.8514 -0.0738 -1.3590 -0.6771 -0.7176 0.8730 0.9284 -0.6285 0.4092 0.4062 0.4377 0.3409 0.3987 0.4772 0.3744 0.5595 0.3840 -0.8388 -0.7540 -2.1930 1.5397 -0.8892 -0.5478 -0.3070 0.3789 0.4270 -0.6084 0.3253 -0.9320 -0.2212 -0.4634 0.0798 -0.5635 1.0886 0.5532 -0.3277 -0.5027 -0.3218 1.4736 0.2490 1.2703 0.9248 1.2276 -1.1391 -0.5410 -0.4260 0.4915 0.5060 0.1778 -0.7830 -0.8659 2-aminophenol sulfate 0.0211 -1.1746 0.8942 -0.7962 0.3474 -0.2008 -0.0819 2.1154 -0.2323 0.1628 0.6228 0.4472 -0.8662 -1.1066 -0.0209 1.1634 -0.2937 -0.3091 0.8820 0.8651 -0.1634 1.4894 0.5140 1.7333 -0.2276 -0.0588 0.6505 0.1605 -0.1478 0.0125 2.1672 0.6827 0.4692 0.0753 -2.6434 0.1867 1.4881 -0.0885 -0.2361 -0.1496 1.7769 1.2303 -0.7775 -0.6494 -0.8583 0.0096 0.0741 1.5595 -0.1999 2.1412 3.1836 -0.3420 0.8551 -0.4033 1.3225 -0.0118 -1.3738 -0.8703 0.1675 0.6313 0.2601 0.2963 0.6739 1.1138 -0.1646 0.0726 0.6538 0.6591 -0.0415 0.8632 -0.8363 -0.3900 0.3265 -0.7004 0.4325 -1.2987 0.7215 1.0301 -0.9906 0.4219 1.9827 1.0001 0.8883 1.0537 -0.3662 0.4751 0.0816 -1.2160 -0.4647 -0.9239 0.3619 0.5881 -0.6081 0.3374 0.7770 0.7938 0.6403 0.9547 0.1922 0.0321 0.4699 -0.1160 0.2229 1.2851 0.1220 0.4177 -1.3077 0.1805 0.7642 0.3838 1.2276 -0.7269 0.3266 -2.3503 -0.7087 -0.6522 2.3063 -0.7826 -1.5457 0.6008 0.8471 -0.2072 0.8604 -1.4365 0.9634 -0.0837 -0.8976 0.6533 0.9675 -1.0703 1.0844 -0.3672 -0.1962 2.2477 0.0841 0.2877 -0.2032 -0.8737 0.2546 1.0824 -1.6087 0.5431 0.1381 -0.1191 0.8117 1.4410 -0.6159 0.9672 -0.3286 0.7925 0.7639 -0.1673 -1.5428 -0.2966 -0.2298 -0.9867 0.0499 0.5158 1.1661 0.2205 -0.6551 -0.3621 -0.0872 0.1866 -1.2462 -0.3152 2.3817 -0.8736 0.6484 0.1805 -0.5357 0.0483 0.0959 -0.1704 0.8619 0.5180 0.1842 -0.6988 -0.2019 -0.9933 0.1424 0.2825 -0.1145 1.4440 0.0553 0.3685 2.5419 -0.1779 -0.3114 -0.1817 0.0440 1.7975 0.8545 -2.2083 -2.1912 -0.8335 -1.0570 0.8641 -0.4378 -0.1373 0.5824 1.0608 1.1533 1.0108 0.3467 -1.4669 1.0150 -0.1936 0.1760 1.3532 -2.3121 -1.5425 0.5967 -0.5352 -0.7853 0.9029 -0.9541 0.7940 -1.2400 0.0800 -2.1199 -0.6416 -0.4594 1.6583 0.0534 0.1910 -0.1026 -1.3568 0.9261 1.1297 -0.3724 0.1614 1.6617 0.0871 0.1536 -0.2243 3.0613 0.0762 -0.1837 -1.3020 0.1276 -0.8629 0.1875 0.8574 -2.4811 -2.3676 -1.4680 1.3941 0.2372 -2.4507 -1.2061 -1.0707 0.5712 -0.9638 -1.7703 -0.1280 -0.5813 0.4356 -1.2174 -0.3314 -1.0895 -0.6351 0.3813 0.4172 -0.3831 -2.0832 0.8467 -0.5841 -0.4160 -0.7679 -0.6687 0.2501 -0.8153 -0.0651 0.2888 -0.2816 -0.4694 2.2796 1.3203 -1.1475 -0.3531 1.8234 -1.5877 0.1971 -1.0608 0.1463 -0.4878 0.1193 -2.5175 -0.1819 -0.8185 1.3496 -0.4361 -0.2928 -2.3513 1.1511 1.0705 -0.4983 1.2131 0.6028 -0.3502 0.2837 -1.0178 -0.9364 2.2901 -0.6512 -0.9520 -0.3646 1.9247 -1.1205 -2.3319 0.1464 -1.1499 -0.8733 0.6666 1.6294 -1.6298 0.5357 -0.4604 -0.6571 1.3554 -0.0904 0.3109 -0.9751 0.3922 -0.0687 0.3609 -0.4400 0.2670 -0.8011 0.4414 0.1247 -2.3753 -0.1806 -0.2905 0.0062 -0.2371 -1.6116 1.2722 -0.7813 2.4412 -0.0558 -0.5398 -2.5262 -0.3268 1.5169 -0.2925 0.8991 -0.8198 -0.0934 -0.8647 0.7301 -0.0564 -0.7767 -0.1912 -0.3711 0.6009 -1.0973 -1.7693 -0.6808 -0.2291 1.3572 -0.3347 1.6347 -0.4624 0.0987 -0.9872 0.2455 -0.1918 1.4496 -0.9885 0.2887 -0.8999 -1.1436 0.6562 -0.4497 -1.7401 0.4270 0.1657 -0.9848 -1.5554 1.8581 0.8860 0.4677 1.2656 0.9258 0.9829 -0.2463 -1.2425 0.1037 -0.0181 -1.2096 0.0613 0.0759 0.3869 -0.1600 -0.7204 0.2048 0.6944 0.4955 0.1708 -1.4436 1.9017 0.7444 0.1732 -1.2420 -0.5799 0.2976 -1.0950 -1.1373 2-arachidonoylglycerol (20:4) 0.7235 0.1497 -1.5281 0.7045 -1.0048 0.8709 0.2532 -1.6290 0.8732 -1.1283 -1.3338 1.2202 1.2726 -1.5348 -1.7073 1.0221 0.3281 0.6003 0.9322 0.9836 0.3709 -1.4316 0.1344 0.1290 0.4197 -1.1174 -0.0952 0.6366 0.6558 0.5239 0.4896 1.1709 -1.0767 0.9147 0.7418 -0.2118 1.1180 0.2562 1.0655 0.9835 1.1971 0.9982 0.8816 0.6068 1.5101 0.1145 0.3722 0.2618 0.7308 0.9315 0.7271 0.5869 0.4851 -1.5786 0.5945 0.9288 0.4238 0.6106 -1.5302 0.4929 1.5513 0.8309 -1.6267 0.0385 1.1558 -1.6917 0.7535 0.0655 0.6873 0.0721 0.6255 0.9441 0.0869 -1.6813 -1.4793 0.0966 0.8561 1.0427 0.4131 -0.1290 -0.1051 -1.4061 -1.4736 0.8876 -1.3770 0.8297 0.0320 -0.3249 0.5456 0.3650 1.1102 -1.4074 1.1154 1.1446 0.8014 0.6919 0.7287 0.9508 -1.4024 0.4187 -1.6356 0.5795 1.0621 0.1991 0.9913 0.5414 -1.5413 0.8808 0.6301 0.6096 0.0342 0.0115 -1.3077 -1.4863 -1.4877 -0.1218 0.0738 -1.4121 -1.5894 0.3417 0.8595 -1.4272 0.6289 2.2372 -0.0516 -1.5620 1.0262 -1.5357 1.1164 0.9820 0.7290 -0.0359 -1.1852 -1.6246 -0.0189 0.2972 0.2294 0.4411 0.2822 -1.0110 0.5663 0.7195 -1.4203 1.0293 0.9239 0.8007 0.7740 -1.5403 0.4051 1.0401 1.7225 0.6843 0.6208 0.1896 0.3425 1.2042 0.7199 0.6119 1.3144 1.0466 -1.4417 0.2643 0.5254 1.0631 0.5205 0.4119 1.2750 0.4545 -1.6455 0.5652 0.6066 -1.5036 -1.7945 -1.2716 0.6433 1.5026 0.4478 -1.2853 -1.4159 1.2766 0.6554 -1.7728 0.7413 0.8456 1.4980 0.6294 0.8617 -1.4091 -0.0373 -1.3706 -1.7759 -1.3056 0.9605 1.2370 -1.3026 0.5500 0.4894 0.6422 0.4245 0.8448 -0.0781 0.6329 -1.3382 -1.4407 -0.0076 -1.1729 0.5290 -0.7828 0.7116 0.5803 0.3237 -1.4924 0.3407 0.6352 0.2802 0.2061 -0.5627 -1.7277 1.0158 0.1300 1.1321 0.3421 0.9089 -0.0599 -0.2100 -1.7554 0.1900 0.5695 0.2187 -1.4678 0.8373 -1.3461 -1.4419 0.7097 0.0189 -1.7141 0.3026 0.4688 1.1038 0.5425 0.2134 -1.7337 0.5463 -0.2985 -1.6237 -1.5058 -1.5511 0.3803 -1.6973 -1.5966 -1.5846 -1.6506 0.5080 0.3368 -0.3317 -0.2001 0.3051 -1.5730 0.1651 0.3212 0.2449 0.4963 -1.6949 0.0429 0.4411 1.0662 1.4335 0.7391 0.7430 1.0498 0.4121 0.4233 -1.6785 -0.1097 0.1781 -0.0251 1.9142 0.3018 1.0123 1.1399 0.7156 0.7894 0.7757 -1.6847 0.6275 0.5043 0.9748 0.2673 0.0439 0.1372 0.4061 1.3503 -0.4622 0.0471 0.0495 0.0935 -0.3447 -0.2873 0.5016 1.1648 0.5946 -1.6495 1.4383 -1.6667 -0.0269 -0.0042 -1.6291 0.4320 0.3871 -1.7514 -0.0820 -1.6788 -1.5879 0.8963 0.2651 -1.5529 0.4831 -1.5363 0.2725 -1.6434 -1.5116 -1.6582 1.3853 -1.7323 -1.5900 -0.3616 -1.5561 0.5756 -0.6757 -0.0152 0.4872 -1.4249 -1.5152 -0.1397 0.2644 0.5720 -0.0952 0.1588 1.5880 -1.3439 -1.5139 0.5982 0.1490 0.3738 0.7667 -1.4547 -1.3664 0.4407 0.9769 -1.7309 0.7475 -0.9325 -0.0293 0.2429 -0.1557 0.2715 0.1421 0.6573 1.8840 0.6031 1.1646 0.7113 -1.5444 0.0989 0.6616 -1.7166 0.9924 -1.8040 -0.3293 0.8605 -1.4079 -1.6363 0.5625 -1.5030 -1.9017 -1.3640 0.4242 0.4203 -0.1254 0.2873 0.2092 -1.8710 0.0953 -1.8776 1.3521 0.6271 -0.0533 0.9162 -0.1068 0.8159 1.0379 0.0917 -1.1154 0.9477 -1.7276 0.2711 -0.1955 0.3340 0.1721 0.6302 1.1347 -1.6464 -1.4685 -1.7105 0.4374 -0.1879 0.9029 0.6040 0.9917 0.1972 2^-deoxyinosine 0.4163 0.6104 -0.9690 0.8924 -0.5428 -1.0043 -0.0500 -1.0537 0.3663 -0.6354 -0.8001 -1.0587 -0.8818 1.8257 -1.1227 -1.0071 -1.1058 0.1938 -0.8941 1.2874 0.0119 -1.2761 0.9463 -0.9132 0.1180 -0.9079 0.3782 0.4165 -0.7868 0.7106 -1.0985 0.6218 -0.6013 0.1548 -0.1107 -0.9436 -0.8856 0.6536 -0.8339 0.5145 0.5351 -0.5377 -0.9358 -0.6042 -0.7975 0.8435 -0.9342 -0.9139 -0.9102 1.9627 0.3657 1.1897 0.7972 -1.0108 1.3948 -1.0649 1.6998 -0.6579 2.2028 0.9221 1.4966 0.7231 1.9075 -0.8428 0.8408 0.4309 1.5000 -1.1771 -1.0831 -0.0019 0.3278 1.1235 1.2526 1.1455 -0.9344 -1.0730 0.8723 -0.9187 0.4023 0.1513 -0.9738 -0.8733 2.2744 -0.7488 -0.8423 1.1186 -0.7984 0.2842 -1.1034 0.5668 -0.2541 -0.8727 1.1228 0.5685 -0.8895 1.0236 -0.9098 2.5325 0.1938 1.5291 -1.0599 0.5960 0.6677 -1.1324 -0.0567 -0.8515 -0.9802 -0.9709 1.4276 1.2468 1.0037 1.4976 -0.7904 -0.9345 -0.9356 -0.3617 -0.7784 -0.8766 -1.0192 -1.1389 -0.8239 -0.1638 -0.9676 1.3921 1.8407 -0.9975 0.6861 -0.0993 -0.1732 1.1500 0.7252 -0.8173 -0.6856 1.1665 -0.1408 -1.0633 1.5091 1.3540 1.1177 0.8330 -0.7497 0.8488 -0.8849 0.7125 0.7083 -0.9907 0.9641 -0.9837 -0.2729 -0.8098 -0.7493 -0.4998 -0.8466 -1.3172 0.3781 1.7281 1.8719 -0.7728 2.0282 1.5163 -0.9024 0.4094 0.4656 1.6075 -0.8705 -0.5124 1.1260 -1.0195 -1.0641 1.4674 1.2639 -0.9512 -0.2399 1.3926 0.6151 -0.6966 1.0684 1.0524 -0.8814 -0.7434 -0.8829 1.1595 1.9697 -0.9702 1.2594 -1.1416 1.9274 -0.8704 1.8769 1.6547 -1.1834 -0.7819 -0.8535 1.4325 0.1471 -0.0324 0.8896 0.6938 -0.9569 0.5464 -1.0579 1.1327 -0.3568 -0.9092 -0.9844 -0.6815 -0.9864 1.4012 -0.9162 0.3385 0.4639 -0.2790 -1.1497 -0.9961 -1.0965 -0.9942 -1.1523 -1.1393 -1.1857 -1.0787 -0.9911 -1.0400 -0.7796 0.7065 0.7796 -1.1647 -1.0904 1.3533 1.3718 0.9919 -0.9898 1.0623 -0.9026 0.5680 -1.1156 -1.1274 0.6322 1.5959 1.2178 0.2460 1.3627 0.0870 -0.9747 -1.2135 -0.1474 -0.9505 -0.9903 2.0509 -1.1098 -1.0267 0.1428 -1.0720 0.7602 -0.9849 -1.0282 -0.3230 0.7969 -1.0097 -0.1599 1.8868 0.7690 0.2511 1.9858 0.2131 0.2607 -0.6887 -1.0705 1.3499 -0.9092 -0.0868 1.9058 0.5686 -0.8121 -1.0500 -1.0443 0.4098 -1.0129 -1.0154 -1.0998 0.5905 -0.1309 2.0917 -0.2713 -1.1099 -1.1948 -0.9275 1.0168 0.3423 -1.0884 1.3011 -0.0617 -0.0325 1.2465 2.2156 0.8195 0.5869 -1.0416 -1.3070 0.3125 -1.0735 -0.9406 0.6076 1.4045 1.5685 0.0207 -1.1725 -1.0529 -0.7678 -0.2160 -1.1574 0.2213 -0.2673 1.2294 -0.1667 0.1034 -0.4905 0.4543 1.7490 0.5095 -0.5360 -0.9628 -1.0769 -1.3431 -1.1433 1.4289 0.8240 -0.0606 -0.3254 0.5612 -1.1146 0.7131 -0.8876 -0.9576 -0.8063 -1.0039 1.4199 -1.0407 0.8272 -0.1698 1.1778 1.6642 -1.2680 -0.0364 0.5747 0.4878 2.3069 1.3389 -1.1026 -1.0528 0.6190 -0.7914 -0.4851 0.3118 1.2270 0.2293 -0.4524 1.7976 -0.2186 -1.2653 0.8777 0.2443 0.9275 -0.9879 0.9883 0.6265 1.1528 -0.3966 0.4156 0.0626 -0.5265 -0.8737 -0.2388 0.9114 1.1698 -0.3732 -0.8183 1.6199 -1.1388 -1.1048 -0.1359 -0.9808 -1.2521 0.4778 0.4945 -1.3235 0.3287 0.2470 0.3616 1.0634 -0.3170 0.6112 0.6098 -0.6285 -0.0663 -1.1348 1.1586 0.7125 -1.0504 -0.0740 -1.0824 1.2924 0.2926 -0.5877 0.5392 1.4078 -1.2983 -1.0188 -1.0362 -0.9876 -1.2244 2^-deoxyuridine 0.0438 0.1156 -1.6493 1.0350 1.1795 1.2344 0.4665 0.7462 0.0301 -1.1015 -1.3642 0.4410 0.6801 0.4336 -1.4610 0.1676 -1.8756 0.7341 0.9028 1.3271 0.9110 1.0768 1.0711 1.2768 1.5582 2.2117 0.7141 0.1431 0.5428 0.6223 0.2265 1.5355 0.9681 0.1225 -0.5705 2.6847 0.2902 1.0609 0.7058 0.9255 1.1266 1.1571 -1.5993 0.6352 1.0738 -0.5148 0.9673 0.3231 0.6738 0.7986 -1.5559 0.8166 0.0936 -1.7174 1.2515 -0.3694 0.7162 0.7499 0.5196 1.0461 1.3400 0.4768 0.2630 -1.4446 0.8057 0.3329 0.5839 1.0370 0.9591 0.6489 0.8004 0.8000 1.0586 0.9505 1.0788 -0.0766 1.0755 0.6895 1.1153 0.2521 0.6304 0.9968 -0.1477 0.7295 -1.4403 0.8647 0.5008 -1.4909 0.9188 0.5190 0.8014 -1.4960 -0.5386 0.8179 -0.0747 0.4116 0.3690 -1.5143 0.5429 1.2306 0.1511 0.7619 1.6479 0.3087 1.2655 -1.4574 -0.1693 0.5031 -0.1740 -0.0655 0.0605 -0.2644 0.8321 -0.2658 -1.5947 1.2466 1.0967 0.8718 -1.7304 1.0612 -1.4136 0.3150 0.1023 0.8825 0.8621 -0.1404 0.6978 -0.2165 -1.7430 -0.6487 -0.7841 0.1064 -0.0712 -0.0536 0.1984 -1.8077 0.6590 1.3391 1.4762 1.3354 0.0559 0.9132 0.7643 0.4053 1.1797 0.3168 0.3135 -1.6783 0.7376 1.2029 0.9813 0.9123 0.7966 -0.1992 -0.5151 -1.3538 0.5251 -1.3348 -1.7690 -0.2655 -1.5460 -1.9441 -1.3764 0.8239 0.3997 1.3030 -0.6170 -0.2456 0.3542 -0.1751 -0.2167 -0.2413 0.4003 -1.2987 -1.8302 1.5447 1.1814 0.0685 0.5459 1.4323 1.2566 0.2451 0.6164 0.3887 1.0045 0.2865 -1.6353 0.4877 -1.3153 0.4294 -0.9555 -1.3405 0.8902 0.0997 1.1140 0.9114 0.2838 0.1026 -0.1824 0.7448 -1.8024 1.8732 -1.4037 0.8551 -1.6841 0.0638 1.3707 1.4068 0.7793 0.9379 0.5505 -1.6184 0.4238 -0.4045 -1.8646 0.9776 -1.9466 -1.9329 0.5458 -0.6099 0.8395 -1.7681 0.6338 -1.9836 0.6438 -1.9772 -0.1825 1.0672 -0.0243 0.6929 -0.0177 0.7326 1.0331 0.6637 0.1881 -0.9315 -0.3662 0.4612 -0.2307 0.2392 0.8526 -0.2567 0.1980 0.5370 0.3522 -1.6189 -0.1219 -0.0925 -0.7073 -1.7446 0.5843 -0.1175 0.4811 1.0806 0.0226 0.7530 -1.7307 0.3208 0.6974 0.5894 0.2908 -1.4368 0.1863 0.8734 0.5095 0.3676 0.3007 -1.9311 -0.2134 0.4934 0.6226 0.3606 0.6352 -1.7855 0.6069 0.1751 0.6207 0.9887 0.1413 0.4901 -1.9131 0.9213 0.0859 -0.7048 -0.3230 0.7782 -1.8016 0.2971 -1.1451 -0.5009 -1.9263 0.3150 -1.7637 -0.5915 -0.3827 -1.3511 -1.7689 -1.0282 0.0539 0.1946 -1.6012 -0.4177 -0.0676 0.2479 0.6120 -0.0335 -1.7864 0.7610 0.5021 0.6496 0.8225 0.4563 0.6430 0.1832 -2.0165 -1.6838 0.5529 0.8903 1.1608 -1.8048 -0.5523 -1.8256 0.7544 -0.2716 -1.7533 -0.7579 0.3472 0.0039 -0.3336 -0.6564 1.2050 0.1708 0.6513 -0.3025 -0.0267 -0.8215 -1.7641 -1.7306 1.0492 0.1283 0.8207 0.7840 0.1115 0.7556 0.0197 -0.4153 0.8192 1.0735 0.1497 0.0752 0.5207 -0.8695 -0.6744 -2.0640 -1.7864 -0.4457 -0.0851 -0.0123 -0.5538 -0.2038 -0.3782 -1.7640 1.3416 -2.1487 0.1347 -0.7268 0.2085 -0.3370 -1.9625 -0.3760 -1.4982 -1.8062 -1.6224 -1.6116 -0.7153 -1.3864 -0.9659 -1.9233 -0.2046 -0.0999 0.3311 -0.2659 -0.2192 -0.3269 1.3415 0.2466 -0.9532 0.4122 -0.4579 0.3553 0.9906 0.8276 -1.0945 0.0346 -1.9206 0.6996 -0.2188 0.6211 0.0272 0.2866 -2.0864 0.2084 -0.3433 -1.8960 0.6485 -2.1905 0.1322 -1.7633 -0.0789 -2.0584 2-hydroxy-3-methylvalerate 1.1734 1.1013 0.4691 0.0207 0.4325 0.4762 1.6543 0.6527 -0.5015 1.3400 0.7798 -0.9645 -0.1967 0.8542 -0.2284 -1.4755 0.0630 0.4686 -0.4358 -0.0052 0.4720 -0.0180 -1.7737 0.1991 -2.3694 -0.2801 -0.6416 -0.1803 0.2117 0.6247 -1.0016 0.5386 -0.4167 -1.0541 -0.6289 0.3566 0.5168 1.0948 -0.6915 -0.3217 -0.6775 0.5169 1.3773 0.3809 0.4727 1.5583 0.7704 -0.0403 -0.5713 0.3153 0.3465 0.8700 -0.2083 0.5787 -0.1154 -0.9279 0.2278 -1.7988 0.5731 -0.5325 0.2030 0.1258 0.4877 1.1192 0.0187 0.1616 -0.3851 -0.7034 -0.9776 0.4244 0.2376 0.2710 0.0775 -0.4733 0.0646 0.8709 0.8041 0.0495 1.1741 0.4277 0.1603 1.1647 -0.2230 -0.3863 0.5639 -0.1130 0.0896 1.1682 0.2798 -0.7601 -0.2325 0.2617 0.4111 0.3867 0.5314 -0.3321 0.7531 -2.3621 0.7782 -0.0959 -0.2389 -0.1472 0.6326 1.0447 -2.2533 0.1339 0.7607 0.3773 -1.3299 0.8289 0.2975 -0.9972 -2.1087 1.4925 0.4259 0.0938 0.4665 -2.3054 0.5820 -0.5664 0.6906 0.6841 -0.1020 -0.1232 -1.0651 1.9023 0.2599 0.9838 -0.0813 0.6354 0.9810 0.3267 0.8410 0.3109 -0.6764 0.7124 0.0029 0.3599 0.3566 -1.5727 0.6470 -2.5492 0.5462 0.7594 0.9783 -0.4891 1.0771 0.6991 0.6826 -2.1242 -0.1626 -0.8698 0.7506 -0.3987 -1.0023 1.0046 1.1732 0.9052 -0.8593 0.0650 0.9372 -0.1583 -0.6249 1.0777 1.3515 0.1217 -0.1250 0.4168 -0.5049 -1.3559 -0.1960 -2.4835 -0.0698 -0.5499 -2.8161 3.0998 0.1069 -0.0074 0.1138 -0.5156 0.4844 0.6635 0.0479 1.3192 0.4594 -1.3977 -1.2591 0.6774 0.7802 0.7863 -2.0560 0.0229 0.1703 0.7349 1.2373 0.1429 0.4079 1.0333 0.7102 0.3156 -0.2711 0.6430 0.8113 -0.4299 -2.5019 0.6503 -0.6397 -1.1361 0.6198 0.3888 0.9986 -0.4010 -0.8896 0.5282 -0.5977 0.0500 -0.0437 0.8461 -0.4553 0.3124 -0.4554 -1.1432 1.1364 -0.3236 -0.3966 4.0783 -0.0730 0.2677 -0.8590 0.4501 -1.0643 -2.2025 0.2825 0.4852 -0.3424 0.5656 -0.2948 -2.3509 -0.4614 0.9832 0.2270 0.6091 0.2910 4.2899 -2.6832 0.2270 -2.5727 -0.5547 0.2337 -0.4257 -0.0399 0.7660 0.9891 -0.1213 0.4748 -0.3695 0.2980 0.2200 0.5137 -0.4007 0.8695 -0.1784 0.2220 1.3821 -0.3536 1.0672 -2.7216 -2.0127 0.2208 -0.2069 0.7266 0.5728 0.7463 0.1264 -0.3252 -2.6030 -0.0284 -1.5269 0.3599 1.6592 -2.8892 -2.8542 0.2760 -0.1121 -0.1676 0.1274 -1.0541 -0.0762 0.9632 -1.2074 -0.0825 0.4768 1.1526 -1.0051 1.2768 0.3746 0.3236 -0.1160 0.9357 -0.5039 0.9829 0.2931 0.5966 -0.2788 -0.1737 0.5433 -0.0054 0.5285 -0.5083 1.5834 0.3136 -0.0040 -0.8911 0.2105 -1.0959 -0.0206 0.6958 -2.5379 2.8831 -0.1425 0.5688 0.9576 -1.0978 -0.0439 0.1127 -0.0655 1.1908 0.9107 -0.2491 0.4226 0.4847 -2.3263 0.2500 -2.1972 -0.9658 0.5849 0.8153 1.0018 -0.1406 0.7686 0.3363 -0.6896 -0.3819 -0.4568 0.5566 -0.1303 -2.2142 0.3636 -0.0170 -0.9180 -1.0484 1.4217 0.6028 0.0487 0.3876 -0.7717 -0.3052 -0.9728 -0.3878 -0.5357 0.1315 -0.5297 0.1253 -0.1428 0.5351 0.0444 -1.1402 0.4176 0.2175 -2.3535 0.5980 -2.7206 -0.8858 0.7150 -0.6538 0.9083 -0.1074 -0.3631 0.8519 0.3630 0.1697 -0.1823 -0.1120 -0.1406 0.0635 0.1436 -0.9332 -2.6889 -0.7622 -3.1292 0.6026 0.8501 0.9214 0.8125 2.2329 -0.7474 0.0458 0.1761 -0.3944 -0.2121 -0.9728 0.1738 -0.5092 -0.0409 -0.8549 0.3086 1.0102 1.3550 -0.5120 -0.0978 2-hydroxyadipate 1.1917 1.6596 0.6644 0.4309 -1.1306 0.5732 -0.2001 0.2944 0.7375 0.6263 1.5231 0.7735 0.7851 0.5457 0.2162 0.8236 0.5166 -0.1061 1.9165 0.7356 -1.4811 -0.1858 0.0537 -0.0342 0.3914 0.3745 -0.0012 -1.5482 0.5347 0.5165 1.8227 -1.5109 -1.2202 -0.2815 0.2101 0.8424 -0.2786 0.7024 0.6124 -0.4499 0.8187 1.6630 -1.6975 -0.4014 0.3585 -0.4395 0.6403 0.6837 0.6956 1.4966 -1.6539 -0.0682 0.8661 -0.1221 0.4867 0.1315 0.3389 -1.3045 0.2375 -0.4197 0.2511 0.9820 0.6855 1.7325 0.6996 0.0131 -0.4145 -1.9988 -1.8687 -0.2164 -0.2312 -0.1406 0.6595 1.5208 -0.4497 0.0723 -0.0334 -0.3129 0.4378 0.1640 -0.1625 0.3489 -1.6990 0.0660 1.0299 -0.3168 1.8676 -1.6180 -1.9010 -1.3705 -0.3693 0.3443 -0.0064 0.6613 0.7909 -1.6090 0.3397 0.3508 -1.5879 0.0204 0.2187 -0.4721 0.0543 -1.9429 0.4612 0.4557 1.2404 0.5482 0.3668 0.4708 0.6289 1.8169 0.0724 0.4263 0.6582 1.7632 2.6203 -0.1957 0.1063 -0.7827 -0.1168 -1.6631 -0.2526 0.4298 0.6438 0.2104 1.3074 -0.3769 0.2874 -0.1392 0.2505 -0.5283 1.5391 0.2863 1.4803 -0.1866 -0.3417 0.6516 -1.7297 0.8288 0.9425 0.7112 -1.6163 0.5772 0.7938 0.6386 1.5845 0.2258 -1.5961 -1.4977 -1.4516 -1.4792 -1.5506 -2.2548 0.4121 0.0838 -0.2309 -0.0810 1.5772 -1.1603 0.4814 2.0110 0.4087 -0.0345 0.8539 -0.6295 0.9299 -1.8040 0.5763 -1.6675 -0.1733 1.3902 -0.3495 1.4038 0.8520 -1.3433 0.6654 1.2683 -1.6108 2.2311 -0.5312 0.4555 0.3171 -0.0969 0.1775 1.4236 0.8353 0.6377 1.1019 1.9088 0.3442 0.7164 -0.6118 -0.5758 -0.1801 1.5573 0.5679 -0.7086 -0.2486 0.1717 0.3740 0.0108 0.6399 -1.5862 -0.0844 -1.3252 0.8706 0.5375 0.6612 0.0955 -0.1446 -1.6900 -0.1340 -0.0202 0.2911 -1.7432 -0.0306 -0.0713 0.1732 -0.2704 0.3077 0.1233 -1.5082 2.0354 -0.6400 -1.9809 0.2738 0.1304 0.0568 0.2106 0.2868 -0.0825 -1.6428 0.2700 -0.0759 -0.1808 0.2247 1.5095 1.8248 -0.1750 0.3943 -2.0305 0.1839 -2.0715 -0.2356 0.4993 0.7793 0.6525 1.0520 0.2484 0.0582 -0.2449 -0.0206 0.0652 0.3087 -0.5937 0.4757 -0.1019 -0.5861 0.8722 -1.8097 0.3666 -0.1593 -0.3312 -1.1769 1.9079 0.3306 0.1604 -0.0471 -1.4413 0.6404 -0.0359 -0.0887 -0.6166 -1.8328 0.8856 1.5200 -1.7977 0.4231 0.2874 -0.0426 0.3471 -1.9522 -1.8737 -2.0997 0.0797 1.1380 -0.3692 -1.9618 -2.0114 0.1525 -1.9554 1.5250 0.6480 0.3330 -0.0018 0.2369 -0.0820 0.2421 -1.9044 1.2302 0.0452 -1.7327 0.1488 0.1561 0.4907 0.6764 2.0692 -0.2147 -0.0263 -0.2403 -1.8946 0.4633 0.4715 -1.0879 0.1719 -0.1438 0.5970 -1.6497 0.9717 -1.7038 0.5117 -2.3071 -0.1569 0.5698 -0.2284 -0.1869 -1.7711 0.2225 1.9075 -1.6158 -0.2753 -0.1743 1.0925 0.0412 -0.0736 0.6785 -1.8625 0.7609 0.4895 -0.7579 1.2425 -0.4261 -0.3937 0.5235 0.8825 0.8019 -1.9163 0.0677 -0.5755 0.1300 -1.0323 0.4885 1.2056 0.1665 -0.2447 -0.0087 -0.7081 -0.0241 0.1275 0.5928 0.1619 -1.7563 -0.1083 -1.8553 0.1965 -2.0213 -0.5459 0.3418 1.7740 0.5775 0.4080 -0.3058 0.1572 -2.1710 2.6369 0.1320 0.2176 0.6241 -1.8955 0.1084 1.5412 -0.1396 0.4677 -2.2214 -0.2345 0.1059 -0.3754 0.6301 -2.1253 0.4923 -1.6831 -1.2987 0.2198 0.3831 0.1850 -2.1386 -1.8287 -0.1589 0.3793 -0.0804 0.1540 0.7440 -0.3314 -0.3624 -0.6767 0.1637 -0.8829 2.0284 -0.1867 2-hydroxyarachidate* 0.1110 -0.2319 0.5159 0.5155 -0.7610 -1.5838 1.7099 1.4485 0.4411 0.5920 -0.1793 -1.6808 0.5993 -1.5342 0.5648 -0.5829 0.2674 0.4204 -0.4722 0.2595 -1.1991 -2.0627 -0.9218 -1.4154 -0.0907 0.2601 -1.0047 0.2742 -1.1940 -0.4383 -0.3663 -1.2131 -0.8654 1.5442 0.6183 0.9838 -1.3712 -1.0765 0.2590 -1.0610 -1.0622 -0.7570 1.2118 0.0611 0.2863 1.7604 -1.4525 0.1426 -1.4145 -0.4496 -0.6852 -0.3943 -1.3362 -1.5952 0.3852 -1.6862 -1.4673 0.8350 -0.1455 0.6366 -1.2152 0.2183 -1.6668 0.8363 1.5481 1.1948 0.2557 -0.0905 1.0573 -1.1827 0.2790 -1.6446 -0.6060 0.6916 0.1223 0.4687 -1.2168 -1.4301 -1.1960 -0.1873 0.1305 0.4491 1.3197 -0.0914 0.6084 -1.6354 -1.2177 1.2964 0.1289 0.1022 0.1430 -1.3475 1.3851 -0.9458 -1.3844 -1.3301 1.1790 0.7257 -0.2388 0.7836 -0.1363 1.0596 -1.2371 0.8079 -0.2329 -0.0469 -1.5407 1.7686 -2.0109 -0.2907 0.8290 1.0959 -1.2017 0.6966 -1.4621 1.1298 -1.1781 0.9674 0.3842 0.2184 1.2511 -1.3732 -0.3823 -1.5586 1.6387 -1.5712 1.2120 -1.5344 0.6253 0.0330 0.6376 1.4407 0.3325 -0.6744 0.8464 1.3049 0.5680 -0.9595 1.0567 -0.7652 0.5044 0.0950 1.1354 0.4651 -0.0719 -1.5586 0.9942 0.4756 0.7177 -1.2331 1.2885 -1.1579 0.5027 -0.6737 0.1410 -1.1929 -0.1585 0.9521 -0.0311 -0.8222 0.6886 -1.8231 0.8201 -1.4536 0.0445 1.3998 0.3302 1.7331 1.7636 -0.1256 1.0081 -0.1716 0.9509 -1.1445 0.1207 0.6494 -0.3426 -0.2856 -0.1728 -0.0576 0.6822 -1.8844 0.8941 0.9899 -1.1904 0.7020 -1.5033 0.5688 -1.1567 0.4472 0.4317 0.9640 -0.2144 0.4723 1.4180 0.0087 0.9832 0.9827 0.6185 0.5147 -0.2094 -0.6853 -0.4911 0.3826 0.2357 1.5012 -1.5475 0.3861 0.8885 0.6246 0.6131 0.7396 -0.0952 1.2105 0.0100 -1.5584 0.9697 0.5603 0.1304 0.8008 1.4943 1.6009 1.0699 0.4082 0.2785 0.8181 -1.7370 0.8284 0.7966 0.6779 1.1304 0.2577 -0.1224 0.2920 -1.7756 -1.7972 0.2256 -1.3578 1.4943 1.5870 0.4969 0.6420 -1.5276 -1.9492 1.0745 0.3383 -0.0254 1.4558 0.2441 0.7212 0.5244 -1.7019 -1.7390 0.9880 1.2420 0.4055 -0.3909 0.6469 -0.1651 0.6592 -1.6363 0.0112 0.8269 -0.4090 0.5281 0.8816 0.3489 0.3651 0.8732 0.9281 0.0860 0.9230 0.1720 -0.0493 -1.6493 0.1865 0.9028 -0.5274 -1.7543 0.3153 0.0988 0.6464 0.6318 0.2810 0.1469 1.6001 -0.6474 0.4592 1.2427 0.9859 0.8475 -0.2127 0.1348 0.3680 -1.4587 1.1566 -1.6488 0.8183 -1.8828 -1.7043 0.0255 0.8239 -0.0371 1.0234 0.5819 0.4069 1.2490 0.4301 0.0760 -0.6526 0.6649 0.6659 1.4739 0.1234 0.5532 -1.5579 0.7518 -0.5622 0.2472 1.3044 0.7507 -0.0605 0.8761 -1.8246 -0.4495 0.1224 0.4008 1.3042 -0.1882 1.1096 -1.3617 -1.3735 -0.6573 0.9328 0.1991 0.2661 0.6031 -0.3603 0.1415 -1.2478 1.1709 -1.0002 1.1181 -1.7452 0.7870 0.4481 0.1656 -0.8268 0.0091 -1.8219 -0.0247 0.0932 0.4009 1.0756 0.2366 -0.0885 -0.2997 -1.7030 0.3037 -0.0537 1.6804 -0.6924 0.3848 -0.9162 0.6158 -1.8034 -1.8398 1.4997 1.8578 -1.8875 0.6694 0.1132 0.0326 0.7430 -2.0718 0.5949 0.7680 -1.8242 -0.0266 -1.7087 -1.5427 -0.3232 -0.0609 0.0614 0.5470 0.6066 0.2071 -0.0080 -0.6047 -0.4690 1.0904 -0.0571 0.8772 -1.6754 0.3680 0.6315 -0.4143 -1.6588 -2.1005 -1.7121 0.8599 0.3854 -1.4339 -1.7883 1.9317 0.0275 -1.6047 1.1741 1.6650 -1.9792 2-hydroxybehenate -0.4540 0.2480 0.3619 -0.3061 0.4355 0.0926 0.5029 -0.7387 -0.0089 -0.1805 0.1529 -0.7696 0.3530 0.0594 -0.6910 -0.9765 0.5996 0.0646 0.2645 -0.5968 -0.9123 -0.5483 0.0701 -0.1593 0.3303 -0.4439 -1.8079 0.4637 -1.4098 0.1384 -0.1319 -0.8138 -0.1819 1.8241 0.3833 -0.1770 -3.6760 0.4769 0.4314 -0.5644 -0.9831 -0.0444 -0.0638 0.2159 1.4655 0.4646 0.1855 -0.1113 -1.1388 -3.7060 -0.2136 0.2061 -0.2057 -0.7503 0.6291 -1.6430 -0.0954 0.9296 0.2105 0.7758 -0.7837 -0.6033 -0.3389 0.2998 0.3787 1.0314 -0.2551 0.5340 0.6343 -0.1175 0.3230 -0.0477 -0.2026 0.3372 -0.0482 0.0732 -3.4619 -3.7599 0.7669 -0.3045 -0.2711 0.6527 0.3212 0.3051 -0.3000 -0.3133 -0.1152 2.2781 0.4272 0.3487 0.0503 -0.0234 0.7240 -1.2139 -0.0190 -0.4387 1.1888 1.0896 0.7586 1.4434 0.0678 -0.3858 -1.2342 0.0259 0.1974 -0.7589 -0.3961 1.5894 0.4498 -0.4727 -0.9923 0.3235 -0.1139 1.2405 0.4242 0.5216 0.3082 -0.9562 0.5805 0.4850 -0.4281 0.9505 -0.7174 -3.9161 -0.0291 0.6590 1.7322 -0.1180 0.3092 -0.6606 0.0625 0.2830 -0.5961 -1.6726 -0.0150 0.7876 1.1714 1.1983 0.9790 0.7097 0.8823 0.3563 1.4189 0.1744 0.7293 -0.4912 0.3541 0.3098 1.2383 -0.3576 0.4362 -0.3814 0.3391 0.4577 0.3378 0.7012 -0.0026 1.3401 -1.1375 -2.9048 -0.2289 -0.9466 0.6926 -0.4036 0.5274 0.3770 -0.8495 0.2898 1.0023 -3.8000 1.1607 0.2388 -0.8564 -1.0750 0.2790 -3.2013 -0.5821 -0.8928 0.3401 0.0211 -0.6212 0.1352 0.7337 1.1774 -0.2788 0.8006 0.1447 1.5673 -0.7874 0.3660 -0.6445 -3.4024 -0.1003 0.0687 1.0631 0.5549 0.8495 0.4460 1.1080 0.6576 -0.8665 -0.5593 -0.4199 -0.1955 -0.6089 2.1717 0.5181 0.8769 1.0218 -0.9446 0.4775 1.2192 0.6922 0.4227 -0.2257 0.6117 0.6742 0.1334 0.9285 0.5834 0.0267 1.2372 0.1218 -1.0715 0.2179 0.6935 -0.5756 0.2105 -0.9385 0.9706 2.2933 -2.8388 1.1378 -0.3727 0.2845 0.7611 -0.2884 -0.2333 0.8953 1.3154 0.5707 0.6827 0.8078 -0.7267 0.8297 -1.0696 -0.5501 0.2828 -0.0213 0.9365 0.9296 0.5514 -0.3876 0.2957 1.1885 -0.2252 -0.3314 0.5354 0.8130 0.5350 0.7749 0.7114 -1.2776 -0.6661 -0.0041 1.0258 0.2619 0.2237 0.1345 0.6198 0.7158 0.8141 0.0126 -1.3719 0.3484 -0.8143 0.8228 -0.0424 -0.6313 1.0647 -0.4989 -0.2397 0.9328 -0.4935 0.2625 0.0440 0.4783 0.7629 0.2543 -0.3543 0.1590 0.5715 -0.8719 0.8417 0.4298 -0.3215 0.5955 -0.2978 -0.2575 -0.0652 0.7658 0.0419 1.0339 0.8228 -0.4545 -0.0288 -0.0662 0.8731 0.6136 0.0878 0.7220 0.3189 0.3614 -0.8433 0.5918 -0.9022 0.6504 -1.1442 -1.0310 0.5324 1.0581 -0.6506 1.5508 1.0938 -1.0330 0.3557 0.3710 0.2849 -0.8718 1.0110 -0.2174 0.8812 -0.9927 0.0853 -0.3997 0.1839 -1.1795 -0.7868 -2.5635 0.1317 0.2098 -0.2523 0.1398 -0.1317 -0.5629 -3.7319 0.0329 -0.4494 0.9098 -1.0849 0.8963 0.9032 -0.3398 0.7357 0.2473 -0.3865 0.2529 -0.4401 -0.1434 0.2635 0.2356 -2.0321 0.8246 0.7989 -0.0327 -0.0817 0.0738 1.3201 0.4749 -1.0323 1.2427 -0.7147 0.7737 0.7585 -0.5752 0.1474 0.1930 -0.0749 0.2574 0.3396 0.6889 -0.6461 -1.6158 0.2680 1.8938 -0.1888 -0.5816 0.2532 0.6972 -0.2005 0.7468 0.2738 0.9770 -1.5292 -4.3077 0.4280 -2.1130 -0.0184 0.1774 -1.5668 0.2342 0.2703 -0.5698 -4.2693 1.8769 -0.1793 0.0723 0.4764 -3.9287 -0.0060 2-hydroxybutyrate/2-hydroxyisobutyrate 0.0120 0.0823 1.3488 0.4699 0.3525 -0.0550 -0.3571 -0.6308 0.7748 -0.7488 -0.5467 -1.5986 0.0218 1.1381 -1.0283 -1.0310 0.9510 -0.4246 0.7794 0.3698 1.2104 0.0014 0.6146 0.1664 1.3688 0.2351 0.6993 0.6982 0.1323 -0.2927 -0.9271 0.1889 1.1759 -0.3674 -0.0341 -0.4839 0.1115 -0.1378 0.5928 -0.3337 -0.3453 0.2657 1.4635 0.9135 1.1882 0.1619 -0.7817 -0.2076 0.1176 0.5842 -0.3930 1.1676 0.1752 1.8734 0.8739 -0.7073 1.2368 -0.0003 0.2943 -0.1970 -0.3938 -0.9468 0.0494 -1.2145 -0.5605 -1.6503 -1.8573 -0.6712 0.0816 0.3054 2.3599 0.5609 0.6285 0.6943 -0.8281 -0.0987 -0.8719 -3.0656 0.2187 0.5595 0.6546 0.3678 -1.1389 0.4854 1.4029 -2.2182 -0.2375 1.1008 -0.1068 0.1406 0.1878 -1.0451 -1.1858 -0.7332 -0.7730 -0.8304 1.2091 -0.1093 0.4337 0.6368 0.4491 0.2095 -0.0034 0.1860 0.3009 -1.0160 -1.5404 2.7536 0.0898 -2.4094 -1.4873 -0.5802 -0.6609 2.9134 0.4105 -0.4559 -0.2240 -0.7731 -0.8320 1.3098 -1.3507 1.8590 0.0743 -1.8850 0.1067 0.3056 0.6347 -0.6356 -1.3032 0.1689 0.1493 -0.3531 0.1138 0.0838 -0.1744 -1.3265 0.8848 0.6534 0.2649 -0.0287 0.4470 -2.3342 1.8974 2.5871 0.6072 0.0450 -0.3197 0.4042 0.2664 -0.2116 0.1361 0.2560 2.1415 -0.0757 -0.7852 -0.7628 0.2339 0.6110 -0.9337 -0.8595 -0.1381 0.2344 0.3953 1.0810 -0.2431 -0.3863 -1.9810 -1.1303 -0.7077 0.4958 0.1299 -0.1365 0.2536 0.1379 0.0898 -0.1697 0.1630 0.4340 0.9445 0.5861 0.0205 0.7408 -0.8124 -1.3385 0.0573 -0.0955 -0.3447 0.8339 -0.7070 -0.9011 -0.5428 -1.0732 -0.8860 0.3442 0.8795 0.8411 -0.3270 -0.0918 1.1236 0.5808 2.1113 0.1514 0.1042 0.9897 -0.0137 1.8902 1.3605 0.4454 -0.5505 0.1998 0.2926 1.4401 0.4645 -0.1974 -0.6605 -0.1097 0.9214 -0.4713 -0.4262 1.3299 0.4571 1.2496 -0.3284 -1.3877 -0.2232 0.0947 -0.9490 1.4799 -0.1317 0.9970 -2.1022 -0.0166 0.5923 0.3082 2.2391 0.8025 0.0663 -0.6876 -0.5371 0.1167 -0.0851 0.2474 -0.5102 0.0377 0.6423 0.0482 -0.3013 -1.2017 -0.7685 -0.8237 0.9753 0.0909 -0.6095 0.6412 0.6692 0.6663 1.6544 0.8728 1.9592 -0.5460 0.0104 -0.2851 0.5151 1.6380 1.1252 -0.3573 0.1503 -0.7104 -1.8013 -1.0445 0.4940 -1.1618 0.0890 -0.0957 0.6830 -0.4662 2.6598 -1.1057 -0.1442 0.6501 -1.5482 -2.3395 0.9853 -0.3690 2.1952 -1.2151 -0.3490 -1.5539 2.0348 -2.7875 0.6952 0.4149 0.6381 0.6113 0.5245 -2.2243 0.0464 -0.9751 0.6155 -0.3505 0.9984 -0.1405 -1.1659 1.3900 -0.6675 0.2603 -0.3867 1.0591 -0.7597 2.0158 2.0008 -0.5916 -0.2891 -0.0131 1.5321 -0.2236 0.4880 -1.4443 0.8349 -1.9164 0.3071 0.2132 -1.2325 0.7648 -1.4285 1.8587 0.9880 -0.0888 -0.4569 -1.3183 -0.5300 -0.6955 -0.5557 0.6130 -0.1311 -0.7336 -1.4064 -0.5581 -3.4409 -0.4019 1.1520 1.2993 -0.7019 -1.4432 -0.8953 -1.0667 0.7071 -0.1845 0.7056 -1.2795 -0.5584 0.0578 0.0139 0.1839 1.0499 -1.5213 -0.3059 0.7312 -1.2838 0.4977 -0.0601 -0.4551 0.7625 -0.0523 1.6785 -0.0761 -1.9099 -1.2412 -1.1214 -0.2705 -0.3290 1.9741 0.3169 1.0350 -0.0524 0.5359 -1.4718 -2.0938 -0.8904 1.9391 1.1700 -2.7053 -0.8984 0.8894 -0.1281 -0.3413 -1.3977 -0.1973 1.4356 0.7644 -0.7706 1.3381 0.2144 0.4080 1.8893 -0.1053 0.0009 0.1336 -0.9541 -1.0119 -1.3580 -1.4042 -1.0695 -1.4875 0.5693 0.6880 1.5979 1.2555 -0.9614 -0.8595 2-hydroxydecanoate 0.3075 -0.4856 0.1184 0.2872 -0.2057 -0.1901 2.5196 0.2616 0.1228 -1.0158 0.3256 0.5589 0.3511 0.4507 1.0371 -0.6198 -0.7414 -0.7861 -0.7706 -0.4720 -0.6553 -1.1478 -0.4163 -0.2147 0.1775 -0.2810 0.2679 -0.9426 -3.1667 -0.1499 0.0246 -1.9639 0.5304 1.6080 1.0494 -0.3214 -0.6446 -0.3662 -1.2967 -0.2158 -1.5860 -1.0822 0.5691 -1.3899 -0.6033 0.7722 -0.6272 0.2388 -1.2874 -0.1985 0.0948 -1.0605 -1.7778 -1.1247 -0.1485 0.3009 -0.9429 -0.7569 -1.8188 -0.2114 -0.2580 -0.3041 -0.2139 -0.0805 1.1972 1.2657 -0.6372 -0.1841 -0.8333 -1.5335 0.0890 -2.1748 -0.4516 -0.1580 0.4332 -1.1567 -1.4807 0.8506 0.1474 -0.3774 -0.1608 0.3770 1.5608 -0.2526 -0.0081 0.4847 -1.6015 0.0743 -0.5725 -1.5151 1.1108 -1.1739 -0.4378 -0.7988 -0.9366 -2.0167 -1.0609 -0.9738 -0.5556 0.2699 -0.9696 1.6353 -1.1005 0.9890 -0.5560 -0.7029 0.2572 0.6267 -1.1677 -1.0749 0.8861 0.7450 3.2973 -0.6093 -0.0679 0.4671 -0.3647 -0.5572 -0.4514 -0.6480 -0.0137 -1.4114 0.0195 -1.1859 1.1470 -0.0809 2.3392 0.1037 0.3728 -0.4526 0.8474 0.8596 0.4840 -0.1259 1.5431 0.4778 -0.6306 -0.9538 -0.0856 -0.7119 0.0210 2.0097 -0.7092 0.8142 -0.7184 -0.6732 -0.5959 0.5413 -0.2229 -0.5742 0.0232 -1.4062 1.5409 -1.8107 -0.2804 -0.0874 -0.2805 -0.8784 -1.0689 0.3775 0.2790 0.5935 1.1603 -0.7571 0.3297 3.0335 0.6507 1.3037 0.3876 -0.4178 0.3187 -0.0557 0.1952 -0.9679 2.7152 1.4010 0.3591 -0.2984 -0.5744 -3.0460 0.0111 1.8060 1.3418 -1.5407 0.5379 -0.6385 -0.4740 -0.9367 -0.2778 -0.5807 0.7177 1.6213 0.0021 -0.0301 -0.2472 -0.8171 -0.3041 1.3609 -1.5965 -1.0719 2.2832 -1.0496 -1.2763 2.3722 0.9130 -0.4058 0.8429 -1.6079 -0.0043 -0.9827 -1.2677 0.1855 0.5674 0.1053 -0.1899 -0.4314 0.0049 0.9149 -0.0270 1.1930 0.9507 1.2681 0.3097 -0.1258 2.1266 1.1354 2.0696 2.9857 0.8874 2.2507 -0.5313 0.0451 2.4727 0.5689 0.2564 -0.8940 0.3757 -1.4963 1.9025 -0.1370 0.1305 0.3481 0.3550 0.4476 0.7853 0.1889 -0.2153 0.7758 -0.6624 -0.6020 -1.0834 0.4063 0.8053 0.7761 0.5079 2.6625 -0.8527 -0.0251 1.6736 1.0237 -1.3949 0.2055 0.3683 -1.4078 -0.2561 -0.1006 -0.2781 1.3298 -0.4878 0.8656 -0.7498 -0.5206 -0.0622 -0.3641 -1.0228 0.4016 0.1666 0.7027 0.7103 -1.1705 -0.8273 2.5473 0.9963 -0.5187 -1.7122 -0.5142 0.1321 2.4350 0.0546 0.3303 0.0986 -0.9861 -0.4181 1.0156 0.1557 1.3745 1.2818 0.8998 -0.0891 -0.2105 -0.6259 -0.5125 -0.1673 1.0101 2.0888 0.6061 -0.2047 1.2463 0.8305 -1.3746 -1.3770 0.6656 0.3131 -0.7239 -0.5376 0.8077 -0.9326 2.3168 -0.4934 0.1114 -0.5019 -0.7051 -0.0062 -0.0405 0.1804 -0.5040 0.8918 0.1235 -1.3439 -0.8101 -0.6168 0.8908 -1.3607 0.4943 -0.0871 -0.9163 -1.5233 0.9468 0.2729 -0.9766 0.6926 -1.2719 0.7385 -0.1864 -0.2011 -0.3337 -0.4042 -0.2000 -1.1992 -0.3974 -0.5435 0.2543 0.7020 -0.1411 -2.4978 0.2039 0.0642 -0.1111 -0.7399 0.3171 0.6437 0.9503 -0.1397 1.2278 -0.0063 0.6789 -0.8963 -0.0987 1.5126 0.6023 0.3683 0.3246 -0.7747 1.0377 -0.3567 -0.5570 1.3495 -0.1259 0.1975 1.0955 -1.2408 -0.6892 -0.7157 0.3296 0.7442 -0.8268 -0.2638 -1.0152 -0.0066 -0.1466 -0.4913 -1.6654 0.6872 0.1846 2.0595 -0.1258 1.7531 1.6830 0.1150 -0.9846 -0.1968 0.3760 -0.1091 -1.0595 3.2296 0.2982 -0.0770 -0.8006 -0.4369 0.2413 2-hydroxyglutarate 1.6569 -0.4758 0.2467 0.5926 -1.7740 -0.1348 -0.4006 0.5850 0.4164 0.9189 0.1647 1.1997 0.4325 0.5716 -1.4606 1.0728 0.1992 0.8560 0.5342 1.2154 0.3589 -0.5368 0.6546 0.6387 -0.7792 -0.4020 0.1673 -1.7035 0.8658 1.0439 1.6975 -0.0312 -0.7265 -0.1983 0.1848 0.9909 0.0446 0.8550 1.1517 0.1052 0.3953 1.5862 -0.2899 -0.5037 0.5118 -0.8752 1.1096 0.9272 1.1855 0.8055 0.2581 0.2435 1.1050 0.6812 2.2720 0.3804 -0.2253 0.9836 1.6273 -1.0237 0.6202 0.1723 0.9787 1.0445 -0.3055 -0.4856 1.0927 -0.2701 -1.2124 -0.2722 -0.5375 0.4075 0.6874 -0.2030 0.2491 -0.7041 1.2915 -0.8259 0.9337 -0.2166 0.9775 1.1011 0.6109 -0.7034 -0.3815 -0.6079 0.7343 -0.0424 0.2190 0.0897 -0.7239 0.8756 0.4190 1.0232 0.5975 -0.2030 0.3884 1.2368 -0.1433 -0.2510 0.6802 -0.9306 1.3716 0.0453 0.5941 0.2234 0.1910 0.2617 -0.5835 1.6689 -0.3538 0.6682 0.7308 0.3967 -0.2667 1.5996 1.0718 -0.1814 -0.1790 -0.8745 0.2863 -0.2838 -0.2145 -0.1573 0.5761 0.3933 -0.6380 -0.8712 1.4994 -0.3967 -1.3271 -0.1932 0.6381 0.6551 0.5271 -1.0056 -0.9297 1.8641 0.3722 2.3952 2.0350 0.9612 0.0009 0.3400 1.0227 1.1689 0.1605 -1.0527 -0.3903 -0.0640 -0.2070 0.2678 0.3391 -1.4324 0.1960 0.8273 0.3232 0.2966 0.2412 0.4739 0.2489 0.9614 0.7466 1.6553 1.3475 -0.7687 0.7465 -0.5492 0.9071 0.3040 -0.4256 1.7847 -0.9955 1.4559 0.9423 0.9041 1.0825 2.3093 0.5397 0.9441 0.1563 -0.5163 0.2737 -0.4586 0.7823 -0.5020 0.2822 0.5153 1.7242 -0.2875 0.4244 0.2381 0.2389 0.6698 0.1834 1.3809 1.4569 -1.1470 0.1118 1.2621 0.1339 0.7420 0.9991 0.1876 0.2011 -0.7977 0.3509 1.3378 1.4706 0.3941 -0.2535 -0.1733 -0.2858 -0.0270 -0.3987 -0.1931 -0.5202 -0.7635 -0.9118 -0.0682 0.6812 0.0129 0.4579 0.9254 -1.0158 -0.6488 -0.2892 -0.6453 0.2227 0.0091 0.0243 0.2426 -0.4134 -0.2391 -1.2023 -1.0179 0.5121 -0.3419 -0.1658 -0.5022 -0.1233 -0.1576 0.6386 -0.2579 -0.9584 0.8167 0.7553 0.1693 -0.8806 -1.1952 1.0847 -0.1967 -0.5343 -0.0148 -0.1897 -1.1536 1.0513 0.1865 -0.4310 1.5809 -0.5884 1.5028 -0.2010 0.9987 -0.9791 0.3807 0.8928 -0.4773 0.0946 -0.6031 0.9362 -0.7625 -0.5301 -1.3622 -0.7758 1.2666 -0.8763 0.4281 -0.3925 0.4223 -1.1010 -0.4406 -1.4012 -0.2870 -1.2166 1.0123 -0.0511 0.2199 -1.7793 -0.1988 -0.5215 -0.4423 0.6182 0.5508 0.6523 -1.0740 -1.0306 -2.5804 -2.3760 -0.2709 1.4249 0.1810 0.5493 -0.0566 0.4807 0.0214 0.2508 0.3548 -0.7892 -0.6353 0.1564 -0.8038 -0.5194 -0.0585 -1.5070 1.2651 -1.2170 0.5291 -0.9193 -0.9043 -0.1605 -0.3191 -1.4350 -1.5962 0.7674 -0.6236 -1.1548 0.0173 0.5766 0.4943 0.4144 -0.3164 -1.1028 2.1712 0.0509 -0.9735 -0.7736 -0.4722 -0.4501 1.3350 -1.1783 -0.4399 -0.1940 -0.8328 -0.9560 1.9606 1.8380 -0.0602 -0.1392 -0.9466 1.3794 -6.4833 0.5809 -1.2062 -0.6979 -1.7286 -0.5652 -0.5894 -1.2193 -0.5496 0.0898 -0.4582 0.4946 -1.4890 -3.5520 0.0939 -1.1072 -0.7231 -0.3307 0.0691 0.4704 -0.0908 -0.4727 0.1331 -1.7156 1.6059 -0.6945 -0.2968 -0.3409 -0.0324 0.1951 -1.9877 -1.4674 -1.2203 -1.2922 -1.4806 -1.2543 -0.2371 -0.3359 -1.3998 0.3344 -0.1356 -6.3257 -0.1785 -0.0589 -1.2393 -2.1208 -1.3334 -1.3686 0.4080 -0.0315 -0.0079 1.2644 -2.7682 -0.8136 -0.7865 0.5628 0.1693 0.8284 -1.0494 2-hydroxyheptanoate* 2.3213 -1.7268 1.3292 -0.0635 -1.7980 1.5829 -0.5699 2.0797 0.9419 1.9662 1.5179 -0.3137 -0.0554 2.3406 -0.9565 0.5314 1.1173 -0.0936 -0.1750 0.4397 0.1711 -1.4712 -0.1446 -0.0272 -0.1905 0.6362 0.0089 -1.8792 0.2759 0.8661 0.1227 -0.4303 0.3560 1.0989 -1.3274 0.7529 0.4935 0.9783 0.6855 -2.6640 -0.0464 0.2382 -0.4606 -1.6278 -2.0236 0.4772 -0.0502 0.2771 0.5791 2.8289 0.6695 -0.7815 -0.2837 0.7271 0.0976 -0.6569 -0.7277 -1.3735 0.0342 -0.3868 -0.7657 -1.2363 0.1916 3.6603 -0.6835 -0.0317 1.1475 -2.0079 -1.8749 0.1402 -0.0591 -0.1573 0.8938 -0.3548 -1.2351 -0.7792 -0.7518 -1.3798 0.9351 0.1539 -1.2204 1.9252 0.4482 -0.6289 0.1445 -0.8305 1.1459 0.3373 -1.2633 -0.9438 -0.9703 0.6912 -0.3031 -3.1572 0.3254 -0.1587 -0.2241 0.7652 -0.7091 -0.1572 0.6538 0.3665 -0.2567 0.4684 -0.2662 -0.9867 1.1956 0.9885 0.4710 0.9310 1.8862 0.3173 -1.0323 0.4647 -0.3185 -1.0188 -1.4956 -0.1080 1.0586 -1.4324 -0.0577 -0.5603 -0.6346 -0.9478 0.8560 -0.2779 -0.7661 1.0392 -0.5763 -0.0299 -0.0103 1.0582 -0.7522 0.6768 1.0340 0.7742 -0.4710 0.5076 -0.2587 0.7974 1.5601 -0.0082 -0.5698 0.9164 0.8051 -0.9406 -0.5604 0.0701 -0.0527 -1.9297 0.0345 -0.2733 -0.3303 -0.6312 0.1607 2.4110 -0.0708 -1.0027 0.2989 0.7605 2.4365 -0.0646 0.9635 -0.5093 1.6266 0.7581 -0.2773 0.2656 0.9836 1.4100 0.0916 -0.2289 -1.4423 0.8496 1.6832 -0.9064 -0.2356 1.0618 -0.5115 0.4577 0.5121 0.3535 0.5729 -0.3892 0.8515 1.5185 0.7946 0.6078 2.6591 0.6047 0.0836 1.9949 -0.5416 -0.1521 -0.5849 -3.4832 0.7555 -0.7610 -1.1806 0.0551 -0.2137 -0.0886 0.2503 -0.7391 0.0126 -2.1101 0.0799 0.3671 0.9600 1.6312 1.1889 -0.4244 0.0840 0.0876 -1.2815 -0.6468 -0.0071 -1.0275 -0.1918 0.2740 -1.3373 0.3062 -0.1870 0.8502 -0.5918 0.3867 -0.0760 0.4115 -0.1655 -1.3424 -0.5326 -1.3770 0.7366 -0.4763 0.3805 0.1207 1.2255 0.7805 0.1866 -1.2620 1.3863 0.5416 -0.1183 -0.6549 -1.3017 1.3831 -0.2862 0.3318 0.1033 -0.2129 -0.7665 -0.8176 -0.2280 -1.3612 0.0138 -0.5203 -0.7082 -0.0115 -0.1780 0.8517 0.0653 0.2917 0.0156 0.7449 -1.9992 -0.9900 0.4445 1.0274 0.2608 -0.6881 -0.2978 -0.8297 0.7959 -2.3136 -1.2247 0.6978 -0.7737 -0.0867 -0.7727 -0.8775 -1.6426 0.4911 -0.6049 1.1868 -0.4752 -0.7872 0.0004 0.1889 1.3699 -0.6461 -1.1708 -0.5132 -0.0407 0.6940 0.7963 -1.0207 1.4067 0.0629 -0.8066 0.1805 0.1233 -0.3619 -1.6640 1.0191 0.2559 -1.1466 0.4617 1.2549 -2.1765 -0.7139 -0.4851 -0.7151 0.0454 -1.0797 -0.3592 -0.2211 -1.1606 -0.4082 1.0458 0.6834 0.0832 1.0014 0.1275 0.5567 0.2761 -1.5156 1.2509 1.4266 -0.2568 -0.3432 0.3668 -0.2070 -0.4877 0.5965 -0.5801 -0.7987 0.4116 -1.8542 -0.1173 0.2853 0.0830 0.0820 0.2497 -0.2644 0.0530 2.0270 0.9252 -1.2056 -0.0549 0.5644 1.0013 0.7035 4.4579 -0.7546 0.3374 -0.4077 -0.3763 -0.6173 -0.9822 0.7101 0.4459 -0.2993 -0.9235 -0.5565 -0.1965 1.4336 -1.4485 1.3053 1.4947 0.5210 1.7067 0.7254 0.3797 1.4541 -0.5279 1.8295 -0.7094 0.3726 2.1150 0.2598 -0.2604 -0.0878 -0.5022 0.0375 -0.9134 -1.0540 -0.8611 -1.6072 -1.1639 -1.8902 -0.7203 -0.5497 -0.0676 -0.0512 0.1106 -1.1517 -0.8584 -0.4089 0.5744 1.5326 1.1675 1.2467 1.0717 -0.4042 0.6334 -0.2492 0.0155 -1.1386 -0.8334 -1.8735 2-hydroxyhippurate (salicylurate) -0.8936 -0.1695 -1.1977 -1.0682 2.0146 -1.2353 0.2611 -0.1250 0.6915 -0.8471 -1.0265 0.5861 -1.1049 -1.2041 0.9919 -0.5959 -0.2573 0.3418 0.4577 -0.9611 -0.0570 2.3460 1.6835 0.9065 -0.2375 1.0715 0.6234 0.4698 2.9945 -0.1052 0.5282 1.6341 1.0313 0.2666 -1.4433 -0.3970 1.1885 0.6039 -0.2064 -1.3285 1.0291 0.7039 -1.1589 0.1419 0.4762 -1.3506 0.5276 -1.1306 0.0996 0.9013 1.8663 1.2330 0.9780 -0.4564 1.1375 -1.2946 0.5481 -0.8635 0.5609 0.6447 1.7715 -1.3059 -0.4255 -0.1702 -0.4677 -0.3931 -1.1747 1.0245 -1.3114 0.4904 0.4723 -0.1512 0.0605 1.4445 0.1510 0.0992 -0.0346 1.8796 0.1183 0.1217 1.0245 0.3033 -1.1503 -1.3171 -1.0652 1.0666 -1.0153 -1.0907 -0.5458 -0.8931 -1.4700 0.5007 0.2013 1.1265 1.0679 -0.4607 -1.1342 0.6310 -1.0883 0.2027 -0.2379 1.2680 1.1342 1.8394 0.4814 -1.0733 -1.2093 -1.1962 -0.5437 0.8005 0.0715 -1.3064 -1.0050 0.3008 -1.1623 -0.4384 2.4885 -1.0965 0.4375 1.3538 0.1686 1.1569 -0.2728 -0.2349 -0.2257 0.7391 -1.2839 -1.2047 -0.2838 2.5308 -1.2824 0.1974 -0.8973 0.3260 0.2610 -0.1062 0.5391 -0.8615 -0.3239 -0.7448 -0.9687 0.3037 0.4886 0.1042 -0.1544 0.1895 0.1951 -1.2090 -1.0663 -1.0226 0.2308 -0.9795 -1.0618 0.1293 -1.1999 -0.9997 0.7231 -0.9850 0.1845 -0.7758 -0.3958 -0.8139 2.2925 -1.1571 0.8095 0.1087 1.6017 -1.2466 0.2217 0.4456 -1.3294 0.0760 -1.4316 0.8910 0.2070 -0.9029 -0.9674 1.3328 0.3746 5.0681 1.2056 0.1462 -1.2092 0.4030 -0.9975 -1.3773 -0.5658 0.0035 -0.9791 -1.0602 0.3213 -0.0035 0.3789 0.6381 -1.0008 0.1168 -1.0968 0.6281 -1.1793 -0.9045 0.8165 -0.9844 0.1676 -0.3643 -1.2058 0.7893 -1.2116 -0.5450 -0.1235 0.1660 -1.1211 1.9687 1.6466 -0.0844 2.0732 -0.3127 -1.3934 -1.3733 0.0640 3.1114 -1.2206 -1.2704 -0.9964 1.1953 1.3497 -0.3575 0.4623 -0.3176 0.9331 1.0935 -1.2172 0.1168 0.2805 0.2238 0.5556 1.3540 0.1664 -1.1006 -0.2128 0.0681 0.7351 0.1417 0.3912 1.8959 -1.2822 -0.0214 -0.2852 1.2217 0.2660 0.0852 -0.2754 -0.3515 0.4073 -0.1282 -1.2549 -1.1242 -1.2440 0.0472 0.2495 0.3788 2.2166 0.3025 -0.0115 -1.4289 -1.2711 -0.8972 0.1487 0.4066 -1.1341 -1.2824 -1.2870 0.2658 -0.0627 0.2695 -0.6010 -0.5252 -1.2380 -1.2422 -0.1732 -0.9698 -1.3656 1.1417 1.7484 -0.3709 -1.4381 -1.1511 -0.0524 -1.1964 1.2720 0.8584 -1.3726 1.0582 1.8562 -1.3657 -1.1592 0.1334 0.6494 1.1672 0.7490 1.3083 -1.1690 1.2988 1.3499 -1.0260 0.3895 -1.4084 -1.2863 -0.9781 0.1614 0.1037 0.0524 2.1662 -0.2698 -0.2234 -0.3047 0.9824 1.9817 0.2484 1.5274 0.1667 0.5247 -1.3117 -0.2383 -0.2463 -0.2929 0.1542 -0.7104 -1.2001 -1.2513 0.5295 0.5225 -0.2443 -1.1863 -1.0273 -0.1233 0.7118 -0.1189 0.1009 0.7803 0.2845 -1.1859 -0.0213 -0.5976 -0.5176 -0.4699 0.8243 0.0589 0.5357 0.8453 2.1821 -1.0072 -0.6769 0.0940 0.0320 0.7624 -0.6315 -0.1100 0.3870 -0.4611 0.2398 0.2373 0.3641 1.1517 1.4395 1.5648 -1.3638 0.2065 -0.5599 0.6627 -0.3671 -1.0929 -0.2085 0.4554 -1.1756 0.8461 -1.0522 1.5139 -0.0211 3.1424 0.8163 -1.2109 1.1157 0.1586 -0.3561 -0.0894 0.0333 -0.5310 0.3916 -0.3821 1.1513 0.1116 -1.1813 -0.8362 -1.2868 0.7918 -0.6000 0.8414 0.0846 -1.5450 -0.5064 -0.2392 0.0710 0.3186 2.0255 -1.4394 0.8921 0.0423 0.0940 0.1946 0.8259 2-hydroxylaurate 1.7129 -0.5902 1.1909 1.4084 1.0992 1.6636 0.6625 0.7690 0.1904 1.3183 1.1597 -1.0680 1.1568 1.6489 0.5932 -0.4600 -0.5449 0.7645 0.7411 -2.7338 0.3768 -1.6013 1.8197 0.5293 0.5079 0.2073 -0.5522 0.4918 0.4693 1.4565 -1.7385 1.2164 -0.5693 0.3977 0.1056 -1.1921 0.8299 0.8476 0.3681 0.5657 0.2911 1.0196 1.0083 -0.5114 0.2290 0.2894 -0.5242 0.8410 0.7131 -0.8786 0.6928 -0.1228 -0.5421 -4.8585 0.4830 0.8376 -0.4536 1.2071 -0.7001 -1.4723 -0.1011 0.2234 -1.4312 2.0813 0.1498 0.4884 -0.1129 -0.7256 -1.3583 0.5272 -0.8230 -1.2831 -0.9832 -1.2424 1.2277 -0.7863 0.6605 -0.3962 -0.2665 0.1740 0.0963 0.5182 -1.1172 -0.1598 -0.0647 1.0385 0.1663 0.7137 -0.7567 -0.4457 0.1127 1.1690 0.2131 0.2568 -0.3994 1.3130 1.7913 0.0485 0.8122 -1.7190 -0.4253 -0.2861 1.0227 -0.2639 0.0868 0.2300 0.7462 1.0136 -0.6006 0.0177 -0.0062 1.1763 0.4350 0.3836 -0.0895 1.2989 0.6885 0.8615 -0.5279 -0.1931 0.7267 0.4949 -0.4215 0.6349 -2.1037 0.0987 0.1285 0.0970 0.6179 -0.5064 -0.6616 -0.1885 1.0611 0.4671 -0.1811 0.1011 1.4063 0.0122 -0.2377 -0.1013 0.3809 0.7519 0.1865 -1.3433 -0.0739 0.0036 0.4030 -0.3230 0.6177 1.5508 1.1069 1.4704 -1.7213 -0.5552 1.0147 0.7327 0.3029 -0.1325 1.7432 1.6615 0.7022 0.3826 1.2299 0.5309 -0.1273 0.3425 0.1565 -0.1873 0.2692 -0.4155 -0.6326 0.2801 -0.6090 1.6635 0.1031 0.8362 1.1966 -0.4020 -0.9779 -0.3819 0.1353 -0.5187 1.1272 -0.2978 0.8367 -0.0563 0.8529 0.4657 1.5629 0.5704 0.4072 1.0700 0.5993 1.2734 0.0326 -0.5200 0.6459 -0.6542 -0.3938 0.8131 -1.3273 -0.0901 -0.0538 -0.7083 1.5719 0.6069 -2.0261 -2.5120 1.0572 1.2840 0.2900 0.6212 0.2594 0.3460 0.7624 0.0152 0.4753 -1.2552 -0.6170 -0.4539 0.1018 -1.0440 0.0453 -1.3201 -0.2409 0.4609 -0.2022 0.3299 -0.6968 0.5909 -0.0588 -0.6663 -0.0149 1.8373 -0.1393 -0.1827 1.1028 0.1666 0.0770 0.4974 0.1781 1.1748 -0.6586 -1.0159 -0.0758 0.1723 -0.2915 -1.3183 -0.5485 0.2330 -0.5138 0.4121 -0.1203 -0.1490 -1.0755 2.3454 -0.8707 1.1564 -0.6180 -0.3981 -0.5072 0.3929 -0.9006 0.2436 0.9498 0.7512 1.3372 1.3878 -0.4282 0.1605 0.1248 -0.1794 -1.2235 0.0728 -0.0683 0.2714 -0.1868 -0.1958 -0.7612 -2.2094 -0.8450 0.4028 -1.0107 0.5740 0.3985 0.8823 1.2607 1.2980 -1.0031 -1.2232 -1.6530 -0.9083 -0.4293 -0.1074 -0.9772 -0.5640 -0.7806 0.3648 -1.2873 -0.2588 -3.6220 -1.3105 0.3386 0.9629 -0.2084 0.4946 -0.1369 2.6694 -1.5352 -1.8785 0.4171 -0.0644 -1.8860 -0.3572 -2.8344 0.1866 0.0914 -0.0282 -1.4069 -0.8429 -0.7613 -0.3396 -0.1057 0.8224 1.0702 1.2654 -1.5252 -0.4777 0.8353 -1.8620 0.6276 0.4933 0.7674 -0.1293 -0.0171 -0.7239 0.2909 1.1381 0.2824 -0.7526 -0.4334 -1.4343 -0.4400 0.3099 -0.6676 -0.3147 -0.5246 -0.2336 -0.3109 -0.1830 1.4605 1.6948 2.1832 0.4438 -0.9090 0.2890 -0.4546 0.7713 -0.5488 -0.0876 -0.9572 0.0663 -0.1559 0.5602 -0.9311 0.7276 -0.7970 0.5759 -0.4062 0.4980 -0.4284 -0.4575 0.1113 0.9715 -0.7565 -0.9595 -1.0196 0.2895 0.0325 -0.5093 -1.2007 -5.7181 -0.6421 -0.2612 0.0680 -0.6117 -0.5266 -0.1115 -0.6981 -0.0985 -0.4827 0.4273 2.1396 -0.4723 0.1691 -1.9158 -1.3512 -0.1020 -0.8725 1.1907 0.2219 0.3887 -0.0972 -5.2431 -0.0565 -0.4731 0.8076 -0.4210 -0.4750 0.2544 2-hydroxymyristate 1.1846 -1.8197 -1.3535 -1.1265 1.5409 1.1113 0.3439 1.3727 0.7228 0.9950 0.5928 -1.5032 1.4406 -1.3453 0.1515 0.6243 0.3529 -1.2251 1.3045 -0.1059 -0.0311 1.2059 1.0339 1.0747 1.4255 1.5090 0.9338 0.1734 -0.1175 0.6192 0.5833 1.2738 -0.7296 -1.6445 0.7423 0.3297 0.9459 0.8307 0.9863 1.0065 -0.9243 1.5192 0.6325 0.2606 1.5247 -1.5752 0.5067 0.2336 0.5184 0.6570 0.5568 0.7576 0.1725 1.6816 1.0205 -1.4761 0.3840 1.0601 0.6333 1.1248 1.0537 -1.5057 0.8319 1.3093 -0.5130 -1.5230 0.1658 -1.6393 -0.0716 0.9563 -1.2899 0.1844 0.5714 0.2160 0.0256 0.7976 0.6169 -0.1499 0.7338 0.2057 0.6785 0.5390 0.3119 0.6464 0.7078 0.2018 0.8429 0.9520 0.6583 0.5316 0.1125 0.6235 1.0708 1.2470 0.7572 -1.1680 -1.2535 -1.2232 -1.1580 1.0435 0.5499 -0.2813 -0.5741 -0.6052 1.6267 0.0820 0.7555 1.2184 0.9762 -1.1177 0.5660 0.3725 0.2445 1.6586 0.2888 0.3492 0.6229 0.3620 -0.3750 -1.6176 1.0525 0.8726 1.0519 0.9433 -0.0966 0.7085 0.8743 -0.3945 0.1243 0.3443 -1.4753 -0.3832 0.3460 -1.4572 -1.3517 -1.4787 0.5294 -0.8458 1.6436 0.6402 1.0637 0.8463 1.8413 -1.3212 0.1081 -1.3814 0.2192 -1.3483 -1.1489 0.9336 1.1032 -1.0153 0.1852 -1.9090 1.0582 -1.0361 -1.2381 0.8614 0.2293 -0.6725 0.6967 0.3008 1.1751 0.9620 0.3897 0.5958 -1.4671 0.0234 0.6402 0.5044 -1.5223 1.8369 0.6414 0.3534 -1.5449 0.9443 1.5274 0.5257 0.6609 0.8330 -1.1740 0.4866 0.8428 -1.3240 0.7393 1.2618 0.6499 0.2580 0.4255 1.0004 0.5981 -1.0730 0.9885 -1.0956 0.2475 0.4141 0.3407 -1.6238 1.1493 -0.8875 1.2191 -0.9982 -0.1882 0.8076 -1.3239 1.6247 0.6798 0.7882 -1.2602 -1.2212 0.0952 0.2681 -1.6018 0.9286 0.0352 0.5508 -1.6566 0.9391 0.4707 -1.5144 -1.3856 1.2326 -1.0454 -1.6390 -0.2409 0.0250 -1.5544 0.8311 0.3243 0.4909 -1.3694 0.8370 -1.2167 -0.3758 0.1913 -1.5788 0.0381 -1.2150 -0.2790 1.1327 -1.3798 -1.6380 0.0225 0.8150 0.4823 0.0791 -1.3730 -0.6455 0.2467 0.3198 -1.4127 -1.5080 0.4067 0.5639 -1.4115 -1.2205 -1.4043 1.5272 -1.2787 0.5064 -0.2940 0.4115 0.6990 -0.2960 1.3573 0.8259 0.0715 -0.1118 0.0151 -1.4719 0.3206 -1.1904 0.5442 0.6707 -1.4394 -1.3950 1.1354 0.5096 0.4124 -0.9767 0.4787 0.4998 -0.4975 0.5963 0.6526 -1.2698 0.5923 0.9396 -0.4887 -0.1059 -1.6032 0.1899 0.3792 0.3442 0.4506 0.2129 -1.4634 0.4598 -1.0523 0.6706 -1.3171 -0.1664 0.4941 0.4798 -1.3131 -1.6469 -1.4859 0.4135 0.1313 0.0929 -1.2522 0.5198 -0.1791 -1.5258 -1.7112 0.8182 0.2708 -0.4925 1.0694 0.1051 -1.2969 -1.5243 0.6314 0.7176 -1.4008 -1.7541 0.0178 -1.3515 -1.4066 0.4588 0.7567 -1.1985 1.0907 -1.1060 0.6728 -1.7121 0.8446 -1.4465 -0.4010 -1.1300 -1.3128 0.9683 -1.5920 1.1686 0.1759 -1.2536 0.4235 1.3633 1.6856 -0.2366 1.1710 0.7547 0.6064 0.7941 0.9559 0.1084 -1.6751 0.6047 -1.8383 -1.6659 -1.5201 0.4607 -0.0805 -0.7446 -1.4488 -1.5686 0.0663 -1.6857 0.5640 -1.6928 0.8892 0.4483 0.3617 -1.3265 -1.8274 2.3548 -1.9248 -0.2836 -1.5794 -1.5043 -1.3765 -0.3236 -0.1980 -1.7910 0.1737 0.2820 1.1399 0.7773 0.8928 0.6027 -1.0594 -0.4825 1.0741 -0.2042 1.0009 0.1264 -0.4000 -1.4401 0.6107 1.1257 -1.7888 -1.4869 0.5937 -0.3682 1.0735 -1.8585 0.8374 0.2794 0.3375 0.3867 2-hydroxynervonate* -0.5419 -1.1517 0.2165 1.5652 0.6726 -0.1137 0.0277 0.0933 0.1367 0.9617 1.1247 -2.2959 0.8988 0.5002 -0.6438 -2.3484 1.3159 0.3413 -1.6447 -0.1964 -0.9737 -0.7063 -0.6824 -1.3068 1.2939 0.8884 -1.2113 0.6956 -1.0049 0.1067 0.0933 -1.4193 1.1342 1.7685 0.8023 0.2020 -1.1917 -0.3741 1.3870 -0.8407 -1.2644 -0.3897 0.1967 0.5417 0.9424 0.1950 -0.6300 0.0050 -0.5084 -0.4092 -0.3442 -0.6024 -0.5193 0.8463 -0.9097 0.3372 0.1924 1.7826 -0.3803 0.6531 -1.0405 -1.0918 0.6105 -0.4669 -0.2256 -0.2989 -0.3788 -0.2313 -0.2696 -1.4403 0.4036 -1.4547 0.7510 -0.4408 -0.1922 -0.1111 -2.0603 -1.8930 0.6415 -0.8547 -0.1851 -0.4082 -0.6807 -0.2548 -0.8377 0.0589 1.0071 3.7071 0.2182 -1.2374 -0.3615 -0.0702 -0.1763 -1.1617 -0.4953 -0.2581 1.5870 1.3100 -0.4033 0.0171 0.0025 -0.5720 0.2163 -0.6530 1.1899 -1.3002 0.5218 1.9442 0.4292 -0.8656 -1.3511 0.3573 0.0017 1.6381 0.5342 -0.3792 0.0991 -0.5290 0.5764 0.6024 -1.7484 0.9150 -0.5660 -2.6448 -0.0037 0.2626 1.0303 -1.7796 0.2157 0.4031 -0.5706 0.0107 1.4696 -0.4802 0.0487 0.9500 -0.2937 -0.3240 1.6593 1.1540 1.8776 -0.4441 2.6415 0.7465 0.6846 -1.3634 0.6215 0.8273 1.3507 -0.1099 -0.4408 0.6466 0.0168 0.9180 1.9122 0.7654 0.5358 0.5580 -0.2543 -0.6719 -0.2012 0.4802 -0.1759 -0.0791 -0.1511 -0.8624 -0.1954 -0.9630 0.0974 0.5028 0.8812 0.6496 -0.7193 -1.6261 -0.0706 1.0339 -0.2526 -1.0872 0.4106 -0.5404 -0.4790 0.4387 -0.5466 -0.8518 -0.1100 0.8460 -0.5392 1.4185 -1.8448 -1.1383 -0.4334 -0.5222 -0.8093 1.9881 1.2923 0.6293 0.5829 0.1856 1.2929 0.6038 -0.7003 -0.2881 -1.2448 -0.1928 0.0967 2.1079 0.7807 0.9832 0.6401 -0.9226 1.2751 0.3277 -0.1065 -0.1190 -1.1090 0.0460 0.3467 -0.6856 0.4329 0.0939 1.2767 1.0288 -0.2655 -1.4034 -0.2496 0.2229 -0.3494 -0.0636 -2.3358 1.1664 2.3187 -0.7558 0.4689 0.4700 1.0574 0.0474 -0.5290 0.7369 0.7754 0.1890 0.8187 0.8684 0.0943 -0.6253 0.8766 -0.8593 -0.3821 -0.7323 -0.9632 0.9675 0.7098 0.9264 -0.6644 1.4526 1.1308 -0.6218 -0.6876 1.3178 1.4921 -1.0276 0.9905 -0.0700 -0.3570 -0.3611 -0.1331 2.3829 0.9746 0.2071 -0.8984 -0.2684 0.1538 0.4497 0.4906 -0.1459 0.0752 -0.8123 0.7467 -0.2042 -2.3855 3.3272 -1.5057 0.0933 1.1575 -0.4426 0.7913 -0.4906 1.2887 0.5015 -0.7662 -0.3771 0.0423 -0.3818 -0.1252 -0.3678 -1.0267 -0.2309 -0.1786 -1.0242 -2.7528 -0.5148 -0.2137 -1.1887 0.4887 1.6516 -0.4391 -0.1908 -0.0069 0.6025 -0.3635 0.0067 1.8789 -1.0811 0.2325 -1.6794 0.8866 -0.5957 0.5631 -0.7323 -0.1359 0.2726 0.5590 0.6242 1.0488 1.5805 -0.6407 0.5402 1.5902 -0.0322 0.1378 1.4128 0.4602 0.3568 -0.9154 0.7317 -1.3713 -1.0002 -2.5625 -0.0585 -2.2732 -0.1342 0.1725 -0.6170 -0.6107 -0.6842 -1.0998 0.1527 -1.0907 -0.1630 0.4614 -2.3025 1.1931 1.6687 -1.0841 1.4117 1.2226 -0.9764 0.0969 -0.9590 -1.4547 0.1180 -0.4270 -1.9268 1.2179 -1.0028 1.2783 0.5668 -1.5840 0.9754 0.1838 -1.8459 0.7919 -0.6369 1.3909 1.0489 -0.7036 -0.3012 0.2827 -1.1542 0.2841 0.6591 1.5418 -2.9835 -1.8833 0.8140 0.9421 -0.5611 0.6491 -1.2401 0.1503 -1.8618 0.3076 1.0266 0.8996 -0.2095 0.9399 0.3650 -0.9481 -1.4885 -0.3218 -1.5051 1.6255 0.9878 -0.5412 -2.2749 1.5485 0.2899 0.6045 0.3628 0.3451 -0.4251 2-hydroxyoctanoate 1.6062 -0.1655 0.8738 2.0259 1.6335 0.8999 1.5522 0.9656 0.9233 0.5932 1.2746 -1.0323 0.5190 1.0582 0.4580 0.1503 0.9035 -0.6577 0.5644 0.1964 0.5979 -0.4937 -0.3753 0.2081 -0.7221 -0.6122 0.7264 -0.3571 -2.4975 0.0949 -1.1671 0.2841 -2.0476 1.1887 0.1031 0.1580 0.3779 0.8057 -0.5734 -0.8378 -2.3408 -1.9379 0.6545 -1.6175 -2.5429 0.5721 -0.1468 0.1861 0.6449 1.2978 -1.7671 0.1432 0.5241 0.5127 -0.2116 -0.3521 -0.2087 -0.5152 -0.6840 -0.2826 0.3876 0.0802 -0.1122 0.9402 0.7173 0.7379 2.4455 0.8288 0.0586 -0.3067 -1.4268 0.7965 0.8600 -0.1592 0.0571 0.6301 0.5458 -1.0708 -0.4444 -0.5342 -0.6687 1.2218 0.1386 -0.1885 -0.4291 0.3546 0.1657 -0.6742 -1.1426 -0.2574 0.6793 0.9585 -0.5979 -0.4845 0.7078 -0.8772 0.2611 -0.6220 0.7090 0.4931 -0.2985 1.1960 -0.5450 2.3610 0.7462 -2.7037 1.0116 -0.3877 0.4203 -0.0303 1.2685 0.9003 1.0614 -1.3010 -0.0711 -0.5319 0.1390 -0.8210 -0.3228 -0.6274 0.5718 -1.2015 0.7178 -1.3906 0.5406 0.0403 0.6071 0.8597 1.0610 -0.7255 0.3514 1.2580 0.4627 0.2982 0.2457 0.5242 -0.1789 0.2770 -0.2080 1.7744 -0.4735 0.7740 -0.4288 0.6592 -0.4184 -0.7067 -0.3996 -1.4495 0.5547 -0.4413 0.0310 -1.1364 0.9553 -1.2125 -0.4136 0.1151 0.0801 -0.6027 -0.9738 0.1461 1.0781 0.2785 0.5317 0.6081 1.1730 1.7122 2.4824 0.6699 -0.5082 0.9030 0.0216 -0.7835 0.0792 -0.8246 0.3682 -2.2669 -2.4309 0.2498 0.2847 -0.8971 0.9575 0.4615 0.6333 -1.0139 0.8274 0.0516 0.0495 -0.7865 2.0152 -0.0820 0.9918 1.1725 2.7221 0.7161 0.0317 -0.6860 -0.3467 -0.4705 -1.7533 -2.2849 -0.4775 -0.3653 -1.1784 0.1181 -0.2893 0.2555 0.1080 -1.4856 -0.1444 0.1289 -1.3508 0.9671 1.9785 0.2023 -0.2882 -1.2181 0.1425 0.6160 -0.2045 0.5786 0.1131 0.3779 -0.3582 -0.1332 0.4671 1.0554 0.0065 1.0335 -0.5238 -0.8376 -0.5576 -0.2917 1.3520 0.6431 0.0011 0.3403 0.2564 -2.7784 0.8257 -0.5872 2.5264 0.5676 -0.2946 -0.5051 0.3447 0.7178 -1.2880 -0.1190 -0.2943 -0.9333 -1.2834 0.4454 -0.6621 -0.1660 -1.1777 1.0382 -0.8847 -0.4682 -1.2652 0.7409 -1.0709 0.8108 -0.3870 -1.3459 -0.7736 0.0131 -0.0199 1.2751 0.3878 -1.1160 -0.5922 -0.8656 -0.8890 -0.8399 -0.9198 -0.0476 -1.2768 -0.2834 -1.2210 0.7889 -0.8167 1.2164 -0.1808 0.0665 -1.7785 -1.6900 0.7625 1.3113 2.5958 0.2219 -0.7892 -1.1082 0.5004 -0.0891 -0.7084 -0.4593 0.8418 -0.1347 -0.6862 0.0077 0.1161 0.8371 -0.0627 0.9002 1.3853 -0.4792 -0.6530 -0.3651 -1.0755 -0.5496 -2.8325 0.3385 -0.9840 -0.7061 -0.5778 -0.5564 -1.1913 -0.5487 0.5292 0.0433 0.6886 1.0463 0.3101 -1.2587 -0.0246 -0.3778 1.0883 0.1214 -1.1043 -1.1689 -0.7699 2.2087 -2.9648 0.2102 0.3693 -0.4213 -0.9614 -0.1105 -0.3581 -0.3782 0.4872 -0.4504 0.7192 3.7328 -0.3229 -0.0260 0.4261 1.1102 -0.4920 0.2150 0.3268 1.0524 1.9371 1.3108 -0.2945 0.2431 0.0551 4.5983 -1.0520 0.2280 0.2569 -0.7821 -0.4315 -1.0206 -0.2378 1.0184 -0.7627 2.3488 1.0931 -0.1909 1.1546 -0.0930 0.0516 0.7814 -0.6826 0.2507 -1.3791 -0.0209 0.4351 0.5099 -0.9837 -0.0741 -0.7884 0.3386 0.0373 -1.4599 -0.9523 -1.7301 -0.7870 -0.9910 -0.9189 -2.8741 1.6702 0.6432 0.0826 -1.0543 -0.3320 0.4825 1.3123 2.1624 0.8268 1.3493 -0.2872 -0.3975 0.7128 0.2755 -0.1989 -0.7026 0.1143 -1.3930 2-hydroxypalmitate 1.1174 0.2625 -0.4741 0.3672 2.1394 0.3302 -0.4672 -0.0221 0.0504 0.2062 -0.1118 0.1780 1.6346 -0.4565 -1.6760 0.3678 0.1622 1.1412 0.9785 0.0838 0.4270 1.3125 1.8400 1.0430 0.3820 0.3644 -0.1903 -0.4039 0.4231 0.1740 -0.4119 0.7482 -0.2870 0.9845 0.6025 -1.5542 -0.5769 -0.2952 0.9924 0.4838 0.5040 1.0638 -0.4624 1.0239 2.3335 -0.8473 0.5156 0.1357 1.3269 -0.3939 0.8537 -0.0329 -0.6296 0.8799 1.9380 0.8890 0.7162 2.7633 0.5315 0.9571 0.7420 0.1000 0.1407 -0.6230 0.1381 0.7533 -0.1488 0.3253 0.1067 0.2263 0.6767 -0.5749 0.0269 -0.5768 0.4437 -0.4863 0.7196 -0.7078 -0.1173 -1.3272 0.9590 -1.2686 -0.8443 0.8606 -1.4672 -0.1776 1.0902 0.4543 -0.3973 0.3627 1.1255 1.3944 -0.1061 0.4082 -0.3163 0.1286 1.9336 0.6968 -0.0378 0.9333 -0.7193 -0.7191 0.1586 -0.9712 1.0703 -0.9264 -1.0583 0.9429 1.3432 -0.0474 -0.7429 -1.0013 0.5947 0.4957 -0.2722 -0.0232 0.6734 0.1925 -1.5282 0.5503 -0.3569 -0.4001 1.1171 0.7230 -0.5579 -1.6653 1.7706 -1.5571 0.9891 0.1317 -0.8763 -1.2264 -0.2868 -0.1267 -0.3985 -0.0030 -0.0230 -0.4107 2.0779 1.2572 0.2511 0.7449 1.1000 -0.3329 0.0306 -0.1097 0.8502 0.3404 0.2870 2.6342 0.8072 1.2137 1.0389 0.4069 0.4424 2.0899 0.6608 1.6428 0.5742 0.3158 0.0858 -0.0976 0.6741 0.5860 1.2326 0.0394 0.0100 0.1858 -0.5335 -0.6583 0.0115 0.8845 -0.3742 -0.9365 -0.8881 2.2076 1.0199 -0.0719 -0.7852 1.3557 -0.0749 -0.7934 1.1512 0.4709 0.1616 0.9723 -0.5559 1.5857 -0.3484 -0.3726 -0.9776 -0.5938 2.0571 0.7885 0.3558 0.4032 0.2284 -0.5442 1.3015 1.4216 -0.3891 1.3525 -1.1988 -0.1934 -0.3523 1.0875 -0.1371 0.9482 -1.0481 0.6215 0.2960 -0.9258 0.5199 1.2068 -0.3358 0.5639 -1.9040 -0.7345 0.2606 -1.8401 0.3103 0.5465 0.5554 -0.8765 -0.3205 -1.3585 -1.0578 0.2420 0.0353 -0.5802 0.2447 0.6900 0.0098 0.2107 -1.7423 -1.1284 -0.5394 -0.8065 0.1512 0.0259 0.4988 -0.7601 -1.3838 0.3507 -0.1635 -2.3469 0.1676 -1.6754 -1.3843 -1.0662 -0.4877 -0.2481 -1.0534 1.2939 -0.2546 -1.7720 -0.2479 0.8312 -0.2434 0.3308 -0.5982 1.1743 -2.2397 -0.8198 0.9981 1.6625 1.3209 -0.4760 -1.7748 1.3030 -0.5764 -0.3300 -0.5006 -0.2524 -0.4297 -0.7660 1.9370 0.1775 -1.1674 0.8080 0.5249 -0.6462 1.0047 0.1893 1.2777 0.6915 0.1684 1.8814 -1.4147 0.0886 -1.3574 0.9982 -1.3702 -0.1624 -1.2502 -0.6204 -1.3623 -0.3309 -2.1187 -0.1351 -0.8886 -1.8060 2.3096 0.3975 0.3105 0.0406 -1.6715 0.6067 -0.1070 -1.2178 0.4431 -1.0128 -1.7814 -0.8627 -0.2008 0.7457 -0.4024 -0.9551 -0.1105 -1.1811 0.2119 -0.3886 1.8386 0.0818 -0.0415 -0.3320 0.0015 -1.4198 -0.4371 -0.6183 0.2981 0.1780 -0.1888 0.0660 0.6353 -0.9161 -2.1869 -0.0317 -0.5855 -2.1904 -1.3797 0.9253 -1.1704 -0.8452 -1.0169 -1.7767 -0.3039 1.5891 2.3013 -1.7893 1.3406 -0.9909 -0.9493 -1.6762 -1.9138 -0.3411 0.8852 1.0426 -0.8090 -1.4945 -1.3119 -0.3789 1.9480 -1.7411 0.6036 -1.4078 -1.0215 -0.1070 -0.2698 -1.5322 -0.8628 -0.6873 -0.0823 -0.7515 -0.2797 3.5046 -0.3251 -1.4125 -1.3600 -2.3998 0.2928 -1.4356 -0.1454 -0.2896 0.8862 0.2646 -0.3087 1.3768 -0.8953 1.0615 1.9023 0.6942 -0.6638 0.5206 -0.7736 1.0516 -1.3488 -0.4142 0.5646 1.5993 0.2938 -0.7255 -0.1420 -3.3069 0.1898 -1.1630 1.0528 -0.4893 -0.4504 -1.1504 2-hydroxyphenylacetate -0.2911 0.3021 1.0994 0.3043 0.9315 -0.3197 -0.0019 0.0937 1.0957 -0.6451 -3.8344 0.2147 0.1180 0.7136 -0.9931 1.2122 -0.2772 0.6298 0.4704 -0.2429 -0.1952 -1.2178 -1.5384 0.6866 0.4504 0.9766 -0.2703 0.4388 -0.2824 -0.7260 -0.5615 0.4228 1.2972 -1.6605 0.3079 -0.8526 -0.5450 0.9072 0.7985 0.0583 -0.3679 1.2963 0.0838 -0.6623 -0.0835 -0.3948 -0.9170 -1.4776 -0.0143 1.1343 0.2327 0.2142 0.5210 -1.1060 -0.7076 0.0461 1.1121 -1.7380 -0.1610 -0.0418 -0.4890 1.2839 0.3033 0.8121 1.6598 0.3682 -0.5505 -1.7287 -0.4304 -0.3920 0.0372 -1.0195 0.0752 0.3162 -1.7453 0.6029 0.5004 2.0456 -0.0314 -0.0435 0.7569 -0.5741 0.0944 -0.3177 -0.1130 0.2567 0.4383 -0.6139 -0.7311 0.6049 -0.2850 -0.3524 1.1137 1.0593 2.0252 1.0231 -0.6647 0.0062 0.8395 -0.1347 2.5164 1.6418 -0.2262 -1.5821 2.0335 -0.1818 -0.2410 0.1103 0.1617 0.8719 0.6016 0.9648 -3.5076 1.1389 -0.4702 -0.1868 0.1135 2.8254 -0.7911 -0.2893 0.1423 -0.5558 1.1584 0.2135 -0.8830 -0.4981 0.6776 0.7465 0.0393 -0.3351 0.2907 0.1238 0.0496 -0.2480 0.5495 -2.7912 -0.5451 -0.1877 -0.7510 0.7238 -0.4675 -0.9525 -0.9392 -0.0948 -0.1484 1.2836 -1.6712 0.4590 -0.6470 0.5992 0.1822 -0.5171 -0.6787 0.1363 0.7888 -0.6381 -0.3173 -0.0054 -0.4337 0.6217 -0.1295 -0.8602 0.9815 -1.1375 -1.8433 1.4934 -0.1336 0.9626 -0.3664 -1.9638 -0.2899 0.7048 -0.4446 0.6501 0.9461 -1.2658 -2.1851 -0.3276 0.3606 -0.4286 -0.7479 2.5798 -0.6152 0.8201 -0.1025 0.2776 -0.3414 0.0845 -0.0177 -3.6345 1.0989 -0.1034 0.0722 0.7193 -3.4609 -1.1964 -1.7470 0.3545 -0.7045 0.5527 0.1536 1.4085 -0.1376 -0.5832 0.4521 0.6118 0.0138 -0.0084 -0.8196 -0.2915 0.5433 0.7502 1.6163 -0.6957 1.0332 1.4323 -2.0294 0.5285 1.1189 -0.3382 0.7968 -0.4795 0.2634 -0.0862 -0.3989 -0.8708 -0.8308 1.1792 0.6749 -3.8914 -0.1832 0.5265 0.8517 -1.2335 0.5539 -0.6298 0.5663 1.4186 -0.2352 0.7387 1.0000 -0.8694 -0.0240 0.7272 -1.6196 -0.1957 -0.1485 1.5006 0.0313 0.2997 -0.1356 -2.7847 0.3355 -1.5195 -0.5077 1.8896 0.3699 -0.9168 0.6929 0.2283 -0.5488 -2.3657 0.1467 0.0974 -0.8272 -0.5330 -0.7806 0.3954 0.1933 -0.7601 -0.5226 1.4159 -0.6353 0.2942 0.6763 0.1465 0.0846 0.0431 0.2753 0.4739 -0.2571 1.7146 -0.4661 0.6098 0.4640 0.9136 -0.2190 -0.8019 -0.8871 0.5019 0.0117 -0.5780 0.7990 0.1728 0.3516 0.3229 0.5771 0.2885 -0.1144 -0.6631 0.5065 -0.7692 -0.2782 1.5294 1.2342 -4.4104 -0.3182 1.1446 -1.0418 0.2678 -0.7711 -0.5412 -1.3334 2.5312 -0.5705 0.3747 1.2212 1.6716 1.9249 1.4682 0.5596 -0.9543 -0.2976 0.5011 0.5729 -0.7662 -1.3136 -0.5471 0.0066 -0.1870 -0.0653 -0.4480 1.5720 1.0009 0.9609 0.3306 0.4810 -0.4494 2.8294 -0.1868 -0.3063 1.6952 -0.2935 -1.5022 0.1128 1.3257 -0.4875 -0.2075 0.2147 -0.4672 -1.1709 -0.5658 -0.5855 -0.4531 1.4416 -0.4745 -0.3174 1.3750 -0.9147 0.3179 0.5686 1.4010 -1.3529 2.5011 0.6825 -0.6131 1.3107 -0.7868 0.1921 -0.1464 -0.5111 0.5581 -1.1000 -0.9355 -1.3647 -0.8549 0.1909 1.0830 0.2071 1.3510 -0.2706 1.0777 0.5147 1.3332 0.2786 0.3540 -1.4754 0.3331 0.9195 0.4380 -1.1014 -0.1431 -0.6819 1.2230 -0.4367 0.0655 -0.6574 -0.0614 0.2989 -0.1855 -0.8819 -1.6581 0.3079 0.5029 0.2982 -0.8810 -0.3971 0.0355 0.2336 -0.4377 2-hydroxyphytanate* 1.1949 0.3656 1.0314 -0.0667 0.0536 1.3097 2.1478 0.7126 0.4129 0.4015 0.4903 -0.3247 -0.7226 -0.2190 0.9902 1.0863 0.0668 -0.4082 0.6294 1.2503 1.5646 -1.1646 -0.1700 0.6095 0.4259 1.2404 -0.7081 0.4752 0.1076 -0.3976 0.5121 0.2230 0.9427 -1.0027 1.2586 1.2262 0.9734 1.9084 -1.7740 0.0161 0.7022 0.8508 3.1362 -1.2537 1.0172 -0.1236 -0.0628 0.2152 -0.0563 -0.4609 -0.7793 0.5966 -0.7296 0.1887 0.9365 -0.2326 0.0656 0.5775 0.2820 0.9854 0.3205 0.5438 0.5118 0.3483 -0.5999 -0.3865 -0.4798 1.0501 0.9355 -0.6300 0.1513 0.2441 0.1385 -0.3951 -1.7724 -0.2757 0.3038 0.0308 -0.4540 -0.0639 1.2978 1.1688 0.8206 1.5716 0.0380 -0.0262 0.2693 1.0702 -1.9658 -0.2354 0.5074 0.7403 -0.6644 0.8128 1.0180 -1.9071 0.6531 0.3542 1.5388 1.3008 0.5049 0.2930 0.3677 0.3136 1.7635 1.1181 -0.4433 0.9847 -2.0836 -1.7103 -0.2561 0.8821 1.1677 1.0203 0.5051 0.4331 1.1046 -2.3547 -0.3526 -0.0127 -0.2933 0.5860 0.8367 -1.8630 0.9935 1.2347 0.3568 -0.1092 0.9810 0.3252 1.2646 -0.8887 -0.2671 -0.9460 -1.2274 -0.0968 0.0917 0.7352 2.2828 1.2726 0.4410 1.3072 1.8030 -0.6058 -0.7960 0.1286 -0.2707 0.4597 0.3647 0.9119 0.6017 -1.1529 0.4594 -0.6865 0.6866 -1.9468 0.7042 0.6869 -0.1962 -0.3479 0.7906 -0.3453 0.1202 0.0805 -1.0922 2.2751 -0.6630 -1.1596 -1.3296 -0.6786 -3.4826 1.1426 2.4519 0.5475 0.3618 1.0722 1.5496 0.9093 2.5967 0.0622 -1.0919 0.4123 1.2915 0.0779 0.2749 -0.1629 -0.2010 -0.2843 1.2664 -0.1016 -0.0329 0.0046 0.9196 -1.2990 -0.2310 -1.2726 0.9517 0.5940 0.6363 -1.0730 0.4826 -0.8802 -0.9317 0.4528 -0.2284 0.3306 0.0321 0.8234 -0.3125 -0.9012 -0.3212 -0.5196 -0.4366 -0.5520 -0.7843 0.6332 -1.0152 0.2069 -0.8329 -0.1365 -1.3606 -1.2789 -0.3317 -0.3905 0.8432 -0.1045 -1.1673 -0.1783 0.9499 -0.6599 -0.9971 0.6505 -1.8527 -0.7657 0.4916 1.2552 -0.1113 -0.8890 -0.2332 0.4785 -0.9464 0.7280 -3.3703 2.2041 0.1563 -0.7547 0.9788 0.2544 -0.4135 0.8272 0.2160 1.2653 1.0195 0.7697 0.0708 -0.5019 -1.4498 2.5469 -0.5227 0.6519 -1.4677 -0.6586 0.3944 -1.0510 -0.5320 0.1538 -0.0926 -1.0998 0.0798 0.2756 0.0181 -0.1035 1.5431 -0.2718 -0.4090 1.1855 0.0760 0.4216 -0.8694 -0.5961 -0.3034 -0.9684 0.5231 0.2616 -0.8768 -1.0872 0.1082 0.1183 0.5404 0.1299 -1.8277 0.4774 1.1120 0.7850 0.7881 0.3435 0.9582 0.0778 -1.0288 0.9175 -0.2181 -0.1500 -1.1592 1.4549 0.3745 -2.6730 0.6058 -0.0110 -0.8189 -0.9627 -0.1343 -0.0878 -0.1032 -0.1596 -1.7379 0.2479 0.1931 -0.2032 0.1854 1.3780 0.5896 -0.2363 -0.8699 -1.3243 -0.0600 -0.5845 0.3197 -0.9833 -0.8965 0.0829 -0.0567 -0.5612 1.3696 -0.5596 0.6650 -1.3284 -0.7843 -0.2366 -4.9081 -0.9168 -1.0653 0.4995 1.2348 -0.9376 0.3496 0.5228 -0.5882 0.7815 -1.5629 -1.0494 -0.9634 -1.0672 -0.3138 -1.1236 -1.2007 -0.7517 0.3325 -0.2634 -0.5226 1.0918 -0.6939 -1.2850 0.9246 -1.3693 -0.9595 0.5071 -1.4297 -0.9244 0.8983 0.5030 1.3841 -0.1444 -0.5153 0.3925 -0.9104 0.3703 -1.2315 -0.7083 -0.1643 -0.5069 -2.6490 -1.3205 -1.2242 0.7927 -2.7430 -0.4172 0.0266 -0.1314 0.3704 -0.2944 -0.6497 -0.4705 0.4115 -0.6623 0.8247 0.1386 -0.1147 1.4834 0.9869 -0.3339 -0.7373 -0.4551 1.8452 -3.7971 0.6695 -0.3888 -2.1967 0.2237 -0.2424 0.1787 2-hydroxystearate 0.6438 0.5784 -0.1835 0.3912 1.8156 0.1574 -0.2459 -0.5849 -0.3891 -0.4187 -0.0090 -0.2043 1.6474 -0.0084 -1.4019 -0.3125 -0.0103 0.5330 0.7132 0.7675 0.1389 0.9113 1.2936 0.9788 0.8646 0.0936 -0.6391 0.3734 0.4494 -0.1553 -0.6873 0.7402 -0.6203 0.9131 0.6070 -0.7914 -0.6381 0.4354 0.5428 0.8271 0.7461 1.0457 -0.3484 1.3072 1.4767 -0.5215 -0.2997 0.3452 1.3582 0.1082 0.7069 0.4949 -0.3552 0.4333 1.5134 0.2123 -0.3276 3.7582 0.9628 1.0741 0.8402 0.2215 0.3784 -1.0725 0.2124 0.2056 0.0572 -0.0302 0.2358 0.1356 0.5639 0.0417 0.4499 0.4664 0.6000 -1.0164 0.3055 -0.6978 0.6473 -0.8640 0.9549 -0.4776 -0.3990 1.2084 -1.0596 -0.0977 1.9185 0.8785 -0.2197 1.3511 1.2958 0.7433 -0.0084 0.5030 -0.5930 -0.2624 2.1107 0.8980 -0.1834 0.5846 -0.1277 -1.2705 0.3838 -1.0509 1.0527 -1.3045 -0.5798 0.9697 1.1482 -0.1732 -0.3551 -0.7240 0.2342 1.2939 0.4274 0.8939 0.3121 -0.1434 -1.4929 0.6567 0.3903 0.0128 0.8640 -0.5310 -1.5715 -0.7358 1.6849 -1.2276 0.5414 0.4497 -0.4233 -1.2350 0.0857 0.1699 -0.7297 0.0799 0.2434 0.6874 1.7044 2.0614 1.1032 -0.4847 1.5265 -0.6625 0.5498 -0.2420 1.1841 1.5524 0.3644 2.4460 1.5261 0.9463 0.0953 -0.2079 0.4228 1.4490 -0.4519 1.7558 -0.1036 0.4976 -1.2920 0.6552 1.3602 0.7292 0.8382 0.6315 -1.4780 0.4594 -0.2790 -0.2758 0.7930 0.9425 -0.7007 -0.4482 -0.4331 1.9470 1.5381 0.2991 -0.6538 1.2696 -0.5446 -1.2150 1.5887 -0.9177 0.5965 0.2831 -0.2607 0.9503 -0.2926 -0.1567 -0.7381 -0.1918 1.2340 0.2843 0.5282 1.0696 -0.1317 -0.2836 1.3191 1.4219 -0.8734 1.1739 -1.7727 -0.4877 -0.2196 1.8433 -0.3751 1.6019 -1.1195 0.0408 0.9443 -0.8844 0.5023 0.7947 0.0203 0.9730 -0.6458 -0.6898 0.4491 -2.5884 -0.2168 0.8194 1.4585 -1.0579 0.2900 -1.3046 -1.5016 0.3235 -0.0277 -0.6989 0.6784 -0.2382 -0.0559 -0.9070 -1.2159 -0.8410 -0.0878 -0.6536 0.4922 1.2829 0.4025 -1.0234 -0.8242 0.1674 -0.2017 -2.0055 0.5033 -1.5213 -0.8454 -0.7963 0.4933 -0.2653 -0.2611 1.4776 0.8619 -1.5676 -0.6943 0.3728 -0.2659 0.4086 -0.9557 1.0707 -2.3557 -0.8403 0.8351 1.2750 0.4700 0.3043 -1.2144 -0.2151 -0.4133 -1.7862 -0.2954 -1.0168 -0.2524 -0.3628 1.8147 -0.6441 -0.8501 0.2228 0.3319 -0.6742 0.2219 0.1446 1.1820 0.9013 -0.0200 1.4720 -1.8634 -0.2581 -0.7823 1.0828 -1.2219 0.2760 -0.3106 -0.5581 -1.1727 -0.1785 -3.9651 -0.2640 -0.5670 -1.3541 2.1173 0.4430 -0.6774 -0.3219 -0.9606 0.6756 -0.2359 -1.2887 1.4402 -1.0546 -1.4006 -0.1903 -0.0553 -0.1317 0.0894 -1.1231 0.1054 -0.5687 0.2168 -0.8338 2.3903 0.7810 -0.2110 0.0324 0.5797 -1.0064 -0.5376 -0.2145 -0.7331 0.0293 -0.8881 0.3153 0.6209 -1.6816 -2.2264 -0.9084 -0.3566 -1.4446 -1.1106 0.5157 -1.8463 -1.6447 -0.9505 -0.8921 0.1314 1.3106 1.2617 -2.0604 1.3793 -1.7874 -1.3191 -1.0791 -1.5529 0.2213 0.1603 1.0354 -0.8850 -1.1183 -0.9769 -0.4937 1.7944 -1.3775 0.2301 -1.1429 -0.7190 0.5121 0.4797 -2.0995 -0.7831 0.0016 -0.2932 -0.9611 -0.9294 2.8846 -1.1292 -0.1199 -1.6835 -2.3854 1.1620 -1.2991 -0.9470 -0.2121 0.8510 -0.5012 -1.0454 0.1723 -0.5791 0.1859 1.5135 0.3805 -0.4130 0.6019 -0.4369 0.4139 -2.0067 -0.3488 0.3821 1.1514 1.0219 -2.4024 -1.6280 -2.3433 0.8917 -0.9489 0.8257 -0.9758 -0.1288 -1.5717 2-isopropylmalate 0.3464 0.1231 -0.5458 -0.7942 1.4282 -0.0471 2.2843 0.1796 -0.0665 -0.1644 1.2659 0.2336 0.6244 0.1433 0.7105 -0.2805 -0.1808 -1.8157 -0.4713 -0.4283 -0.3447 0.4236 -1.5133 -1.2828 -0.7889 -1.2119 -0.1035 -1.0519 -2.0323 -0.0404 0.3056 -1.1333 0.2730 -0.3135 -0.0650 -0.3185 -0.5429 -1.9564 0.3244 -2.3898 -0.8375 0.2811 2.0957 -0.6641 -0.7973 -0.2771 0.2142 -2.1611 0.1658 1.9075 -2.1805 -0.4876 -0.1651 0.2765 0.0066 -0.4175 -0.3806 -0.3799 0.2647 -0.8361 -0.4137 -0.6583 0.2813 0.5507 -0.1089 0.1055 -2.2188 -0.0871 -0.2900 -2.0311 -0.7845 -0.3699 -0.2228 1.3492 1.5244 2.4067 -0.4581 0.7183 -0.2759 2.5247 0.1956 -0.7220 -0.6169 -2.3981 0.5676 -0.8042 0.0482 0.0309 -0.3283 -1.9300 -0.2449 -0.9458 0.1642 -1.0541 0.3085 0.8434 2.0555 -0.1205 -0.1257 -0.4237 -0.0550 0.3465 -0.1136 0.6423 -0.1796 0.1578 0.6660 2.6147 -0.4728 0.5031 -1.5058 -0.2178 0.5671 2.0324 1.2993 0.1027 1.0016 0.4955 0.8294 -0.3231 0.1069 -0.6566 -1.0155 -0.0676 0.3177 -0.0474 1.3764 0.9778 -1.1576 -0.9211 -0.1101 1.1338 -1.9387 0.0391 0.5785 0.5400 3.3740 0.3113 -0.2174 -0.0260 0.5832 0.4080 -0.6634 -0.4515 -0.3282 -0.2302 0.0770 -0.2793 -0.2880 -2.0505 -0.1515 -1.0886 -0.0158 0.7186 -0.2669 -0.1549 -0.5349 -0.5110 0.1821 -0.7608 1.0406 -0.2571 0.2266 -0.5078 1.6672 1.2748 -0.5034 1.8160 1.0909 -2.1963 -0.0626 0.0789 0.3054 -0.7307 -0.4809 -0.1166 0.0724 0.1467 -0.5206 0.0123 1.0597 0.6675 0.1337 -0.0296 -0.2140 -0.2673 1.2340 -0.0736 -0.5572 0.8393 0.0591 0.2809 0.3033 -1.0141 0.4021 0.0253 -0.1672 0.2722 -2.2303 -1.9273 1.5007 -2.0077 -0.7756 0.2680 0.0528 -0.2780 -0.3705 -0.3686 0.3739 0.0979 -0.7844 -2.2150 0.2351 1.1969 -1.3980 -0.8103 0.7674 0.8010 0.7327 0.1687 0.1655 0.0710 2.2282 1.0385 -0.1143 -0.5036 0.7048 -0.3401 0.2992 0.2525 -0.9738 0.2430 -0.1192 -0.0824 0.1563 3.5325 -0.6891 -0.8529 -0.0401 -0.1968 -0.3203 0.6916 -0.0962 0.7452 -0.0624 -0.6524 0.0102 -0.4841 0.2971 -0.7435 -0.2631 -0.1975 0.3168 1.1801 0.0272 0.1484 0.3921 0.5259 -0.6238 -0.3435 -0.1946 0.6788 0.8729 -0.1714 -0.0087 -0.3231 2.5044 -0.1816 -0.3081 -0.6120 -0.3823 0.7144 -0.2309 0.7144 -0.1609 -0.2585 1.3472 0.5972 -0.3484 -0.7608 2.3828 -0.2713 0.2879 0.4390 -0.6782 -0.5256 -0.3411 -0.2649 1.1840 -0.0849 0.0643 0.9324 0.0704 0.8278 3.6053 0.8249 0.5981 1.4354 0.3206 0.5538 1.2253 0.5789 -2.2595 -0.4981 0.2750 0.5786 0.4349 0.3226 -2.4282 0.7831 -2.1995 0.1185 2.1106 0.1828 -0.8979 2.8825 0.5327 -0.1688 -0.2022 0.0887 0.2274 -0.0958 -0.3659 -0.0598 -0.1880 -1.0892 0.1784 -0.4893 1.8439 0.1174 -1.5529 2.3737 -2.2674 -0.1286 0.3609 1.0574 0.1403 -0.1735 -0.2251 -0.8938 0.6542 -2.6064 0.6964 0.0506 0.1750 -0.4742 0.1510 0.4626 0.3143 -1.0445 -0.1470 -0.5902 -0.5697 -2.5819 -2.3732 -0.1935 -0.6878 -0.4733 0.0874 0.1066 0.5508 -0.1573 0.9525 -0.2686 0.1965 -0.4095 -0.2842 1.3225 0.8970 -0.4633 -0.9869 -0.0797 -2.2503 -2.2583 0.8416 1.6587 0.0301 0.7241 -0.2899 -0.4922 -2.2949 0.7524 -0.0736 -0.0248 0.8595 -0.2996 -0.0533 -0.5248 1.3675 -0.9205 0.2380 3.4701 -0.6585 0.1410 0.8414 -0.3930 1.9544 0.2787 -0.9677 0.2672 -0.9583 -1.0972 -0.4064 2.6032 0.0788 0.2296 -0.7211 0.5498 -0.0849 1.2785 2-keto-3-deoxy-gluconate 0.6114 -0.1233 1.2982 -0.1476 0.3725 0.5825 -0.7718 1.6608 0.0858 1.9985 2.4205 0.4766 -0.9754 0.4514 -0.7749 0.1745 -0.2797 -0.0545 0.3112 -0.3787 0.1763 0.5041 0.4062 0.0016 -0.1162 -0.5699 -0.2404 0.1054 0.3564 -0.8316 -0.0348 -0.8441 0.5789 -0.0383 0.0707 3.6419 0.4765 -2.9858 0.0294 -0.7193 0.6074 1.1158 -3.3622 -0.5284 -0.1227 -0.8424 -3.2984 0.2691 -0.2223 -0.2636 -0.1792 0.1633 -0.0746 0.5529 -0.2158 -0.2091 0.6068 -0.1125 0.4929 -1.2199 0.0812 -0.4288 -0.2092 0.4489 -0.0856 -3.5671 0.0404 0.6958 -0.0479 -0.0045 0.0374 0.3144 0.6760 0.4728 -0.0649 0.9489 0.2386 -0.5021 0.3496 0.0562 -0.2709 -3.2352 -3.3727 0.0394 2.2334 -0.6435 0.2859 -0.0518 0.6426 0.1562 -0.5028 0.2888 -0.0101 0.7459 0.6208 0.1976 0.7110 -0.6385 0.3561 0.5092 0.6008 -0.0608 -0.3256 0.3873 0.2672 0.4528 1.4024 0.1442 0.4918 0.1828 0.5890 0.4899 -0.0818 1.0520 2.8143 0.5112 0.2930 0.9877 3.7649 -1.2041 0.7312 -0.1684 0.2278 0.3140 0.4181 0.3265 0.3723 0.4247 -0.3787 -0.4170 0.4165 2.0475 0.1713 0.2370 -0.0161 -0.4429 1.1893 0.2756 0.1818 0.6349 1.9018 0.2877 -0.0176 -0.2431 0.4952 -0.4264 0.3581 0.3757 -0.6172 -0.8825 0.4784 -0.6650 -0.3549 1.9557 -0.3357 -0.3540 0.0123 0.5904 0.9737 -1.9271 0.2622 -0.4761 0.7131 -0.3992 0.5171 -0.9258 -0.0934 -0.2364 0.4721 0.1508 -0.2955 0.0214 -0.2499 -0.2485 0.5433 -0.3179 0.5565 0.7069 0.1706 -0.9594 1.0885 0.7547 0.8572 0.5462 0.0636 -0.5335 0.0703 -0.0379 -0.7773 0.2392 -0.3684 3.0580 0.0190 -0.0135 -0.0788 0.1511 -0.4927 -0.2295 -0.5717 -0.1297 0.2868 -0.3291 0.8526 1.3047 0.4169 -0.4072 1.3449 0.7881 0.1696 0.3011 0.5916 -3.3405 -0.1431 1.2593 -0.6195 -0.3613 2.3086 0.7454 -0.0029 0.1563 0.2191 -0.4469 -2.2621 0.2111 -0.5100 0.2440 1.2492 -1.1566 0.1706 -0.7076 -0.6317 1.8572 -0.8439 -0.3706 -0.8497 0.7389 0.0804 -0.1867 -0.7853 0.2662 -0.0879 0.9489 2.0523 -0.0001 -0.8813 0.1712 0.2229 -0.1713 0.0831 0.6093 0.2284 -0.2312 -0.4663 -0.1729 0.4030 1.0553 -1.4187 -0.1830 -0.6956 -0.4708 0.1389 0.1004 0.0785 0.1378 -0.6956 -0.8173 -0.9322 -0.7629 0.1922 -1.0248 0.2311 0.5705 0.3977 0.4497 0.2652 -0.6408 -1.0659 -0.5567 0.6290 -0.0081 -0.6815 -0.2845 0.7656 -3.5409 -0.5638 0.3856 -0.5015 -2.8057 2.4008 -0.7546 0.1343 -3.6647 -0.2651 -0.0825 0.5413 0.0310 0.4522 0.4514 0.3650 0.1552 0.2787 0.3140 0.4321 0.4044 1.5830 0.4118 1.0631 0.2552 0.2548 1.0642 -0.2475 0.3537 0.3138 -0.2709 -0.6120 -0.8943 0.2332 0.0205 -0.3376 0.0227 0.1907 -0.1966 -0.1045 0.1399 0.0361 -0.9667 1.1103 0.2665 0.2636 0.1469 -0.1408 1.3507 -0.6644 -0.1452 -0.9294 -0.7190 2.0104 -0.1638 0.0862 0.0042 -0.2462 -0.9090 -0.0339 -0.6399 -0.1992 0.7889 0.4452 0.0590 -0.4397 -3.6999 -0.1072 0.7611 0.3563 -0.7747 1.2708 -0.6293 -3.8371 -0.6067 0.4634 -1.0419 0.2676 -1.3413 -1.2484 -0.6418 -0.7004 0.4177 -0.4180 -0.3248 -0.0759 -0.9907 0.0841 -0.3925 -1.7915 0.6118 -3.2618 3.9602 0.0107 0.5633 -0.0931 0.8972 -3.5088 0.3984 -0.7775 0.2157 0.3254 -0.1781 -0.8224 -0.5921 -0.9228 0.0132 -0.3378 0.6812 0.3140 -1.2837 -0.1062 -0.3567 -0.8694 0.5353 0.2696 -1.2635 -0.3088 1.3493 -0.0951 -0.8896 -0.6676 0.8058 0.2368 -0.5827 0.0779 1.7711 2-ketocaprylate -0.1235 -0.5027 0.4826 1.3669 1.1102 0.4840 1.2713 0.1072 -0.4228 -0.4151 0.4998 -0.8667 0.1983 -0.0375 0.1256 0.1195 0.4130 -1.3903 0.1356 0.0278 1.4648 -1.0158 -0.6462 0.0905 -1.1259 0.0508 1.0196 0.3669 -4.5157 -0.0624 0.7204 0.4861 -0.3393 1.7927 0.1045 0.2247 0.6975 0.7130 -0.7188 -0.1466 -1.5522 -0.1492 -0.1985 -1.4865 -2.0404 0.6696 -1.6935 0.3479 0.9779 1.3561 -0.3320 -0.3504 1.1575 -0.3740 -0.0778 0.1186 0.6441 0.8372 -1.1259 0.3219 0.9668 0.2969 -0.1892 0.0138 0.0867 0.1809 1.6786 0.6283 0.4955 -0.3699 -1.2061 1.5186 -0.6706 -1.0708 -0.6125 -1.0715 0.3444 -1.0132 -2.0048 -1.2212 -0.6850 1.0556 -0.2969 -0.0712 -0.7838 0.4092 0.1706 -0.3308 -0.8970 -0.3185 0.7195 0.6424 -0.5585 -0.4016 0.0647 -0.6021 0.5197 -1.4936 1.7971 0.6419 -0.3040 0.9934 -0.2363 1.3671 -0.1289 -4.7134 0.5878 0.2266 -0.0088 -1.0728 0.6694 0.7111 1.7157 -0.7487 -0.1979 -0.9614 0.1397 -1.2536 -0.8988 -0.6652 0.0547 -1.1663 1.4241 -1.5180 0.8502 -0.2623 0.8697 -0.0260 1.4283 -1.2158 -0.0073 1.8820 -0.5512 -0.6514 0.6426 0.7623 0.1338 0.4198 0.3397 2.1706 0.5554 0.7436 0.0680 0.1405 -2.0250 -0.3781 -0.0337 -1.0967 1.0302 0.1657 1.1087 -0.5501 1.2521 -1.6226 -1.0821 -0.9350 -0.4489 -0.4795 -0.9517 1.1075 -0.1439 0.4825 0.0148 -0.9326 1.1567 1.9381 1.6217 0.4228 0.3130 0.9936 0.3572 -0.9388 0.5468 -1.8917 1.1182 -1.2639 0.3120 -0.4220 0.2914 -0.3004 0.9880 0.6426 0.4192 -1.4360 1.2431 0.7725 -0.4073 -0.5611 1.6177 -0.4629 1.1481 0.8829 2.4635 0.5899 -0.0792 -0.9028 -0.2382 0.6734 -0.3485 -1.7245 -0.8905 -3.7901 -0.3898 0.9002 -0.7932 0.0693 0.6486 0.2863 -0.9188 -0.2138 -0.8399 0.5004 2.2656 0.2304 0.4107 -0.9322 0.4653 1.3597 0.6711 1.0029 0.0575 0.6801 -1.3515 -1.1215 0.3970 0.4322 0.2722 1.2696 -0.5667 -0.4947 -0.9024 0.3746 1.7906 1.2147 -0.0715 0.1665 -0.6150 -0.9637 1.1754 -0.5263 0.5585 0.0516 0.2324 -0.1236 0.6138 -0.1117 -0.9111 0.3095 -0.1375 -1.7780 -1.4442 0.8627 -0.0992 0.6884 -1.0117 1.0490 -0.9554 -0.6294 0.4648 0.6307 -0.9699 0.8109 0.5033 -1.8992 -0.7536 0.3257 0.0763 1.1802 -1.1556 -0.3657 -1.1686 -1.4163 -1.0565 -1.0887 -0.0111 0.1824 -0.5630 0.8349 0.4180 1.4401 -0.9669 0.7871 -0.5842 -0.2303 -2.1110 -1.0406 1.2720 0.9782 1.6879 0.6061 -0.5471 -1.4569 0.8643 -1.0655 0.0159 -0.5964 0.6360 0.4729 -0.8725 0.3642 0.0131 0.4313 -0.1294 1.4337 1.7193 -0.6047 -0.4485 0.6212 -2.3985 -1.1381 -0.7143 0.6937 0.0779 -1.2084 0.5164 -0.4882 -0.9702 -0.1978 0.1921 0.2890 0.8975 -0.4715 -0.0164 -0.4632 0.5038 0.5699 0.3156 -0.6453 -0.9491 -1.3398 -1.0710 3.0217 -0.7619 0.1811 0.1397 -0.6017 -1.6165 -0.7553 0.0687 -1.0944 0.0321 0.0829 0.6343 2.2729 -0.9305 -0.1315 1.5135 1.9418 0.0812 0.5408 0.8585 0.8078 0.1731 0.8781 -0.9559 0.1750 0.3987 4.6206 -0.4749 0.4450 0.5043 -0.8124 -0.6072 -0.9064 0.0412 0.9529 -0.4607 1.0779 0.9571 0.4371 0.5578 0.2425 -0.0317 -0.1308 -0.3879 -0.6639 -1.4486 -0.7131 -1.2362 1.3921 -1.9333 -0.8630 -0.3768 0.8309 0.3236 -0.1956 -0.2295 -1.6837 -0.2665 0.1182 -0.8494 -1.0411 2.1086 0.4121 -0.0446 -0.3975 0.1000 0.5195 0.9471 1.6616 0.6960 0.9319 -1.0562 -0.5864 0.7275 0.5874 0.1571 -0.3153 0.2953 -0.4444 2-linoleoylglycerol (18:2) -0.7069 0.8787 -1.4081 -1.9244 -0.3092 -3.2948 -0.7197 -0.5728 -0.3990 -1.1078 0.3053 0.9687 0.1856 -1.8417 -1.9081 -1.0967 -1.2322 0.3904 -0.1423 -0.7370 0.6272 0.5204 0.4957 -0.3058 -0.6057 -0.8976 -0.1078 -0.1212 -0.7778 -0.0897 0.5190 0.6711 -2.1763 1.5227 -0.4107 -1.8687 -0.3116 -0.9983 0.4409 0.8272 -0.3587 -0.3362 -1.2443 1.1307 0.8892 -0.4943 0.0750 -1.0780 0.5203 -1.1360 0.0317 0.1395 -0.1616 -0.5149 0.5136 0.5150 0.4919 0.2784 0.5599 0.5517 0.4772 0.7530 0.0549 -1.3814 0.8676 0.6001 -0.4877 0.4991 1.3546 -0.9474 0.2361 0.4381 -0.2671 0.5386 0.5179 0.6325 -0.1663 0.5751 0.6464 -0.0592 -1.0229 -1.9468 -1.1367 0.4622 -0.5532 -0.1660 0.1050 -1.0457 -0.2008 0.1757 -0.1374 0.0348 1.3966 -0.3557 -1.0462 0.1405 0.2813 0.7345 -1.3710 -0.1940 -1.1839 -0.0099 -0.6927 0.1538 0.1326 -0.9287 -0.3583 1.0187 0.4509 0.1531 -0.2705 -0.2780 0.0552 -0.0753 -0.2317 -0.8276 -1.2535 0.8060 -0.7337 -0.5468 0.4664 -0.0993 -0.5748 4.8564 0.6149 -1.2886 0.5971 -2.5358 1.0138 1.4812 -0.0151 -0.0186 0.0660 -0.1081 -0.6252 -0.2307 0.8431 -1.2577 0.4346 -0.4216 -0.4195 0.0731 -0.4146 -0.1118 1.0055 0.2422 0.5495 0.3880 1.2295 0.2636 0.8262 0.4055 0.7010 1.6027 0.7033 0.7809 -1.0917 0.3790 0.5401 -0.4070 -1.9618 0.8047 -0.4888 1.2641 1.2801 1.0491 -0.3064 -0.7243 -0.5391 0.1708 0.8821 -0.1166 -0.1050 -1.4937 0.2523 0.0682 -0.0323 -2.0442 0.5512 1.0433 -0.0919 -1.6490 -0.1054 -0.2115 -0.4532 -0.2459 0.3239 1.0435 -1.0036 -1.1724 -0.1177 -0.1443 1.1516 0.8044 0.7475 1.1635 -0.3430 -0.8728 0.6950 0.4872 -0.0414 0.4499 -1.6013 -1.5649 0.5281 0.6276 0.6265 -0.5435 1.1211 -0.1698 -0.1383 -0.0822 0.6281 1.1976 0.1631 -0.9350 0.2949 -0.5696 1.0519 0.6062 2.0378 0.4390 1.5622 -0.7345 -0.3842 0.2190 -0.7877 -0.1461 -0.3280 -1.0317 -0.1821 0.1467 -1.4307 0.3256 0.4842 -0.6652 0.0465 2.1032 -0.2605 0.7962 0.2224 0.6746 -0.6559 -1.6156 -0.0313 -0.3942 -0.5943 -1.5708 -1.2855 0.4611 0.5327 -0.5544 -0.6597 0.0697 0.5533 -1.1568 0.7967 -2.2125 0.8463 -0.7994 -1.0047 -0.0959 -1.3848 -0.8753 1.0165 0.6316 0.7934 0.2320 1.2054 1.5377 0.5183 -0.2204 0.3477 1.0257 -0.8663 -0.6583 1.5912 -0.4027 0.4636 0.2575 0.6507 0.4324 0.9795 -0.4961 -0.4311 -0.7102 -0.0008 0.3549 1.4023 0.7509 0.6495 0.7780 -5.1575 0.0916 -0.3378 -0.7776 -0.5024 -0.0815 2.3243 0.7403 -1.0040 -2.0161 -0.1584 -0.0437 -1.4718 0.3393 -0.5374 -0.0044 1.3545 0.3071 0.5919 0.8384 0.4432 0.7576 1.9874 0.2518 0.0817 -1.0842 -0.7376 -1.2320 -0.4211 -1.0353 1.5787 0.1525 -0.5109 0.3117 -0.2448 1.5848 -0.0744 -0.3457 -0.5108 -0.0781 0.2529 -0.0342 -0.0817 1.9014 -1.2948 0.4361 1.0316 0.5542 0.7102 -0.5201 -0.5720 0.6125 2.5548 -0.6269 1.8249 -0.3634 1.6313 0.5453 0.1812 -3.3992 -0.0523 0.4593 -3.0796 0.1262 0.7726 0.4659 2.2284 0.3259 2.3477 1.5274 -0.3865 -1.1456 2.5363 -1.3802 0.5957 0.2129 0.3889 -0.4474 -0.9557 -0.4730 1.5659 -1.5601 -0.6553 -0.5182 2.0327 -0.6704 -2.1266 0.1825 1.5137 -0.1544 0.6659 -0.0784 2.3428 1.1087 -0.0985 0.8545 0.0109 0.7871 1.2026 -0.6230 -1.7314 -0.0842 -0.8585 0.9909 0.6322 -0.7299 -0.0688 -0.3303 0.5029 -1.7320 -0.2694 1.1851 0.2123 -0.2895 -0.3361 1.1117 1.1038 -1.9014 2-methylbutyrylcarnitine (C5) 1.2483 0.2362 1.0952 -1.7107 0.9198 -0.2041 1.4939 0.8273 1.1310 0.9299 -0.3304 -0.4526 0.7106 0.7584 0.8229 -0.2977 0.1856 0.4021 -0.6963 -1.5515 0.1895 -1.2428 -1.1901 -0.0663 -0.1347 0.3187 -0.0966 -0.5359 -1.7975 1.0344 -1.5155 -1.3005 -0.5614 -0.8444 0.1979 0.2077 -0.6415 0.6764 -0.1606 1.3018 -1.4047 -1.0998 1.0797 0.0305 0.0902 0.3136 0.4570 -0.6913 -1.5004 -0.7619 0.6510 -1.2828 -0.1383 0.4168 -0.0068 -0.3010 0.9699 -0.2748 -0.7799 0.0555 -1.8388 1.3346 0.6277 -0.5569 1.0452 1.4020 -0.6163 -0.3697 0.1716 0.8685 0.4724 -1.5817 -4.0625 0.8773 0.1275 -0.1456 -0.6563 1.3740 -0.0125 0.5140 0.4228 -0.3039 1.2250 -1.7343 0.8993 -0.7797 -1.7408 0.9815 -1.1560 -0.8139 -0.1400 0.1894 -0.6074 -0.6498 0.8059 0.2221 -1.7392 -0.4874 -0.4705 -0.2105 -0.4553 -0.6064 -0.3328 -0.1053 -0.3637 0.7804 0.9437 1.9683 -1.3984 -0.2948 -0.2365 0.1738 0.4355 -0.3810 -0.4317 -1.3126 0.0002 -0.4913 -1.4279 -0.6689 1.3258 0.5376 -0.0786 -1.2917 0.8339 -0.2341 -0.6030 0.7088 0.1571 -0.2302 0.4001 0.4086 -1.1129 -0.6121 0.2270 1.5222 -1.8860 -0.9860 0.7425 -1.4999 0.3709 0.8338 -0.8432 0.0782 -0.3501 0.8354 -1.7365 -1.0508 -0.4852 -0.3783 0.0048 -0.0744 0.9732 0.7253 -0.3238 -0.2371 0.6359 -0.1767 -1.0004 1.6034 1.5503 -0.8503 0.6178 -1.1206 -1.1129 2.2688 1.5465 1.3058 -0.5075 0.1016 0.6172 -0.9859 -0.3801 -0.8895 -0.4977 0.4546 -2.0457 -0.3529 -0.1888 -0.2010 0.7288 1.6034 -0.6931 -1.4578 -0.9618 -0.3943 -0.8367 -0.7731 -1.7238 -0.9747 0.5943 0.2327 0.1089 0.9197 0.6224 -0.3977 -0.1256 -1.3947 0.4230 1.2568 -0.0480 -0.2131 -2.0436 0.0804 -0.3688 -0.2340 -0.2519 -0.1293 -0.3797 0.3689 1.3432 0.5251 -0.3084 1.8936 1.2479 0.2485 0.8150 0.6077 -2.0452 1.3692 -0.9513 0.3125 -0.8219 0.1449 0.2854 2.4196 -0.3070 1.6650 0.9547 1.2766 -0.3067 -0.8942 -0.9770 0.6840 1.1699 -0.0655 -1.0932 -0.2406 1.5938 1.2738 -0.0231 -0.1209 0.1320 4.1390 -0.7639 -0.0775 0.4606 1.5379 0.6879 -0.7082 -0.3994 -2.2866 -0.4937 1.0616 -0.0968 -0.3713 0.9391 0.2725 -1.1856 -0.3145 0.6433 -0.1868 0.9154 2.1743 0.0585 -1.3631 0.5720 0.3943 2.1804 -1.5990 0.5627 1.1976 0.2811 2.3117 0.9944 1.2464 0.4994 -1.4563 0.7515 -0.9353 2.6969 -0.3044 -0.3680 1.7546 1.6919 -0.5391 -1.8759 -0.1009 1.1779 0.7824 0.7477 -0.4506 1.7946 0.5672 0.0952 0.1532 0.0892 -0.3773 2.4240 -1.1027 1.1606 0.1413 0.1022 -1.2230 -0.3841 1.0718 0.5200 0.3181 -0.1803 0.4889 -0.3029 -1.3912 2.3284 -0.3750 1.8498 -0.1643 -0.5491 -0.4719 1.7823 -0.8356 -0.2800 -0.6558 0.0524 -0.9497 -0.8283 -0.1160 0.1271 -0.8019 1.0968 0.7879 -0.4489 -1.6564 -0.2282 0.3167 -0.0107 -0.6167 -0.5046 -0.6862 -0.4400 -1.3929 0.7611 -0.3733 0.9708 -1.0976 -0.4291 -0.9292 -0.3813 0.7390 -0.4307 -0.5134 -1.0677 0.4309 -0.3947 0.2977 0.4848 0.5994 0.8831 -0.7105 -0.8990 0.0455 -0.1086 -0.4777 0.7944 -0.5982 0.7977 1.1066 -0.7433 -0.3148 -0.7495 -2.0843 0.5586 2.5883 -2.3390 1.1353 -1.7874 0.6164 -0.8169 -0.6440 -1.5337 0.6518 0.0883 0.3240 0.0608 1.4400 -0.4230 0.5189 0.2995 -1.0654 1.4783 0.8564 -1.4220 -0.3294 0.5607 2.4237 -0.5501 -0.8587 0.7669 -0.5493 -1.4502 0.3371 0.3104 -0.5373 -0.3359 2.2296 -1.3989 -0.2217 -0.1358 1.1514 -1.0088 -0.0177 2-methylbutyrylglycine (C5) 0.9127 0.7231 0.5575 -1.9863 1.1610 0.1541 0.0083 -2.2196 0.2912 0.5373 1.1124 0.2823 -0.2344 0.9121 0.3187 -2.1578 0.0982 0.6865 0.6351 0.0181 -1.9174 -2.4678 0.4826 0.7137 0.6189 -0.1064 0.6840 0.8402 0.7418 0.4242 0.5407 0.9861 0.4172 0.2966 0.2285 0.3131 0.6103 0.8627 0.4038 -0.9521 -0.0188 0.3918 0.8924 -2.2663 -1.9296 0.3266 1.0254 1.0313 1.3221 -2.0481 -2.0521 0.2176 -0.3886 0.3168 0.6577 0.4201 2.1783 -1.7705 -0.3912 0.0284 0.9094 0.4946 -2.2175 -1.3905 0.6477 1.2572 -2.0984 0.6555 0.3046 0.4718 0.5755 -2.1981 -0.0789 -0.4953 0.6196 -0.1796 0.8362 -0.7431 0.7583 -0.8296 -2.1164 0.6132 0.5251 -0.5687 0.0779 0.5654 0.9308 0.6165 0.5955 1.0034 0.1850 0.4961 0.4526 -1.7558 -1.2932 0.7747 0.9425 -2.0346 -2.0076 0.6359 0.6459 0.8080 -0.2659 0.4196 0.8239 -1.9950 -2.1388 0.5352 0.3647 -0.4072 -2.2692 1.0242 0.7067 0.2101 0.2347 -0.2672 0.5504 0.7255 -1.2550 0.8298 0.6278 -0.4976 -0.0612 0.4425 -0.0448 0.2359 0.3270 1.0240 0.8131 0.4753 0.2162 -0.2742 0.1932 0.5905 -2.1317 0.2973 0.4766 -1.7710 0.5312 0.8680 -1.8860 0.9524 -2.0246 -2.1102 0.6242 0.7838 0.7885 0.3846 0.8505 0.8804 0.9769 0.8022 1.4313 0.1478 0.7120 -1.9152 0.3753 0.7764 0.4863 -1.6756 -2.0446 0.2498 0.9833 1.0974 0.2880 -2.2591 0.3092 -2.1758 1.1199 0.4267 0.2616 0.3599 0.1417 1.6847 -1.0182 1.0107 0.7382 -0.4281 -0.4006 -1.8629 1.2824 0.3364 -0.6943 0.3359 -1.9118 0.0887 -0.7075 0.3886 0.8087 0.7545 0.9249 0.3844 0.5993 0.5841 0.5449 0.6489 0.9785 0.6974 0.6688 0.6381 0.7386 0.5991 -0.0418 0.4880 0.2505 0.6735 0.3429 0.5178 0.3735 0.0588 -2.0442 -0.2592 -0.1558 0.7319 0.6291 -0.1493 0.7747 -0.0060 -2.3650 1.8339 0.1168 0.2582 0.3458 0.9037 0.8482 0.5413 -0.3827 1.7656 -0.2780 0.0835 -0.4766 1.0060 0.5738 0.0989 0.5141 0.1103 0.5468 -0.2471 0.3553 -1.3831 0.4193 0.0754 0.7108 -0.3216 0.1517 0.2314 0.0905 -2.2986 0.9824 0.5291 0.1486 -0.2343 0.4007 -0.5498 -2.1841 0.9008 -2.1735 -0.1440 -0.8929 0.9674 0.1258 1.4983 -0.2833 0.0779 -0.5135 0.7213 -2.2315 -0.1561 -2.0592 0.6478 0.1900 -0.4733 0.2827 -0.0230 -0.2339 -0.0340 -1.8469 0.2667 0.3780 0.5490 0.5507 -2.2775 -0.2168 -0.3977 -0.2411 -0.3204 -2.2194 -2.1215 0.3571 0.3773 0.7359 0.2802 1.7154 -0.5214 -0.4304 -0.5814 -2.2065 0.3767 0.1751 0.1789 0.8819 1.3136 0.4581 0.6632 -0.5021 0.2950 1.4618 1.9452 -2.2590 0.3987 -2.0642 0.6492 0.7826 -2.2614 -2.3781 1.0036 -2.0872 0.5580 -0.1599 -0.2153 0.6668 -0.2688 0.2753 0.4159 0.7227 0.3341 -0.0095 -0.6711 0.3626 -2.2791 0.4843 0.8065 0.7307 -1.9474 0.5336 0.8435 0.6673 1.2980 0.2938 -1.9576 1.4061 0.3357 -0.3695 -0.4034 0.3382 0.8669 -1.9750 -0.0663 0.0232 0.1520 0.9182 -1.5710 -2.2089 -2.4124 -0.0814 0.4870 0.0338 0.7861 -0.3056 -0.0895 0.4701 -0.4256 0.1791 0.3504 0.2920 -0.4399 0.2719 -0.9963 0.3376 0.4310 0.6640 0.7702 -0.5772 0.3562 0.2342 0.3637 0.1993 -0.0360 0.1941 -1.1468 -0.3941 0.2983 0.4360 0.5096 -0.2146 0.1774 -0.3773 0.5643 0.5644 -2.4244 0.7112 0.6436 0.7660 0.1432 0.3307 0.3249 0.1089 0.5286 -0.1060 -2.2376 0.1256 -0.0704 0.3847 -2.2956 -0.0285 -0.1398 0.6513 0.2709 0.0354 0.1503 2-methylcitrate/homocitrate 0.6073 0.0400 -3.5568 -0.6008 0.8068 -3.6449 0.9424 0.0655 0.7205 -2.7658 0.9715 0.3937 1.0924 0.5976 0.0270 0.1464 -3.8674 -0.0170 0.3976 0.4999 0.1204 -0.0336 -0.2347 0.4951 -0.1056 0.2798 0.2048 1.1767 0.6466 -0.1398 0.3697 1.3074 1.2511 0.2303 0.2227 0.0147 -0.1643 1.2200 0.7511 -0.6982 -1.2720 1.3253 1.1338 -0.5205 0.3411 0.2302 0.4873 0.4567 -3.3885 0.5959 0.0140 -0.1960 -1.2696 -3.6592 0.5686 0.6141 0.6552 0.3420 0.2802 -0.6660 0.1062 0.2505 0.8060 -0.2505 -0.0060 -0.2126 0.3645 -0.3878 0.5546 0.5945 -0.2414 0.5071 0.2023 0.2835 -3.4220 0.2185 0.9264 0.2831 0.3910 -0.4701 -0.1975 1.0507 0.1150 -0.4395 0.4931 -0.0750 0.5182 0.8518 0.1615 0.7917 0.2348 -3.2903 -2.6115 1.2464 0.0099 0.2145 0.5440 0.5608 0.3034 -0.2134 0.4479 0.0649 0.9324 0.4051 0.2618 0.6704 0.6662 1.0943 0.4656 -0.0436 -0.5626 0.0045 -3.0871 0.9535 1.1440 0.0908 0.5380 0.2379 0.1534 -0.0865 0.8153 0.1624 -0.4004 -0.0651 0.2180 -0.6308 0.1663 -0.7989 -0.0009 -0.3405 -0.1474 -3.2103 0.0680 -0.1073 0.1986 -0.0275 0.8957 0.1280 -0.1100 1.3460 0.8259 2.3930 0.4832 0.5630 -0.2973 -0.5010 -0.0513 0.7883 0.4643 -3.1074 -0.3974 0.2158 -0.0914 0.5215 -0.1243 -1.1195 -0.0783 0.8159 0.2966 0.1894 0.2208 0.1541 0.4075 -0.0665 0.8448 -0.3655 -0.2250 0.0137 -0.5210 0.1262 -1.1635 0.6410 0.1816 0.4906 -0.6235 0.6530 0.5264 0.5504 0.5270 1.1315 0.8045 0.0753 -0.0604 0.8784 0.6653 0.3212 0.4100 0.7699 -0.1638 0.4094 1.1218 0.3207 2.3227 -0.0129 0.4695 0.4284 -0.1436 0.3003 -0.4288 0.6436 0.4162 0.4688 -0.0027 -0.1408 0.2892 0.4436 0.6904 1.7868 0.3400 0.9471 0.5443 0.3871 0.8242 0.6219 -1.5376 0.0570 0.6270 0.1879 1.2449 0.7109 -1.5284 0.5663 0.2826 -0.0076 -0.7839 0.4060 -3.8631 0.2618 0.4013 0.3561 0.0912 0.7648 -0.1866 0.6375 -0.1270 0.7294 0.3086 0.3134 -0.1953 0.2893 0.7860 0.2853 0.0122 -0.0443 0.0003 0.0068 0.2544 0.0088 0.3376 0.6378 0.8924 0.7896 -0.1253 0.4060 -0.9084 0.1469 -3.6379 0.8230 -0.0107 -0.0252 0.3941 0.6412 -0.0589 0.2995 -1.6737 -2.8374 -0.1234 -0.1711 0.0773 0.1815 -0.9024 -1.0324 0.1050 0.6928 0.1836 -0.7471 -0.1927 -0.1768 -0.5729 0.1014 -0.1881 0.1622 -0.3145 0.3047 0.0664 -0.2362 0.1063 0.2836 0.1129 -0.4767 0.8495 0.3961 0.7601 -2.9589 -0.5708 -0.5209 0.3499 0.2615 0.4435 -0.0532 0.2098 -0.5464 0.0870 0.1134 1.1271 0.0040 0.3522 -3.0044 -0.2815 0.2068 -3.4045 0.2251 -0.6642 0.2384 -0.0378 -3.6046 0.1714 -0.5298 0.6310 0.5101 0.4932 0.1028 -0.3766 0.0311 -0.0646 -0.6143 0.7933 -0.3307 -0.8020 -0.6286 0.4417 0.9769 0.0813 0.7691 -3.6070 -1.0224 -0.0522 0.3666 0.2904 0.6114 -0.4474 -0.1869 0.3446 -0.1868 0.0505 0.1554 1.4766 0.6060 0.5464 -0.3291 -0.1139 -2.2956 -0.1521 -0.5835 -0.7139 -0.1287 -0.5976 0.5590 -4.2967 0.1405 0.5940 0.2352 0.4104 -0.0923 0.5686 0.1761 0.0571 -0.4308 0.6374 -0.0536 0.6444 -3.7509 -0.7190 0.0952 0.3271 2.4380 -0.5676 -0.0998 -0.0594 0.6290 0.6867 0.6267 -0.1634 0.4946 -0.3169 -0.4231 -0.4997 -0.5439 -0.2323 -0.5010 0.4881 0.6053 -2.7157 0.0812 0.7588 -1.5277 -0.5236 0.5876 0.0798 0.8502 -0.7428 0.3067 0.9828 0.8961 -0.5242 0.3533 0.2727 0.9835 1.1503 -0.4042 2-methylserine 1.0872 -1.0558 0.4876 0.1536 1.0043 -0.8304 0.9793 -0.0777 -2.4560 -0.5265 0.5852 -1.0360 0.1115 0.1051 -0.3588 -0.4133 -0.5234 -0.1194 0.8810 0.1895 -4.2193 -1.4045 0.8959 0.5291 0.6770 0.8279 -0.3336 0.0626 0.8210 -0.3009 0.4495 0.7775 1.3930 -2.9637 -0.5973 -0.0427 0.0213 1.1141 -0.1562 -0.9941 0.1310 2.2360 1.3841 -1.5800 1.3967 0.0279 1.4501 0.4888 -0.3423 0.8677 -0.0010 -0.5719 -0.3038 0.8937 -0.2484 -0.3428 -0.0328 -0.4339 0.2947 -0.9494 1.1003 -0.5138 -1.0265 0.6597 -0.2975 -1.0794 1.3443 -0.0940 0.6217 -0.4333 -2.6778 1.0744 -0.5210 0.1531 0.4824 -0.8948 -0.2947 -0.4570 0.4111 0.8925 0.3954 -0.3206 -0.2438 -0.1424 -0.1441 0.4132 0.9369 -0.3390 0.7314 1.2330 -1.0609 -0.7106 0.5045 -1.4079 -0.4815 -0.7545 1.5307 -0.2850 0.2033 -1.5998 1.0554 -0.8067 0.8304 0.4948 0.3815 -0.4749 1.4437 -0.0619 -0.8666 0.0632 -0.7157 0.6493 0.5275 0.1860 0.8182 1.3101 2.5368 1.1334 -0.1108 -0.1002 0.8393 0.0932 0.2266 0.1336 -0.3388 0.3392 0.3384 -0.0385 -0.1755 -1.1085 0.4414 -1.6535 1.7901 -0.0007 -0.6234 -0.3809 0.2299 -0.0130 -0.2824 2.0438 1.3574 -0.8007 0.4577 -1.2209 0.8636 -1.0969 -0.1876 0.6026 0.4849 0.0205 0.6868 -0.1064 -4.3196 -1.1117 -1.2120 0.3116 0.7507 0.3784 -0.4523 1.7790 -2.7492 0.7324 1.0911 -0.0590 -0.8228 -0.8780 -0.3135 0.1282 -0.2013 -0.1210 -0.8622 -0.9952 0.8471 -1.1336 -0.9436 0.6246 0.8591 0.3307 1.6299 0.3574 0.3935 -0.7758 0.5307 1.1481 0.4631 0.6754 1.0900 0.0388 -0.7549 1.3970 -0.8301 0.5864 -0.2323 0.6066 0.7461 0.7547 0.2723 -0.7962 -0.2259 -1.4903 0.0639 -1.0168 -3.6050 0.9070 1.1832 1.2390 0.2592 1.0116 -0.5134 1.4530 -0.2815 0.7158 0.3361 0.8211 -0.9940 0.9981 -0.0759 -0.2419 -0.1230 -0.4590 -0.6443 -0.7534 -0.2218 -1.3475 0.6107 0.0591 -0.7564 -1.2662 -0.5315 0.5303 -0.7239 0.0849 0.4644 -1.9127 0.1542 1.4654 0.9146 2.6417 -0.6108 -0.2113 -0.2312 0.1599 0.3495 -0.2242 -0.0422 -1.1477 0.6411 -1.5057 -1.1647 -0.6810 0.0279 -1.0383 -0.2901 0.5392 0.6463 0.6948 0.1626 3.1091 -0.5824 0.2312 -0.3827 1.9631 0.5156 -0.3489 1.4510 0.6403 -2.4374 -0.5004 0.0593 1.2550 -0.5561 -2.1836 -0.8167 -0.1960 0.2350 0.0915 -0.8709 0.5711 1.1718 0.5663 0.2070 0.6795 0.1390 -0.1685 -0.4772 2.4763 0.0457 -1.1379 0.1939 -0.4173 -0.1939 0.0997 -1.2679 -0.9941 0.3582 -0.5961 -0.5669 0.3636 -0.3807 -0.4480 -0.6239 0.2028 0.6379 -0.2885 1.7105 1.2350 0.2164 1.5013 0.9907 1.1553 -1.6446 -0.1914 -2.8647 0.1845 -0.8384 -0.3645 0.9156 -0.5461 -0.1881 0.2864 0.8916 -0.8110 1.1798 -0.1916 1.0427 -1.0539 -4.6344 0.2700 -2.4672 -1.3092 -1.0396 0.7241 -0.4073 0.4796 -0.2425 0.2923 -0.0704 2.1248 -0.5749 -0.0076 1.2354 -0.7482 0.3039 0.6779 -0.0119 -0.1724 2.7190 0.9555 1.3026 -1.0424 0.1116 1.1701 -0.2857 -0.2588 -0.6094 -0.3387 -0.7740 0.0195 0.8160 -0.3111 0.8231 0.2701 -0.4455 0.0369 -0.2724 0.7773 -0.4492 -1.0864 -0.2818 0.9249 -0.2024 -0.0869 1.2309 0.0956 0.2386 0.3637 -1.1979 0.2901 0.7798 -0.2769 -0.2971 -0.6498 -1.6846 -0.0653 0.2782 -0.6120 -1.0326 -0.2714 -0.1303 -1.2966 -0.5791 2.4657 0.2945 1.2103 1.0702 -0.4443 -0.3140 0.7544 -0.2484 0.0446 1.4476 -0.2943 -0.4694 -1.5107 -0.7283 -0.6306 0.0657 0.9585 -1.3214 0.1266 2-myristoylglycerol (14:0) 0.2947 0.9571 -1.4973 0.5904 0.3476 -1.5263 0.5220 -1.5651 0.4141 0.3788 -1.3684 0.4368 0.8395 -0.1997 -0.1424 0.7563 -1.6060 -1.4456 -1.4304 0.9222 0.6039 0.8715 -1.2197 0.8085 -1.4407 0.0417 -1.5852 1.1814 0.6127 -1.4694 0.7245 1.1726 1.0365 0.7615 -1.6856 -1.4732 0.9557 0.3805 0.4887 0.8473 0.2178 0.7838 0.8319 0.2331 1.1968 0.0448 0.4298 -1.4418 -1.4460 0.6174 0.2329 -1.6146 -1.4108 1.0048 0.3331 -1.5701 0.9016 1.1120 -1.4977 -1.5420 0.3525 0.7555 0.4976 -1.3929 1.2377 0.5734 -0.0393 -1.6589 0.2994 0.4207 0.2335 0.3576 0.3574 0.6357 0.2182 0.7364 0.3140 0.8469 -1.3437 -1.4964 -1.4896 -1.4132 0.8388 0.2376 -1.3957 0.2926 -1.3558 0.2835 0.6267 -1.2617 -1.7060 0.7229 1.0119 0.7108 0.7956 -1.4074 0.7419 0.5425 0.9491 -1.5425 -1.3397 -1.6630 0.8196 -1.6231 0.3594 0.5242 -1.5061 0.8840 0.4885 1.0948 0.5288 -1.5781 -1.3471 -1.4690 0.8525 0.2769 -1.3343 -1.4178 0.7413 0.2795 -1.3775 1.0482 0.2086 1.6030 0.6421 -1.5201 0.0458 0.6155 0.5902 1.0339 0.9637 0.7136 0.7474 -0.4299 0.6139 1.0822 1.1234 -1.2379 0.4623 0.6906 0.9220 0.6390 0.6336 0.5337 0.2344 -0.6772 -0.6775 -1.5041 -1.3954 -1.3594 1.1829 -1.3282 0.8045 0.7931 0.6840 0.8563 -1.4486 0.9742 0.4018 -1.1681 0.6769 -1.6309 -1.3532 0.9431 0.5284 -0.0404 0.6235 0.6326 0.5949 -0.0655 -1.5964 0.0685 0.8150 -1.3243 0.6154 1.0100 -1.3178 -1.3337 1.0835 -1.3048 -0.2299 -1.6609 0.6655 0.1684 0.7714 -1.6345 -1.4881 1.0579 0.7158 -1.3896 0.0604 0.3168 0.7942 0.3764 0.5239 0.4736 -1.4189 -1.6448 0.9445 0.4620 0.2025 -0.3268 0.9222 -1.4343 0.7708 -0.1366 0.9387 1.1693 0.9897 -1.4507 -1.4371 0.3950 0.6503 -1.5139 0.8658 -1.5090 -1.6489 -1.6307 -1.6711 0.9264 0.9473 -1.5522 0.9740 -1.6550 0.2934 0.6199 0.3570 -1.6682 0.3597 0.8439 -1.5112 0.7765 0.5798 -1.5452 0.2889 -1.6216 -0.0832 1.1408 0.7125 0.2917 -1.5150 0.8606 0.7335 0.2317 -1.5601 0.6616 0.8830 0.1346 0.3685 -1.5432 -1.5345 -1.5796 0.8081 0.7381 -1.5391 0.4155 0.7243 0.9134 0.5435 0.4816 0.1625 0.7963 0.7462 -1.6733 0.4612 -1.2638 0.2802 0.6407 -1.4481 0.7979 1.0259 0.6754 1.1727 0.9566 0.5489 0.6331 -1.5258 0.7190 1.1116 0.7514 0.6878 0.5797 -1.6266 -0.1965 -1.6833 0.6419 -1.5648 0.6361 1.0952 0.7577 0.3656 0.6128 -1.5475 0.9630 0.7954 -1.7270 -0.0550 0.8298 1.1853 0.6968 -0.1188 0.6357 0.9746 -0.0735 -1.4896 0.6391 0.7115 0.6152 1.3121 0.2670 -1.4517 0.8233 0.8987 0.6250 0.7075 0.7667 0.6804 0.3714 0.7486 -1.5753 -1.4838 0.6133 0.3209 0.9435 -1.5368 0.0729 -1.5140 0.8129 0.6609 1.0632 0.7686 -1.4263 0.8074 -1.3666 0.6770 0.5733 -1.5579 0.6702 0.2757 0.1754 0.8890 -0.0405 0.7744 -1.6001 1.4069 0.1773 0.4597 -1.6006 -1.5625 0.4330 -1.3492 1.1473 0.8664 -1.7057 0.5230 0.6149 -1.6573 -0.4289 1.1175 0.7875 0.9143 0.8952 -1.5067 0.3695 0.4059 0.4941 0.5250 -1.6817 0.6943 0.4259 -1.4148 0.6209 0.1127 -0.0157 0.3420 0.9605 0.5598 -0.1415 -0.0731 -0.0675 -1.5077 0.4240 0.0450 -1.7319 0.9227 0.5037 0.9788 0.8845 0.4612 0.6575 0.4278 -1.4807 -1.2179 0.6599 0.6340 0.6400 0.9354 0.8342 0.0253 -1.5780 -1.7177 0.5833 0.6940 0.7761 -1.6839 0.7812 0.6849 1.0091 1.2061 0.4233 2-naphthol sulfate 2.0051 1.2268 0.6326 0.4149 1.2138 0.8261 -1.1915 -1.6076 0.3848 1.2052 1.4816 -0.9397 0.1609 0.3743 0.2753 0.1016 1.5977 1.5917 -1.4525 -1.2965 -0.2579 -1.1345 -0.0394 0.5543 -1.4607 -0.6631 -1.6467 -1.3960 1.6710 -1.4822 -1.6606 -1.3517 -1.1588 0.8852 1.3291 -0.4854 -1.4404 1.4317 -1.3861 -0.2306 -0.2244 -1.0882 -0.5083 -0.4965 -0.3727 -0.1015 0.0956 0.3131 -0.2143 -0.3282 0.2120 -0.3063 0.2116 0.5567 1.0625 -1.6243 0.4063 0.6586 0.6309 -0.0193 -0.2667 -1.6289 -0.1179 0.1215 -0.1660 0.7418 0.7418 1.6193 -1.6468 -0.1098 -0.4408 -0.5106 0.0849 1.7753 -0.2204 0.3750 0.7933 0.3716 0.8865 -0.0686 -0.6190 0.8320 -1.4804 0.7693 0.0040 1.0239 1.0985 -0.4424 -1.0055 -1.2338 -0.3280 -0.0662 1.1187 -0.2068 -0.2761 1.6258 0.3712 -1.4370 0.8366 -1.5957 0.7981 0.8470 0.5034 -0.3876 -1.3885 0.5581 0.0254 -0.4300 0.4144 1.9853 1.6291 -0.6540 -0.7067 -0.8879 -1.4869 -0.4542 1.2253 -0.5190 -1.5701 -1.6934 0.4598 -1.4357 -0.3637 0.0015 0.5031 -1.5498 -0.5444 0.1291 -0.6257 0.1400 -1.6039 1.7030 0.1297 -0.0456 0.3756 1.6416 0.0190 -1.2007 0.8536 -1.0927 1.0479 0.3806 -1.4435 -1.5118 0.5117 0.0283 0.0604 0.4676 -1.3986 0.6034 0.1041 -1.3173 0.0840 1.1265 0.7015 -1.0818 -0.3228 0.0310 -0.4677 0.3601 0.4298 0.3050 0.9220 -1.4828 0.8340 -1.6567 -1.6124 1.1731 -0.3586 0.9515 0.1224 -1.5061 0.4350 0.3580 -0.2908 0.4466 0.9019 -1.3133 -0.2800 1.8737 0.4186 0.1192 -1.5386 -0.3357 0.3596 1.4439 -0.1679 -0.4902 -0.4395 0.8578 0.7324 1.6216 0.6457 0.4892 -1.3461 1.3232 0.0838 -0.1132 -0.0466 1.1246 -0.3839 -1.3342 0.3972 0.2361 -1.5490 -0.1129 1.3853 0.1953 0.0199 1.2407 -0.4869 3.4985 -0.2253 0.1437 1.0287 -0.4596 -1.7026 0.2081 0.2348 0.8214 -1.5434 0.3904 0.3852 -1.7314 0.0559 -1.3449 0.5511 -1.7469 -1.5922 0.2010 0.5355 0.9359 -1.4610 -1.5999 -1.1126 -0.2379 0.4974 1.6805 -0.5976 -0.3102 0.8800 0.2700 1.6063 0.5990 0.4103 0.5586 -0.1092 0.7318 -0.4983 0.0396 -0.5524 0.3934 -1.6544 -0.2857 -0.9667 0.7404 -0.6212 0.7359 -1.4780 -1.0534 1.0571 0.4856 0.5356 -1.1867 1.4485 0.0450 0.7083 -1.6996 0.2078 0.7121 0.1066 0.6480 0.9824 -0.0350 0.9096 -1.5726 0.6971 1.5455 -1.6494 0.8792 -1.6849 -0.9388 0.4728 1.5243 0.6107 1.0121 1.6916 -0.3772 -0.0355 0.6907 -1.6938 1.2417 0.0314 -0.9161 0.1263 -1.8138 -1.5951 0.6109 -1.7172 -1.6285 -1.4896 0.9669 0.6639 -0.3847 -1.5292 1.8383 0.6568 1.1060 0.3164 0.8319 0.3275 0.8639 -0.7121 1.1658 1.5967 -1.5421 0.9004 -1.5358 0.4606 0.2162 0.3018 -1.6295 0.8298 -1.3069 -0.4218 -0.0164 -0.9964 -0.4588 -1.5853 0.8029 0.4952 0.0363 -0.6470 0.1273 0.7390 -1.7645 -0.3976 2.0567 -0.4317 -0.4053 -0.3262 0.9338 -0.3839 0.2373 0.2953 0.6881 0.3012 0.4364 -1.6092 1.0079 0.7669 0.4424 1.5620 1.1517 1.2352 0.7109 -1.1374 0.9985 -1.8161 -1.7058 0.6477 0.1489 0.3400 1.4449 -0.1485 -0.3300 1.0044 -0.2962 -0.4691 -1.7258 0.6432 0.6164 0.8905 -1.4961 0.5930 1.7444 1.2940 1.6627 0.5519 0.1888 -0.3569 0.0026 -0.8282 -0.7687 1.6737 1.2174 1.0326 0.9070 -1.7984 -1.7955 0.6562 0.5589 -0.2808 -1.6250 -0.3103 -0.6543 0.3341 -0.1621 -1.1968 -0.4577 0.0917 -1.6315 0.1975 -1.6728 0.5616 1.4218 1.1275 1.5792 -0.0386 0.2552 2-oleoylglycerol (18:1) -0.0404 -0.6717 -2.8545 1.1147 -0.2628 -2.8887 -0.0010 -2.9298 -0.5974 -2.5496 -0.0401 -0.7588 0.6027 0.4484 -2.9786 -0.6931 -2.9732 -0.2177 0.4137 -0.0207 0.3310 0.0126 0.6709 -0.8998 0.6821 -2.7851 -2.9398 0.7279 -0.3669 0.1386 0.1874 0.2136 0.2678 0.3588 -0.5300 -2.8185 -0.1747 0.3895 -0.1044 -0.1644 -0.4536 0.3397 0.0930 0.0461 0.9662 0.0779 -0.1335 0.5098 -0.4939 -0.3065 0.4110 0.5897 0.3139 0.0644 -0.0688 -0.1791 -2.8123 -2.5395 0.3252 -0.1465 0.6083 -0.4595 0.3129 0.2161 0.4394 0.0403 0.0555 0.5324 0.2485 -0.5531 -0.0800 0.7130 0.7592 0.8716 -2.7986 -0.1537 0.1975 -0.1578 0.5681 0.7270 -1.0992 0.7735 0.3448 0.3311 -0.4795 -0.1252 0.3319 -0.1085 0.4066 0.6004 0.0787 -0.6178 0.8445 -1.0984 -1.1407 0.0706 0.2555 0.9313 -0.4494 -0.4903 -2.9330 0.2570 0.1160 0.5505 0.8125 -2.7431 -0.0712 0.3699 0.4064 0.2895 -0.0644 0.8132 0.6694 0.3127 0.0744 0.4693 -0.8706 -0.0593 0.6397 0.0371 -0.4169 0.7192 0.5723 3.1018 -0.0436 1.3830 0.6064 -0.0485 -0.5207 0.3107 1.5079 -0.2512 1.1187 0.3905 -0.2410 -0.5891 1.2447 0.7631 -0.5432 -2.4451 0.0186 -0.2766 1.1929 -0.0388 1.0417 -0.6620 -2.7889 0.8357 1.4847 0.7824 0.5736 0.7207 -0.0973 0.3199 0.1411 0.8257 -2.7846 1.1725 0.0887 -0.6972 -2.7717 1.0288 0.0899 0.9127 -0.1523 0.2112 -2.9207 -1.3059 0.4980 0.4340 -0.1642 0.1781 0.1581 -0.9001 0.7364 -0.7331 1.0847 -0.0574 0.7390 0.0831 -2.7461 0.9032 0.7172 0.2153 -2.6570 -0.7892 -0.4575 1.3620 -0.7274 0.0609 0.2445 0.6483 -0.7633 -2.7019 0.8815 0.7629 0.5473 0.2306 0.0894 -0.5028 -0.0882 -0.0159 -0.3246 0.6890 1.2022 0.0501 1.4909 0.9672 1.5260 -0.8080 0.0922 0.7116 0.3455 -0.3068 -0.0517 -0.0521 0.1585 1.3709 0.3367 0.3207 0.7121 -0.1180 0.3223 -0.9083 0.7001 -0.2033 -0.7893 -0.4767 -2.6095 0.5331 0.2953 1.1448 -0.0303 -0.2472 0.7999 0.7336 0.2925 2.1701 -1.1466 0.3819 0.7840 -0.0888 0.3428 -3.0667 0.0023 -0.6093 0.8621 -0.4853 0.3407 1.2008 0.0070 -0.6721 -0.2231 0.0474 0.6061 0.2857 0.2580 0.7631 1.2557 0.4096 -0.0850 0.6360 -0.2289 -0.0391 0.4618 0.3357 -0.0226 0.4393 0.4072 0.4443 0.5630 -0.7818 1.0019 0.7721 0.2453 0.7329 0.4047 0.0907 1.0540 0.6286 0.1743 0.5221 0.1525 -0.5224 -1.0825 -0.0722 0.4793 -1.1754 0.5970 -0.1161 0.8222 -0.1971 -0.5994 0.6701 0.3027 -0.0636 -0.2613 1.0015 1.5544 -0.6021 0.0414 -0.6488 -0.9358 0.9502 0.2781 0.4574 -0.5954 0.2267 0.9094 0.5022 0.3747 0.8303 -0.5676 0.7512 0.3164 0.2023 1.0224 0.2885 0.1548 0.8472 0.3269 -2.9556 -0.5066 0.4644 -0.3823 0.0406 0.3733 0.5487 -0.1501 -0.0433 -2.7529 -0.1182 -0.0134 0.7326 0.0106 0.8453 -0.0275 0.8610 -0.3354 0.5885 1.1773 -1.0516 -0.8001 0.9339 1.7896 1.1478 0.3348 -0.2052 0.6326 0.3983 0.1871 -0.2222 0.5007 0.6600 -0.9125 -0.4410 0.1632 0.7524 1.1841 0.6422 0.8728 0.4993 -1.0647 0.6995 1.1242 0.2366 0.7780 -0.0557 0.5780 1.2294 -2.7477 0.2901 0.2474 0.1729 -0.7707 0.4634 0.7450 -0.3717 -2.9888 -0.2869 0.7857 0.0438 -3.1250 0.7781 0.6141 0.4045 0.3197 -0.0553 1.0497 -0.6975 0.0495 -0.6912 0.4788 -0.4447 0.9410 0.0701 0.5625 0.1967 -0.1730 -2.9196 0.1641 -2.9321 0.1755 0.7452 1.3768 -0.8587 -1.1717 0.8435 0.7242 0.1136 2^-O-methylcytidine 0.0712 0.1532 0.3371 0.5565 0.0471 -3.3709 0.7699 -3.4314 -0.4837 -2.8186 -3.1459 -0.5526 0.9289 1.0469 -0.3389 0.5262 -0.5387 0.5273 0.2802 1.1982 0.4930 0.3178 -0.1625 -0.0665 0.6431 -0.1149 -0.4071 -0.2947 0.6466 -0.3086 -3.4374 0.9595 1.0207 0.6826 -0.5254 -1.3215 -0.8401 0.8642 0.5042 0.0351 0.1009 1.1283 1.4880 0.2876 0.3681 0.2928 -0.6242 1.2476 -0.6408 0.5378 0.3379 -0.1070 0.6685 0.3504 -2.8243 -0.4004 -0.4142 0.5992 0.8435 -0.7026 0.8093 0.0603 -0.4124 -1.0476 0.2642 0.6652 -0.1034 0.5429 -0.7962 -0.3674 0.2155 0.2977 0.4246 0.0427 0.4223 -1.2006 1.2787 0.5600 0.5484 0.9035 -0.1518 0.1408 0.8914 1.0307 -0.5389 0.7613 0.6061 -0.6326 0.8497 0.4294 -0.4882 -0.5270 -0.0726 0.0116 -0.5953 0.6084 0.7931 0.9431 0.2985 -0.0084 0.4140 0.2757 1.3894 0.8714 0.4674 -0.2024 -0.3339 0.0209 -0.7872 -0.1128 1.2140 -3.3898 -0.6452 0.7027 0.2253 0.4304 -0.9363 0.4185 0.5501 -0.3745 -0.3092 -2.2785 0.4746 0.8060 -1.9300 1.0922 0.6828 -0.5990 0.6226 -0.4988 0.1963 -0.6038 0.5799 0.1459 -0.3842 -0.3167 -0.0245 0.4848 -0.0938 1.5464 0.6800 -0.1082 0.4583 -0.9605 0.8772 -0.6667 -0.3529 0.1943 0.3782 -0.1799 1.3148 0.4757 0.0937 -0.0597 -0.1276 0.0316 -0.5722 -0.1573 -0.2968 -0.2467 -3.1461 0.7154 -0.6458 1.0006 -1.1137 -0.6392 0.1729 -0.6658 1.1382 0.3543 -3.4412 0.7946 0.7623 -0.6538 0.4304 0.9786 1.5257 1.1773 0.9172 0.4365 -0.7737 -0.2273 1.9638 -1.4039 0.9316 -0.4811 -1.2550 0.2814 0.3203 0.3096 1.3042 -1.9138 -0.4606 -3.0625 1.0588 0.8198 0.2245 0.7077 -0.0355 0.1735 -0.3771 0.6724 0.8688 0.0347 0.4833 0.0189 0.2454 1.3274 -0.0331 0.3010 -0.0119 0.4476 -0.2063 -0.9105 -0.3988 0.8152 -0.4291 -0.4946 -0.3171 -0.0048 -0.9773 -0.2037 -3.0017 -1.4829 0.4251 -0.5058 0.0128 -0.4806 -0.1217 1.5783 -0.5033 0.8388 0.3453 0.1632 0.7342 1.0575 -0.3438 0.3975 0.0863 0.0309 -0.0837 -3.6112 0.6764 -0.6020 -0.1946 -0.6196 0.2439 -1.7523 1.6154 1.0479 0.3804 -0.0978 0.5835 0.8014 1.0177 1.2744 -0.7849 0.4588 0.9324 -0.0369 -0.1405 1.6347 -0.1363 -0.1585 -0.3337 1.0284 -0.6275 0.7714 -0.2368 0.3635 1.1787 0.0291 0.4921 -0.9949 1.3109 0.8923 -1.3204 -0.0453 -0.0875 0.1100 -0.5298 0.6172 -0.3543 -0.0467 0.2456 -3.2123 0.8024 -0.0455 -0.2455 -0.1876 1.1282 0.0995 -1.0248 -0.4238 1.1658 0.7631 0.2650 0.8928 -0.4493 0.0533 -1.0801 -0.6412 -0.0478 0.9351 0.8414 -0.7410 -0.2985 1.0242 1.0812 0.7031 0.6508 0.1755 -0.0514 1.0049 -0.1339 0.5337 0.4168 1.3140 0.5050 1.0408 0.1231 -2.2078 0.3064 0.1454 1.8304 -2.0592 0.4146 0.8240 -0.2778 -0.4851 -0.2059 1.2548 0.5041 0.7842 -0.2180 0.2522 0.4914 1.1274 0.4692 0.7689 1.2106 -0.4204 -0.8049 0.0832 1.0214 1.1180 -0.5877 0.1880 1.2705 -1.4017 1.7487 0.4040 -1.3134 0.7657 -1.4018 -0.9295 -0.2417 0.5449 0.8069 -0.1296 -0.2473 -0.0398 0.3636 0.6910 -0.0948 0.6126 0.6606 -0.3871 -0.8348 0.8193 -0.8094 0.0153 1.1548 -3.2940 -0.2370 -3.2588 -0.2682 -0.3648 -3.5450 0.2028 0.8457 0.6483 -0.7382 0.8531 0.7164 -0.3243 -1.7440 -0.6874 -0.2362 -0.7015 -0.0862 1.0819 -2.7605 0.3828 -0.0305 -0.2045 -0.0809 0.9394 0.8757 0.0819 -0.6987 -3.4138 -0.3434 -0.4810 0.9957 0.6898 -0.8852 -0.3020 -0.1943 -2.5065 2^-O-methyluridine 1.4154 1.0020 -0.4140 0.2267 -0.4194 1.9132 0.2051 0.8492 0.4672 2.2761 1.6014 0.1624 -1.0569 0.2491 -1.5159 -1.2986 0.6161 0.9003 -1.0830 -0.7997 -0.8862 -0.0480 0.1680 -0.1493 -0.1469 0.4492 0.5302 -0.9757 0.9416 0.5584 0.8986 -0.8973 -0.5294 0.4828 1.4020 1.8908 0.4000 1.0346 0.6683 0.2252 0.5383 0.3070 0.3148 0.4591 -0.8990 0.6009 0.1935 0.3345 -1.1120 1.3877 0.7683 0.9242 -1.0259 1.7189 -0.6458 0.1581 -1.1701 -0.6360 -1.2332 0.3033 -0.9039 -1.4203 -1.3797 2.8195 -1.1000 0.6096 1.2527 0.1953 0.3127 0.4609 0.3592 -0.2445 0.0873 -1.4584 0.0668 -1.4208 -0.9047 0.3971 -0.8817 0.1358 -1.2372 -1.0438 0.0224 0.1943 1.6252 -1.3447 -0.8998 0.6817 0.3544 0.8914 -0.0668 0.6424 -0.4550 0.1792 1.3242 0.6653 1.4814 0.8268 -1.0406 0.6799 0.6099 0.2307 0.2381 -1.5353 -0.9741 0.2225 1.8767 0.4392 0.4658 0.5393 0.9379 1.1611 -0.8860 1.4785 1.0131 0.4882 -0.8650 0.7604 -0.1237 -0.3900 1.3133 -1.0629 -1.2239 0.4393 -0.3159 -1.2757 -1.3893 -1.2397 0.6564 0.0962 -1.3757 0.9888 -0.6855 -1.3858 -0.1801 0.6934 0.5212 0.4283 -1.2016 -0.4149 1.6662 -1.2623 -1.0657 0.5778 1.0796 0.2261 -1.1397 1.0908 -0.0646 -0.9247 -0.8075 -0.8358 0.4029 0.1727 -1.2397 0.8580 0.3918 -0.8536 0.4978 -0.4887 1.5349 0.3816 1.4342 -1.1499 2.3496 -1.4644 0.4848 0.8412 0.3175 1.0643 0.6602 0.3927 -1.6470 1.7308 0.7550 -0.7103 1.6159 -0.8364 0.3322 -0.7992 -1.0629 -1.6198 0.5328 0.2345 -0.8772 1.2894 1.5023 -1.0349 0.7878 0.1890 1.6721 2.5693 0.9202 2.0417 0.4277 0.5948 0.3777 -1.5778 -0.4259 0.9439 -1.3944 -0.8565 0.6238 -1.1166 -1.2563 -0.6816 0.0626 -0.0616 0.1892 0.4473 0.7253 -1.1817 0.0904 -1.2760 -1.4670 0.8471 1.0762 0.7212 -1.6336 -1.4305 0.3143 -1.3576 0.2237 0.6884 -0.4418 0.1978 -0.3703 -1.6352 -1.3459 -1.1302 -0.2375 0.6865 0.0891 1.0109 -1.5025 -1.5241 1.1166 -1.0440 0.1632 -0.9968 0.7725 -0.0227 1.4056 -1.6874 -0.5927 1.6311 -0.2384 0.0082 0.8351 0.0768 -1.3185 -0.0418 -0.6533 0.6093 -0.0116 -1.1006 -1.3134 0.3682 -1.1399 -0.4812 0.5119 1.0878 0.3921 0.7521 -1.3628 -0.6935 -1.4173 0.3366 0.0346 0.3724 -1.3840 -1.0647 0.8067 -0.8634 -0.1488 0.1706 -1.3089 -1.3126 -1.4679 0.3381 -1.5262 0.4123 0.0975 0.2008 0.3114 0.7972 0.8791 0.8498 0.2314 -1.6260 -1.5409 0.6485 -0.2788 -1.5185 0.0062 -1.1187 -1.3596 -0.3322 -0.0492 0.0664 1.9473 0.5355 1.1641 -1.4393 1.0458 -1.6100 0.8824 -0.8453 0.3119 -0.1229 0.7861 -0.3951 0.1484 0.1150 -1.6472 1.4097 -1.1531 -1.2430 -1.0953 1.7005 0.1411 1.6835 0.7589 -0.4010 -1.3373 0.1719 0.6293 0.0485 -0.1159 -1.5016 0.4195 1.2031 -1.1995 0.9497 0.1040 0.3440 1.6387 0.3561 0.1379 -0.9219 1.4101 -0.7454 0.2929 0.1357 -0.1564 -1.1082 -0.9794 0.9753 0.4895 -0.3477 -0.8872 -0.3117 0.8046 0.8511 1.6506 0.1946 -1.5855 -1.4291 0.2965 0.5683 -0.1720 -1.3555 0.5374 -0.2629 -1.3430 -0.3461 -0.2531 0.3425 -1.5846 -0.2797 1.4506 -1.4010 0.7110 2.2892 0.2843 1.7431 -0.2669 0.5968 1.8381 0.7952 0.8395 0.5677 -1.8103 -1.7824 0.8193 -1.8481 -1.8471 -0.0278 -1.7460 -0.6603 -0.9013 0.2989 1.5952 0.7250 0.3142 -0.4725 -0.5201 -1.3801 1.2499 -1.4431 0.5971 2.4542 1.4142 -1.5075 0.1727 1.2371 -0.2986 -1.3513 1.3127 0.3960 2-oxoarginine* -0.7575 0.1608 -0.1629 -1.1006 1.0134 0.0777 1.0262 -0.0815 0.8995 -0.8949 0.0392 1.2443 -0.9868 1.3718 0.0729 -1.2197 -1.2363 -0.7413 -0.2918 -0.7247 -1.6694 -0.7637 -0.9573 0.0241 -1.0332 -0.3788 -1.5594 -0.8226 -0.5030 -1.2375 -1.9687 -0.9091 0.3446 -0.4115 0.2805 -0.6937 -0.6323 2.4151 -1.7043 -1.0047 -0.7076 -0.0723 1.7202 -0.2488 -0.1372 -0.5972 0.4296 -0.8144 -1.1642 1.3103 0.7776 0.6219 -0.3146 -0.7974 -1.2533 -1.6338 -0.0926 -1.4288 -0.5027 -1.5986 -0.3825 1.0403 -0.6060 0.9158 1.8774 0.2836 0.0640 0.0593 -0.7392 -1.5321 -0.3476 -2.9374 -0.0319 0.6265 0.2723 0.7541 -0.0427 1.2745 -0.4064 1.5735 0.1959 1.3103 1.2296 -1.3335 1.4633 1.1921 0.2707 -0.6331 0.0588 -0.5226 -0.5746 -0.4988 0.5894 1.0944 -0.0733 -0.0337 1.7387 -0.7984 0.2999 -0.5854 0.1876 0.5968 -0.9156 -0.3331 0.9604 1.4747 -0.8814 1.3336 -1.8248 0.8577 -0.6311 -0.3189 -0.2734 -0.8392 1.4243 -0.5841 0.5652 0.6810 -1.0473 0.1630 0.8400 0.0729 -1.1959 0.7211 0.1259 0.1959 0.2052 -0.3345 0.6473 0.7824 0.9483 0.9566 0.8513 0.7817 1.4755 1.6208 -0.1811 -1.2558 0.3641 -0.5246 -2.3592 -0.5120 -0.3893 -0.8769 -1.5627 0.7065 -0.4690 0.2097 -1.2618 -0.4299 0.7154 -2.0324 0.5673 -1.2315 -0.8843 -0.5570 -0.5534 -0.5048 0.1805 -1.0771 1.4158 -0.7301 2.0038 -2.9005 -0.1054 0.3332 -0.0933 1.2812 -0.6260 -1.6004 0.3512 -0.0862 0.5015 0.5516 -1.0827 -0.9991 -0.0590 -0.6353 0.4876 -1.5179 1.0247 0.5508 0.2225 0.3067 0.3394 -2.0319 1.1360 -0.5962 -1.4693 2.4496 0.5593 0.5566 0.4244 -0.9945 0.2854 -1.5504 0.0769 0.0472 0.3014 -1.1959 0.3454 0.5025 -0.3626 -0.3024 0.8773 -0.4244 0.1309 -0.9334 -0.1686 0.7813 -1.0501 0.9923 1.0082 0.6166 0.7588 0.1953 0.4330 1.2257 -2.5824 0.2497 -1.3088 0.2135 0.2164 -0.1456 -0.5336 0.9229 0.0299 1.0264 0.7208 0.9099 0.0167 1.2932 1.3617 0.3718 0.1210 1.8262 0.6127 -0.6756 0.2777 0.2004 0.4851 0.0069 0.8460 0.3252 0.0387 -0.6149 1.0814 0.5302 0.5903 0.6806 -1.5353 -0.6499 -1.6327 1.0399 -1.1522 1.3466 1.0093 2.1469 -1.6762 -3.4225 -0.6869 0.2590 0.6134 2.2144 -1.0423 -1.3473 1.3727 0.7447 0.6303 -0.9063 0.9150 0.9449 0.5530 1.8753 0.9902 0.3896 0.3776 0.0971 -0.4367 -1.8078 1.4389 -0.1289 -0.3869 0.9894 0.6015 1.0121 -0.5397 -0.2314 2.1593 0.2562 1.1714 0.4622 -0.0060 0.8120 0.4321 0.3155 1.4601 0.1729 1.4668 -0.8258 -0.4931 0.0404 -1.0723 -1.1871 -0.3632 1.3015 1.0053 -0.6141 -1.2830 0.6830 -1.7247 0.1708 0.8646 0.2733 -0.4602 -0.4897 0.6446 1.2189 1.2250 1.5290 0.3967 -1.0361 1.6917 -1.2666 -1.0971 -0.4383 1.5809 0.3623 -1.0280 -0.9791 -0.1509 -0.1135 0.3805 0.6686 -0.3429 -0.7161 0.7669 -1.2279 1.0476 -0.4477 1.3028 2.2166 -0.2209 -0.8920 1.6481 0.3800 -2.1929 -1.3506 -0.5242 -0.2601 -1.8386 0.5877 0.0412 0.8270 0.2516 -0.0567 -2.2061 -0.8484 -0.5397 0.5517 -0.7650 0.4684 0.2803 1.5712 -0.2438 -1.3887 0.1213 1.0350 -0.5136 -1.7254 -0.7099 0.6170 -2.2144 0.0043 -0.6676 -0.5387 -0.4437 1.6193 -0.4787 0.9632 -1.8248 0.9773 -0.1033 0.9679 0.2325 1.0607 0.1528 0.2167 -0.2857 -0.3854 -0.6497 0.7734 0.4683 1.7800 -0.0495 0.0848 1.2197 1.0677 -0.2784 -0.8897 -0.9828 -1.3491 1.3793 1.6818 -0.0279 0.3908 -1.9234 0.7583 -0.7123 1.0600 2-palmitoleoylglycerol (16:1)* 1.0096 0.6382 -1.1321 0.8360 -0.6835 -1.1685 -1.2717 -1.2165 -1.1390 -0.7956 0.1088 -1.2257 -1.0418 -1.1349 -1.2797 0.8071 0.3160 -1.0647 0.8801 1.4669 1.1210 0.2303 -0.7839 0.5914 1.0298 -1.0643 -1.2398 0.4771 -0.9361 -1.0976 0.7549 1.0493 -0.7452 -1.3238 -1.3669 -1.1007 -1.0419 -0.8689 0.0582 0.5836 1.1774 -0.6881 0.1016 1.0518 1.3697 -1.2782 0.8062 0.6274 0.5061 -1.0603 0.9235 0.5553 0.5048 -0.1892 0.7487 -0.2613 -1.0961 0.3253 1.0587 -1.1885 1.0038 0.3378 0.6691 -1.0008 1.1077 1.0430 -1.1031 0.9611 -1.2352 -0.9312 -1.0959 0.2786 -0.1620 1.3542 -1.0862 0.3577 0.6894 1.5585 0.5781 -1.1294 0.2586 -1.0247 -1.0843 -1.2448 0.3630 -1.1974 0.9046 0.7392 0.1364 -0.8364 0.5435 -1.0270 0.5060 1.0650 -1.0582 0.5933 -1.0699 0.7584 -1.0207 -1.1860 0.3766 0.6595 -0.9569 0.5705 1.0348 0.9752 0.6145 -0.0379 -1.4190 -0.9904 -1.2605 -1.2302 -0.9424 -1.0966 0.5806 0.7896 0.4918 -0.4158 -1.1844 -1.3038 0.2807 1.2224 0.3282 2.5302 0.3837 0.5952 -1.2102 -1.1366 -1.1639 1.4931 0.8881 0.4192 -0.8413 0.8388 -1.1358 -1.2212 0.9805 -0.8070 0.3646 0.0916 -0.9136 -0.1347 -1.0367 -1.1161 -0.9838 0.4133 -1.0755 0.6278 0.4610 -0.9566 -0.9025 -0.9195 -0.9947 1.4318 -1.1288 0.7032 -1.0691 -0.9218 0.8891 0.5667 -1.0550 0.6680 -0.9498 -1.0925 -1.0358 0.4345 -1.2130 -1.1749 0.4954 0.7885 -1.2538 -1.1094 -0.2069 1.3153 -1.2504 -0.8411 0.7971 0.7827 0.8920 0.7283 -1.0318 0.4147 -1.1404 1.4602 -0.9333 -1.3027 0.7600 -1.0314 -0.9195 0.6167 -1.3346 -0.9459 -1.0065 -0.9649 1.0079 0.5217 0.4380 -1.3151 1.1353 -0.8443 -1.2100 -0.9197 -0.9681 -1.0482 0.4126 -0.8262 1.1559 -0.4985 1.8639 -1.0696 -1.0556 0.5175 0.7131 -1.1509 -1.2507 -0.2084 -1.3226 0.3643 -1.3487 0.5720 1.5509 0.9082 1.0647 -1.3274 0.3986 0.9810 1.1521 -1.3441 0.0973 0.9443 -1.1484 1.0617 0.6032 -1.1893 0.7008 0.8745 0.7587 0.8650 0.8500 1.2367 -1.1535 1.1777 -0.8405 0.5510 0.2932 -1.1132 0.8623 0.0831 -1.2748 0.6563 1.0389 -1.2346 1.0914 -1.1448 -0.3720 0.7246 1.2044 -1.1674 -1.0861 -1.2666 0.7687 -0.9840 0.0585 0.2563 0.9000 -0.8380 -1.2254 0.7568 0.0643 0.6277 0.5870 -1.0375 0.9125 1.5497 -0.0020 0.7218 1.2228 -1.1706 0.1765 1.5062 0.9151 0.3657 0.8767 -1.2559 0.8162 -1.0845 0.9119 0.4124 1.5811 0.9297 1.5766 0.8400 -1.1934 0.8421 1.6994 0.9798 -1.2046 0.3161 2.2377 1.3361 1.2241 -1.2299 0.6376 0.8013 -1.1200 -1.3311 -1.2174 -0.9135 1.3032 0.8775 0.5751 1.4299 0.7004 1.6836 -1.3617 -1.1528 1.5186 -1.1364 -1.0555 0.5846 0.2472 -1.2420 -1.5182 1.2196 -1.1787 -1.3975 0.1514 0.8661 -1.1787 1.4443 -1.0339 -1.0415 1.6116 -0.9691 -1.1605 1.2305 0.7564 -1.1877 -1.3022 1.7860 1.1635 0.9904 0.1277 0.8353 1.8677 1.0013 0.7287 -1.2595 0.5560 0.5503 -0.9455 -0.6205 0.8687 0.7642 -1.2166 0.4587 0.4477 0.6815 1.4637 0.2971 1.3899 1.6727 -1.1417 1.1860 1.6568 -1.2860 1.1207 0.2897 0.1060 0.5959 -0.2094 -1.2206 0.5060 -0.4454 -1.4451 -1.0048 0.8982 -1.3110 0.1753 -1.2362 0.5820 0.5021 0.0677 -1.4239 0.3504 1.3929 0.4143 0.6439 1.2813 1.4728 0.2704 -1.1074 0.8889 -1.2108 0.4660 1.0526 1.0975 -1.2028 0.3104 -1.2290 0.6702 -1.2284 0.0292 1.1669 0.6607 -1.4630 1.1530 1.0986 1.9652 0.8680 2-palmitoyl-GPC* (16:0)* -0.4195 -0.7887 -1.2940 -0.4123 0.6302 -1.4301 -1.2286 -2.5110 -0.6906 0.7393 3.0182 -0.1087 0.4490 -0.9006 -0.9188 -0.4252 -1.6248 -0.2032 0.9321 0.2930 0.3427 -0.6878 0.5936 0.1926 -0.6477 -0.2928 -0.4091 -0.1975 1.1223 0.3830 -0.2766 1.8256 -0.0031 0.2623 -1.1826 2.2344 0.0878 -1.1030 -0.5410 0.4101 0.9735 0.2823 0.1088 -0.3298 1.0896 -0.9412 0.1264 0.3446 1.2307 0.1892 0.3834 0.9434 -0.7973 -1.2469 1.0161 0.7169 0.2589 0.8399 -0.8479 0.5932 0.6445 -1.3108 0.4288 -0.8176 1.8858 0.2952 -0.3360 0.5620 0.8100 0.2179 0.9636 0.2604 0.8241 -0.0230 -0.0578 1.2899 0.0990 -0.1168 -0.6195 0.3283 0.1959 -0.4457 -1.2515 -0.4033 2.0745 -0.7162 0.3291 -0.5520 0.5877 0.3103 0.2076 1.3301 -0.1205 1.6637 -0.5985 0.2119 0.7550 -0.1209 -0.5785 0.0472 0.1851 -0.1883 0.5960 0.7765 0.4273 0.4185 2.4361 -0.7539 -0.6217 -0.6188 -1.8438 -0.4985 0.8998 1.3589 2.6926 0.9118 1.4479 -0.7679 2.7535 0.1198 1.1797 0.1599 0.5438 0.6623 0.3839 0.7251 1.1531 -1.2953 0.3065 -0.4246 0.0306 3.7530 0.7902 0.2590 -0.5931 -0.3259 -0.5575 -1.0974 1.5245 0.4347 0.6072 -0.1035 -0.5145 0.0871 1.2888 -0.2010 0.0090 -0.4426 0.0435 0.5470 0.5641 -0.1506 1.3947 -0.3070 0.6909 0.7641 0.4109 0.8538 0.9409 0.7090 -0.1197 -0.4589 0.1943 -0.1942 0.3749 -0.5411 -0.1532 -0.1192 -0.6334 -1.4937 -0.2861 0.6538 0.9747 0.3132 -0.4910 0.4201 -0.4793 0.0739 -0.3535 0.5743 -0.3914 -0.7422 -0.6323 1.1632 0.5521 -0.7054 0.3249 -0.0112 -0.4018 -0.7881 -0.3017 3.3195 1.4697 0.3289 -0.0916 1.2996 0.4494 -0.2368 1.0448 -0.6351 0.7395 0.7401 -0.5767 -0.5505 0.6933 1.2275 -0.0820 0.1366 1.0769 0.2831 -0.1056 -2.0113 -0.2637 -0.7044 -1.0445 0.4941 3.0146 1.9747 -0.2079 0.5752 1.7995 0.2135 0.5735 -0.0453 -0.1445 -1.2558 2.8022 -0.3018 0.2086 -0.7887 -0.9497 -0.5388 -0.3797 -0.1954 -1.4353 0.0698 -0.4114 -1.0499 0.5860 0.9470 -0.9391 -0.2614 2.6952 0.3591 -0.8076 0.2696 -1.8667 -1.0186 0.5133 -0.2268 0.1729 0.1870 -0.2187 -0.0321 -0.4616 -1.5900 -0.2501 -0.8189 -0.2975 -0.6185 -0.9543 -0.4473 -1.2279 1.3443 0.4514 1.3454 0.4341 -0.2897 1.0375 0.7994 -0.6519 0.1928 -0.1529 -0.4499 0.1114 0.4693 0.7806 -0.3149 -0.4277 1.1641 -0.5095 0.3724 0.4545 -1.1494 -1.8831 -0.3437 -1.7121 0.5919 2.2292 -0.2054 0.3384 0.4318 -1.0444 -0.8587 0.8868 -1.3022 0.8778 -2.0861 -0.6287 2.2341 0.3163 -1.4341 0.6836 -0.5230 -0.8355 -0.3003 2.3914 0.3010 -0.2116 0.4871 1.2536 -0.8652 -0.8322 0.2686 -0.1626 0.1716 -3.6011 -0.5175 -0.8882 -1.3589 -0.6535 -1.0313 -0.0952 0.1422 -0.6708 -0.6640 -0.5397 -0.4474 -1.1517 -0.1447 0.0172 0.1750 -0.1758 -0.5666 -0.6686 -0.2044 2.2719 -2.0499 0.4656 0.6034 -0.1620 -0.0951 -1.6159 -1.6240 -0.3230 -1.2289 -0.0585 0.2613 -0.3121 -1.0151 -0.3428 -0.7528 -1.3449 -2.0215 -1.6131 0.4174 -0.8456 -0.4114 1.7156 -1.2543 -0.5708 0.0593 0.0946 -2.1096 -0.6508 -1.5466 -0.0845 -1.1871 -0.0267 -0.8159 0.6781 -1.7146 -0.4633 -1.2690 -1.9320 0.1126 2.4156 -0.9556 -1.1711 -0.4593 -1.0029 -0.1884 -0.1437 -0.3563 0.5998 -0.4002 -1.0192 0.8514 -2.0351 -0.3291 1.0568 -0.2082 2.7306 -0.9795 -0.3027 -1.0224 -0.3284 0.5341 -0.6753 0.1245 -0.0056 -2.4095 -1.2270 -0.5088 -0.0103 2.1097 0.4504 0.3340 1.5441 2.0636 2-piperidinone 1.4123 0.9302 -0.0187 1.6868 2.2799 0.9852 0.1025 -0.8414 1.6976 0.2319 -0.4950 0.7217 -1.4117 0.3040 -0.6185 0.0709 0.4573 1.3064 -0.0010 -0.9745 0.8371 0.2925 0.7202 -1.2247 -0.9660 -0.7525 -0.5507 2.5634 0.8785 2.2346 -0.6991 -0.7578 0.0783 0.6711 -0.2397 -0.2461 0.7176 1.6693 -0.3950 -1.1618 -0.7862 -1.0889 0.2494 0.5760 0.2096 -0.5000 1.9358 0.2638 -0.8107 1.9385 -1.3480 1.0976 0.0946 -0.8670 1.3608 -0.8382 -0.9116 0.7771 -0.3006 1.0986 -1.3493 0.1057 -0.4392 0.9337 -0.1968 0.5719 1.3116 -0.5723 -1.6053 -0.8415 -1.2926 -0.7071 0.6710 -0.3862 0.3195 -1.6564 -0.9453 -0.0253 1.1403 -0.3374 -0.5873 0.1932 1.1716 -1.1490 -1.0422 -0.5749 -0.1311 -0.1592 0.4028 -0.9149 -1.3681 0.0424 -0.1180 1.0279 -0.8314 -0.4036 1.8704 0.0879 0.3974 -0.7760 -0.5464 -0.7279 0.0331 -0.3819 0.9446 1.2203 -0.6049 0.4471 -0.5951 0.9483 0.2902 -0.6540 -0.3562 -0.5592 0.2631 -0.6986 2.2796 -0.6604 0.4958 0.0365 -1.0405 -0.4069 0.9355 -0.7312 -0.8247 0.2273 -0.3806 0.6751 -0.7304 1.1241 2.0801 -0.4088 -0.6759 -0.4678 -1.1424 -0.4870 -0.6291 -0.7523 0.0233 1.6441 0.2701 -1.0064 1.4127 0.3988 1.9970 -1.1757 -0.6937 -1.4332 1.8662 0.6403 1.6551 0.6956 -0.2970 -0.5510 1.6582 -0.4987 -0.3851 -0.0823 1.4602 1.4285 1.8347 -0.6922 1.7139 -0.1921 -1.1013 2.4522 -0.7869 0.4526 0.0103 1.0132 -1.3961 1.3778 -1.5962 -0.4150 -1.2030 2.7078 1.9638 0.9259 -0.2982 1.2828 2.2310 -1.0846 -0.7581 0.1230 -2.3445 1.4300 0.2925 0.3564 1.6833 1.9514 -0.5279 0.6418 -0.9803 0.1106 1.3197 -0.5387 -0.1726 0.5569 -1.1091 1.0098 -1.1290 -0.3416 -0.1228 0.4309 0.6369 1.1328 1.0406 0.1447 2.2731 -0.0889 -1.0152 -0.4982 0.2921 -1.4661 -0.8548 0.5112 -1.2721 -0.9549 -1.0071 -1.2055 -0.4720 -0.3500 -0.9004 -0.6315 -0.9140 -0.5810 -0.8216 -0.8755 -0.8355 0.0296 -1.1848 0.7823 -1.1501 -0.9540 0.1272 -1.2535 -0.4626 0.5662 0.3088 -0.9346 0.6452 -1.9571 0.6450 1.3078 -0.2977 1.1513 -0.8880 -0.0964 -1.0536 -0.0896 -0.2529 0.0414 -0.6612 -0.1952 -0.7265 -0.4595 1.1146 -0.3283 -0.8740 -1.0027 -0.6812 -0.7463 -1.4417 1.0522 -0.6729 -0.0402 -0.8652 -0.7465 1.0589 0.0292 1.6800 1.2503 0.0542 -1.4456 0.0963 -0.5195 -0.8963 -0.8685 1.3669 1.3484 -1.0687 -0.2182 -0.2195 0.4352 0.6783 1.2558 0.3271 1.2312 -0.6191 -0.6145 0.4634 0.5193 -1.2352 0.4842 0.0650 -1.1848 -0.0747 -0.2179 -1.7017 1.0894 -1.0193 1.9124 0.7165 -0.4408 -0.9428 0.6463 -0.7682 -0.4790 -1.2892 1.2085 1.2711 0.6260 -1.2579 0.0719 -0.1155 -1.3796 0.2655 -1.1356 -0.6924 2.0377 -0.6195 0.7586 -0.3963 0.4389 0.1144 0.4834 -0.0843 1.0838 -0.4596 -1.2256 -0.4509 1.0430 -0.4429 0.0786 -0.0232 -0.5611 1.0679 -0.9346 -0.1365 1.7570 -0.8991 -0.5069 -1.0435 -1.0762 1.3709 1.2090 1.0983 0.4968 -0.0912 1.7705 0.4191 2.4572 1.3875 -0.6431 -0.7844 -0.2814 -1.3104 -0.4314 -1.0223 1.2568 -2.7290 -1.0947 -0.1106 1.6192 -0.8729 0.3792 0.3957 1.1147 0.7044 -0.2486 0.9093 2.0249 -0.1805 0.1192 -1.0688 -0.6461 -1.8078 -0.9910 0.6833 -1.2021 -0.2754 -1.2686 -1.8151 -0.3020 0.7939 1.0898 0.5373 -1.2177 -0.1636 -1.6318 -0.9655 0.5122 1.9228 0.6726 -0.6584 -1.3287 -0.4123 1.2233 -0.6181 -0.8284 0.5146 0.9322 1.1802 -0.8616 -0.9875 -0.8564 1.2328 -0.7621 -0.0538 -1.4270 2-pyrrolidinone 2.1063 0.3146 -1.1586 0.9329 -2.4606 -0.7729 -1.1071 0.6090 -0.0527 1.3509 -0.7239 -0.9228 0.2882 0.2795 0.1138 0.6856 -0.3088 -0.2254 0.3849 0.6819 -0.1731 0.3296 0.7300 1.0437 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0.1281 0.2481 0.3552 0.0357 0.5778 1.3071 0.3871 0.7672 1.4899 0.9956 0.0973 -1.8536 0.5441 -0.3076 0.6095 -1.8258 -1.9967 0.7813 -2.4370 -0.0328 -2.0225 -2.1344 0.7179 1.0237 0.8849 -2.2853 -0.0853 -0.2168 0.3432 0.0200 0.3932 0.2088 -2.2848 0.1781 -0.6609 0.5027 1.5596 0.4266 1.9824 1.6282 1.1835 -2.0055 1.2102 1.7727 0.7523 -0.5891 0.0735 -1.9532 -1.8761 -1.7895 -0.2867 -1.9377 0.4020 0.6132 0.8299 -2.0578 0.3712 -0.3214 0.4768 0.2393 0.8598 -1.8654 0.3340 0.9027 1.3585 0.6306 -0.0915 0.8762 0.3930 -0.8067 1.6900 0.2454 2.0118 1.0573 0.4115 0.5918 1.7808 0.7785 0.5657 -0.0763 -0.0678 0.0027 -0.1059 -1.8387 0.2640 0.6420 0.3417 1.0067 -1.9396 0.2410 1.4644 0.2184 -1.8906 -1.8444 0.4480 0.9249 -0.2530 -2.1220 0.4216 0.4124 0.5657 0.3874 -2.0232 -0.0121 -1.6658 -2.1741 0.7673 0.8953 0.7454 -2.0363 0.4331 -0.1522 -0.9490 -2.3506 -0.5677 -0.3566 0.3461 -0.5277 0.2935 0.5433 -0.0130 0.3482 0.7106 -0.0793 -0.5727 0.3557 -0.0888 0.3437 0.9183 0.5194 0.7728 0.2323 0.3597 -0.0029 -0.2152 0.4596 -2.0113 -0.5828 -0.0997 0.5586 0.6584 -0.5346 0.0878 -2.2823 0.5477 0.9390 0.8395 -0.0708 1.2538 0.4655 -0.0946 0.4670 -0.0510 0.0589 -0.4246 0.9739 0.3315 -0.0115 1.6847 -0.6547 1.3205 0.8187 -0.0007 -0.4143 -1.6852 0.1857 -0.2230 -0.4878 -2.2890 0.9208 -0.7766 0.3873 -2.2827 0.2484 1.2901 0.0615 -2.2216 0.5062 0.2065 -0.1166 0.9715 -0.3783 -0.5824 -0.6829 -0.4356 -0.4412 -0.3354 -0.3866 -2.4892 0.4697 -0.4502 0.5175 0.8654 0.7356 0.9810 0.2248 -0.5505 -0.1470 0.0285 1.6260 0.4117 -0.4919 -0.5131 0.1380 0.1317 -0.1338 -1.8067 -0.3402 -0.4153 -0.2866 -0.0456 0.4111 -0.6363 -2.5305 0.9083 -2.1024 0.4407 -2.0361 0.2112 0.3707 0.4262 -0.6988 1.3031 1.2232 -0.1580 -2.1884 0.4374 0.1212 -0.7401 0.5438 0.3542 -2.1433 1.9521 0.3447 -0.1931 1.1479 -0.2590 -0.5337 1.2677 0.2133 -0.5585 0.3474 -0.2451 0.4654 1.6114 1.5363 -0.4033 -0.3923 -0.6004 0.2005 -1.3337 0.4014 -0.7115 0.0427 -0.5785 -0.1946 -0.3010 -0.2888 0.2410 0.7536 0.2782 -0.3143 -0.7040 -2.2622 -0.3788 -2.4565 -0.2742 0.0326 0.1169 0.4891 -0.1635 -0.3859 0.3688 -0.7144 1.5019 0.4117 0.0831 0.0807 0.0353 1.1726 -0.2881 -0.3255 -0.5405 -0.6834 -0.8109 1.1740 -0.3418 0.8764 -2.5969 0.5587 0.3925 -1.5947 -0.2598 -0.0412 -0.0374 0.0449 0.1158 -0.0359 0.3618 0.8284 -0.0651 0.7984 -2.4091 -0.4157 -0.4121 0.6385 -0.2185 0.7779 0.3720 3-(3-hydroxyphenyl)propionate 0.1237 -0.0222 -1.2949 0.6671 0.9566 0.2530 0.2328 0.8340 0.4059 -0.9704 -1.1415 0.5251 -1.2081 0.8333 -0.0302 0.3090 -1.1443 -1.2308 -1.2129 -1.0741 0.1652 1.0993 2.0517 -1.2275 0.1053 0.0315 -1.3994 0.9559 0.8319 1.5686 1.2831 1.5359 -0.9229 1.1480 -1.5215 0.0497 1.0340 -1.0419 0.3120 -1.4110 -1.0361 0.6077 1.1173 0.6838 0.2122 0.2734 0.8873 -1.2255 1.1256 1.4286 0.8955 1.7899 0.4922 -1.3362 1.2465 -1.3815 0.5269 -0.9799 0.6126 0.4920 1.0760 0.0998 0.0018 0.6337 0.9408 -1.4220 0.2456 -0.2738 -1.3952 -1.1019 -0.0548 0.5585 0.5687 0.1556 -1.2514 -1.3910 1.4009 0.2829 0.4017 -1.2928 0.4438 -0.0131 0.6899 1.7263 0.9245 0.3873 -1.1237 0.4809 0.2206 1.7231 -0.7429 -0.2045 0.7815 0.0755 -1.2232 0.2188 -0.4376 0.5911 0.1190 1.4060 0.8428 0.0557 0.7203 1.1877 1.0801 1.1899 -1.3056 -1.2907 0.1031 -1.1589 0.8832 -1.3904 0.3328 -1.2607 0.6421 -1.2428 0.7842 -1.1980 0.1582 0.2317 0.2653 0.2607 -1.2811 0.3865 0.0506 0.4254 1.2115 0.4263 0.0731 0.2669 1.2329 1.3265 -1.0148 0.5353 1.2641 -1.3813 0.3471 1.1107 0.4908 1.3347 -1.0840 0.3696 -1.2036 0.8349 1.6479 0.9454 0.0382 0.3060 0.9940 1.1290 0.6854 0.9843 -1.1634 -1.6381 0.7205 0.5297 -1.2348 -1.0929 0.1869 0.9149 0.6631 0.8250 0.4857 0.6603 1.5006 -0.0304 -1.3734 -1.3368 0.7099 1.1382 0.3376 0.0312 1.3382 0.4588 0.3040 -1.0153 0.9617 1.5408 1.8152 -1.0606 -1.1991 0.2967 -1.3034 0.5441 0.6417 -0.3642 1.1820 0.4486 0.4004 0.3982 0.4333 0.4653 1.2017 -1.1338 0.7594 -1.3416 1.2482 0.4673 -1.2734 -1.0182 0.1033 -1.0911 -1.1374 0.9572 0.0738 0.8103 0.5470 -0.6848 -1.2405 0.5146 1.6334 0.2293 0.5105 0.9329 -1.4100 -0.2289 1.5150 0.4324 1.7842 1.7927 -1.3159 -1.3606 0.2653 0.9484 0.4667 0.5735 0.3818 1.8604 -1.3503 -1.2449 0.3711 0.4493 1.3559 -1.3509 0.0808 1.4910 0.3030 0.7068 0.6725 -1.1735 -1.3158 1.6783 0.1614 -1.5282 0.7059 0.6688 2.2852 1.0017 0.4393 -1.3501 -0.1199 1.3137 1.7293 0.7118 -1.3438 0.0012 -0.1715 -1.3294 0.8830 0.1106 0.5292 -1.1529 -1.4281 0.1726 -1.3600 -1.0121 0.3839 0.6263 0.7022 0.5240 0.9632 0.6275 -1.4176 -1.3689 0.3239 -1.3312 -1.3276 1.1794 -0.0964 -1.0776 -1.4499 0.2140 0.7930 1.0066 0.8804 -1.2495 -0.3593 -1.2883 0.1262 0.0983 -1.4556 0.5502 1.0448 -1.4525 -1.2569 0.3749 0.2802 -1.6141 -1.5015 0.6801 -1.2692 1.2893 0.5069 1.1664 -1.2840 1.0640 -1.3772 -1.0852 -1.4123 -1.4749 0.5182 -0.2826 -1.3438 -0.0006 0.4385 0.3560 -1.2603 -1.2995 0.8968 0.8550 -1.2767 0.4521 0.5896 -1.4582 0.5366 -0.4936 -1.3132 0.5167 1.1744 -1.4272 -1.2009 0.4410 -1.2848 0.2352 -1.3228 0.6776 0.8689 -1.3483 0.1836 -1.1473 0.3584 0.3093 -0.2070 0.2685 0.3329 -1.2347 0.5432 1.0092 0.2416 1.2096 -1.1155 -0.8030 0.1831 -1.5467 -1.3764 -1.5204 -0.0559 -1.3875 -1.5901 -1.4830 -1.3961 -1.3676 -1.3048 0.3730 -1.3561 1.4065 0.1755 0.6342 0.2246 0.2253 -0.0962 0.7419 -0.0685 -1.2753 -1.5971 0.6351 2.2219 -0.0715 0.6899 -1.3957 -1.3077 0.3313 0.2037 -1.5768 -0.0174 -0.1763 1.3144 0.6378 -1.5701 -1.5563 1.5144 -1.2724 0.6486 -1.3718 -1.4573 0.0010 0.3050 -1.3639 0.2957 -1.3896 0.6009 0.0428 1.1931 -1.4437 1.3260 -1.6142 0.2436 -1.3549 -1.3159 1.1129 3_4-dihydroxybutyrate 0.4422 -0.0280 -1.6628 -1.9928 1.0928 -2.7828 -1.1242 0.6837 -1.0460 -0.5575 -2.6649 -0.9445 1.2047 0.4958 0.5494 0.6375 -1.8189 0.5107 -1.3227 0.7269 1.0662 0.9659 -0.0560 -0.6241 -0.3668 0.1926 -0.1805 0.2959 -1.2161 -0.8062 -0.6860 -0.8161 1.5660 0.1158 -0.2399 -2.3681 -0.2222 -0.0321 1.1380 -1.0235 -0.1933 2.9691 -0.0102 0.1891 -0.5483 -0.3310 -0.0166 -1.0484 0.1002 0.9399 -0.3526 -0.4929 0.4473 -2.4992 -0.5560 -0.8164 -0.0838 0.9725 0.9669 -1.8654 -0.1076 -1.3429 1.3130 -2.0155 0.6198 2.0355 0.0679 -1.0727 0.4883 -0.3609 -1.1536 0.0289 0.4898 0.7249 1.7203 1.3239 0.1123 -0.0109 -0.2700 0.7429 0.9278 -1.1681 -0.3675 -0.8688 -1.3869 -0.4230 -0.0107 1.0464 0.1187 -0.4296 -0.3251 -0.3249 2.6797 0.9183 -1.5662 1.5702 0.9408 -0.2627 0.9470 0.1689 0.0937 -0.7913 -0.7584 0.8590 1.2438 -0.0526 -2.2678 1.2183 0.0164 0.4329 0.3385 -0.4082 1.0561 -0.2039 -2.0806 -0.0102 1.2089 0.0881 -1.9984 -0.6803 -0.1771 -0.9328 -0.7374 -0.5502 1.0144 0.4898 1.5388 0.6203 -0.0464 -0.5999 0.6254 -0.6426 0.5679 0.1647 -1.2238 -1.0081 1.0635 1.2165 1.5317 0.4151 -1.5716 0.2375 -0.1868 -1.2825 0.5808 -0.9337 0.4167 -0.0531 0.9632 -0.2403 1.1619 1.1684 -0.3453 2.3551 1.1655 -0.0199 -1.4397 -0.6056 1.6516 -0.1784 -0.3533 0.7931 0.7765 -0.0147 0.2052 0.7734 -0.5239 0.1013 -0.6477 0.8445 1.6545 -0.1703 -0.9106 -0.5083 -1.0568 0.0875 0.5559 1.9208 0.3983 1.1032 1.3605 0.4811 2.1725 0.5957 0.9617 -0.8788 0.0092 1.2991 0.1876 0.7561 -0.3642 -1.0961 0.2471 0.3786 -0.6279 -0.6554 -0.4681 -0.4099 0.7506 1.5543 0.4512 -0.5040 -1.3540 1.2283 -0.6216 -0.6308 0.2288 0.1092 -0.0345 0.1614 -0.1317 0.7964 0.0711 0.9857 0.5156 -0.0584 -0.6667 -1.6337 5.0677 -0.2187 -0.8443 -0.4159 0.7073 -0.8532 -0.9130 -0.3095 -1.8624 -1.1230 0.4965 0.1277 -1.4456 -0.4441 0.0451 -0.0603 1.0123 -0.8198 -0.7186 0.1300 0.1571 1.0110 -1.2912 0.8528 -1.8200 -0.8923 -0.8857 -0.3953 0.0852 0.3910 -1.6739 -1.1043 0.5489 -1.4486 0.2901 0.0038 0.3775 1.1694 -0.0385 -0.4339 -0.0026 0.5906 -0.3373 -0.8688 -0.4500 -0.0137 0.3666 0.4768 -0.2462 0.3386 -0.6341 -0.2327 0.6100 0.7106 1.8453 2.3188 -0.9738 -0.1995 -0.3949 0.1118 -0.7228 -0.0319 -0.2252 -0.0960 0.5675 0.6431 -0.1683 -0.2464 -0.2397 2.2900 -0.1688 -0.3053 0.8370 -0.4989 -0.2047 3.0099 1.6083 0.2204 -0.2387 0.4336 -0.3528 -1.0074 0.0156 -0.2191 0.2893 1.7594 -0.3523 2.1769 -0.3165 0.7198 -0.7947 -1.2151 -0.9736 0.0663 0.2290 -0.6193 -0.0981 -0.0316 1.9051 -0.0081 0.6594 -0.8980 0.4926 -1.7937 1.1668 1.5424 -0.3747 -1.7068 0.8097 0.3542 1.6561 0.8069 1.2418 3.0380 -0.0081 -0.3865 0.4785 0.2235 -1.2119 -0.5238 -0.2318 -0.9409 0.2439 -1.9079 0.2791 -1.5547 0.7963 0.5132 0.0896 0.9705 1.0730 0.1726 0.2790 -0.2336 -0.9263 -0.1335 0.3728 0.5407 -0.8228 0.6549 -0.4748 1.2879 0.8607 0.0457 -0.3864 -0.6757 0.6086 -0.6719 -0.1703 -0.5476 -0.1023 -1.0875 -1.5056 0.0512 -0.5320 -1.2170 -0.1083 -2.5802 -0.9700 -1.0652 -0.3109 0.0189 0.7689 0.6189 1.5447 -1.4474 0.3461 -0.3680 0.1381 -0.5535 -0.2107 -0.3713 0.6692 -0.4973 0.4420 1.0297 -0.1874 -1.0444 -0.8644 -0.1510 1.4928 0.6354 -0.7329 -1.1596 -2.3437 1.2433 0.4001 -1.1400 -0.8100 0.6950 0.7205 -1.3058 3-(4-hydroxyphenyl)lactate (HPLA) 2.1765 -0.6266 0.1643 -0.1890 -0.5752 0.0304 1.4567 0.9108 0.8386 2.0675 1.6200 -1.3225 -1.9688 1.1527 0.7905 0.4222 0.8460 0.8417 -1.1996 -2.1121 -1.4270 -0.9507 -0.8757 0.3931 -0.7991 0.7589 0.6438 -1.3883 -0.0633 -0.4122 -0.6904 -0.2964 0.8965 -0.5595 0.1405 3.8001 1.2211 1.6018 -0.7508 -0.3966 -0.2597 -0.3133 0.1042 0.9984 0.0683 0.0638 -0.1160 0.6532 -0.5642 1.6888 0.9291 -0.4462 -0.2964 2.4244 -1.1749 -0.5250 0.8980 -1.4622 -0.3872 -1.4912 -1.0107 -1.1188 -1.7346 1.1784 -0.3468 0.5033 -1.4711 -0.8804 -0.5983 -0.4835 -0.3347 -0.5655 -0.8360 -0.0663 1.8673 0.6030 0.6010 -1.4353 0.3371 -0.2836 -1.1100 0.8256 -1.5938 -0.6830 1.6799 0.1806 1.2639 0.5902 -0.8976 -1.9492 -0.7132 -0.5462 0.0243 0.8938 1.1423 0.2141 -0.7264 -1.0716 -0.0179 -0.7073 -0.4192 0.3841 0.1566 0.4512 0.5055 -0.7210 1.0760 0.6578 0.5085 0.5641 -0.5309 -0.6239 -1.5524 -0.1830 1.5691 0.3148 -0.1601 2.2786 1.6744 -0.8256 0.8023 -0.3894 0.2517 -1.5007 0.0228 -1.0965 -1.0438 -0.5443 0.5383 0.0075 -0.1645 0.3160 0.2041 -0.5524 -0.2215 0.4989 0.3401 -0.8204 -1.3146 -0.7087 0.1337 -0.1726 -0.9420 0.0356 0.2167 -0.1222 -0.7627 0.2661 -0.9175 -0.1061 0.1958 -0.4186 0.3141 -0.3860 -0.3578 -0.9793 0.3779 -0.7796 -0.3167 -0.2686 1.3469 -0.1196 1.6202 -1.8453 -0.4660 -0.4084 0.0254 -0.3378 -2.2447 -0.6686 -1.4091 -0.6574 -0.7169 -1.0308 -0.6917 0.0852 1.6200 -1.3855 -1.4808 0.2835 2.0691 2.3694 -1.1037 0.2925 0.6646 -1.4874 0.4805 -1.4044 0.3508 -0.1463 -0.7455 2.8170 -0.1523 -0.0320 0.7670 -0.8650 -1.7230 -0.3660 -0.5402 -1.3900 -0.1770 1.2870 0.2801 -0.1615 1.0353 0.1215 -0.5700 -0.7103 0.6758 1.6454 -0.4435 0.1582 -0.3948 -0.4132 -0.5556 1.5020 1.7624 2.4363 -0.8896 -0.9032 -0.7861 0.1588 0.0616 -0.1167 -0.0793 1.4058 -0.4739 -0.2450 -0.6811 0.0755 0.1791 -0.2135 1.1125 0.6901 -1.5472 0.6251 -0.4349 -1.2370 -0.1814 -0.0024 -1.1403 0.4042 1.2510 2.5472 -1.6547 0.2024 -0.5589 0.4918 -0.4359 -0.7973 -1.2197 -0.4605 -0.9237 -0.4452 0.0535 -0.8202 -0.2502 1.1609 -1.6721 -0.9122 0.8887 0.4380 -1.1868 3.3966 0.0907 -0.4892 0.2423 -1.1063 -0.2446 -0.9964 -0.1868 -0.0177 1.4635 0.7400 0.1123 -0.3347 -0.1681 -1.2166 -0.4585 0.9939 0.5345 -0.1764 -0.0511 -0.1747 0.6754 0.0028 0.5894 0.8238 1.2573 0.2527 -0.7674 0.1610 0.0986 -0.5557 -1.4912 1.1124 0.0871 0.2332 0.8890 -0.9128 0.1114 -0.6532 1.3220 -0.7917 0.5441 0.9254 1.7273 1.8339 -1.0942 0.5398 -0.5296 0.5981 -0.3353 1.0135 -0.7881 -0.2346 -0.5623 -0.7788 2.2212 0.4507 -0.6293 -0.8196 -0.1216 0.5103 -0.7939 -0.9128 0.7995 -0.3068 -0.9722 -1.1195 0.3778 -0.1621 1.3044 -1.0419 0.8362 -0.0243 2.1374 0.5756 1.1956 -0.4312 -0.2727 1.1996 -0.1823 -1.5345 0.7226 -0.0482 -0.4920 -0.0682 -0.4923 -0.3540 -1.0512 2.3000 0.5313 -1.0611 0.7300 0.1019 -0.6848 -0.7364 0.5499 -0.8294 -1.9714 0.0412 -0.1068 -0.0263 0.1740 0.6507 -0.8928 1.0552 -0.6045 -0.8238 0.4768 1.1151 -1.0727 0.6278 0.1564 5.8075 -0.5741 0.2795 0.4795 -0.2135 -0.9836 -0.3474 -0.3654 0.9296 1.4014 0.1718 0.8221 -0.9995 -0.5044 -0.5673 -0.1005 0.4899 2.5578 1.0625 0.0828 0.1113 -0.5501 0.8391 -0.8750 -0.2141 -0.8179 0.9546 0.1273 -0.0490 -0.5878 1.2418 0.1683 0.9525 -1.5494 0.5894 3_4-methyleneheptanoate 1.6068 1.1101 1.4210 1.2105 -2.3283 -0.2805 -0.1596 0.4382 1.5262 1.7342 1.1306 0.3119 0.5800 0.4741 -0.4390 -1.0960 0.9715 -1.6366 -0.8625 0.3550 0.9950 -0.0191 0.4192 -0.0304 0.5358 0.3128 1.0904 -2.8783 0.6071 1.1213 -0.1590 -1.1601 -2.4428 0.0460 0.5991 1.6223 0.3780 1.0618 1.0257 0.4619 -1.1249 0.8163 0.1395 0.4603 0.4619 -0.0877 -1.0894 0.2133 -0.0355 -0.0121 0.6099 0.6275 0.6906 0.6249 0.9322 0.8106 1.0348 -2.5516 0.7991 0.3455 -0.5232 0.4254 0.7633 0.9056 -0.3444 -0.0259 0.8274 -0.5325 0.8514 0.1389 0.4182 1.0897 1.2145 0.3530 -0.5751 0.3783 0.0367 -3.0489 -0.6146 -1.2960 0.3363 1.3359 1.0758 0.4096 0.2022 0.2902 0.8324 0.1026 -0.2803 0.3229 0.0671 0.4711 0.2716 -2.5194 0.0008 -0.8537 -0.0790 1.0694 -2.9352 0.8648 0.4405 0.5210 -0.0901 0.6091 -1.1500 -0.3813 1.1797 0.7125 1.1490 -0.0609 0.4312 -0.1429 0.9583 1.1785 0.0174 0.7407 -0.1867 0.8076 1.4807 -0.1198 0.1102 -1.6109 0.1630 0.0485 0.3163 0.6875 0.8319 -0.5235 -0.3548 -0.8816 0.1537 -0.9158 -0.5381 0.2640 0.1770 -0.6650 -1.8250 -0.5913 -0.5429 1.8211 1.8590 -0.2831 -2.9678 0.9115 1.2095 0.4680 0.6436 0.1478 1.3473 -2.8180 -2.7361 1.0378 0.4286 -0.4538 1.2097 0.5994 -0.4176 -0.1961 -1.6491 1.2164 0.2547 0.0049 0.3844 1.3164 0.8003 0.3310 -1.0495 0.0876 0.7759 -0.4902 0.2657 1.2819 0.2157 0.4122 1.0065 -0.8012 0.6472 0.6707 -1.5644 0.9037 0.3091 -0.9171 0.7437 -1.7271 -1.4996 0.7372 0.3475 0.0107 1.2577 -0.0423 1.4629 1.4588 0.5697 0.2376 0.3622 0.2404 0.5914 -1.0033 0.2160 0.5163 0.3692 1.5339 0.6928 -2.4044 0.4983 0.3884 0.1651 -0.6329 0.1010 0.5028 -0.6171 -1.3436 -0.4166 0.2202 -0.5981 -1.2459 1.0833 1.1665 -0.7339 0.1093 2.2737 0.1813 -0.8795 0.1881 -1.7635 0.4786 -0.3761 0.6789 -1.4307 0.7281 0.5296 -0.2837 -1.0115 0.6269 0.5445 -0.0061 0.8489 0.3430 -0.0596 -2.9225 -0.9959 -0.1108 0.4431 -0.4716 -0.6556 1.0108 0.4439 0.0440 0.3443 -0.4911 0.5060 0.7240 -0.0312 0.3292 0.8771 0.4415 -1.3155 -0.3631 -0.6928 0.5340 -0.9540 0.8632 0.4582 -1.0040 -0.9928 0.5171 0.7888 -0.1557 -1.2212 -0.4573 0.6258 -1.4227 -0.8193 -0.4402 -0.3835 0.1624 0.1544 -1.0057 0.6481 0.1238 0.0049 0.5969 -0.0563 -1.4990 0.8274 -0.9124 0.8577 -0.5131 -0.3484 0.0442 -1.7343 0.0731 0.0631 0.1863 0.3901 0.0582 -1.1390 0.2240 -0.4937 0.1320 0.3140 -3.3099 0.3274 0.0839 -1.1813 0.1277 -0.8588 1.0134 -0.2910 0.2223 -1.3933 -3.3495 -1.1674 -0.0820 -0.1293 0.0792 0.1313 0.4812 -0.4473 -1.3533 -0.6252 1.2141 -0.8202 -0.3791 0.4534 0.4472 -0.2301 -0.3680 0.2624 -3.3770 -0.4910 -0.0769 -0.2483 1.5892 0.3650 0.0350 0.4245 0.6323 -3.4365 0.8727 1.1504 -0.0995 0.6502 0.8569 -0.5632 0.7469 0.3918 -0.5301 0.3256 -1.9545 0.9662 -0.0023 1.0638 -0.1928 -0.6346 -0.2907 1.1295 0.2590 -0.3128 0.0055 0.7356 0.2948 -0.5335 -3.6680 -1.6337 0.1857 -2.1353 -0.3668 -0.1585 -0.0767 0.6686 0.1064 0.4935 1.8800 -1.2429 2.0176 0.0607 0.7681 1.0064 0.8095 0.8801 -0.5645 0.0603 0.6248 -0.0778 -0.9282 -1.4622 0.4803 0.5444 -0.9981 0.1167 -0.3034 -2.5248 0.3094 -0.3234 0.0398 -0.0981 0.3951 0.5742 0.1708 0.8622 -1.1812 1.1435 0.0140 0.5541 0.4114 0.2451 -3.2541 -0.2587 -1.2808 3_7-dimethylurate -0.5943 0.9715 0.1890 -0.8060 -0.4294 1.0302 0.3266 -1.0480 -0.9603 -0.5372 -0.7348 0.6156 1.4539 -0.2783 -0.0984 0.3290 -0.5157 -0.8822 1.6044 -0.6733 -0.7293 1.5806 -0.5335 -0.8804 -0.0800 1.5994 -1.0888 -0.7869 -0.7254 -0.8999 1.6726 -0.7363 -0.5000 -1.1787 0.7820 -0.9150 0.1581 -0.6439 -0.7806 0.5291 0.5603 -0.4205 -0.9059 0.0084 -0.7374 -1.1231 0.5374 -0.8820 -0.8742 1.0414 -0.3213 1.5587 0.9621 0.3926 -0.5744 1.6042 0.1800 -0.5685 -0.2568 -1.0092 1.6049 -1.0723 1.3542 -0.7915 0.6203 0.1625 -0.9296 1.6078 0.4911 -0.0658 -0.9069 -1.0375 -0.1411 -1.0965 -0.9052 -1.0728 0.2356 -0.8844 -0.7264 -0.9515 0.3314 0.6577 1.8985 0.4679 1.0193 0.1345 -0.7378 -0.8256 0.6875 2.1022 0.6860 -0.8290 -0.0455 1.2235 1.4052 -0.8157 -0.8728 -0.8439 2.0754 2.0391 -1.0559 0.9449 -0.7586 -0.2144 1.7956 -0.8014 0.4616 -0.2586 -0.4062 0.3229 1.1117 -0.1506 0.4426 -0.9025 0.8562 -0.8912 1.5055 -0.8337 -1.0051 -0.2219 -0.7685 0.4684 0.8372 -0.9619 -1.1427 0.1213 1.6893 1.6752 1.6870 1.3475 0.4463 0.2199 -0.5999 -1.0504 -0.9546 0.5768 -0.8644 0.9018 0.6803 -0.4260 -0.6760 2.1569 -0.8447 -0.0335 -0.7633 0.7478 -0.8923 0.0041 1.4200 0.8443 -0.6785 -0.6966 -0.7988 0.5031 0.5781 -0.7230 -0.1426 0.4652 0.6749 1.5877 2.1618 -1.1614 0.4970 -0.8984 -0.8232 1.8896 0.7791 1.2852 -0.3145 -0.9022 -1.1055 0.9442 0.4416 -0.6837 -1.0799 -0.6164 -0.6867 0.9384 -0.8405 -0.6736 0.3055 0.6362 1.2364 -0.9483 1.1560 0.7547 1.5447 1.1993 1.4442 0.9240 0.3209 -0.7153 0.7928 -0.7434 0.3914 -1.0020 -0.8305 1.4924 -0.9327 -0.6151 -1.0561 1.5740 -0.7601 0.4836 -0.9675 -0.5979 1.2411 -0.1991 1.6849 1.1405 -0.8608 0.3532 2.2093 1.2828 1.3221 -0.9790 0.8386 -1.1541 -1.2095 -1.0789 -0.9715 -1.0321 -0.7145 0.2716 -0.0626 -0.2848 -1.0916 -0.3265 1.7584 -0.8858 1.5752 -0.7622 2.0459 -1.0311 -1.1255 1.5242 -0.9753 -0.8301 -1.1016 -0.8001 -0.0505 0.2810 -0.9533 -1.2442 -0.1747 -0.9219 1.0551 0.1178 -1.1160 0.2341 0.1008 -1.0705 1.8309 -0.9648 -1.0194 1.4698 0.1044 0.4003 -0.8920 1.3348 -1.0317 0.4320 -1.1203 -0.1059 -1.0356 0.8868 0.7068 0.9288 -0.8718 -1.0448 0.3103 -0.8440 -1.0962 -1.0448 -1.0387 1.3515 -0.6689 -1.0034 -1.1026 -0.6934 0.5875 -1.1065 0.6081 -1.1214 -1.2183 -0.8953 -1.0562 -0.9543 -1.0885 1.0473 -1.1499 -1.1554 0.7009 -1.1352 -0.9046 1.6878 0.9926 1.7987 1.4679 0.9771 2.4496 0.0165 0.7745 1.5044 0.5265 -0.1505 -1.0465 -0.7032 -0.0055 -1.1754 -0.8830 -1.1089 1.0588 1.3109 -1.2180 -0.9700 1.3445 0.6825 -0.8636 -1.0604 -0.9406 0.7837 -1.3986 -1.1591 -1.0195 1.9944 0.2207 -0.9489 0.1172 0.9589 0.0337 0.9337 1.1442 -0.7454 -0.9888 -0.1522 0.8642 -1.0057 0.9495 -0.7515 0.0881 0.8948 0.6932 0.6175 -1.0930 -0.0739 -0.7891 1.2083 -1.0478 -0.0248 -0.7297 1.2772 0.4329 -1.2537 -1.0465 -1.2209 0.8560 -1.0785 -1.3039 0.5641 -1.0674 0.4613 1.0994 1.5683 -0.1102 0.8882 0.0569 -1.2343 1.1869 -1.1945 0.1744 -1.0601 -0.9240 -0.5799 0.3015 0.8288 1.2048 2.2331 -1.1089 0.5243 -0.2138 2.2374 1.7715 -0.3555 -1.3781 -1.3469 1.5991 0.5123 -0.0999 2.1001 -0.7389 -0.9410 -0.5307 -1.0598 1.3334 -1.1562 -1.2799 -0.2881 -0.1285 1.2973 0.1963 0.5146 -0.3659 1.0020 2.5013 -1.3467 -0.5066 -1.0281 -0.9662 0.7595 3-amino-2-piperidone 1.1240 -1.5057 1.8896 0.9325 -0.8690 2.8998 -0.3903 2.0816 1.5488 3.2053 3.0680 0.3292 -2.0241 -0.0373 -0.6294 -0.7841 1.7159 0.0682 -0.1704 -0.0068 -0.0195 -0.8104 0.5819 -0.2791 -0.3705 0.0930 0.9532 0.7018 0.7581 1.4837 -0.7196 -0.4403 -0.2684 -0.8067 -0.7579 2.7431 0.7552 0.6410 -0.9079 -0.4413 0.4094 -0.4949 -0.6379 -0.4091 -0.7140 0.6736 -1.6305 0.3500 -0.9771 0.8293 0.2035 -0.2883 -1.0747 2.8299 -0.4770 0.3624 0.0914 -1.1025 -1.5795 -0.0406 -0.3131 0.2757 -1.3968 2.7516 -0.2570 -0.7008 -0.0300 -0.5499 -0.1408 0.4531 0.2342 0.4623 0.5312 0.1420 -0.9550 -0.5542 -0.2987 -1.0626 0.1936 -0.0869 -1.2262 1.3589 0.0089 0.2695 1.4170 0.2853 0.1058 -0.4556 0.0260 0.5476 -0.7864 1.6194 -1.7997 -0.2949 1.7897 0.7291 -0.0794 0.1633 -0.6952 -0.1836 0.6646 1.0676 -0.9552 0.1693 -0.4130 0.6026 1.9853 -1.4283 -1.3786 0.4651 1.7970 0.9436 -1.3777 -0.0442 0.7780 -0.4376 -0.4648 0.5732 1.4206 -1.0895 1.1111 0.3353 -0.3826 -0.9537 -0.7518 0.9065 -0.6784 0.6242 -0.6543 -0.1576 1.5895 0.7397 0.8189 -0.6456 1.0569 0.5309 -0.2607 -0.9474 -0.1133 -0.5739 0.5327 -0.8800 -0.9340 0.0918 0.6706 -0.2846 -1.2260 1.8032 -1.0813 -1.0153 -0.4661 -1.4030 -1.0266 -1.2330 -1.1855 -0.3652 1.0385 -0.0347 0.9527 -1.0004 2.0697 -0.6689 0.9513 -1.3406 -0.2375 0.9498 0.5792 0.3566 -0.1639 0.1154 0.6996 -0.3323 -0.0331 0.6082 0.2113 -0.8554 0.0469 -0.7104 -0.4321 0.1767 1.0497 0.1597 0.9679 -0.2758 -0.5103 0.8744 0.5035 -0.4443 0.5309 -0.0742 -0.4868 2.6442 -0.2809 0.0341 0.0909 -0.7748 -0.3649 -0.3799 -0.2654 0.0966 -0.6914 0.4230 1.7400 -0.2962 -0.5953 -0.6546 -1.4013 0.0570 -0.5550 -0.9317 0.9093 -0.5818 -0.9204 -1.2215 -0.7234 -0.0160 1.4964 0.9580 -0.5466 -0.0692 -1.0477 0.2982 -0.6918 0.0298 -0.8903 -0.2460 0.1747 0.8745 0.1159 -0.2430 -0.1009 -0.3173 -1.1922 0.2743 -0.3576 0.6308 1.1643 0.3935 -0.3589 -0.2066 1.0250 -1.0660 0.9142 -0.4062 -0.0603 0.3180 -0.9561 0.2481 1.3586 0.7339 -1.0356 0.3131 -0.9329 0.0594 0.6386 -0.4974 -0.6503 -0.5811 -0.6753 -1.0252 0.5022 -0.4064 0.1455 -0.0753 -0.9668 -1.6305 -1.0759 0.2144 0.8753 -0.6937 -1.1264 -0.2018 -0.2461 -1.1835 -0.1822 -0.1327 -0.7065 -1.4446 -0.7003 0.4464 -0.4275 0.5151 -0.3613 0.6600 -1.8460 -0.5230 -0.5415 -0.7246 -0.2685 -0.4017 -1.3530 -0.4925 -0.8042 -1.5242 -1.0317 0.2592 1.9958 -0.8023 -0.4953 0.3715 0.4839 0.0668 0.6778 0.5471 0.5586 -1.2369 1.0109 -1.5510 -0.0911 0.0496 -0.1369 -0.5549 0.5395 -0.5938 -0.6546 -0.5327 -0.5499 -0.0790 0.0035 0.5615 -1.6207 2.2348 -0.9645 -1.4114 0.6045 0.4372 0.1811 1.2726 1.1650 -0.4956 0.2392 -0.1858 -0.0330 0.0939 -1.1846 0.1620 2.1390 -0.0792 0.3858 0.4431 0.9827 -0.2109 0.0840 -1.1018 -0.4543 0.7521 -0.7425 -1.1470 -1.3731 -0.2822 -1.5218 0.8045 1.8823 0.0416 2.1903 0.0873 -0.3756 -0.5190 -0.3849 0.2166 -0.8274 -0.3075 -0.7813 -0.1409 -0.5293 0.7367 -0.1762 0.4386 1.6653 -0.6218 2.1140 -0.9003 -1.0176 1.5952 -0.2020 6.9261 0.2550 3.0238 1.7934 0.8680 -0.7949 -1.0627 -0.8613 0.8916 -0.4603 -0.8088 -0.3199 -0.4942 -1.6226 -1.2818 -1.2860 0.5717 1.3297 -0.5615 -0.7611 -0.1074 -0.8674 0.2866 -0.3372 -1.0244 1.5701 2.2192 0.6505 0.2966 0.5476 0.2522 0.0664 -1.4499 -0.7376 -0.2737 3-aminoisobutyrate -0.9329 1.2746 -0.9657 0.4962 1.0654 -0.7659 -0.1222 -0.1437 -0.5209 0.4319 -0.5595 -0.3736 0.0873 0.1604 -0.2708 -0.8995 0.8031 -0.3515 0.6238 -0.0498 -0.0391 -0.7072 0.4172 -0.1971 0.4707 0.5991 0.7898 0.9024 -1.5955 -1.1633 -1.0257 0.0453 1.1158 -0.2502 0.3882 1.2009 0.5306 0.6089 -2.3202 -0.5351 0.1437 0.9797 0.3827 0.1586 -1.6742 0.4536 -3.0107 -0.6750 0.7553 1.7030 0.3225 -0.9527 -0.0695 -0.2121 -1.8517 0.2892 2.9993 0.4634 0.4190 1.6057 -0.2058 -0.0177 -0.1611 -2.7860 -0.2683 0.1306 -2.9061 0.4073 -0.1061 0.3675 0.7871 0.5019 0.1543 1.7091 -0.0863 -0.5626 -0.7096 0.0272 0.1074 0.4148 0.2489 -0.4944 0.3926 -1.0090 0.1783 0.3497 1.9622 -0.8800 0.2671 1.6227 -0.7158 -0.5339 -1.5578 0.4619 0.5655 0.8641 0.9661 -0.4870 1.5573 0.7241 0.7260 1.7123 1.2972 -0.7472 1.4769 -2.0737 -0.0109 0.3032 -0.6708 -2.4946 0.7454 -1.1909 1.3330 -0.9111 -0.3756 0.0681 -1.3976 0.5882 0.3475 0.4873 0.4352 0.4202 0.1782 -0.6473 -1.1947 0.0553 -0.0981 -0.9041 -0.4045 -2.1453 0.4859 0.4773 0.5661 0.0943 0.2379 0.2400 -0.6636 -0.6065 -0.0572 2.0504 -1.2003 0.5531 -1.0441 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0.5726 0.7459 0.7277 0.6197 1.1213 -3.9228 0.9257 -0.0593 0.9648 0.3972 0.4082 -0.5211 0.4650 3beta_7beta-dihydroxy-5-cholestenoate 2.6312 0.1277 0.0614 0.6238 0.0701 0.5023 -0.2293 -0.7797 0.6675 1.0483 -1.1477 -1.8880 0.1367 -0.0339 -0.1617 0.0018 0.7080 1.0603 0.7280 0.3384 -0.9508 0.1007 0.4173 0.7038 1.7517 0.3838 -0.3714 0.0487 -1.5296 -0.3627 1.4286 1.1602 -0.4382 -0.1172 -0.7688 -0.8786 -0.1854 0.6115 -1.2850 0.3126 0.0702 1.9574 0.4370 0.3931 0.8782 -0.4391 0.4692 0.3278 0.5593 -1.4100 0.6251 0.8749 -1.5046 -0.6032 1.0187 0.6916 -0.8436 1.2527 -1.3379 0.3313 -0.3338 -1.1705 -0.1403 -1.2733 -0.5053 -0.2023 0.3209 0.9767 0.3665 0.5695 -1.2699 -0.1195 -0.1799 -0.6727 -0.7966 0.2155 -1.4418 1.5146 -1.9536 -1.7648 2.1261 0.9993 -0.4241 0.3879 -0.4144 -1.0543 -0.1866 0.1283 0.6507 -0.8433 -0.4083 -0.8897 -0.2768 1.0273 -1.0163 1.2026 0.2041 -0.9096 -1.8415 -0.9882 0.4503 -0.6643 0.1386 -0.4639 -1.3221 -2.6590 -0.8687 -1.5019 0.0718 1.1458 0.0076 0.1784 0.2615 0.7821 -0.2831 -1.3423 0.4159 1.4164 -0.0529 0.4315 -1.1919 -1.0384 0.4065 -0.9876 -0.3543 -0.5966 0.7297 -1.2361 0.0991 -0.0375 -1.2907 0.8525 -0.0745 0.7858 -1.0540 0.3703 -0.5485 1.0640 0.6620 -1.9529 1.4772 -1.0011 -0.7166 -0.5927 -0.3427 -0.0812 -0.2080 0.9892 0.3604 -0.0427 -0.5435 1.0592 -0.6628 1.0604 -0.4758 1.4502 2.6895 0.7028 1.2166 -0.8280 -0.8458 1.0652 -0.8268 -1.4897 -1.3569 -0.0515 -0.3732 -0.0572 -0.2148 -1.4666 -0.8677 -1.4836 -2.2209 0.0331 0.1628 1.0445 -0.9562 0.2165 -1.3035 0.4036 -0.8468 -1.2046 1.2011 0.6201 -1.6470 -0.4953 0.6522 0.0155 -0.1653 -0.8620 -0.0671 2.2313 0.3397 -0.5598 -0.6851 1.8770 -0.0143 -0.1108 -0.7463 -0.0309 1.2393 -1.4067 -0.5374 0.2818 0.3638 2.0603 1.1708 0.3814 0.6149 -1.7245 0.5629 -0.6867 -0.6224 1.5770 -0.6656 -0.9773 -0.5554 -0.9679 -0.2746 -0.6880 -0.5044 1.3861 -1.2596 -0.4036 -0.2723 -0.1805 -0.9955 -1.0673 0.3056 -1.6522 0.0150 1.4960 0.1218 -0.4639 0.1531 0.3216 2.3973 0.2164 -2.2699 -0.1189 -0.8879 0.5166 -0.4389 -0.0920 -0.0954 -0.0587 0.4702 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1.1466 -1.4795 -1.1798 0.2833 0.8362 2.0499 0.2059 1.3943 0.5586 0.3387 1.1542 0.0674 2.7443 0.5054 2.1801 -0.0132 1.2373 1.4434 2.1181 2.0802 -0.6621 0.4472 -1.4888 0.4458 0.4906 -0.1937 0.8619 0.9820 1.2576 -0.1163 3beta-hydroxy-5-cholestenoate 1.5141 0.3459 0.5628 2.1934 1.6883 2.1827 0.0758 0.8119 0.5501 1.4107 1.6224 -1.0969 0.5995 -0.1804 0.7307 1.1169 2.0064 2.3248 1.1538 0.0938 -0.1910 0.8670 0.8784 0.6853 0.7542 0.1239 1.2004 -0.5750 0.6052 0.5511 -0.4595 0.7136 -1.8945 1.7938 -0.1573 0.6584 1.5879 2.8901 1.2446 0.9800 1.4768 1.5780 1.4074 -0.7152 0.2686 -0.5659 1.2067 0.1233 0.1519 1.5009 0.3755 -0.1500 -0.6244 -1.4098 0.6523 1.4151 0.4989 2.3312 -0.2260 0.8797 0.4733 0.7674 0.3547 -0.3497 0.3759 -0.0382 1.3068 -0.5773 0.3992 -0.9772 -0.4603 -0.1073 0.3980 -1.2372 -0.2725 0.2669 1.1619 -0.7565 -0.8601 -0.4057 0.2913 0.3935 -0.5513 0.9778 -0.7890 0.7894 0.9241 0.7171 0.1892 -0.1933 0.0974 0.9045 -0.3385 0.2313 0.0679 0.6426 1.7501 0.1153 0.5742 0.2027 -1.0776 -0.2760 0.4204 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-1.6887 -0.8886 -0.7753 -0.1466 0.4457 0.3240 -0.3089 -0.0525 -0.0245 -1.2422 0.3299 -1.2113 -1.2823 -1.5101 -0.9140 -0.3230 -0.5850 -0.9817 -0.1163 0.0780 -0.9230 -0.7153 0.7840 0.3609 0.8967 -0.6697 0.2106 -0.5652 -1.4166 -0.0584 0.7520 0.1092 0.5501 1.1584 0.5858 -0.3568 -1.5186 0.2379 0.1251 -3.0137 -1.1406 -1.8277 3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-CMPFP) 1.1536 -0.1332 1.2643 -2.3552 1.4123 -0.2027 1.7037 0.8369 -0.2167 0.4619 -0.4898 -0.5491 -0.1290 0.0782 -0.7370 1.5231 -0.7235 -0.6794 0.4909 -0.9265 0.4912 -0.5160 1.6405 0.6828 1.6593 1.9255 1.1088 1.5711 3.5025 -0.2610 0.2662 -0.3375 0.6857 1.2900 0.7083 -0.0674 0.5936 1.4285 0.1646 0.9693 1.0005 0.0681 -0.1912 -0.5746 -0.0346 0.4049 1.1403 -0.0340 0.5994 1.2960 -0.0638 -0.4454 -1.0559 0.1056 -0.1280 0.3163 2.0116 -0.4715 0.0982 1.0235 1.0107 1.1185 0.0571 -0.2101 1.0612 0.6629 -1.2289 0.9421 2.0990 0.7345 0.5324 1.5587 -0.2548 -0.5889 -1.3017 2.2948 1.6266 0.2370 -0.8072 0.2917 0.5656 1.3869 -0.4344 0.3531 0.3396 1.3639 0.4494 0.8719 0.4316 1.3650 1.3712 0.3264 -0.2385 0.5486 0.6780 -0.8853 -0.0325 0.6459 0.1155 0.7232 0.3535 0.0964 -0.6256 -0.2787 1.0319 -0.7047 -1.1580 0.4811 -0.5341 -0.8787 0.4694 0.6666 -0.6673 -0.5127 -0.1807 -1.5635 -0.4501 -0.1350 -0.0537 0.8692 -0.2886 0.6363 0.6991 -0.4919 -1.2669 1.4934 1.9245 0.5256 0.2254 0.3341 0.6682 -1.1382 0.6387 0.4929 -0.3511 -0.3158 0.7340 1.2027 0.5999 2.0406 -0.3710 0.9523 -2.1387 -1.5521 -0.6243 0.9435 -0.7315 -0.8166 1.9368 0.7454 0.8653 -0.7538 1.4807 -1.8127 -0.6757 -0.4961 -1.2945 -0.1167 -0.3899 -0.2286 -0.6456 -2.3108 0.3838 0.7139 0.9406 0.6270 1.0824 0.1104 -0.1720 -0.0474 0.5937 0.7382 1.4013 -0.6202 2.0498 -0.8436 -0.8398 1.3928 0.1603 1.1474 0.3102 -0.4301 1.0216 -0.7712 0.6780 1.0908 -0.1413 0.1876 0.6660 1.1388 1.1042 0.4959 1.2408 2.1780 -1.2703 -0.6212 -0.4793 1.1026 0.4483 -2.0094 -0.1081 0.0165 0.5074 -0.2692 -0.3939 1.3652 -0.6636 0.5449 -0.8855 0.7181 0.5909 -0.1956 1.2748 -0.4538 0.0598 -0.8622 0.2481 0.2722 1.0667 -2.1871 -1.5765 -0.7722 0.6700 -0.1816 0.5805 0.5268 -1.2809 1.1201 -0.1715 -1.0095 -0.8240 -0.4690 -0.7480 1.1967 1.2979 0.9249 -0.3834 -1.3257 -0.7408 -0.1039 -2.3209 -1.8297 0.7222 2.5167 -1.0061 -0.0193 -0.3221 0.7966 0.3523 -0.8916 0.8177 -1.9156 -0.9250 -0.2655 0.2360 -0.9280 -1.2099 -0.9098 0.4546 0.8668 0.0216 -0.0462 0.3038 -2.5911 -1.2122 -1.3093 -0.4242 -0.5822 0.0648 -0.6050 -1.5929 -0.9607 1.5837 -0.6751 -0.0917 -0.5337 0.6255 1.5496 0.4917 -1.4988 -0.7986 0.6540 0.5496 0.6814 -0.6050 -0.9848 0.9378 -0.7011 1.8329 1.2219 -1.7348 -1.7015 -0.9511 0.6084 -1.5283 -0.1574 -0.8542 0.8707 -1.5184 0.2656 -0.4672 -1.1544 -0.1143 1.6073 -1.0415 -2.4322 -0.7355 0.0245 -1.9043 0.4580 -0.8266 -0.7238 -1.5427 0.9811 0.1846 -0.1332 0.1794 -0.3181 1.9399 -1.1242 1.1541 -0.6599 -0.7196 -2.8511 1.0949 0.1667 1.3966 -1.5879 -2.0479 1.1398 -0.9764 0.0592 0.4017 -0.5525 -0.2166 -0.3792 -1.7583 -0.6286 0.8894 -1.1298 -1.6185 -0.4233 -0.3263 0.7801 -0.9542 -0.5952 -0.7844 -0.5456 0.1724 -0.0311 -0.4149 -0.8920 -0.9056 -2.0711 -2.4903 -0.4851 0.5791 0.7021 -0.7832 -0.8391 -1.0144 -0.7317 -0.1563 0.2583 0.0878 -0.0276 -1.7885 0.3969 -0.2649 0.2725 0.2573 0.9364 -0.0753 -2.2549 0.0211 0.4057 -1.4160 -0.0514 -0.2770 1.3676 -1.9184 -0.2754 0.3314 1.3660 0.2283 -0.7762 -0.1990 -1.0225 0.5467 -0.1974 0.1183 -0.6661 0.6890 -0.7532 0.4169 -0.2351 0.7319 0.2762 0.5267 1.1211 -1.7387 -2.1880 -0.0081 -1.0737 0.6435 0.1626 -0.3612 -0.4668 -0.5039 -0.0922 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) -1.0420 -0.4284 -1.2156 -1.7885 0.3829 -0.6859 1.7101 0.8021 0.6085 -0.3540 -0.0683 -0.2955 0.2404 0.0172 0.1955 2.0163 -0.3847 -1.3600 -1.4216 1.3124 1.5980 1.1316 0.3766 -0.0705 1.1172 1.0424 1.6849 0.5044 2.4400 1.4911 1.4972 -0.1750 0.5998 0.4957 0.6340 -0.1360 1.6210 -0.5230 0.0112 -0.6677 0.4132 -0.8764 0.5057 -0.9223 -0.7312 1.0177 -1.0088 0.3177 1.7570 0.5791 -0.1476 0.0602 0.4378 1.0470 1.5202 0.2575 2.0833 -0.5614 0.8746 1.1779 -0.3555 -0.5094 0.7568 -0.6752 0.5868 -0.4452 -0.4040 0.9665 -0.2846 1.8281 0.7250 0.6253 0.1099 0.5365 -0.5493 0.2473 0.7863 1.8547 -0.0669 0.8258 1.7705 -1.0067 0.4512 -0.3885 -0.3235 1.8589 0.6560 -0.4127 -1.5122 1.1354 1.2270 -0.3236 -0.3544 -1.6565 1.5944 0.2950 0.8128 1.0589 -0.4194 -0.5869 -0.1984 1.2591 -1.0898 -1.8341 0.4385 -1.9304 0.2071 -0.0505 0.0298 -0.7557 0.2332 0.8575 0.5047 -0.3554 0.7322 -0.5032 -0.6653 -0.4040 -0.2121 1.6888 -1.8365 0.6931 0.0960 -0.2793 -0.2552 0.7229 0.9753 1.2793 0.9416 -0.7358 -1.0446 -0.7080 1.5897 -0.5804 0.9501 0.0919 -0.3923 0.5689 0.7344 1.5416 0.1434 1.2134 -0.1662 -0.0912 -1.3055 0.5811 -1.1651 -0.0578 0.5978 1.1523 -1.5725 0.5046 0.2930 -2.1923 -0.5832 0.3306 -1.9270 0.6113 -0.7676 0.1870 -0.8105 0.1195 -0.2779 1.2412 1.5552 -1.7991 1.5066 -0.1727 0.4513 0.4582 1.5360 0.6748 0.5338 0.8720 1.4013 -1.2368 -2.3369 0.4003 0.7030 -0.3201 -0.3732 1.1736 -1.0787 0.3770 -0.0356 -0.7103 -2.0300 0.4078 -0.5385 0.4124 1.3793 -1.1735 -1.2490 1.9435 -0.7046 -1.9352 -0.6566 1.5989 -0.9092 -1.0984 0.2826 0.5553 -0.1845 -0.8603 -0.4241 0.2540 -0.5643 -0.3932 -1.6533 -0.6724 -0.5465 -0.5538 -0.2077 -0.5877 -2.3408 0.8724 1.7217 -0.3596 0.4839 -1.6562 0.0739 -0.5465 0.4811 -0.8270 1.1245 -0.4603 0.8306 1.2563 1.2693 -0.3223 0.4701 -0.1828 -0.9463 0.6625 2.0432 -0.0897 1.0502 0.1961 -0.2582 -0.1881 -0.3270 -0.2450 0.2371 2.6554 0.6846 0.5875 -1.0268 -0.5776 0.3088 -1.2586 0.2080 -0.0973 -1.5110 0.6033 -0.1798 0.4076 -1.2222 0.6631 -2.1121 1.5227 -0.2078 0.2192 1.5940 0.5524 -1.9122 -1.7638 -0.2970 -0.2079 -1.0452 -1.0321 0.1930 -0.6182 -0.1302 -1.4391 -1.0636 -1.2978 -0.6325 1.8967 0.5176 -0.3275 0.4137 1.4441 1.0180 0.4411 -0.8605 -1.1357 -0.3253 -1.0699 1.0618 0.4061 -0.7300 -0.6683 -1.4182 1.4133 -0.7238 0.5071 1.7909 -1.2131 -1.2652 0.6398 -1.8987 -2.0321 -0.2628 0.6536 -2.1709 -1.8572 0.0268 -0.2284 0.7252 1.1370 -0.9283 -2.1899 -0.4892 -0.2581 -0.3570 0.7640 1.6640 -0.6868 1.8703 -0.3268 0.1281 -0.1842 -0.2598 -2.1103 -0.0652 -0.7864 -1.0770 -0.4161 -1.3948 -0.3711 -0.5902 -1.7402 0.9998 -0.7958 -0.9614 -0.3179 -1.2128 -1.1363 0.5335 0.6389 0.7088 -0.5665 0.3390 1.8628 -0.7066 -0.0461 -1.1875 -1.8837 -0.8787 -0.1504 -0.2982 -0.4486 -0.3153 -1.3378 -1.1889 0.5873 1.3368 -0.2283 -0.9286 0.9079 -0.1320 -0.2315 -1.0918 -0.2080 -0.1914 -0.4185 -0.5713 1.1935 -1.4897 0.3744 -2.1490 -1.3352 0.9184 -0.0420 0.9767 0.2642 0.5759 0.4342 -0.4325 0.6206 -0.2956 0.3008 -0.2375 0.8196 -0.2897 0.8305 1.1161 0.4533 0.6640 -1.8141 -0.8019 -0.0076 0.9049 -0.8714 1.3325 1.2859 1.5146 -0.7758 0.4903 1.8684 0.1110 -1.3719 1.5342 -1.3310 0.5856 -0.0389 -0.7227 -0.2146 -0.4078 1.3045 3-decenoylcarnitine -0.9424 0.8667 -1.2440 -1.0831 1.2908 0.8072 -1.3744 0.4589 1.2636 0.9649 -1.1125 0.8938 -1.1487 0.8772 0.6448 0.6712 1.4286 1.5419 -1.1359 1.2030 0.3683 0.5168 -0.8801 -0.8124 -1.1561 -1.1629 1.6818 0.5147 -1.0210 0.9756 -1.3436 -0.1469 1.0522 0.9964 0.9108 0.1681 0.2664 -0.9540 0.4088 1.6286 -0.0042 -0.7799 0.7502 1.5919 1.3295 -1.3876 0.3246 -1.1321 0.2401 -1.1695 0.1718 -1.4189 -1.1261 1.2946 0.3490 -1.3172 0.6838 0.6730 -1.2302 1.7292 0.0715 0.6466 0.4326 0.2657 -1.1334 0.4942 -1.1853 -1.4208 0.5502 0.6381 1.1191 -1.2802 -1.2426 -1.3838 1.2429 0.7422 0.1129 0.7633 -1.0240 0.6370 0.9304 0.7903 -1.1863 -1.3491 0.4231 -0.2603 -1.0531 -1.1245 1.0927 -0.9335 1.2534 1.0783 0.5332 -0.3687 0.4649 0.6997 -1.1765 0.6113 -1.1044 0.5825 -1.3292 0.5486 0.1710 0.8165 -1.1072 -1.1198 -1.2545 -1.2245 -1.5515 0.5386 0.5353 -1.3151 0.7165 -1.2070 1.0850 -1.1704 -0.1868 -1.1259 -1.3004 -1.4168 0.4888 0.9755 -1.1983 -1.3042 0.9525 -0.2128 -1.3019 0.2141 0.8017 0.3913 -1.3227 0.5185 0.6354 0.5743 -1.2393 0.6789 0.6274 -0.9081 -0.0338 0.7648 -1.0312 0.1815 0.6359 1.0856 -1.0983 1.1261 0.7424 -1.2331 -1.1066 0.5554 -0.9967 2.2053 -1.0761 1.5432 1.4368 0.6110 1.3352 -1.0063 0.4206 1.4438 0.3752 -1.3813 0.8273 -1.2015 0.8698 0.0439 0.2777 0.3094 -1.3566 0.5191 0.7572 -1.2112 0.2259 0.4365 -1.3739 -0.9171 0.7795 -1.0405 -1.1212 0.8010 0.1615 -1.4301 -1.2409 0.0289 -1.0160 1.0314 0.3699 -1.1404 -1.0196 -0.1521 -1.4166 -1.0633 0.5845 1.1166 -1.0212 -1.2943 1.2058 0.3064 0.8372 1.1416 0.7299 0.3571 -1.0591 1.4689 -1.2102 -0.9029 -1.2346 0.4511 -1.1800 0.0027 0.5726 -1.1829 0.6118 0.6817 1.1082 -1.2250 1.0481 0.2571 0.8783 0.7481 0.7660 0.6706 0.8542 0.3663 -1.4944 0.8146 0.4697 0.4660 0.0673 0.4370 0.5975 -1.0821 1.1629 1.0276 1.1595 -1.3858 0.2696 -1.1552 0.4339 0.8702 1.6061 -1.4368 1.4348 1.3591 0.7404 1.0356 0.8820 0.5205 0.4921 0.3206 -1.2778 0.2595 -1.3487 -1.2495 1.4330 0.5750 1.0534 -1.2668 -1.1932 -1.3800 -1.2754 -1.0678 0.5518 0.9198 0.7032 -0.9249 1.0449 0.4111 1.3057 1.2420 -1.3273 0.2456 -1.3747 1.4365 1.0791 -1.2636 1.0877 -1.2644 1.3871 -0.9836 0.9227 0.6763 0.5726 0.8501 1.5797 -1.1841 -1.3093 0.3519 0.4008 -0.0928 -1.4044 0.9451 0.2688 0.7576 0.8051 0.3560 0.4972 -1.5510 0.8064 0.2472 -1.2223 -1.3199 0.9761 -1.3640 -1.2070 0.5414 0.6335 -0.9910 -1.3812 -1.4223 1.2957 -1.3408 0.2536 0.7161 1.3193 0.3535 0.2076 -1.2352 0.8291 0.1792 -1.1943 1.1900 0.6640 -1.3976 0.6739 1.0310 0.9783 0.7487 0.5900 0.2814 0.0471 -1.1350 -1.2359 -1.0836 1.1481 0.5240 0.1208 -1.3086 0.7809 -1.1033 -1.2093 0.6352 0.4592 -1.3735 -1.4091 -1.1770 0.9292 1.0787 -1.3162 0.4939 -1.0410 -0.6802 0.4085 -1.5160 1.2757 0.3821 -1.4603 -1.3110 1.1130 0.4872 0.5519 -1.3278 0.3366 0.6927 1.5181 -1.3742 0.6361 0.4218 0.7869 0.9827 0.9496 -1.3201 -1.2190 -1.2284 1.0668 -1.1710 1.0325 -1.4399 -0.6585 0.9892 -1.2604 -1.5474 -0.0029 0.9289 -1.5897 0.9631 0.4574 0.7940 -1.5429 -1.5139 0.6362 0.7557 -0.8781 1.3082 -1.4154 -1.4264 0.7384 -1.2899 0.1596 0.6947 0.9847 1.1173 0.4399 1.0412 -1.4878 1.3593 0.9636 0.0113 0.9037 0.3455 3-formylindole 2.6538 -0.3268 -0.1240 1.0975 2.0195 1.8008 -0.8296 0.4864 0.3411 1.5814 -0.2972 -0.4571 -0.7661 0.3168 0.1088 0.8753 -0.0722 0.1715 1.2007 1.4272 1.1981 0.2130 -0.0698 1.1223 0.6240 2.4423 -0.0250 0.9887 1.3587 0.2542 0.9417 0.7569 1.3980 -0.3989 0.3527 1.5062 0.5858 1.9363 0.2971 -0.8097 2.7348 2.1087 0.2515 0.3381 -0.2734 0.0527 0.5248 1.8700 0.6546 -0.5019 0.0357 -0.3078 0.3256 1.0564 -0.1002 -0.0187 1.1197 0.0218 0.8058 -0.1690 0.9529 -0.1983 -0.2008 0.7438 1.7775 -0.2127 1.0457 -0.1503 -0.9066 0.0033 -0.0197 -0.1118 0.1396 -0.3469 -0.2359 1.4240 0.5988 0.2773 0.2329 0.1293 1.1034 1.2160 -0.2150 -0.0065 -0.2128 1.2603 1.4425 -1.0290 -0.0994 1.2233 0.1639 -0.3999 0.0069 2.2531 2.3310 0.7934 -1.2529 0.2234 1.0224 0.8123 0.8501 0.6941 1.4726 -0.2215 1.8287 -0.2291 -1.0914 -0.2595 -0.3068 1.1964 1.1186 0.4256 -1.0497 -0.3220 -0.8508 0.0540 1.1609 1.7386 -1.8287 0.1816 -0.8022 -1.7840 1.6680 -0.7054 -0.7242 -0.5729 0.1807 -0.6304 -0.1470 -0.5412 0.4780 -0.9901 -0.3555 0.1069 0.0971 -0.4189 0.1261 0.2688 0.5837 1.2241 -0.7897 0.9610 -0.6600 -1.2305 -0.4628 0.8135 -0.4869 -0.1496 -0.1440 0.7869 0.9709 0.4993 -0.6456 -0.1630 0.2000 1.1556 0.9847 -0.4551 0.3094 0.8426 0.3759 -0.0357 1.7824 -0.5220 -0.5270 0.4109 0.3500 0.2816 -1.6185 -0.1963 -0.5402 1.8679 -2.9315 1.0490 0.1302 -0.6789 -0.3419 0.5372 0.4702 0.9167 1.0067 2.9712 -0.4302 1.3940 0.5644 0.5544 0.5866 -0.0281 -0.8920 -0.5860 -0.0838 -0.1577 0.0245 2.4603 -0.9133 -0.6812 -0.3589 0.0849 -0.5429 -2.2543 0.7404 0.4567 0.1064 -0.3906 -0.8788 -0.0290 -0.3443 1.2634 0.5172 1.1033 0.7118 1.5288 0.5205 -0.3380 -0.4375 0.8375 -1.7647 -0.4067 -0.3359 -0.9877 -0.2513 -1.1501 0.4352 -0.7006 -0.5063 -0.1279 -1.1974 0.4735 -0.7496 0.0096 0.0765 -0.2566 0.7020 0.9229 -0.5038 -1.1381 -0.1978 -0.2384 -0.1594 0.1414 0.6275 -1.5511 0.3253 2.4185 0.2601 -0.3754 0.8388 -0.3140 -0.0591 0.2505 -0.6580 -1.3266 -1.6101 -0.4353 -0.1019 0.3625 0.5405 -0.1880 -2.4600 0.5608 0.0274 0.1468 1.3468 0.4868 0.2773 -0.1579 0.6185 -0.2373 -0.6828 -2.2176 -0.3856 -0.2581 0.2266 -0.0856 -0.0517 0.8077 0.6406 0.8097 -0.9590 0.0779 -1.0758 0.4322 -0.5403 0.4552 -1.0635 -0.6843 -0.7364 -0.5954 -0.8195 -0.2866 -0.9154 -1.2937 -0.4747 0.6740 0.2507 -0.9599 -1.2206 -1.8315 -2.0329 -0.5706 -0.2885 0.8614 0.5445 0.7821 -0.1864 -0.2811 -1.4491 0.8671 -2.9954 1.0249 -0.6771 -2.5413 -2.5043 0.2186 -1.9381 -0.8653 0.0721 0.8674 1.3407 -0.8618 1.1754 -1.7768 -1.7613 -1.9549 1.4044 0.8049 0.5449 -1.8787 0.2783 -1.0384 1.1774 -0.5324 1.2504 -0.0286 0.6182 -0.7789 -1.7785 -1.1198 0.7455 -1.0038 -0.5395 0.7926 -0.3313 -0.0967 -1.2157 0.0905 0.1911 0.1380 -0.2117 -0.8704 -0.5864 0.6935 0.9692 -1.0430 -0.7143 -1.2657 -1.4195 0.7300 -3.1171 0.1362 -0.8086 1.2046 -0.4693 2.1450 -0.3623 -0.6490 -0.5190 -0.9668 -0.8826 -1.5578 0.8059 -0.3035 -0.6514 -1.0543 -0.4711 2.8947 -0.3154 -1.1697 0.6556 -1.5654 -1.6131 -1.9081 0.5338 0.1558 -0.2561 -0.6861 -0.0698 0.0909 -0.9422 -0.3134 -0.0847 0.1933 -0.0023 0.4161 -1.5028 0.4981 -1.0963 -0.0033 -0.3529 -1.0227 -1.3110 1.4970 1.0651 -1.2214 -2.0604 -1.4534 -1.1102 -0.4880 -1.3570 -1.3712 3-hydroxy-2-ethylpropionate 0.6088 -0.1844 1.5594 -0.0673 -0.6190 0.5830 2.4529 -0.8351 -0.0629 -0.1692 -0.7894 -1.8143 0.6452 0.2861 0.3955 -0.0011 -0.8830 -0.0719 -0.0220 -0.7238 0.7029 -0.3633 -0.4224 -0.0406 2.0192 0.0011 2.1176 0.2570 -0.4111 -1.1174 -0.9056 -0.5386 1.2793 -0.5568 -1.1038 0.3241 -0.7122 0.3252 -0.6095 0.5554 -1.4296 -0.7296 1.1967 -0.5549 0.3600 -1.0833 1.9185 -1.6579 -0.3144 -1.5598 0.2187 0.1252 -0.8282 0.6467 0.0957 0.3386 0.9163 -0.1621 -1.5560 1.4730 -0.1896 -0.4732 0.5617 -0.5363 -0.7797 -0.2191 -1.7930 -0.3247 0.3443 -0.8521 1.2243 -1.8962 -1.8887 -0.9868 1.4249 0.0775 1.1157 0.1790 -1.2179 -0.0102 -0.1232 0.2741 0.6364 -0.4582 2.7192 -0.4762 -1.8944 0.4201 0.5941 -1.4802 0.9634 -0.0477 -0.2628 -1.0431 -0.0118 0.3068 -0.0603 -1.8565 0.2055 0.7854 0.5139 -1.2234 2.5295 1.4334 -0.6021 1.1457 -2.4587 0.6523 1.6275 -2.2785 -0.2043 0.1708 -1.6523 0.9754 -0.9906 -1.2760 -1.0160 -0.2349 -0.0245 0.2316 1.5987 0.2029 0.2951 -1.1413 0.6455 0.7936 0.5683 -0.9937 -1.5054 -0.5901 -0.1904 -0.2297 -0.2423 0.5923 0.7292 -0.1566 0.9982 0.7586 -0.0342 -1.9659 2.3080 0.7503 0.1501 0.6305 -0.9001 1.5244 -1.2865 1.0997 1.5093 1.8488 -1.6002 -0.1294 0.5608 0.5312 -0.2950 -1.3589 0.4826 -0.1743 -0.2047 -0.0115 0.1695 0.0965 -2.0563 2.7719 -1.1849 1.0792 -0.5528 1.3237 -1.3594 -0.3868 -0.2259 -0.5300 0.4501 -0.5433 -1.0229 0.0744 0.6826 0.3573 1.4789 -0.2667 -0.9999 2.2204 -0.2972 2.1139 -0.0091 -0.0592 -0.9814 -0.1755 -0.6788 -0.3431 0.0928 -1.8151 0.0151 0.1671 0.7641 -0.3895 -0.3137 1.4379 -0.6961 2.4728 0.9537 -0.4948 -1.9831 -0.6708 1.1990 0.2060 1.0653 0.4370 -0.4723 0.3642 0.6082 -0.2164 0.2609 0.6824 2.1393 0.4997 -1.9920 0.6859 -1.3599 0.4131 -1.2608 -0.4382 0.2641 -0.2604 0.3839 0.1884 -0.1939 0.2213 1.4458 0.8929 -0.3659 0.7727 -1.4423 0.6132 0.6712 0.6706 -0.1223 0.5678 -0.0786 0.6230 -1.1492 0.0192 0.1613 1.8234 -1.6596 -0.9336 0.8128 0.7992 -1.4267 -0.0603 -0.2482 0.7828 0.0202 -0.5327 -0.0869 0.0284 0.1955 1.2626 4.1807 -0.3625 2.4267 -1.6025 0.6813 -0.2870 0.6754 0.7114 -0.0709 -0.6180 -0.3930 0.5727 -0.1847 0.4155 -1.0082 1.4394 -0.4273 0.1797 -0.0670 -0.4074 -0.1440 -0.0123 1.4498 -2.1139 -0.7608 0.4075 -0.2179 -0.9672 -0.6941 -1.3776 0.8219 -0.4537 0.0797 -0.3181 1.5974 0.8329 0.0935 0.1961 -0.5457 -0.3303 3.4255 -1.5171 0.3053 -1.2333 -0.4590 0.7953 1.8669 -1.3650 -2.3366 -0.0672 0.0191 0.3463 -0.0976 -0.8409 -0.3670 0.6924 0.8836 0.1147 0.0774 0.4137 0.3172 -0.3463 0.7337 -1.0380 -0.5570 -1.0364 0.0322 0.0232 -1.2728 -0.9567 -0.5949 0.1453 0.6303 -0.3495 1.7300 0.0395 1.6049 0.1657 -0.7618 -0.0745 -1.8672 -0.7961 -0.3316 0.1889 0.1801 -0.8771 -0.4144 -0.6600 0.4756 0.4106 1.4638 -1.0542 0.2391 0.2292 -1.1723 -0.4228 1.2539 0.1866 1.5266 -0.7237 0.1382 0.8515 -0.4264 0.3178 -0.5463 -0.4437 -0.8490 -1.3483 -1.1717 -0.4117 0.3024 0.2918 2.4909 -0.0867 1.2716 0.2902 -0.6987 -0.4051 -0.1699 -0.7112 -1.4365 0.3321 -0.9045 -0.6215 0.5807 1.2586 -2.1777 0.3129 0.0364 -0.6791 1.0026 0.6130 -0.9778 -0.8591 0.8128 0.7508 -0.2500 -0.0669 -0.0004 -0.0250 -0.8415 0.6379 -1.8583 0.5828 -1.3473 0.8047 0.7216 -0.0537 1.1963 1.6941 -0.7132 -0.0393 3-hydroxy-3-methylglutarate -0.1186 0.0454 -0.4749 -0.0576 -0.1817 0.4171 1.1687 0.7139 -0.1557 0.5175 0.2028 -0.0170 -0.0608 -0.2454 0.0652 -1.5411 0.5378 0.1239 -2.4805 -0.3521 -1.8882 -0.8050 0.0185 0.3417 -0.5260 -0.1939 -0.0418 -0.2620 -0.6714 -0.4040 -2.1241 0.1407 -0.0188 4.1035 -0.1019 -0.6752 0.9587 -0.5853 -0.4971 -0.7291 -0.5775 0.1248 1.6401 -0.5201 -1.0653 -0.1644 -0.5642 -0.5167 0.4464 0.7376 0.1908 -0.1222 0.0901 1.2445 -1.8261 -0.3483 -0.2663 0.1799 -1.5652 -0.1167 -1.3246 -1.1107 0.7312 0.1265 -0.2725 -1.1395 0.0406 -0.5341 -1.6435 0.2948 1.0583 -1.0823 0.3279 0.7098 0.3986 -0.8040 -0.4609 1.0232 -0.3289 -0.0454 -1.0819 0.7765 0.0884 -2.5795 -0.5420 -1.0517 -0.9346 0.1301 0.3509 0.0609 -0.9804 0.1259 -0.1410 -0.0230 -0.2181 -1.3123 1.3771 -1.2187 -1.2863 -0.8810 0.3716 0.8617 -1.5275 -1.5862 -0.2468 -0.5831 -0.7206 -0.0481 -0.9999 -0.6858 -0.8489 -0.3515 1.2437 0.2524 0.0419 0.0763 -0.4891 -0.0500 0.5692 -2.2411 0.0667 -1.1587 -0.2175 -0.3962 -0.6458 0.6739 0.0414 -0.1197 0.7474 -0.2261 -0.7001 1.2363 0.7619 -0.0364 1.8292 -0.5225 -1.6466 -1.2054 0.0331 -0.1897 0.3045 0.0923 -0.1407 -0.7111 0.4019 -0.2518 -1.1446 -0.4199 -1.7751 -0.7676 -0.8113 0.2268 -1.9373 0.4941 -1.1431 -0.8805 -1.4470 -0.8437 -0.3994 0.4083 -0.0568 -0.0581 -0.4645 -1.2567 1.9212 2.4739 -1.6426 1.1796 -1.1364 -0.4601 2.0584 0.0561 0.8339 -0.2306 0.5484 -0.2097 0.2592 -0.5879 -1.9656 -0.1126 1.6248 -0.0653 0.2945 -0.4459 0.3955 -0.5829 -0.0026 -0.6865 0.1671 -1.5548 1.7587 0.4599 0.5564 -0.8198 -0.5773 -0.0962 -1.7509 0.2518 -0.2969 -0.0350 0.1199 -0.6247 -0.2431 1.0914 0.5959 -0.5247 -1.0786 0.3116 2.0367 -1.3791 -0.5115 1.0635 -1.5868 0.2599 -0.1802 0.4572 0.9235 -0.1580 -1.7117 -0.3618 -0.2031 0.6509 -0.0755 0.9451 0.8038 -0.1810 0.3165 -0.3334 1.3414 0.0868 0.2727 -0.3958 0.4192 0.4159 0.2740 -0.1014 -0.9415 -1.3023 -0.0124 -0.0321 -0.3791 0.0757 1.6050 0.2013 0.4493 -0.0462 -0.8976 0.2337 -0.8342 -0.3083 -1.7411 -0.3065 2.0565 0.7880 -0.6927 -0.2838 -1.2994 0.5628 -0.3401 0.3794 -0.4132 0.2881 -0.7094 1.2175 -0.4023 -0.8445 -1.6569 1.3805 -1.0269 -0.7646 -0.2299 -0.6838 1.2943 -1.0741 0.0093 0.6979 -0.2268 1.4706 -0.0452 0.1821 1.0418 1.3838 0.1724 0.1554 -0.6353 -0.2748 3.0423 -0.4275 0.0355 0.4468 -0.2180 -0.5012 0.9781 0.5685 0.9150 -0.2509 1.7926 3.8941 -0.5852 0.4504 2.2783 -0.8840 -0.4054 -0.0010 -0.0616 1.6072 0.1891 0.4017 -0.5919 -0.6122 1.1666 1.0630 -0.5776 -0.9148 1.2132 2.7106 0.7910 0.7280 1.9707 1.0957 -1.0772 1.5535 -1.0263 0.9316 0.4905 0.3015 1.2504 -0.3669 0.7891 -0.3971 -1.7076 0.9536 2.0709 0.4459 -1.0233 1.0925 0.9881 -0.0396 -0.4215 -0.5165 0.3680 0.0421 0.5610 -1.6859 0.8467 1.2087 1.1143 0.4092 -0.8686 -0.8478 0.9702 -0.1127 0.1024 0.3777 2.3739 0.1379 -0.2522 0.2025 1.3333 0.4935 0.9728 -0.7947 0.1263 0.5698 0.2230 2.3340 -1.8826 0.4078 -0.0368 -1.0167 0.1597 -0.1012 -0.4323 -1.2617 -0.4208 -1.2425 1.8554 1.1735 0.0487 -1.2571 0.7616 1.5601 -0.3319 0.3682 -1.3756 -0.5493 -0.8447 -0.2585 0.0311 -0.3382 -0.6950 1.0460 0.0382 1.4444 3.6261 -1.2850 -0.8978 -0.2240 -2.2880 2.8353 -0.5071 1.1527 -0.1591 3.4169 1.5505 0.6551 1.0175 -0.4108 -0.0870 0.8416 3-hydroxyadipate* 0.9267 -0.0297 0.6493 0.7197 0.9286 0.4065 -0.3592 -0.6428 1.0383 0.7479 1.1162 -0.4467 2.5257 0.8316 -0.6916 -0.1482 1.6810 1.3038 -0.5674 -0.6076 -1.8661 -0.7824 -1.6258 1.2298 0.0760 0.6988 0.5140 -0.6662 -0.8136 -2.2385 -0.3223 -0.2679 -0.3676 0.3523 0.8889 -0.5331 -1.1201 -1.7468 0.4119 -1.4738 -1.7570 0.7160 0.7524 -0.6474 -0.0964 0.4120 -0.3488 -2.0525 -0.6120 1.7568 0.1121 0.0539 0.4523 0.1637 -0.1940 0.7072 -0.2812 -0.3241 0.2678 0.4499 -0.5447 -1.2661 2.3684 0.3715 0.1246 0.1468 0.0479 0.1802 0.3229 0.0288 0.4354 -0.5636 0.0672 0.8805 0.9221 -0.2582 -0.7678 -0.2389 -0.3326 -0.2543 0.3879 -2.0317 -2.1763 -0.6180 -0.9732 -0.8667 -0.2393 1.7057 -2.4466 -1.7217 1.5925 0.3301 -0.2274 0.3068 -1.1374 -0.8213 -0.8622 -0.7899 -0.5176 0.1921 -0.6812 -0.8377 -0.2989 0.8204 1.2209 0.2386 1.7050 1.4240 1.3237 0.2297 0.1911 0.6535 1.0774 1.5096 -0.8455 -0.9137 0.5214 -0.3779 -0.3313 -0.8187 -0.5793 -0.1700 0.4695 -0.4692 -0.6733 -0.0780 0.3823 0.0759 -0.6701 -0.0831 -0.1868 -0.7384 -0.7289 0.1185 -2.2720 -2.4117 -0.1075 0.4976 -2.2159 -0.4625 1.9690 0.0321 0.3554 0.6214 1.3208 0.0680 -1.0775 0.5119 -0.6859 0.1096 -1.8315 1.2253 -0.4277 1.2490 -0.0570 -0.4165 0.2006 -0.3386 -0.1353 0.6719 0.5596 0.6273 1.7674 1.7343 1.9721 0.1822 -0.9430 0.2115 -0.4888 -0.5526 0.3416 0.9846 -0.3373 -0.1152 0.0536 1.7178 1.0243 0.3810 0.2160 1.7249 -0.5628 0.2083 0.2856 -2.2201 2.6213 0.0088 0.0579 -0.1501 0.0322 -0.6719 -0.1305 1.1155 -1.2981 0.8924 0.7615 0.2289 1.6756 -0.0223 -0.7535 2.0187 -0.3183 -0.3783 -0.2603 0.0219 0.0462 0.3254 1.2550 0.5408 0.4270 -0.0516 1.8241 -2.1550 0.1707 0.9998 0.9207 -0.8882 -1.1819 -2.5432 1.0125 -1.0857 0.8362 0.1643 -0.1457 0.1872 1.5552 -0.0105 -0.9411 -0.3051 0.0413 -0.9086 -1.1720 -1.3239 -0.7329 1.1297 0.1450 -0.3386 -0.8834 0.9910 0.0266 0.0270 0.6485 0.1233 0.2432 1.5108 -1.2588 -1.1115 -0.0722 -0.2608 -0.7729 0.0794 0.2175 0.1914 -0.0813 -0.4217 0.6333 -2.0995 -0.5632 -0.2622 2.5027 0.4598 -0.3024 -0.1237 -0.7444 -0.1258 0.0824 2.1698 -0.3908 -0.7703 -0.3634 -0.2430 -2.4349 -0.7794 -0.5989 -0.0641 -2.3552 -0.3410 0.6614 0.0669 -0.3581 0.5270 -0.7703 1.2165 -0.2928 -2.3998 1.0129 0.9641 0.4877 0.5916 -0.9423 -0.1765 1.1204 -2.5232 -0.3195 0.7280 -2.1837 -1.0133 -0.7564 0.9759 0.2697 -1.2777 0.4733 -0.5156 -0.6934 3.0613 1.2534 1.2477 -0.5351 0.5645 -0.9447 0.2272 1.0630 -0.7866 -0.6899 -0.7279 1.3333 -0.5495 -1.2141 -0.2237 -1.3897 -0.7121 -2.1717 1.5764 -1.1827 1.4018 1.3842 0.0950 0.8087 -0.0664 -0.1905 0.5573 -1.1840 -0.4339 -0.2531 0.4406 -0.6834 -0.4985 0.0451 0.5120 -1.2346 -1.4647 -0.0554 -0.4764 -2.5656 -0.6264 0.0632 -0.6887 0.8509 0.9528 1.6730 -0.0078 2.2073 -1.2354 0.7514 -0.1990 1.3963 -0.4620 0.4492 0.7326 -0.1439 0.0531 0.3028 -0.3396 0.4456 -0.1350 0.3516 1.3438 -0.8832 -0.4072 -0.0668 -0.3362 0.1319 0.7557 0.6370 -0.0732 -1.4518 3.4350 0.6292 0.8165 1.1013 0.1329 0.3570 0.0595 -0.2139 -0.3861 -0.8432 -0.4798 -1.1747 -0.2427 0.1786 -0.0310 -0.5574 -0.2406 -0.4809 2.6146 -0.7613 -0.5778 -1.1887 -0.6263 0.7445 1.1381 1.5437 0.0516 1.2822 -0.2579 0.3248 0.0832 2.7030 0.8921 0.5762 -0.2443 3-hydroxybutyrate (BHBA) -1.2438 0.3978 0.0172 1.9060 0.3014 0.8895 -0.2087 -1.2222 0.4386 -1.7477 1.0622 -0.5789 3.3810 -0.3965 0.6497 -0.7241 2.9225 1.3770 -1.3575 -0.0531 -1.1908 -0.5911 -1.3362 -0.8566 -0.5980 -0.7618 0.5992 -0.6140 -1.9609 -1.3475 0.0806 -0.9623 0.3720 1.3440 1.5366 -2.0907 -1.0602 -1.8998 -0.4907 0.3195 -0.7468 -1.7340 0.2515 -0.2913 0.5007 -0.2038 -0.7592 -0.8368 -0.6461 -0.4976 -0.9482 -0.5161 -0.1272 -0.1512 -0.0851 0.1381 -1.7050 1.9311 -0.5736 1.6914 -1.1147 -0.1906 -0.8089 -1.0083 -0.2617 -0.0181 -0.6425 0.2726 -0.9051 -1.5875 1.3826 -1.7003 -0.8536 -0.2008 1.1718 0.1747 -1.6870 -1.0475 -0.0382 -0.3634 0.2576 0.2738 0.6333 0.6378 -0.5406 -1.7284 -2.0879 1.7112 0.5000 -2.0772 0.2977 -1.6296 -0.3554 -0.7269 -1.6262 -0.5953 -0.1663 -1.2295 -0.1379 -0.3000 -1.1757 -0.6365 -0.5507 0.1976 -1.0662 -0.1143 0.2035 0.7532 2.4992 -2.0075 -0.2239 -0.5118 -1.0345 2.9386 0.1455 -0.7704 -0.3809 -0.8863 -0.6144 -0.0488 -0.7585 0.5260 -1.1444 -0.8954 -0.1615 -0.4721 0.7150 0.1545 0.1434 0.0818 -0.1788 -0.7277 -1.1507 -1.0903 -1.0014 0.5608 -0.0820 -0.3739 -0.2308 -1.8664 2.5698 -0.2540 0.2784 1.5213 -0.0344 -0.4272 1.0810 -0.5974 -0.7984 -1.0360 -0.3909 1.4447 -0.0593 -0.0316 -0.7625 -0.3370 0.5091 -0.3259 -1.0765 0.5535 -0.7844 -0.3387 -0.8255 1.8592 -0.6621 -0.0521 -0.8022 -0.8495 -0.3329 -0.4021 0.9801 -0.2504 -0.0982 -0.6767 -0.9791 2.6330 1.8137 -1.1968 -0.3893 -1.1202 -0.8277 0.0138 -1.1675 -0.0046 -0.2720 -1.1514 -1.3433 -0.3528 -0.9880 -0.4345 0.1679 -1.4643 -1.6040 -1.0200 0.4232 1.3884 -0.5114 -0.0707 0.5009 2.5261 -0.1613 -0.9798 -0.2932 0.0527 -0.4173 1.9032 0.9534 -1.2842 0.0202 -0.8721 -0.4715 0.7867 -0.3702 -0.0608 1.0175 -0.2492 0.3184 -0.3554 1.2543 -0.3719 2.6424 1.5173 -0.0117 0.1437 0.8258 0.6921 -0.1336 0.1935 -0.4993 0.3825 -0.6771 -0.9695 1.3607 0.0843 1.1458 -0.6081 -0.9101 0.7294 -0.0485 -0.4073 0.9069 0.3108 -0.5965 0.6093 -0.1979 -0.2546 0.5170 -0.1283 -0.6822 -0.3040 2.3067 -0.0068 -0.1630 1.2904 -0.6303 0.5209 0.2107 -0.1556 3.5915 0.6004 0.0453 -0.5098 0.4078 0.3804 0.2789 0.8896 -0.2395 0.2742 -0.3022 -0.5994 0.0129 -0.3481 -0.3089 0.3360 0.3043 -0.3203 2.2935 -0.0515 -0.5816 0.0219 -0.0668 -1.1203 -0.1699 0.4535 1.8092 -0.7287 0.1069 -0.2050 0.9720 -0.5873 0.5884 -0.4884 -0.1843 0.4139 0.9309 -0.5470 0.1976 1.5738 0.0060 -0.4846 -0.0071 0.3215 -0.3956 0.5663 -0.1545 0.0254 -0.3946 0.5694 1.6424 -0.1672 2.1013 -0.0172 0.1420 -1.4533 2.7286 0.4033 0.1573 -0.4915 0.1181 -0.7150 0.0637 1.9022 1.0766 1.0477 -0.6928 0.9080 -0.2543 0.0145 -0.1770 0.5398 -0.5500 -0.2493 -0.1177 1.7214 -0.0878 -0.2342 -0.8384 1.6196 -1.4606 -0.0081 0.3053 -0.4118 -0.1014 0.1119 0.1267 -0.7137 -0.1610 -0.9578 2.0682 -0.9740 2.5565 1.3478 -0.3554 1.0112 1.0329 -0.1941 2.6772 0.9597 -0.3200 -0.1153 0.2239 -0.6973 -0.3772 0.5029 2.4668 0.0847 -0.3703 -0.0376 -0.2392 -0.1543 -0.0253 0.8675 1.8476 1.4643 0.0610 0.2547 0.5407 -0.6628 -0.9555 -0.8795 3.0367 -0.0431 0.0711 1.4956 -0.2033 -0.1126 -0.1856 0.1775 0.9409 1.4297 -0.6771 -0.8474 -0.2638 -0.0648 0.4335 1.0276 -0.1440 -0.1120 -1.0759 -0.8427 -0.0250 -0.6007 -1.4402 -0.2604 0.7344 1.6696 3.3792 1.1587 0.0624 -0.4009 3-hydroxydecanoate 0.8782 1.5380 1.2207 1.3549 0.1804 1.5423 -0.0760 -0.0638 1.6225 -0.3825 1.6045 0.1349 1.9696 -0.0330 0.7938 0.1166 1.6771 1.7881 0.5826 -0.7896 -1.6176 0.0762 -1.9028 -3.5758 0.5319 -0.8657 1.0835 -0.9407 -1.5190 -0.7676 0.3769 -2.3110 0.4431 0.5743 1.2435 -0.1209 -1.0836 -0.0812 0.0912 0.2777 -3.1648 -0.9895 1.0354 1.4567 1.4004 1.4654 -0.7819 -0.4136 -1.6081 -0.1814 -0.6583 0.5820 -1.7498 2.5014 -1.7626 0.3187 -1.9026 0.0743 -0.6634 1.4326 -0.8324 -1.0195 0.1825 0.4042 -0.0946 -0.1788 -0.1299 0.0971 -0.4584 -2.6366 1.6891 -0.1837 -0.5237 -0.1103 0.8483 0.7456 0.1962 -2.8670 0.2868 -0.4468 -0.2024 0.2297 -0.0845 0.7749 -0.1785 -1.4816 -0.3770 1.1784 -0.0136 -1.8941 0.4609 -1.5841 -0.7460 -2.9774 -1.3296 -0.4710 -0.6194 -0.2257 -1.8557 0.2189 -0.8301 -0.6700 -0.2716 0.7925 -1.1478 0.6269 0.6229 1.1062 2.2474 -0.7134 0.1252 -0.9051 1.5746 2.0040 1.1320 -0.9683 -1.8650 -0.7851 0.3768 0.0045 -0.1690 -0.0014 -0.9361 -1.1559 -1.7183 -0.7521 0.3343 -1.4711 -1.3078 0.7596 0.7809 0.7263 -0.8736 -0.0974 -1.4422 0.2172 -0.4195 -0.5302 -2.7561 -1.3629 1.5015 -1.7894 -0.2557 0.9969 0.2555 0.3675 1.1048 0.6488 0.5729 -0.8607 0.2383 0.8771 0.2779 0.5700 0.9512 0.3643 1.3609 -1.2155 -0.6802 0.7157 0.4368 -0.0982 -0.0738 1.0477 0.8523 0.4563 -1.4015 -1.2781 -0.7664 0.0108 0.0164 1.1716 0.4439 -1.5981 -0.0266 1.2814 1.9656 -0.7513 0.9447 0.0356 0.0019 -0.2077 0.1371 -0.2867 -0.6455 0.0912 -1.0968 -1.0692 -0.2114 -0.0048 -0.6165 0.9164 -1.0504 -0.1207 0.0338 0.9068 0.0434 -1.3197 -0.3857 0.5600 -0.0277 -1.1340 -1.0269 -0.5009 0.7636 1.1254 0.3417 -1.4960 0.7209 -0.1818 -0.7008 0.5814 0.4364 0.5760 -0.3036 -0.9662 -1.0268 -0.2012 1.2398 -0.0588 2.4548 0.8015 1.2990 -1.2962 -0.5953 0.0587 -0.5669 -0.0957 -0.4879 -0.8297 0.1553 0.4923 1.3903 -0.6827 0.1796 0.1092 -0.2059 1.0529 -0.3210 -0.0919 1.5830 0.7137 0.6352 0.9102 -0.8344 0.3444 0.6788 -0.5247 0.3499 0.5870 -0.1637 1.0683 -1.0006 0.9822 1.4166 0.1148 0.3002 0.3537 1.6265 0.6298 0.1664 -0.3508 -0.7664 -0.1347 1.5170 0.1884 -1.0115 -0.0235 -0.8122 -0.7317 0.0279 -0.8135 0.3442 1.6755 -0.5662 -0.6345 1.4524 -1.3879 -0.9581 1.4446 -0.5139 -0.4156 0.3476 0.0335 1.0432 -0.6601 0.1256 -0.2661 0.3637 -0.6245 -0.0277 -0.0985 -0.9412 0.1759 -1.0531 -0.1489 0.1145 0.7336 0.2750 -0.5887 -0.3344 -0.7904 -0.0382 0.7462 -1.3440 -1.0822 0.1805 -0.0650 1.1678 0.2562 0.5035 -0.7435 0.0764 -1.4650 0.1934 -0.9212 0.2393 -2.2480 -0.1591 -0.3707 0.8021 2.2301 0.8499 0.3898 -0.4191 -0.1749 0.0485 0.5640 -0.6683 0.2473 -1.1825 0.0723 -0.2885 0.9932 0.2980 -1.0478 -0.1944 1.9547 -2.2066 -1.0291 0.5889 0.9808 0.2940 0.5901 0.3305 -0.2729 0.1711 -0.4483 1.0790 -1.2599 0.5292 1.7150 0.4225 0.4840 1.3398 -0.8366 2.0747 -0.0730 0.7218 -0.3431 0.0972 -0.6720 -0.9263 0.6703 1.7133 0.7932 0.1793 -0.1333 0.9833 -0.7905 0.3061 -0.2716 1.7368 1.7880 0.6446 1.4393 -0.0721 0.1660 -0.8827 -0.5158 0.5488 -3.1292 -1.4069 0.7952 0.1115 -0.2893 -0.5469 0.5505 0.4242 1.1036 0.4330 -0.7789 1.7543 -0.6349 0.2404 1.7737 -0.4835 -0.0358 -0.4369 -1.3410 -0.1013 1.5515 0.1365 -0.8264 1.1283 1.1389 2.2321 -0.5999 -0.0189 -0.3059 3-hydroxydecanoylcarnitine 0.2646 0.6173 1.6676 1.1283 0.8001 0.8471 1.5680 -0.6737 1.2700 0.6633 1.5266 0.1277 0.2225 0.0974 0.0055 -0.1655 1.2251 0.9091 0.5943 0.6669 0.0983 -0.4123 -1.1111 -1.4446 1.0300 -0.2933 1.8363 0.3347 -1.2119 0.2703 -0.3596 -1.5820 0.8445 0.5672 0.9900 -0.0451 -0.2845 -0.5670 0.0542 0.9902 -1.1789 -0.0245 0.7756 1.6307 1.2843 0.8511 -0.4138 -0.9020 -0.8094 0.6512 -0.0415 0.3749 0.0536 2.3216 -0.3851 0.8114 0.1559 0.5758 -0.6125 1.8160 -1.0526 -0.7116 -0.6048 -1.9793 -1.6732 -0.3999 -0.3194 -0.0023 -0.2914 -0.6200 1.5743 -0.1165 0.0974 -1.3598 0.7172 -0.1270 -0.6570 -0.3600 -1.6638 -0.6932 0.6627 -0.0192 -1.0330 0.5531 -0.4994 -1.1836 -1.1645 1.1169 0.6191 -0.6354 1.4681 0.1821 -0.0122 -2.6662 -0.0885 0.2602 0.0136 -0.4301 -0.8336 0.3299 -0.3178 -0.5232 -1.2901 -0.2162 -0.4137 -1.0771 1.0650 1.1722 1.1784 -0.4341 -0.5015 0.1626 0.4106 0.8997 0.7262 -1.7854 -1.6972 -1.0650 -0.5164 1.0672 -1.3134 0.8276 0.1370 -0.2221 0.6252 -0.9843 0.7648 -0.7703 -0.0401 -0.8494 -0.2550 0.3793 -0.7379 -0.8061 -1.3862 -0.5402 0.1768 -0.6154 -1.1110 -2.5162 0.7418 -0.5066 0.3736 0.5744 0.9313 -0.0077 0.4855 -0.3544 0.8129 0.3842 -0.3442 2.2700 0.9951 1.3774 1.5346 -0.8095 1.4461 -0.5072 -0.2771 1.0988 -0.0892 0.1885 0.2370 1.2000 0.4060 -1.9820 -3.3033 -1.4775 -0.6404 0.0277 -0.1584 -0.2569 -0.3446 -1.0946 0.6649 1.1011 0.9171 0.0226 1.3573 0.1294 -1.4754 0.1122 -1.1082 -1.8399 -2.8817 0.7380 -0.5095 0.1720 -1.5377 -2.9749 -0.1196 0.3754 0.2278 0.7763 -0.5738 -0.5636 0.7763 -0.5231 0.3440 0.9287 0.3976 -0.1864 0.1067 -1.3418 0.2071 0.3105 1.3063 -0.7572 -0.9494 -1.3020 0.0319 -1.2278 -0.1750 -0.6312 0.4780 -3.2006 0.2520 0.0292 -0.0455 -0.2999 0.6586 -0.1027 0.3899 -1.4260 -3.5750 -0.5830 -0.0214 -0.1469 -1.7766 0.2982 -0.6825 -1.1526 1.2394 0.2463 0.7678 -0.0181 -1.1904 1.3882 -0.0441 0.3088 1.3308 -1.2497 1.1604 1.3900 -0.5709 0.1904 0.8143 -0.2271 -0.9392 -0.6983 -0.1655 -0.1257 -1.7012 1.1933 1.4254 -0.4970 0.8005 0.5163 0.4806 0.2816 0.5318 -1.1721 0.1058 -0.3483 0.5485 0.1146 1.0131 -0.2622 0.3087 0.6166 0.3950 -0.6235 -0.2255 1.0277 -0.3889 -0.1758 0.8019 0.0483 1.2167 1.1952 0.9941 -0.4706 -0.2294 0.5442 1.5980 -1.0878 -0.1660 -1.2027 -0.0917 -1.9394 1.0733 0.3118 -1.3152 0.6363 -0.0581 -0.7421 -0.1322 0.0741 0.9928 -1.5181 0.1694 -3.3302 0.8473 0.2621 -0.0467 -0.5358 -0.3108 0.8711 1.4620 -0.2106 0.9168 -1.2038 -0.6465 -0.3362 1.3653 -0.2125 -0.4201 -0.2092 -0.0495 -0.2767 0.2020 1.2019 -0.4139 0.2795 0.3133 0.5159 0.9224 -0.2221 -0.3137 -0.8354 -1.6261 -0.3398 1.7032 -0.1457 0.7683 -0.5519 -0.9653 0.9640 -0.5775 -2.9459 -0.1534 0.6384 0.1330 0.5661 -0.1735 -1.7699 0.2808 0.5614 -0.2840 -0.3928 0.3447 1.8671 0.2875 0.4870 1.5286 -0.6960 1.5241 0.4752 1.0486 0.2042 -0.4862 0.0332 -0.5913 0.8920 1.4327 0.5518 0.0419 -0.0658 0.8012 0.7013 0.5502 1.3285 1.4279 1.8929 1.4559 0.5187 0.7315 -0.0709 -3.3920 0.3080 0.8495 -1.8424 -1.6374 0.4603 -3.7161 1.1893 0.1077 0.5325 0.6413 1.3485 0.0125 0.4081 1.6153 1.3947 0.4610 1.3345 0.1264 -0.3530 -0.7637 0.1233 0.9883 1.3680 -1.2127 -0.0380 0.6664 1.4422 0.3679 -0.8181 0.2173 -0.3109 3-hydroxyhexanoate 0.2999 1.0723 0.2202 1.1425 0.2012 0.1083 0.8141 -0.9952 1.0065 -0.7591 -0.9778 -0.7611 1.5007 0.7975 -0.3912 -1.4480 2.2316 0.6553 -0.1687 -0.4725 -0.2649 -0.8129 -1.3106 -1.6584 0.6477 0.0054 0.4936 0.0476 -1.5379 -0.4171 -0.3409 -1.2935 0.2231 1.0330 0.0872 -1.5018 -0.9796 -0.2252 0.0774 0.0064 -1.9478 -3.6710 1.9879 0.0266 0.6733 0.9294 -0.8369 -1.6395 -0.9770 -0.5772 -0.2154 0.3057 -0.1556 0.2498 -1.5596 0.6334 -0.7862 0.0332 -2.2743 0.7642 -1.2388 -0.6546 0.7832 -1.0928 0.2663 0.1279 -0.9426 0.2353 0.1328 -0.3210 0.3132 -1.1612 -1.6608 -0.8445 0.0662 -0.2921 -1.4885 0.7644 -0.9110 -0.5918 0.0789 -0.2114 -0.5279 -0.2436 -0.6527 -1.0995 -0.1647 1.0098 -0.8798 -1.0229 -0.4069 -2.5155 0.0891 -1.6110 -1.6740 -0.0496 1.5943 -0.3321 -0.6047 0.5749 -1.2588 0.3593 -1.3063 0.9303 -0.2662 -1.2213 0.1609 1.5296 1.4618 -0.7775 0.4584 0.1185 0.7206 1.4926 0.4188 -0.2658 -1.7777 -0.1581 -0.3669 0.0282 0.2444 -0.0648 0.6615 -1.8937 -0.0612 -0.6371 1.3936 0.6128 -0.6778 0.5540 0.5734 0.1763 -0.9575 -0.5551 -2.0139 0.6756 -0.0660 -0.1856 -0.5399 0.4726 2.1164 0.0327 0.4858 1.3773 1.7377 -0.8828 -0.3880 1.2746 0.2052 0.4065 -0.3285 1.5653 1.0622 0.9096 0.9028 -0.7147 0.4453 -0.9318 -0.6201 0.4976 1.5270 0.7252 -0.1865 1.3586 -0.4573 0.4233 -5.4043 -0.1194 0.0448 0.8032 0.7927 -1.4333 1.6595 -2.0692 0.4190 1.0083 1.6969 -1.2313 0.5879 0.9057 -1.9661 0.3900 0.8857 -5.2035 -0.5943 -0.3100 -0.0845 0.3049 -0.9912 -0.1256 0.9271 -0.7887 -1.1090 -0.8269 1.6767 -0.6267 0.1748 0.7645 0.4559 1.8238 -0.1847 0.8181 -1.4752 -1.0698 -0.0832 0.2648 -0.1280 -1.9228 0.0553 -0.7079 0.2288 0.4696 -0.3776 0.2989 0.0116 -0.7109 -0.5867 -0.2324 0.3922 -0.3080 1.1078 0.6694 0.2387 -1.2011 -0.2892 0.4914 -1.3101 0.1587 0.1200 -0.2398 -0.7233 -0.8865 0.4216 -0.3190 0.3030 0.6098 -1.0793 1.1768 1.1528 -0.8700 0.6038 0.7180 -0.4451 1.1500 0.0530 0.7570 -0.2055 1.1082 -0.5321 -0.3999 0.3314 -0.0306 0.4795 0.0438 1.0236 -0.2202 -0.4395 -0.0862 2.7876 -0.6250 -0.1061 -0.8152 0.6209 0.7923 -0.2820 0.4684 -0.2966 0.2202 -0.6200 -0.1756 -0.5057 -1.4014 0.6771 1.0787 -0.8685 0.2573 1.0302 0.3017 0.2127 0.5929 0.7409 -1.4442 0.1621 0.5401 1.6364 -1.2915 0.5787 -0.4696 -0.5237 -0.1583 0.3171 0.1780 -0.3007 1.2869 0.3235 -0.1055 -0.0526 2.8022 0.0226 -0.8660 -0.0716 -0.6267 0.1086 1.2806 -0.4903 -0.6702 -0.6817 1.1169 -0.2531 0.0594 0.7032 -0.6192 -0.0318 -1.0852 1.7072 0.5544 0.4020 0.1107 0.4822 -0.4386 0.2745 1.6352 -0.6489 0.6063 1.0374 -0.6301 0.5888 -0.1379 0.1142 0.8881 -0.6617 0.5657 0.2578 1.1455 0.2698 0.0570 -1.3248 1.0467 -1.5365 -2.1386 1.4320 -0.1104 0.2720 0.1581 -0.3686 0.1063 0.3936 -0.5124 1.0393 -0.8235 1.2588 1.3280 0.4534 0.4164 0.3033 -0.9165 2.0089 0.9093 -0.2715 0.2447 -0.4369 -0.6077 -1.3762 -0.1146 1.5317 0.8353 -1.4282 0.5658 0.6285 -0.3549 -0.3329 1.6441 0.9998 1.1746 0.2593 0.1834 -0.0940 -0.7733 -0.7728 0.6217 0.8696 -2.0757 0.9249 0.1512 -1.0637 -0.9045 0.2371 0.3237 0.8058 0.1723 -0.5584 1.4598 0.9015 1.0232 0.5077 0.8056 0.6763 -0.6356 0.4252 0.4341 2.1203 1.6243 -1.8577 0.7424 1.4795 0.7191 2.3687 -0.6051 -0.6644 -0.8901 3-hydroxyhippurate -0.5910 -0.8691 -0.5038 -1.7132 0.9313 -0.4835 -0.2022 0.8083 -0.6053 -0.7110 -1.6717 0.7764 -1.7490 0.1963 0.3467 0.1533 -1.3611 -0.7065 0.3626 -0.2143 -0.1158 1.4208 1.6885 0.1144 -1.7701 0.0473 -0.8655 0.7759 0.5777 1.8371 1.1046 1.7544 -0.0949 0.6662 -2.0819 0.4078 1.3079 -1.5769 -0.6952 -0.8968 0.1005 0.6915 0.3316 0.4734 -1.6588 -0.1796 0.6936 -0.5237 1.5387 1.7417 0.5698 2.0409 0.8431 -1.8839 0.4526 0.2887 0.2349 -1.0824 0.6521 0.6863 0.9242 0.3034 -0.1033 0.1411 0.3099 -0.9022 -0.1032 -0.9764 -1.2384 -0.6243 0.8267 0.0942 0.9128 -0.1565 -0.3848 -1.0253 1.2080 -0.0204 -0.2378 0.3258 -0.5288 -0.2004 0.4862 1.7069 1.0161 -0.1008 -0.7217 0.7671 -0.1771 1.8389 -0.4189 0.1640 -0.0860 -1.4992 -0.3081 0.2272 -1.7779 0.3007 0.0253 1.1412 1.4812 0.2038 0.8621 0.8399 1.6212 1.5020 -1.8517 -1.8389 -0.8212 -1.7002 1.1213 -1.9474 -0.5722 -1.8043 0.4698 -1.7889 0.0608 -1.1339 0.1325 -0.2606 -0.3567 -0.7113 -0.0960 0.8924 -0.3577 -0.1552 0.6972 -0.0039 -1.8828 0.1318 0.8891 0.4709 -0.4947 0.1509 1.9437 -1.9348 -0.0035 0.8949 0.5062 0.5490 -1.6149 -0.0531 0.1212 -0.0253 1.8516 1.6658 -0.5078 0.6934 0.5602 0.7461 0.6801 0.8078 -1.7069 -2.2027 0.4900 -0.3369 -1.7809 0.1781 -0.6936 0.0268 -0.6071 0.8881 0.3821 0.2960 1.7987 -0.4667 -0.1391 -1.0480 1.1477 0.0841 -0.7143 -0.0206 0.7367 0.3228 0.5847 -0.7666 -0.4015 2.1417 1.9743 -0.8250 -0.1512 0.6503 -1.8517 0.5098 0.4985 -0.1780 1.6939 -0.2609 -0.5295 -1.7052 -0.3030 -0.2949 1.0151 -1.6694 -0.8202 0.0429 1.2865 0.6519 -0.9099 -1.5521 0.0761 -0.7329 -0.2328 1.2513 -1.4341 0.4147 0.5287 -0.4418 -1.0275 0.1551 1.4448 0.0961 1.0864 0.6618 -0.6267 -0.7354 1.2794 0.0448 1.9713 1.7734 -0.8423 -1.0267 -0.2927 1.2639 0.8018 0.3220 0.5623 1.6791 0.1092 -0.7918 0.5652 -0.8250 1.4946 -1.6108 -0.4757 1.7078 -0.9606 0.4717 0.7007 -0.9958 -1.0902 1.7583 -0.0409 -0.4549 0.7746 0.4052 2.3206 0.7494 0.0090 -0.2911 -0.4787 1.4826 2.0390 1.0171 -1.8967 -0.2185 -1.0644 -1.8796 0.1221 0.6412 0.3263 -1.6952 -0.2870 -1.2689 -0.1468 -1.5449 -0.4163 0.5161 0.7365 -0.2170 1.3954 0.2240 -0.9324 -0.5664 0.6474 -0.1113 -1.8801 1.6541 0.2315 -1.6164 -0.3225 0.0243 0.6300 0.6675 0.9604 -1.2228 -1.0074 -1.8392 0.0860 0.3903 -0.5506 -0.1550 1.1269 -0.2206 0.1624 0.5164 -0.0297 0.4599 0.0814 0.9245 0.5201 1.5747 -0.4503 0.8727 -0.6466 1.2209 -0.9428 -0.1544 -1.9619 0.4748 0.9915 0.1925 -1.2436 0.9140 -0.4758 0.7808 -0.8483 1.0560 1.3658 1.3737 -1.8272 0.0422 -0.2508 -0.7953 0.6569 -0.5668 -1.8655 0.5706 1.0383 -1.9856 -1.7448 -0.4471 0.1348 -0.3479 -0.3200 0.7007 1.0506 -0.3838 0.4383 -0.8190 -1.8288 -0.5390 0.2414 0.2861 0.3658 -0.3552 0.1671 1.1031 0.2918 1.5558 -0.6090 0.6130 -0.6078 -2.1057 -1.3548 -1.3997 0.1274 -0.1183 -0.0072 -0.2546 -0.1058 -0.5866 -0.6379 0.6074 -0.3015 1.8560 0.8189 0.0768 -0.0392 0.9114 0.7974 0.3323 -0.9512 -1.8185 -1.1609 0.6158 2.5909 1.1592 0.8467 -1.4629 -0.3628 0.6174 1.2069 0.2910 -0.6218 -0.2120 2.0543 0.3319 0.1142 -0.5870 1.0004 -0.6084 -0.1005 -0.4958 -0.7136 -1.0294 0.3219 -1.9188 -0.4800 -1.2992 0.1184 -1.3672 0.8411 -0.4845 1.7562 -2.1801 -0.5681 0.0661 -0.0991 1.3187 3-hydroxyisobutyrate 0.2937 0.5980 0.9177 -1.5699 -0.1171 0.1373 1.5408 -0.5953 -0.3164 0.3853 -0.5294 -1.5746 -3.9255 0.7707 0.2141 0.2313 1.3904 -0.0407 -0.1027 -0.3384 -1.4897 -0.5213 -1.5126 -0.0597 -0.9969 0.3424 -0.8924 -0.3165 -1.0762 0.0667 -0.5173 -0.4806 1.4811 0.7894 1.3047 -1.5579 -0.4207 0.1876 0.1460 -0.3710 -1.5585 -0.7907 1.9198 -0.2064 0.3724 1.0346 -0.0691 -0.7471 -0.6859 -1.4107 -0.6287 0.7823 -0.8141 0.0446 -0.7003 -0.0017 -0.8974 0.5185 -0.2996 1.0391 -1.0600 0.2761 -0.0411 -0.0123 0.2706 0.5914 -0.8675 -0.4461 -0.6835 -1.2124 1.6768 -1.3004 -0.5367 0.6662 0.9742 0.7122 -1.4994 -0.0824 0.9112 0.7253 -0.0745 0.5482 1.6288 -0.1753 0.8790 -1.9551 -1.6634 1.5934 -1.0930 -2.0005 -0.0067 -1.3035 -1.0122 -0.3015 -0.1125 0.0846 -0.5200 -1.1166 0.0926 0.1553 -1.1655 -0.0828 -0.5266 0.9526 -0.7338 -0.1093 -0.5672 2.1664 1.9186 -1.4215 -0.1867 -0.6569 -0.9216 3.0982 0.4259 0.1791 -0.6076 -0.6670 -0.6790 0.5140 0.4400 0.6148 -0.0960 -1.4051 0.4684 0.2655 0.0416 -0.6779 -0.8805 0.2577 0.5614 -0.0553 0.2435 -0.8711 -0.3570 1.0587 0.2383 -0.3465 -0.7757 -1.6783 0.7952 -0.0400 0.6313 0.4935 -0.6026 0.3073 -0.0076 0.1131 -1.2220 -1.0948 -0.3986 0.0822 0.2238 -0.5117 -0.7421 -0.8125 1.0061 -0.0003 -1.1652 -1.2170 0.2113 -0.1608 0.5482 -1.0982 -0.3292 -0.3240 -1.0169 -0.5564 -0.9509 -0.4338 -0.1392 0.1225 -0.8278 -0.7364 -0.7051 2.0547 1.8959 -0.4686 -0.5690 -0.5185 0.1583 1.3947 -1.3372 -0.3753 -0.6006 -0.1964 -0.4932 -0.0775 -0.6384 0.0225 1.2678 -0.4326 -1.8636 -0.8723 0.5486 0.3581 -0.9267 -0.2922 1.0660 1.4426 0.4157 -0.5042 -0.2522 0.4431 0.3804 1.4602 0.8316 -1.5472 0.0882 0.4379 0.8840 1.8297 -0.1416 0.3709 1.2005 1.3736 0.9703 1.5394 -1.8662 0.4702 -4.1428 1.0243 0.3381 0.1299 0.5810 1.4262 -0.5232 1.6773 -0.2555 0.3379 -0.1824 -1.1007 1.2447 0.3029 1.8713 0.3430 -0.0180 -0.3795 0.3185 0.2097 -0.0268 0.5698 -0.5363 3.2298 -0.3545 -0.0590 0.8974 0.2209 0.6632 0.4815 1.8873 -0.8201 -0.7967 0.8091 0.3888 0.5339 0.2803 0.7659 -4.0008 -0.1222 0.2503 -1.2671 0.7487 1.2917 0.8512 -0.6916 0.1896 -0.1860 -0.3598 -1.2672 0.8665 0.0179 1.0909 0.6592 0.8563 0.0119 1.9807 -0.4081 -0.7058 -0.5638 1.4945 -1.6923 -0.5553 0.7887 -0.4228 -0.2666 -1.2938 -0.2796 2.0870 -1.1931 0.8751 -0.3558 0.3646 0.4329 1.1919 0.6703 1.0868 1.8427 1.1939 -1.6687 -0.0761 0.1828 0.3750 -0.4697 -0.1068 1.0416 0.2922 0.6256 0.4275 1.6245 1.3334 -0.5684 0.7058 -0.4486 1.3037 -0.5394 0.1879 -1.0089 1.5794 -0.4711 -0.3411 -1.8235 0.8479 0.8381 -1.1911 0.1922 -0.1516 0.5921 -0.1793 -1.4315 -0.5276 -0.7242 -0.2821 1.7393 0.4013 -0.0632 0.1375 0.0600 -1.4340 -0.6336 1.4016 -0.2940 -0.1929 0.7274 0.4892 -0.3416 -1.4546 -0.8920 1.7045 -0.9662 -0.7779 0.5379 -0.1564 1.0372 1.0571 0.6900 0.9522 0.1828 0.9258 0.4824 0.0716 -0.0741 0.4730 0.9151 -0.1695 0.3276 -0.2775 1.3336 -0.0558 -0.8086 0.0087 1.4802 1.4161 2.0252 -0.5625 0.3303 -0.8311 -0.5144 -0.1891 0.6180 -4.1642 -0.3193 -0.1156 1.7150 0.7860 -0.0750 -0.4253 -0.0989 0.8306 0.7125 -0.9811 -0.4290 -0.1262 1.3479 0.2393 0.7197 0.5528 1.5729 -0.9951 -0.3501 -1.2341 -0.2053 -0.5316 0.4157 0.2798 -0.3383 -4.0351 1.1851 -0.9296 0.0364 3-hydroxylaurate 0.6514 0.6710 1.4755 1.8680 0.5910 1.5684 0.5121 -0.1631 1.2553 0.7227 1.5527 0.5243 1.3661 -0.5631 -1.0913 -1.1782 1.1962 1.7920 0.4900 0.0655 -1.7226 0.3756 -1.0274 -0.8859 0.6492 -0.7406 1.0504 -0.3922 -1.7570 -0.0915 -0.0804 -1.2658 0.5206 0.7306 1.4118 0.0549 -0.5295 -0.1482 -0.4576 -0.3576 -1.2730 -0.6740 0.5211 1.8985 2.0577 1.5524 -0.9597 -1.1668 -1.9268 0.1839 -0.0766 0.9538 -1.0966 3.3830 -0.9348 -0.1082 -2.1963 0.8891 -0.0815 1.4967 -1.3328 -0.6476 -0.5872 -0.2704 -0.8228 -0.7718 0.1754 -0.5882 -0.6384 -1.3001 2.0967 -0.4779 0.0115 -0.5826 0.8046 0.4171 -0.9242 -1.8392 -0.8138 -0.9223 0.1200 0.4413 -0.7728 1.4371 0.2076 -1.1008 -0.6582 1.3553 0.0550 -2.1422 0.4752 -0.5496 -1.1149 -1.0838 -0.5960 -0.7448 -0.1123 -0.1832 -0.6645 0.6588 -1.0467 -0.6950 -0.9650 -0.4878 -0.4818 -0.3139 0.9161 1.2205 2.5543 -1.0886 -0.1713 -0.8025 0.5414 1.9292 1.1932 -1.2051 -0.9200 -1.0107 0.3867 0.9151 -0.2358 0.3407 -0.9695 -1.0641 -1.0099 0.1362 0.2449 -0.5945 -0.2958 0.2162 0.0333 0.0715 -0.4468 -0.4928 -1.6450 -0.2606 -0.0300 -0.4608 -1.2787 -1.4189 1.0753 -1.0377 0.1490 0.5229 0.1421 -0.3832 1.2747 0.5413 0.2125 -0.0780 0.0199 1.5915 0.3671 0.4730 1.1399 0.2802 1.8308 -0.5829 -0.5395 0.5235 -0.3336 0.0521 0.1317 1.1469 1.1954 -0.3873 -1.0798 -1.3786 -0.9013 0.5945 -0.0918 0.4550 -0.1265 -0.7250 0.2635 1.5543 1.0668 -1.6421 0.9661 -0.8716 -0.5826 -0.3232 -0.3955 -1.3415 -1.2120 0.0416 -0.6421 0.3421 -0.0485 -0.7985 -0.4403 0.9996 -0.8665 0.4065 0.2050 0.5856 0.9213 -1.1956 0.4809 0.7989 -0.5128 -0.5042 -0.0994 -2.0099 0.3182 0.6632 1.1943 -2.9898 -0.1002 -1.2037 -1.0165 -0.3260 0.0944 -0.4139 0.4869 -1.3897 -0.5465 -0.1842 0.9129 -0.1612 2.0224 0.6331 0.6452 -1.6641 -0.3372 -0.2566 0.2187 -0.3917 -1.0932 0.0392 -0.0495 -0.5498 1.4757 -0.9982 0.6629 -0.5681 -0.3945 1.4028 -0.1093 0.4024 2.1952 0.4155 0.9148 0.0448 -0.5246 -0.3123 0.7205 -1.5205 -0.7016 -0.1577 0.1578 1.1368 -1.1273 0.8324 1.2548 -0.2454 1.0264 0.0716 1.0984 0.6907 0.2991 -0.6464 0.0449 -0.4445 1.6729 0.3826 -0.3454 -0.2862 -0.7257 -0.6169 0.1215 -1.2249 0.0829 0.7568 -0.6030 -1.2527 1.7007 -0.4578 -0.1705 1.8418 0.1146 -0.7496 -0.3651 -0.1085 0.9767 -1.1897 -0.1756 -0.0506 0.2884 -0.7067 -0.0333 -0.2432 -1.6021 0.0648 -0.6220 -0.0595 -0.0971 0.2995 0.2432 -0.0771 -1.1811 -1.1202 -0.0226 1.3518 -0.8984 -1.3152 -0.1608 0.1581 1.7769 -0.0589 1.2701 -0.9671 -0.4743 -1.1583 0.6449 -0.6817 0.2655 -1.9339 -0.8107 -0.3364 -0.1232 2.3083 0.3531 0.4717 -0.3303 0.1857 0.9095 0.4708 -0.3291 -0.4501 -0.9958 0.1407 0.8765 1.0894 0.0193 -1.8961 0.3369 1.9281 -1.7441 -1.4145 0.5776 1.5537 -0.1241 0.3330 0.3546 -0.4883 -0.2376 -0.3679 0.7219 -1.0989 0.0169 1.6452 0.4751 0.8166 2.3978 -1.2777 2.1012 -0.2413 0.8579 -0.1097 -0.7366 -0.6631 -0.8733 0.9774 1.9432 -0.6575 -0.0181 -0.3183 1.1415 -0.1703 0.3871 -0.4031 1.7147 2.2549 0.7723 2.1239 0.2493 0.4988 -0.3575 -0.4054 0.9222 -4.9675 -1.4963 1.1741 -0.8423 0.2886 -0.7312 1.2190 0.1033 1.2523 0.6464 -0.8508 1.5868 -0.3383 -0.0685 1.9454 -0.8282 -0.2214 -1.6011 -1.4831 0.0614 1.8901 0.1986 -1.1255 1.2890 1.3157 1.3783 -0.8563 0.3019 0.2549 3-hydroxyoctanoate -0.1613 1.5797 0.5511 0.7143 -0.1710 0.7235 0.9005 0.0950 1.3863 -0.2154 0.8384 -0.0110 1.8664 0.8289 0.6596 -1.4579 1.4757 1.2957 -0.1427 -0.4033 -2.2050 -0.3816 -0.7644 -2.4292 0.4274 -1.0005 0.7397 -0.5576 -2.2016 -0.9519 -0.3400 -1.5030 0.6161 1.2352 1.0976 -0.5626 -2.4085 0.1566 -0.3000 0.1908 -2.0724 -1.7475 1.0750 0.8629 0.8839 1.3172 -0.7551 -1.2431 -2.4546 -2.4508 -0.7308 -0.3084 -2.3771 1.0543 -1.9975 0.0053 -0.5689 0.5482 -0.7886 1.0897 -2.2208 -0.9280 1.2160 0.3212 -0.6087 1.2605 -0.9106 0.5240 0.1459 -0.5523 0.8971 -0.6766 -2.5936 0.4608 0.5652 0.0517 -0.7228 -0.9417 0.2981 -0.0516 -0.2537 0.1844 0.4307 -0.0958 -0.2772 -1.3552 -2.2461 0.8448 -0.4379 -0.5520 0.2563 -2.3776 -0.0801 -1.9225 -0.8839 -0.2215 -0.5357 -0.3974 -0.8137 -0.0879 -2.7485 -0.3668 -2.2311 0.5529 -0.4398 -0.5041 0.8904 0.7720 1.3381 -0.8288 0.6420 0.1119 2.4485 1.6651 1.5371 -0.6220 -0.9772 -0.0861 0.7625 0.2876 0.1622 -0.6476 0.3807 -2.6660 0.0919 -0.2633 1.2016 0.1154 -0.8402 1.0047 0.5417 0.4459 -0.8413 -0.3425 -0.4592 0.1688 -0.5585 -1.9752 -1.1580 -0.4664 2.1511 -1.0290 0.0581 0.8095 0.2705 -0.3843 0.4820 0.3359 0.3643 -0.3609 0.2781 1.3093 1.1847 -0.0103 0.4965 -0.1788 0.7977 -2.1748 -0.1972 0.9567 0.7859 0.5635 0.1594 1.0026 -0.0823 1.4242 -2.7266 -1.1678 -0.4577 -0.0587 0.6053 -0.2812 0.8426 -1.6418 -0.1319 1.0175 2.2919 -1.3555 0.7922 0.0508 -0.0419 -0.4127 0.4145 -2.5558 -2.1948 -0.3401 -2.5595 0.1130 -0.3357 0.9200 0.5270 0.8414 -2.3378 -0.1362 0.7585 0.1024 0.0868 -0.3246 0.3000 1.4994 -0.1262 -2.1658 -2.2658 -0.6725 0.6248 0.3308 0.3718 -1.3868 0.1206 -0.6062 0.0175 0.3349 -0.6943 0.8095 -0.2296 -2.5833 -0.1289 -0.0714 0.7471 -0.3774 1.9896 1.2384 1.0045 -0.2143 -0.5723 0.6245 -1.4721 0.2675 0.3621 -0.5043 -0.4743 -0.1647 0.8528 -0.2883 0.2308 -0.4580 -0.3173 0.9767 -0.2325 0.1499 0.7712 0.3597 0.0212 0.9418 -0.6133 0.4619 -0.1225 -0.1821 0.4487 0.5704 0.6903 0.4594 -0.2680 1.5283 1.2213 -0.3561 0.4356 0.0871 2.3740 0.5307 -0.2528 -0.3066 0.2773 0.3929 1.0268 0.6653 -0.2145 0.2563 -0.4304 0.1391 0.1435 -0.7701 0.4787 1.1871 -0.4811 -0.4641 0.9652 -0.6126 -0.3891 0.9514 0.3469 -0.9063 0.8805 -0.0085 1.0194 -0.5808 0.6882 -0.2274 0.2786 -0.2228 0.5150 0.1087 -0.8937 0.2768 -0.3037 0.1909 0.3427 2.7105 -0.0471 -1.0739 -0.5952 -0.7944 -0.1378 0.6312 -0.1321 0.0070 0.4705 0.3403 0.3798 -0.6396 0.8748 -0.2256 -0.2706 -0.2256 1.1287 -0.0552 0.0905 0.2691 0.1701 -0.4770 0.7466 1.5612 0.5563 1.0360 0.0309 0.0651 0.0841 1.0435 0.1892 0.6402 -1.5178 0.3650 0.2742 0.6678 0.2278 -1.9407 -0.5686 1.7706 -1.0949 -1.4888 1.2110 0.0197 0.2013 0.4065 0.2130 -0.8022 0.6551 -0.4490 0.5783 -0.7114 1.2087 1.6894 0.2607 0.3407 0.2868 -0.7599 1.9025 0.4365 0.2472 -0.1002 0.3941 -0.3442 -0.4974 -0.1631 1.4140 0.1219 0.2071 0.1713 0.7131 -0.7697 0.3179 0.7040 1.6864 1.9278 0.3228 0.9602 -0.0619 -0.6721 -0.6662 0.2448 0.6900 -3.1348 -0.7069 0.4063 -0.1454 0.0443 0.5826 0.2746 0.2537 0.3518 0.1760 -0.5055 2.0145 0.0988 -0.8045 1.2304 -0.2828 -0.1022 -0.0538 -1.0304 0.7723 1.5915 -0.5034 0.1129 1.5542 1.1245 2.2727 -2.6901 0.5137 -0.9485 3-hydroxypyridine sulfate 0.1608 -0.0411 0.2574 -0.9759 -1.3460 -0.7833 1.7021 0.0064 -0.7596 -1.4116 -1.5316 -0.4376 -0.6953 -0.3558 2.6946 -0.5418 0.8181 0.7550 -0.4466 -0.1773 -0.2916 -0.3492 0.2042 -0.7302 -1.6120 -0.5171 0.3883 -0.8336 -1.5256 -1.2531 -0.4991 -0.0802 0.5017 0.1074 1.4334 -0.2514 -0.9166 0.9521 -1.5592 1.5699 -0.7529 -1.3407 0.5349 1.2669 -1.5330 -0.8217 -1.3605 -0.8581 -0.4079 1.5766 -1.6154 0.0248 -0.4374 0.4889 -1.2433 0.3357 -1.6387 1.5353 -0.8305 -0.7501 0.0202 -0.1442 0.7958 -0.4908 0.5914 0.1257 0.4711 -0.3862 -0.7071 0.0426 -0.1607 -0.3863 -0.4412 0.4154 -0.9585 0.2864 0.1699 -0.1139 -0.1759 2.3077 0.0895 -0.5176 -0.4188 0.1439 -0.2108 1.4820 -1.5332 -1.5865 0.1960 -0.5757 -0.8653 -0.4948 -0.9128 -0.9123 -0.0032 -0.4613 -0.6304 -1.5977 -0.8291 -0.6552 -1.3691 0.3947 0.1109 0.7636 0.0449 2.0542 -1.6669 0.9038 -0.8106 -0.3398 -0.2512 0.1912 -0.0440 -1.6332 -0.4348 0.0047 -0.0951 1.8954 1.0066 -0.2839 -0.4047 -0.0925 -1.6598 -0.5581 0.5191 0.4653 -0.3136 0.2067 -0.4015 0.0703 1.0457 1.6352 -1.4496 0.3164 1.2493 -0.6048 1.4310 -1.4243 -0.5745 -1.3441 -0.5183 0.2662 -0.4723 0.5693 -0.3249 -1.6750 -0.5416 0.2630 -0.9695 0.0307 -0.3957 -1.5083 -1.2047 0.1239 -0.6387 -0.8917 -1.6210 -1.0031 1.6033 -0.5520 -0.4417 1.3470 -0.0873 -0.8599 0.5036 0.3823 1.9381 -0.2831 0.8084 -0.4348 1.7799 -0.6241 1.6649 0.0463 0.8204 0.0020 -0.7665 -0.8831 -0.0461 -0.5237 0.4666 -0.5013 -0.3867 -1.1574 -0.1480 -1.0859 -0.6044 -0.6721 -1.1379 0.3016 -0.0224 -0.2788 -1.0775 -1.5367 -1.5264 0.1431 0.7977 1.1440 -1.6514 -1.4588 2.1056 -1.5165 -0.5146 0.2845 -0.1181 -0.1460 0.5841 -0.5017 0.4651 -1.1326 1.2149 -0.0512 0.1890 1.7961 1.1517 0.2153 0.8254 0.7367 0.4094 0.5856 0.6293 1.8835 0.1557 0.0670 0.1903 0.1599 -0.1653 0.5492 0.3784 0.0456 1.8875 -0.0573 0.2368 -0.2040 -0.6050 -0.1087 -0.4883 -1.5893 -0.2931 -1.5710 -0.6665 -0.5560 -0.7482 -0.2151 0.9335 0.3711 2.2209 1.7201 0.0730 1.5445 1.5356 0.5439 1.9322 -0.4710 1.5696 -0.0224 -0.0060 0.2879 -1.6268 1.8531 -0.5365 -0.3813 -0.0617 -1.3785 -0.5801 -1.4528 -1.7352 -0.4676 0.0813 0.5696 1.4299 1.2471 1.4765 1.4478 -0.0465 -0.0018 -0.8431 -0.4777 -0.4749 0.3617 1.5015 0.1839 1.8602 2.9683 -1.8249 0.1419 -0.2206 -0.8623 -0.0061 0.3325 1.3863 1.8728 -0.7345 -0.0879 0.4079 1.9963 0.1112 0.7161 1.2936 -0.0945 0.5881 0.1991 -1.6854 1.3239 0.0246 2.0704 1.0863 -1.5121 -0.3944 1.1472 -0.8271 1.6576 0.1844 -0.1829 1.5251 -0.8012 0.0916 -0.0031 0.5518 0.3405 -1.6562 -0.6678 0.2465 1.8017 -0.0473 -0.4614 -0.4683 0.4005 -0.3337 0.8560 -0.8453 0.2944 -0.3996 -0.9524 -0.2143 0.7112 1.3535 -0.6845 -0.0194 0.1207 1.3208 1.5129 0.7108 -0.6745 0.1425 -0.7530 -1.5643 -0.3235 -1.7213 1.5410 -1.5283 -1.3041 -1.0158 -0.7640 -1.7205 0.0297 -0.8114 1.6549 1.3206 1.8657 0.2237 -0.6743 -0.8661 -0.3857 0.9243 1.4271 1.1096 1.8614 -0.7291 1.8103 -1.0584 0.0450 0.1533 -1.6419 1.6999 0.8150 1.4595 0.2815 2.3508 0.0804 0.1328 1.6508 2.0821 -0.0745 -0.1657 -0.2361 2.2730 -0.9468 1.8668 -0.1928 -1.5338 -1.6563 -0.6659 -0.8300 0.1258 1.3157 -0.5254 0.1075 -0.8046 0.6121 -0.6171 -0.8148 -0.8906 0.1360 0.8862 0.1865 -0.4316 -0.2891 2.0779 1.1111 3-hydroxystachydrine* 0.1016 0.1481 -0.3479 0.4374 -1.7453 1.6943 -2.1077 -0.4809 -0.0227 0.0784 0.4308 2.0826 -0.1097 0.6099 -1.2832 0.3397 0.3275 -0.9125 0.1715 0.4562 0.0815 1.1503 -0.5728 0.5236 -1.1307 0.3721 -0.1395 0.0160 0.8205 1.0844 0.0958 0.7259 -0.0809 1.8699 -0.9937 -0.1173 0.1407 -1.1666 0.5039 0.0781 0.3902 0.7532 -0.9899 -0.7948 -1.9126 0.7369 0.1278 -0.1739 0.7953 0.4208 0.8271 -1.3749 -0.7926 -0.3006 -0.6697 0.3181 0.9978 0.5263 0.5915 -0.2671 1.0443 0.5271 1.9654 0.6691 -1.9692 -0.2238 -0.4093 -0.3083 -0.3993 -0.8614 -0.4899 -0.8471 -0.2311 0.1967 -1.5482 -0.3786 0.6332 0.4988 -0.4541 -0.6923 -0.3878 0.5189 -1.9954 0.5284 -0.3333 -2.0662 1.4581 0.4186 -0.1412 0.4495 -0.0639 0.1129 0.9576 -0.4513 -0.9280 0.8331 0.1865 -0.2798 -0.2865 -2.0514 0.2703 1.9514 -0.1890 -0.8049 0.9192 0.0552 -0.4467 -0.4716 0.2829 -0.5633 -0.4321 -2.0771 1.7785 -0.8599 0.7567 1.0842 -0.7623 -1.1603 -0.2756 -0.2951 0.2968 -0.4821 -0.7658 2.0760 0.8002 0.9805 -2.0673 -2.0268 -0.4024 -0.0885 0.0049 0.7552 0.0489 -0.1044 0.4081 -1.7072 -1.9764 -0.7536 -0.2343 -0.4471 0.0618 0.9273 -0.0759 -2.0147 -0.1969 -0.8536 0.6436 1.4065 0.5172 -0.0047 0.8940 -0.9140 -0.1600 -1.0920 0.8504 0.9590 -0.6036 0.2276 0.0201 0.3388 -1.9740 1.2301 1.0399 -2.0026 0.8914 -2.0918 -0.8086 2.0253 1.6836 0.4767 0.0231 0.1004 1.6571 0.9244 0.3195 -0.3613 0.6699 1.4741 0.9720 -0.4744 0.7229 0.2366 1.9058 0.5945 0.1496 -0.5296 0.7018 -0.5015 0.0875 -0.7620 -0.8882 0.0469 0.1299 -0.5136 -0.5402 0.5798 0.7685 0.2608 -0.0510 0.9220 0.7500 -0.0087 0.1284 -0.7125 -0.2883 -0.5000 0.2077 -0.6793 -0.2208 -1.9763 -1.0957 0.5647 -2.1245 -1.0361 0.5612 -2.0242 0.4284 -0.1134 -0.1257 0.2557 -0.9744 -0.9846 0.4226 1.1480 0.4827 -0.3533 2.0209 -2.1494 0.7243 0.6787 -1.0711 0.3939 1.6291 -0.3148 -0.7971 -0.0616 -0.1465 -0.7689 1.9905 -0.2745 0.8732 1.6029 -2.0215 0.8694 2.3637 0.8633 0.3661 0.7806 1.4792 -2.0606 0.4334 -0.1585 0.8721 -0.4615 -0.9280 0.6753 -0.7410 -0.4463 0.3138 1.2413 -0.5584 -0.1431 2.1648 -0.7415 -0.5216 1.7990 -0.5143 1.7911 -0.4118 2.3658 -0.8159 0.2499 -1.1788 -1.5104 1.1195 -1.3232 -0.7429 1.9620 0.1426 -0.5878 0.1561 0.6763 -2.1163 -0.0644 1.5683 0.5789 0.6635 1.0275 1.8878 -0.0859 -2.1248 0.2970 1.0566 -2.1287 -0.6159 0.4472 0.6061 1.1037 1.9747 -1.0907 -2.0129 0.2055 0.1902 -0.4500 -2.0119 2.3309 1.3923 -0.0799 -0.6080 -0.6821 -0.2573 -0.1232 -0.6954 0.4435 -0.7012 0.1513 -0.5084 -0.3456 0.0517 0.4276 -0.4728 -1.2742 -0.0488 -0.0985 1.8752 -0.2013 2.1551 -1.6340 0.6708 -1.2304 0.1189 0.1055 0.3846 0.0128 1.9233 0.0397 0.1844 0.4294 1.2995 -0.6855 -0.0964 0.2128 0.2728 0.0598 -0.9666 -1.3398 1.5274 -1.2354 0.5093 -0.2169 -1.1388 -0.3043 -0.2066 -0.1548 -0.7618 2.0583 0.7709 0.0914 -0.6082 -2.1489 -0.4186 -0.7057 -1.5023 -0.4499 -0.2685 2.1566 -1.1812 0.1135 -0.8671 -0.6642 -0.8427 -1.4816 -0.4393 -0.6418 0.3182 -1.3166 1.9003 -1.0603 -1.1323 0.2485 0.9091 0.3298 2.0336 0.6848 -1.8302 -0.3237 1.0473 0.6812 -0.0656 -2.1890 0.7368 0.3301 0.2836 0.4900 1.7421 0.2951 0.1702 -0.2676 0.5170 0.0380 1.3035 0.7287 -0.0351 -0.6406 -0.1359 -0.7438 0.5653 -0.6854 -0.4969 1.6636 3-hydroxystearate 1.0718 -2.0785 1.0385 1.2279 1.1495 1.0368 0.7037 0.5982 0.7861 0.3469 1.1807 0.1201 0.7554 -1.6011 -1.8086 -0.0381 0.4031 -1.4638 0.0894 1.0437 -1.2795 0.5028 -1.0838 -1.4500 -1.4877 -1.4999 0.0820 -1.3569 -1.2795 -1.5908 0.5092 0.5078 -0.9800 0.5925 1.1538 0.6062 0.2348 -1.1816 -1.4038 -1.7435 -1.1911 -0.9329 0.3021 0.9745 0.5958 1.0885 -1.4816 -1.4313 -1.5040 -1.5195 0.3309 1.2638 0.4150 -1.6976 -1.1445 -0.4629 -1.5402 0.9709 -1.5989 1.1182 -1.2904 -1.7680 -0.0015 0.6209 0.0375 0.7497 0.7066 0.7638 0.0832 -1.2845 -1.5560 -1.6599 -1.6202 -1.8442 0.5637 0.3051 -1.2982 -0.0304 0.7084 -0.2194 0.4617 1.0407 0.3728 0.7243 1.1528 -0.3526 -1.3396 1.0185 1.0101 -1.1627 0.5501 0.1859 0.0902 0.5570 0.7640 0.0696 0.9390 0.7300 1.1011 1.0543 -1.7518 0.7312 -1.2818 -0.1851 -1.4276 0.6868 0.8701 1.0615 0.7060 0.2993 0.4024 -0.0468 0.8332 1.0707 1.5918 -1.5056 1.1690 -1.4423 1.4671 1.0863 1.0001 0.4941 0.2481 -1.7467 0.7363 0.6531 1.3928 -1.6152 0.6561 0.7734 0.3064 0.6731 0.9109 -1.7030 0.6308 0.6886 0.8254 -1.1293 1.2719 -0.9418 -1.3251 -1.6071 1.4803 -1.5865 -1.4202 0.1013 0.1410 -1.5987 0.8050 -1.2956 0.5362 0.3499 0.7257 0.4851 0.4876 0.7626 1.0209 -1.2576 -0.1752 0.1971 -0.0293 0.1106 -1.3079 0.4738 -1.5069 0.5126 0.3119 -1.6515 0.2616 0.2027 0.4658 -1.5736 1.2368 0.3141 -1.8321 0.3592 -1.2408 -1.3340 1.1160 -0.6810 0.5308 0.1083 -1.6158 1.0156 -1.2702 0.9323 0.0584 0.4890 0.5194 -1.3848 0.4364 0.9089 -1.3999 0.8859 1.0304 0.7863 0.8932 0.3440 1.0689 0.3426 0.1771 -1.2387 -1.3409 0.3961 -1.5501 0.6549 0.5474 -0.6263 1.5763 -0.4497 -1.4875 0.5617 0.6068 0.1119 0.7608 0.1758 1.3982 0.6093 0.5363 0.7109 0.6771 0.8475 -1.3216 0.3319 -1.9884 0.9686 1.1789 -0.5763 -1.6741 0.8819 0.8633 -1.3874 1.6611 -0.0041 0.1970 1.1053 -1.6275 0.9353 0.5367 0.6134 -0.0666 1.9036 1.0496 0.6918 0.6461 0.6692 -1.6367 0.3490 0.7355 1.1073 0.1824 1.3225 -1.7703 0.5933 0.7178 0.4756 0.1908 1.0504 0.8884 -0.0835 0.5974 -1.3471 0.3142 0.3296 0.5610 0.1562 1.1108 0.0340 0.1287 -0.0307 0.4860 -0.3679 0.6650 0.4944 0.7334 -1.6437 -1.6207 0.5909 -0.1624 1.3371 0.5554 -1.8523 0.1524 0.2644 -2.0051 -1.5319 0.0733 -1.5514 1.4303 -0.4558 0.3946 -1.8213 -1.6867 0.4528 1.1973 1.4227 1.0951 0.9460 0.5606 0.6300 0.1204 0.7696 -1.5574 0.9841 -0.2444 0.4751 0.9738 0.8290 0.6301 0.5300 0.8719 0.4908 0.1004 0.3422 0.3778 0.3299 -1.5811 -0.4621 -1.4769 0.4717 -1.5306 -0.1765 0.3509 0.0522 0.6090 0.4586 -1.5917 1.2884 0.4873 0.3208 0.8829 -1.4544 0.3342 1.1266 -0.0201 -0.1760 0.7405 0.0280 -1.8250 -1.4364 0.1257 0.5813 0.3228 0.1024 0.4249 -1.5290 -1.3733 -1.7798 -0.1927 -0.0530 0.2150 0.7346 1.0672 -0.6424 0.3000 -1.9990 0.7764 -1.7030 0.0320 0.4746 0.8266 -0.2593 0.5139 0.6855 0.1247 -1.7997 0.4940 0.8474 0.7216 0.1077 0.4948 -1.7309 0.8941 0.9060 0.1129 0.7073 -0.1575 -1.9338 -0.3509 0.8367 0.7618 -0.5757 -0.3173 0.4670 0.2441 0.7156 -0.0608 0.5028 -0.1408 -2.0253 -1.3197 -1.5017 1.5054 -1.6756 -1.8848 0.2113 0.0587 0.5392 -0.0618 -1.6814 -2.0675 -0.1235 0.5737 -0.0624 1.0599 0.6696 0.2124 0.9322 0.6823 0.9147 3-indoxyl sulfate -0.1010 -0.1140 1.0200 0.6770 1.1100 -0.2510 0.2650 -0.2810 0.6930 -2.2300 -0.3980 -1.3500 0.2790 -0.2870 0.6870 0.1480 0.3270 0.3270 1.2800 -0.9270 0.7950 0.7040 0.9000 -0.1100 0.2140 0.0052 0.2550 0.8690 0.3140 1.2600 0.9330 -1.5100 0.4550 0.7700 -1.3700 0.4660 -0.8340 -0.1640 -0.1770 0.4480 -0.0906 -1.6100 -0.0696 0.4220 1.1100 0.7440 0.7200 1.1500 -1.4200 0.6670 0.5510 -0.2660 -0.1230 -0.6820 -0.4490 1.0900 0.3190 -0.8930 -1.7800 -0.3420 1.6000 1.4200 0.2750 -0.3630 0.7850 1.4200 -0.3280 0.8750 0.9810 0.6640 0.4540 0.8200 0.5210 -1.4500 0.3370 0.1480 1.0400 -1.9700 -1.4900 0.8330 -0.6090 0.7280 -0.2900 -0.5630 0.3920 0.4610 -1.6900 -0.1850 -0.3820 -0.0658 0.9130 -0.2020 -0.1030 1.4600 0.2270 -2.2500 -0.3200 0.7110 1.3700 -0.0333 0.5030 0.7560 1.6700 -0.9320 0.9280 1.7600 -0.8880 -2.3800 -0.4720 -0.9430 -0.7980 0.1400 0.3780 -2.4200 -2.7500 -1.4500 0.3340 0.9290 -2.2200 0.7590 -0.2410 -1.1300 0.8910 -0.9050 -0.8330 0.0941 0.4750 0.7920 -0.4030 -1.1000 -0.2440 -2.1700 -0.9590 0.8610 1.0400 -0.0542 -1.4900 0.6880 0.3600 -1.3300 -1.8400 1.1100 1.3700 0.9860 0.3040 -0.0150 -0.0208 0.8160 0.3040 0.4100 0.3760 -0.2310 0.9770 -1.3600 1.4000 -1.5900 -1.6100 0.8770 -0.8520 -1.6000 0.2620 1.2400 -0.3800 0.3360 -0.1540 0.9450 -0.3900 0.9670 -0.7650 -0.1620 0.2230 0.7120 0.1260 -0.9600 0.4720 -2.0000 1.3100 -0.4870 0.8340 0.3430 -2.2800 -0.4690 1.3200 -0.1430 0.5190 0.7520 0.2050 -0.6410 -0.0526 -0.9090 0.9400 0.6330 -1.2700 -1.9200 0.4050 -0.1560 -1.3200 0.7620 0.5080 0.4280 1.2100 1.6300 1.0700 1.5500 0.9940 -0.8070 -1.1800 -0.3190 0.5100 0.9380 -3.0600 -0.0122 1.4700 0.8410 0.4310 0.7990 -1.7800 0.5710 2.1600 -0.4930 -0.8590 0.2410 0.0073 -2.1200 -0.9040 -0.7970 -1.5000 0.7700 0.6690 -0.6200 -1.1100 1.5100 -1.9400 0.1010 1.1100 0.5780 0.4440 0.6140 0.8020 -0.9320 0.3170 0.2770 0.7750 0.6260 0.2300 -0.6760 0.0602 0.9400 0.0000 -1.1700 0.2530 -1.1100 0.8620 -0.0668 -0.4600 -0.2380 1.0600 0.1900 1.6400 -0.9770 0.1110 -0.1480 0.3990 -0.8210 0.1240 0.0163 0.2310 0.6250 -1.1300 -0.4560 0.1450 0.1940 -1.1900 0.1810 1.7500 0.4060 0.1720 0.4270 0.1320 -1.1200 0.9400 0.1740 0.2520 0.1430 -0.0485 -0.2050 0.0838 1.6400 -3.6300 -0.5430 -0.0997 -0.1730 1.2000 -0.6420 -2.0600 0.6970 -1.0600 0.9610 -0.5450 -0.6200 1.4900 -0.1360 0.4150 0.7860 0.8570 0.4530 -0.2960 -1.7700 0.1970 0.4900 -2.9200 0.9170 0.7630 1.0500 -1.7900 -1.5600 -0.0251 1.0900 -0.9790 1.2300 0.6840 -0.4400 0.1940 0.0548 0.6150 0.6260 -0.5540 -2.4400 0.5830 1.3800 0.7580 0.2300 -1.7500 1.0600 0.8710 0.9920 -1.8500 0.1450 0.4710 -0.0960 -2.6600 0.8890 -0.2080 -0.0410 -1.5000 0.8730 -0.0146 0.3500 -0.7060 1.0200 0.0198 1.5500 -1.7800 -1.4600 0.6210 0.6700 -0.8360 0.7280 0.0652 -0.4090 -0.0738 0.1940 0.8410 1.6500 -0.7080 0.6160 -0.0055 -0.2450 -1.4200 0.5240 0.9920 -1.9900 -0.2480 -0.7070 0.7440 -2.1100 -0.9230 -1.3800 0.6920 0.6010 0.2910 -0.0118 0.6090 0.3380 0.2820 -0.5600 -1.1400 -1.6500 0.5730 1.0000 0.8220 0.1350 0.5500 1.1400 1.1900 -1.9400 -0.8440 0.0081 0.9380 0.9650 -1.8100 0.4540 1.0800 2.4200 0.1860 0.7990 -0.1580 0.4510 -0.4350 -0.4160 3-ketosphinganine -0.5934 0.3001 0.8028 1.1514 -0.3931 0.8381 -1.1625 0.8065 1.0229 1.9013 -0.7679 1.6072 -0.8602 0.9497 -1.1735 -1.0141 1.6561 -0.8924 0.7100 0.6868 -0.7267 -0.4696 -0.5225 -0.1898 0.9014 -0.8906 -1.1216 0.1274 0.9348 1.7972 -0.4996 -0.7405 0.5768 -1.2302 -1.2868 -0.9382 -0.8611 0.2599 -0.7947 2.0195 -0.6268 -0.3971 -0.9259 1.0351 0.2024 0.2325 -0.9161 -0.1442 -0.8937 -0.8842 -0.8882 1.2846 -0.8362 1.8377 -0.5691 1.5407 -0.9324 -0.5510 -0.9784 2.3692 -0.7385 0.6681 0.6467 1.6474 0.0346 -1.1531 -0.9431 -1.2423 0.8284 -0.7166 1.4817 0.4835 1.3884 1.0729 -0.9203 -1.1096 -0.7405 0.5747 1.7654 -0.9762 0.7997 2.1956 -0.9164 1.2085 1.2809 0.3871 -0.7458 -0.8405 0.8821 -0.5914 -1.3203 -0.8419 -0.8538 -0.5331 0.8626 1.3435 0.3690 0.3574 -0.8346 1.7978 0.3261 0.4664 -0.7519 -1.1837 -0.8034 1.1113 1.1149 -0.9733 0.3531 1.1753 1.6153 -1.1096 -0.7311 -0.9317 0.8453 1.0099 -0.7098 1.8958 0.3200 1.4765 -0.7815 1.0973 0.0512 -1.0159 -1.1874 1.6555 -1.0827 0.2484 -1.0239 -0.0786 0.8051 1.6241 1.4947 -0.1465 -0.9839 0.6430 -0.8805 0.1681 1.1889 -0.4036 -0.6908 -0.9958 -0.8552 -0.9581 2.0519 0.3168 -0.9063 2.2640 -0.8108 -0.7509 0.2218 0.5666 -0.8008 -1.4447 -0.9761 -0.7244 1.5813 0.8267 0.7431 -0.4366 0.5415 1.0684 0.8793 0.7540 1.5220 -1.1356 -1.0856 -1.0361 -1.1098 0.3163 0.2396 -0.9494 1.2897 1.2161 -1.1325 -0.5995 -0.6830 -0.7100 0.1623 -0.6612 0.3924 -0.1101 0.6128 -0.9698 0.5545 0.8932 -0.9630 -0.8462 -0.7003 0.3445 0.2263 -0.7332 0.1578 -0.7589 -0.7245 -1.0417 -0.8494 0.5820 1.1022 0.5124 -1.0829 -0.7026 1.5258 -0.8730 0.7390 -0.5799 -0.9919 -0.1493 0.9258 -0.9002 1.1195 -0.9344 -1.2076 -1.0047 1.0646 1.0933 -1.2272 1.2016 0.8379 -1.1207 -1.0068 -1.0680 -0.7225 -0.0220 -1.3211 -1.2255 1.3253 0.4460 0.2852 0.2269 0.3228 0.3109 0.2689 0.6929 -1.1641 -0.0227 1.7918 0.9464 -0.0728 -0.8135 1.9777 0.1075 2.4623 -1.2963 -1.0803 -0.9534 0.5532 -1.1834 1.0623 0.5950 1.0638 1.7298 -1.1370 1.1548 0.3301 0.7671 -1.0336 -1.0258 1.8731 -1.1548 -0.3614 -0.7864 -1.1603 1.4106 -1.0676 -0.5945 1.6487 -1.1910 0.7400 -1.0839 0.6022 -0.8560 0.3206 -1.0795 -0.0087 -1.0285 1.0554 1.0266 -1.1573 -0.6842 -1.1892 0.4843 -1.1894 -0.4607 0.3154 -0.9170 -1.0883 -0.9707 1.3354 -0.3154 -1.1972 0.6320 -1.0600 -1.1921 -0.9271 0.9995 1.7657 -1.4139 0.4910 1.2906 0.7483 0.7414 -1.0011 0.4901 0.6736 0.2927 0.1496 0.0757 1.4048 0.2737 1.8019 -1.1405 -1.0446 0.8881 0.6207 -1.0055 1.2900 0.4624 0.9470 -1.1062 -0.9550 1.8175 0.8992 -1.2013 0.8717 -1.3274 0.7600 1.3637 -1.0414 -1.1594 -0.8513 -0.8611 0.5023 -0.7640 -1.0169 0.2036 1.8095 0.4844 -1.2038 1.0200 1.0877 1.0441 -1.1825 0.3380 0.3665 -0.8964 1.2998 -0.1310 -1.0849 -1.2003 0.2772 -0.3114 0.9279 0.7952 1.7861 -1.2846 0.5501 -1.1057 0.4446 1.2640 -1.1156 0.4691 -0.9928 0.6249 -1.0616 0.7062 1.2686 -0.2563 1.0805 -1.2578 0.8099 -1.0956 0.5770 1.5190 0.3825 -0.8059 1.1318 1.4641 -1.1631 -1.1159 -0.9954 -1.3592 0.3538 0.8062 -0.3369 0.4932 -0.0557 0.8007 -1.3521 -1.3341 -0.7428 -0.9496 -0.5196 -1.0844 -1.1991 1.0576 0.4605 0.4964 1.3922 -1.1091 -1.3402 -1.1062 -0.9120 -1.1805 0.0262 0.6659 0.2617 -1.0606 -1.0063 1.2698 3-methoxycatechol sulfate (1) 1.8000 1.6166 -0.1527 -0.6670 -0.0625 -1.5560 -0.1926 1.4314 -0.3922 0.6543 -1.3889 -0.7068 -0.5314 -0.0333 1.5449 1.4058 -1.6398 -0.2056 -1.4591 -0.3645 1.9146 0.5215 -1.2392 1.6145 -0.8810 -1.4723 0.1965 -0.3459 0.5121 1.8199 -1.6309 -0.4159 0.8325 0.7587 -1.7223 0.0712 1.0984 0.1926 0.0838 -0.3649 -0.5147 0.7757 -1.4952 0.9666 0.3423 -0.8085 -0.3535 0.5032 0.4763 0.5035 1.2978 -0.7632 0.6575 -0.8285 0.7845 -1.6036 -1.4992 0.0887 -1.5279 1.9290 0.6181 0.1169 -0.3487 0.4091 0.1681 0.5419 0.0735 -1.6967 -1.6172 -1.3631 -0.8237 -1.5831 0.1168 0.0099 -0.4544 -1.6111 0.0323 -1.4819 0.3912 0.4791 -1.5227 0.6746 -1.4882 1.0693 0.6952 0.6228 0.2900 -0.0633 0.1951 -1.2828 -0.9650 0.0382 0.6536 -1.2491 -1.4617 -1.4340 -1.4753 -0.0912 0.1072 -0.2290 0.8973 0.6031 0.5121 0.0204 -0.2837 1.5103 -1.5353 -0.6370 0.1469 -1.4123 0.5809 -0.5709 -0.0202 -1.4968 0.7778 0.4690 0.8655 0.4219 0.0255 -1.6689 1.1978 -0.8634 1.0409 0.9160 0.3176 -1.5499 -1.5951 0.0869 -0.8816 1.5169 0.4688 0.6429 -0.3967 0.3943 1.6667 -0.2697 -0.1243 1.2358 -0.2938 -1.1643 -0.5138 -0.3747 0.4151 0.0156 0.1692 0.4905 1.9172 -1.5352 0.4551 -0.1234 0.2585 -1.3518 -1.4178 -1.8204 -0.3233 0.4866 -1.4778 -1.3563 0.5017 -1.1894 1.0403 0.2652 0.3430 -1.4936 0.3824 1.0865 1.0559 0.6652 0.7027 -0.7780 -0.0335 0.7428 0.3110 0.3833 -0.0883 -0.3281 1.1248 1.8260 0.6913 0.3189 0.5681 0.7228 0.4196 2.1356 0.0669 0.7106 -0.0495 -0.0821 -1.3514 0.2433 -1.7007 -0.6934 0.8039 -1.3872 -0.3899 -1.5661 -0.0686 -0.0943 0.5423 -0.4891 0.9146 -0.5605 -1.3937 0.0148 -0.7895 0.8149 0.9221 -1.0048 0.2906 1.7520 2.4139 -1.5019 1.2381 1.1488 -0.0857 0.3646 1.0654 -0.1036 0.6745 0.2843 -0.4572 0.8977 -1.3652 0.4136 -0.2919 -0.2442 1.5680 -0.3263 -1.5768 -1.4840 0.9760 0.8863 0.6749 -0.6469 -1.6462 -1.6568 1.0028 2.0465 0.1607 1.2977 -1.5453 -0.0361 -1.5281 1.3306 0.9739 1.0916 0.5179 1.2903 -1.6446 0.9708 0.3279 1.4465 0.1969 -0.4737 -1.5720 -0.3030 0.2273 -0.6509 -1.4887 0.5474 2.3670 -1.4083 -0.3769 0.0151 -1.5848 -1.2861 0.1388 0.5890 0.8118 -0.4116 0.4716 0.3635 1.3844 -0.0447 -0.7589 -0.3392 -1.5585 0.0821 1.7836 -1.3443 0.1480 -0.3806 0.5228 1.5368 -0.6294 0.1002 -1.5983 -0.0526 0.7899 0.2190 -0.1080 0.8538 -0.5344 1.2754 0.1195 2.1779 0.7436 1.6316 0.2936 -1.6131 -0.3827 0.4429 1.2671 0.0219 0.3030 0.7974 -0.4887 0.1200 -1.6248 -1.6828 -1.4802 0.9828 -0.1941 0.6873 0.9488 -0.4119 -0.6070 -0.2187 0.9509 -1.6068 -1.5155 0.2014 0.5785 -0.0379 -0.2182 -0.1398 -1.5466 0.6684 0.1551 -0.5695 -1.4485 1.1960 1.6127 -0.3576 1.4195 1.1012 0.5709 2.4537 -0.0317 -1.3965 1.1059 0.2321 1.0206 0.8045 0.4580 0.9133 -0.0144 0.3819 -0.4280 0.2553 1.4552 0.6353 0.2747 -0.3560 -1.5963 1.0092 0.6063 0.6642 0.3124 0.4217 0.4044 -0.5694 -0.5362 0.9512 -0.9935 -1.6590 -0.3163 0.7136 -1.6881 0.6258 1.8623 0.9692 -1.5106 -1.5083 0.3570 -0.0885 0.3976 0.0176 1.1675 1.3168 -1.5365 0.9214 0.5092 -1.7714 -0.0571 0.5215 1.2660 -0.7648 0.4061 -0.6943 0.4010 -0.2981 0.5346 -0.5853 -1.4304 0.3065 1.7547 0.0488 -1.8034 -1.6144 -0.0702 -1.2792 1.2616 -1.6537 0.3241 -1.8021 -0.4449 1.3305 0.6492 0.2540 3-methoxytyrosine -0.0075 0.5789 -3.8193 -0.5301 1.1242 -0.0278 0.6345 -0.1647 -0.8727 0.7971 0.0205 -0.6539 1.4186 -0.7865 -0.2304 0.6302 -0.2810 -0.3717 -1.3950 0.1404 0.5239 -0.0524 -0.4008 0.3925 -0.3094 0.0625 -0.4670 0.4103 0.8819 -0.8467 -0.6617 0.1124 1.1488 1.0573 -0.4158 -0.0671 -0.2786 0.5277 -0.8092 -1.6883 -3.0402 0.3735 -0.0154 -0.9145 0.0930 0.1471 -0.4856 -0.2935 -0.4606 1.9713 0.5410 -3.1690 0.1213 1.2938 0.8225 -0.9563 0.8009 0.9372 0.2853 -2.0345 0.8725 -0.9106 0.0967 1.7558 0.1731 -0.7318 -1.0778 -0.3217 -0.2346 0.4619 -1.9714 0.5895 -0.0846 -1.1887 0.9231 -1.5890 0.6945 -0.0632 0.2403 0.2849 -0.6525 -0.0167 0.0150 0.5446 -0.9518 -0.0578 0.7942 2.4763 -0.1626 -0.0505 -0.8137 -0.5043 0.8920 -0.3652 -1.4716 -1.7013 0.6061 0.6095 0.2269 -1.4101 0.2194 -0.7606 0.4693 -0.3397 0.1233 -1.4035 1.1046 0.6228 0.0182 0.5739 0.3039 1.6553 0.5924 -0.1242 -0.3323 0.7791 0.3915 -0.0009 -0.7848 -0.8766 -0.0444 -0.6128 1.2739 0.1390 0.9596 -1.1803 -0.3556 0.0220 -0.8180 -0.4395 -2.5047 -0.8599 -0.3372 -0.8515 -0.4510 0.5452 0.2405 0.7290 -0.1558 1.1099 1.2797 0.2908 0.1568 -0.0117 -0.5022 0.0725 0.2731 -3.7547 -0.1268 -0.4975 0.1192 0.7987 1.1725 3.2685 -0.1463 -0.1287 0.7209 0.8199 -0.1973 0.8527 0.4163 1.4886 0.7590 -1.1671 0.8789 -0.0164 -1.1547 0.9618 -0.0877 0.7578 -0.3434 -0.9285 0.6183 -2.3882 -0.4193 1.4631 1.6813 0.9065 0.1212 1.8382 1.7478 -0.5269 0.7335 0.5569 0.9961 1.0709 1.3419 0.4535 -0.4091 0.9835 -0.9685 -0.9554 -0.1413 -0.6640 1.1185 -0.9112 0.1342 0.0469 -1.2537 0.9787 -1.3728 1.3366 -0.8314 0.7122 0.5936 0.6813 0.4545 1.7888 -0.2418 -0.3092 0.5421 -2.1241 -0.8814 0.2636 0.2832 0.7379 0.2059 -0.4541 -1.4284 -3.0990 -2.2547 -0.8907 -0.5138 -0.3991 0.6050 -1.9661 -1.2703 -1.0756 -0.7163 0.9836 -0.2914 -0.5275 -0.3183 0.0749 0.0847 -0.2408 -0.3352 0.6634 -0.6613 0.2495 -1.5510 -0.1707 0.0583 0.1749 -0.8847 -0.9168 -0.6043 -0.2566 0.5681 -0.0511 -0.6067 -1.4407 -0.0541 1.0821 -0.0799 -0.5068 -2.2666 2.0780 -0.8246 -1.0522 0.6652 0.9060 -0.7086 0.6442 -0.8584 1.2793 -0.3520 -1.2864 -2.3657 1.4129 0.3937 0.0949 0.1269 0.5452 0.6897 0.0593 1.6075 0.4957 -0.8919 1.2981 -0.5051 0.6901 0.8026 0.2161 0.8090 0.2762 1.7557 1.2352 -0.8043 -1.1911 -0.7545 -0.1153 0.9653 -1.0530 -0.9928 0.8592 -1.0327 1.5534 -0.8177 0.3367 -1.6838 0.5234 -0.1273 -0.4606 0.1450 0.4411 -0.7892 0.7234 0.4871 -0.1475 -0.2713 0.7208 1.2645 0.1572 1.7148 0.5730 -0.3839 0.5942 0.8753 -0.2199 -0.1987 -1.2081 0.4114 0.7058 2.0257 -2.2384 -1.0339 -0.7423 0.0034 0.3780 0.3158 1.1502 0.4918 -0.3763 -0.6270 0.3496 0.0524 2.7419 0.3463 -0.1071 -0.9090 1.0612 -0.2790 -0.6375 -0.6132 1.7378 0.4915 0.8815 -0.1533 -0.2060 2.0006 2.5563 -1.7695 -0.0802 0.9141 0.3967 -2.2939 0.2654 -0.5291 -1.2690 -0.8643 0.0238 -0.0495 -1.0091 0.0686 1.5245 -0.3205 -0.0623 -0.5514 0.1545 -0.1386 1.6463 1.0154 -0.0572 -0.6267 0.2922 0.3003 0.3550 0.7289 0.7675 2.1754 0.4725 -0.9279 0.0320 0.8014 -0.1292 0.3167 -0.5981 -1.4743 -0.4805 -0.1541 1.3480 2.7389 0.3283 -0.4278 -0.0979 -1.9915 0.3787 0.7494 1.5576 -0.1536 1.3508 -1.5519 0.7965 -1.0101 0.1521 -0.5626 0.0498 -1.0677 -0.7844 3-methyl-2-oxobutyrate -0.0477 0.7066 -0.0353 -0.9846 0.7178 0.2921 -0.3283 1.1488 -0.7335 2.7937 1.9020 -0.7749 0.9646 -0.2264 1.0726 -0.0606 -0.5053 0.0353 -0.3019 0.5431 0.3161 1.1961 -0.3561 0.1740 0.0837 0.3518 -0.6866 0.2794 -1.3040 -1.4167 -0.2742 0.8449 0.5765 -0.6648 -0.3654 1.4021 0.5184 -0.0803 0.2956 -1.1713 -1.0176 0.4594 0.4652 -0.1439 0.7062 -0.7952 1.5385 -1.2567 0.2317 -0.5463 -0.9057 0.3928 0.8873 0.5225 1.3161 -0.2713 -0.4547 1.4435 0.3123 -1.2910 -0.1792 -0.6621 -0.0835 -0.9995 -0.2038 -0.4408 -2.1134 0.3898 -0.3447 0.5026 -0.4903 0.5796 0.1013 -0.3756 2.0855 1.0477 -2.0258 -1.0610 0.6083 0.3782 1.1929 1.1797 -0.2265 -0.0254 1.5848 -2.0822 -0.0824 1.6774 0.5746 -0.3566 0.2416 -0.5850 -0.3234 1.2083 -0.0674 -0.2639 0.6691 -0.6467 1.2759 0.0064 0.0092 -0.4721 1.1411 -0.4783 -0.5841 -0.4862 0.0270 1.7061 -0.5725 -1.4990 -3.1885 -1.7025 -0.0149 0.7687 1.8409 0.0675 1.8809 0.5347 2.1649 0.5939 0.6020 0.9712 0.0656 -0.5333 0.1944 -0.0118 1.1613 -0.8852 -0.0955 -0.4917 -0.4753 2.7211 -0.7066 -0.2813 0.2357 -0.3731 0.0292 1.0273 0.5024 -0.4073 0.7078 0.7454 1.6206 -0.0252 -0.2899 -1.3699 0.6393 -0.3683 0.1396 0.1919 0.3428 0.3430 1.2388 0.6324 -0.0158 0.2426 0.7913 1.3709 -0.0173 -1.4890 -0.8580 -0.2978 0.0917 0.7078 0.9550 -0.2285 -1.1385 -1.3514 -1.2894 0.1023 0.5210 -0.2322 -0.2000 -0.5098 -1.0123 1.2597 0.5730 0.0865 0.3048 -0.7975 0.3204 0.2036 -0.8319 0.7189 -0.2397 -1.7360 -0.0057 0.8435 -0.3536 0.5637 -0.8192 1.4718 -0.1615 -0.6611 0.9780 0.7746 0.1206 -0.1052 0.7900 0.3546 1.4141 -0.4201 0.6820 1.2839 -0.1845 1.1529 0.8749 0.8554 -0.0581 -0.1443 -0.5931 0.8480 0.3449 -0.0060 -1.1858 -0.2769 2.6584 2.2258 -0.7634 -0.2536 0.1032 0.5145 0.3883 -0.8297 0.0426 0.0284 1.3716 0.2937 -0.7762 1.6787 -2.3603 -0.5263 0.8446 -0.0040 0.9001 -0.1828 -2.3763 -1.7652 -0.8760 0.8129 -1.8743 1.0927 1.1417 1.8899 -0.4642 0.2652 0.7381 -1.5118 -0.0967 -1.1831 0.6942 0.6609 -0.1474 0.9351 -0.0228 0.2691 0.8975 0.7501 0.5012 0.0752 0.5012 -0.5332 0.3521 0.8857 -0.1546 1.1937 1.1771 -1.2991 -1.0189 -1.6349 -0.1560 -0.0688 -0.4908 0.2457 0.2190 -0.2331 1.1163 -0.3044 -0.7937 0.9169 -0.2377 -1.4432 0.1047 0.1967 0.9262 -0.4190 -0.8401 -0.8849 1.3114 -1.6919 0.8459 -0.7057 0.6884 0.4952 2.1810 -1.0107 0.2374 -0.6159 0.2142 -0.0966 0.7772 0.1636 -0.8696 -0.8482 -0.3105 0.9964 0.9032 1.4043 -1.6458 1.1606 0.5357 0.5723 -0.2681 -0.9324 0.4248 -0.1679 1.2291 -0.9034 -0.2734 -1.5637 0.8615 -0.3040 0.9039 0.0888 -1.5438 -0.5826 -0.3044 0.0638 -0.8703 -0.2225 0.3648 -0.0874 -0.0672 0.2091 -0.3245 -2.0357 1.0933 0.0444 -1.5811 1.4205 0.5647 0.3383 -1.3539 -1.5352 -0.0616 -0.6467 0.9126 0.8367 1.2733 -1.6755 0.0726 1.3812 -1.0715 -1.4380 -2.9145 -1.5906 -1.1627 -0.4757 0.2521 -1.0195 0.0696 -0.4875 0.1906 -0.5443 0.2322 -1.7499 -1.4936 -0.1619 -1.1524 -1.9711 -1.5841 0.5831 -0.4774 -0.8978 -0.9594 5.9869 -1.1579 -0.0511 -1.7713 -0.0624 -0.0546 -1.2074 -0.4450 0.7120 0.5617 -0.1973 -0.1571 -1.1831 -0.3306 0.1272 0.0943 -0.3937 0.5366 -0.4645 0.7542 -0.5148 -0.2490 1.1135 -0.1989 -0.7081 -2.2265 -3.2424 -0.6570 -1.7335 -1.6183 1.1144 0.2512 1.0108 0.3461 0.2161 3-methyl-2-oxovalerate 0.4670 0.5117 0.9304 0.3204 0.2745 1.1219 0.4706 2.0882 -0.2148 2.9065 2.1280 -1.5598 0.5407 0.9127 0.8246 -0.9282 0.8769 0.8638 -1.0622 0.7973 -0.3343 0.3795 -1.4765 -0.8407 0.3314 0.1757 -0.0413 0.2413 -1.2457 -1.5250 -0.1999 0.2510 -0.2984 -0.0719 -0.8605 1.0013 -0.1752 -0.4333 -0.3339 -0.2276 -1.9998 -1.3082 -0.0107 0.6015 0.4865 1.0791 0.9275 -0.7184 -0.6626 -0.3412 -0.3642 0.3681 0.1318 1.0878 -0.3813 -0.3657 -1.5982 0.4455 0.1792 -0.0202 -0.3333 -0.5715 -0.8087 -0.5306 -0.4950 -0.3208 -0.4797 0.8350 -0.3144 -0.9242 -0.0430 0.5108 0.3210 -0.6537 1.3460 1.0933 -3.2381 -1.5405 0.9751 0.4155 0.9189 1.7565 -0.9022 0.2670 1.1174 -3.1141 -1.8331 0.8949 0.5209 -1.0529 0.7867 0.0104 -0.8808 0.0493 -0.2351 -0.4677 0.7868 -0.8138 0.5546 0.4011 -0.2684 0.2607 0.2376 0.2414 -1.8460 -0.5971 0.6593 1.0780 -0.0272 -0.7188 -1.8510 -0.7933 0.5235 0.0490 1.4287 -0.8104 0.6916 -0.1527 1.9383 0.1155 0.7311 0.4414 0.2534 -1.0842 0.3784 0.8476 1.6543 1.0910 -0.1040 0.9878 0.8528 1.9528 -0.8569 -0.2881 -0.4024 -0.1180 -0.2476 0.4048 0.1745 -1.7054 0.4780 0.3196 0.8492 0.6108 0.4763 -1.5495 0.1510 0.3659 -0.7682 -0.5440 -0.2223 0.1751 0.7782 -0.1477 0.2167 1.0714 0.6541 1.1424 -0.0313 -0.7486 0.6134 -0.6464 1.3546 0.2158 0.7438 -0.4827 -0.9072 -0.1782 -0.7519 0.2694 1.4921 -0.2703 -0.6432 -1.5375 -1.7235 0.7402 0.5076 -1.0269 0.0472 -1.9030 1.0890 -0.3051 -0.5378 0.1859 -0.0987 -1.2327 -0.0897 0.1044 -0.7577 1.0421 -1.2071 1.1108 -0.6602 0.0069 1.3204 0.8014 0.2328 -0.1919 0.6032 0.2131 1.0648 -1.7420 1.1713 1.3181 -0.2781 0.4211 0.8906 -0.0850 0.1655 0.1175 -0.0438 0.5731 -0.7114 -0.3835 -0.5049 0.1057 2.5391 2.0954 -0.5502 -0.0852 -0.5877 -0.2536 -0.2643 -0.7510 0.9196 0.7644 0.9929 0.7354 -0.9192 1.8508 -1.8101 -0.5358 0.6764 0.9482 1.7907 0.4913 -0.2789 -0.3791 -0.0800 1.5555 -0.9752 1.2560 0.7307 2.3882 0.3008 1.0910 0.5172 -2.8581 0.9597 -0.4895 0.5011 1.6397 -0.7057 0.6364 0.8688 -0.2017 0.5324 0.6571 1.2399 -0.3753 0.4017 -0.4682 0.7243 1.3183 0.4322 0.9324 1.8842 -0.1522 -0.2327 -0.3983 -0.0579 -1.1083 -0.7615 -0.7510 0.3570 -0.6020 0.8746 -1.1496 -1.7828 0.7465 -0.5858 -1.4942 0.3455 -0.4809 0.8393 -0.4079 -0.6829 -1.3062 1.8782 -2.2852 0.4644 0.0115 0.5622 0.0102 2.2060 -0.8153 0.3616 -1.5814 1.1476 -0.5434 1.5522 1.1520 -0.1881 -0.5492 -0.0223 1.1348 0.7582 1.2032 -1.8428 1.1945 0.6777 0.5872 0.1491 -0.4347 0.8345 -0.3253 1.5406 -1.1320 -0.1145 -2.1692 0.1511 0.2138 0.4427 -0.5102 -1.3629 0.4956 -0.5405 1.6716 0.4589 0.1872 0.1928 0.2812 -0.1741 0.0126 -0.7185 -1.6484 1.1783 0.5256 -2.0446 -0.4540 0.7873 -0.2406 -1.4429 -0.8653 0.0677 -1.0371 1.2460 -0.1346 0.3490 -1.0276 0.1443 1.3184 -0.5513 -0.2425 -1.4626 -1.2396 -0.6358 -1.3889 -0.0946 -2.1149 -0.0764 -0.7258 0.9290 0.0221 0.6090 -1.8572 -1.8379 -0.2005 0.0592 -3.6610 -0.2811 0.2069 -0.0793 0.4766 -1.8695 4.3305 -0.8994 -0.6721 -1.2523 0.2358 -0.2372 -2.2020 0.0142 0.4290 0.6468 0.2704 -1.0110 -0.5822 0.2763 -0.2958 0.0480 -0.0704 1.8818 -0.8633 1.1458 -0.3836 -0.1848 0.7725 -0.2990 -0.7328 -0.9519 -1.1519 -0.9433 -1.8888 -1.7147 -0.0237 0.0882 0.9149 -0.2107 -0.5747 3-methyl catechol sulfate (1) -0.9097 -0.7351 0.2965 -1.6439 -1.3797 -0.4285 0.8033 0.7873 -0.8603 -0.4750 -0.7371 0.2573 0.4272 -0.6294 2.1907 -0.4610 0.8473 1.1950 -0.5916 -1.5503 -0.2655 -0.6154 -0.4868 -1.0650 -0.8321 -1.1932 -0.3067 -1.6304 -0.6467 -0.8081 0.0492 -0.5237 -0.9074 0.6515 0.8853 -0.5500 -1.6704 1.0853 -0.3114 1.3806 -0.6030 -1.3730 0.9029 1.0080 -1.5955 -0.6972 -0.7002 -0.9671 -0.1502 1.3881 -0.7130 0.6580 -0.4361 0.1661 -1.4809 -0.3367 -1.7178 1.3300 -1.1360 -0.1262 -0.0289 0.4233 0.7640 -1.6333 0.8975 1.1377 0.9155 -0.7687 0.2228 -0.4868 -0.9209 -0.1392 -0.4717 0.0010 -0.3977 -0.4189 -0.0475 -1.6986 -1.1055 1.4667 -1.7490 0.4062 0.6705 0.1683 -0.6287 1.6733 -1.5956 -1.6573 -0.3907 -0.1023 0.0654 0.1903 -0.0357 -0.8716 -0.9065 -1.6503 0.1034 -0.2972 -0.1167 -0.5555 -1.4825 0.0517 -0.3186 1.1549 -0.3348 1.7185 -0.8021 1.4637 -0.9213 -1.0202 -0.1354 -0.3957 -0.4351 -1.7111 -0.4848 1.7205 0.2658 1.3502 0.9105 -0.9931 1.7032 -1.6689 -1.7426 -0.0567 0.0310 -1.7650 0.0288 -0.4541 0.1236 1.5425 1.1803 1.2333 -1.4988 -0.0668 0.4611 -0.0715 1.3154 -0.3338 -0.7394 -1.3768 0.2211 -0.3419 -0.2353 0.5734 -0.3751 -0.8057 0.6351 0.1309 -0.7202 -0.2627 0.8494 -1.5668 1.6434 0.4839 -0.0695 -1.0985 -1.6975 -1.5753 1.1927 1.3118 1.0191 2.0785 -0.0450 -1.0353 -0.0379 -0.7345 1.7967 -0.3182 0.3273 -0.3811 0.7534 -0.6332 1.4215 -0.6495 0.4772 -0.3248 0.5812 -1.5665 -0.2103 -1.5510 0.4185 -0.6424 1.2071 -1.4305 -0.2887 -0.5344 -0.7383 -1.0680 -1.5657 0.0874 0.0327 0.5803 -1.0429 -1.5994 0.4335 -0.1437 1.2004 1.1750 -0.4973 -1.5098 1.9766 -1.5768 0.0706 0.7376 -0.4149 -0.8862 0.6574 -1.2178 -0.1044 1.0991 0.6232 0.0598 -0.1677 2.1279 1.1769 -0.7601 1.1080 0.8167 0.4585 0.4272 1.0540 1.4946 -0.5994 -0.2497 -0.0593 -0.4959 -0.3786 0.9362 -0.0053 -0.4597 1.7753 -0.8487 -0.5748 -0.7665 -0.9138 0.4680 0.0677 -1.4377 -0.5998 0.0897 0.2014 -0.6482 -1.7470 0.5553 0.9598 -0.1983 1.0111 1.6969 0.1600 0.7873 0.9619 0.3503 1.2701 -0.3708 0.3696 -0.5472 -0.0093 -0.7888 -1.7038 1.5979 0.8643 -1.1799 0.0698 -1.2801 -0.3078 -1.5029 -1.0875 1.2576 -0.2524 1.0437 0.5667 0.3784 0.5534 0.7032 -0.3771 0.1769 -1.0683 -0.1811 -0.8122 0.5950 1.3566 0.1167 1.0262 2.1036 -1.9326 1.2207 -0.3989 0.1704 -0.5311 -0.6010 1.1433 1.6208 0.3585 1.2566 0.5169 2.3457 -0.1276 0.3661 1.3009 -0.7914 1.2627 0.0358 -1.7725 1.2655 0.4803 2.0735 0.8367 -1.5718 -1.0488 -1.9029 -0.7107 1.0174 0.1718 0.3257 1.6707 -0.6889 -0.7657 -0.5780 0.9072 0.3779 -1.7384 0.9224 0.9100 1.6139 0.2951 -0.3165 -0.1132 0.2104 -0.2058 1.1530 -1.4237 0.9455 -1.7305 -1.6007 0.6405 0.3720 1.4566 -1.7834 -0.3930 -0.1163 1.3453 1.3399 1.2451 -0.4413 0.2841 0.3399 -0.2904 -0.8766 -1.8133 1.0262 -1.5901 -1.3314 -0.6336 0.8284 -1.8121 0.8577 -0.6557 1.0231 0.6873 1.5800 0.6056 -1.8007 0.1118 0.6012 0.3764 0.0011 1.8563 1.4187 0.0200 1.7413 0.7027 0.2611 0.2894 -1.7210 1.5902 0.7476 1.4920 -0.1741 2.1819 -0.2198 -0.8381 1.6717 1.8255 -0.1926 -0.3845 0.1637 1.9111 -0.4681 1.7220 -0.5747 -1.0497 -1.2151 0.8391 0.3314 0.7940 1.4178 -0.8951 -0.3092 0.8019 -0.2593 0.4029 0.1609 -0.6237 0.0871 0.9668 0.4346 -0.6809 -0.3084 1.1085 0.9117 3-methylcrotonylglycine 0.1903 -1.4452 -0.2385 0.4752 0.6919 -0.3596 0.1152 -0.7183 0.0603 -1.5112 0.1815 0.6382 0.2692 0.1187 1.4453 -2.0453 -0.5741 -0.0429 -0.2916 0.1995 -1.7212 -0.7315 -1.4929 0.0203 -1.9018 0.1846 -0.6913 -1.7938 0.5073 0.3208 -2.1875 -0.4296 1.7276 -0.3344 0.5370 0.0962 -0.2537 0.4598 -1.8011 -0.3406 0.6900 0.5037 -0.0563 -0.1690 0.7508 -0.6401 0.8278 0.3079 0.0210 -0.2722 -1.9047 -0.9988 0.5371 -0.7341 -0.1135 -1.2441 0.6345 0.2077 0.0445 -0.9319 0.8653 0.4706 0.4774 0.5566 1.1135 1.0382 -0.2639 -2.3039 -0.2410 0.2703 -0.0715 -0.1048 0.1959 0.5192 -0.0331 -0.8401 0.4903 1.7579 0.3192 0.1502 -1.9870 0.2698 1.1825 -0.4468 0.2491 -0.0457 0.1178 -1.8521 -2.1933 0.5990 -1.4355 -0.9262 -1.4121 0.3278 0.3557 -0.3349 -0.7279 -0.3272 -1.2741 -0.3870 -0.9619 1.1726 0.3484 -0.1450 0.7784 1.3049 -0.0613 -0.5086 0.2498 0.0173 0.3216 -0.0637 0.6913 -1.9570 -0.2129 0.8725 -0.3445 0.7835 0.0852 0.6684 1.0988 -0.5790 0.0270 -0.2161 -0.4696 1.0096 -2.1242 1.4915 -2.0544 -0.1836 1.3902 0.4019 0.9306 0.0785 0.6835 0.4906 -1.2284 -1.5275 0.0645 0.4721 -0.3981 -0.1494 0.2712 0.2863 -1.7903 0.6255 -1.9245 -2.0187 -0.3583 0.5438 0.3002 -1.6939 -1.8044 -2.5381 0.3165 -1.7197 -0.4185 -1.6965 0.3156 -1.3903 1.0376 0.7795 0.4397 -1.9509 -1.8676 0.2615 0.7784 0.7815 0.2979 -1.9334 -0.5206 0.7508 0.1580 0.1717 -0.3926 -0.1778 -1.6726 -0.0472 0.3722 0.1550 0.1679 0.6081 0.6077 0.3004 1.3888 -0.4157 0.2768 -1.8603 0.0845 -0.6077 0.4910 -0.0555 -1.8225 0.4967 1.9912 -0.0069 0.4525 1.2222 -0.1934 -1.5816 -2.1236 -0.4732 0.0041 0.7541 0.1295 0.9215 -1.1445 1.0830 -0.0418 0.2583 0.2773 0.9415 0.4008 0.9392 1.5761 0.8054 -0.3655 1.7837 0.4264 0.8195 -1.2951 -0.3995 0.2751 0.4433 1.2044 1.7235 -0.5288 0.3822 0.5692 0.9323 0.4177 0.4054 -1.8946 0.3222 0.6875 -0.5066 0.4940 0.1482 1.8060 0.2578 -2.0410 -0.8037 0.6276 0.3744 -0.0264 -1.9817 0.7198 0.9109 1.0606 0.4036 -2.0761 -0.3609 1.4919 1.0810 0.6176 0.4167 -2.0699 0.0996 -0.2926 -0.5329 -0.9100 0.0760 0.5318 1.1628 1.0630 0.2615 -2.1469 0.6648 -1.9181 -0.0171 1.3711 1.3295 2.0926 0.7198 -0.3764 1.2000 0.1355 0.8291 1.0958 0.3198 1.2412 1.2502 -0.8446 0.3796 -2.3567 1.9292 -2.1311 0.4578 -0.2175 0.6227 0.5816 -2.2499 2.7818 -0.2968 0.7172 2.0190 -0.1700 0.7404 -1.1799 0.5162 1.1909 0.4986 -0.1772 0.1635 1.2472 -0.1751 -0.4400 -1.6839 0.3837 -0.2801 -0.2894 0.2257 1.5336 -1.6735 -0.6401 0.5162 -0.5880 1.6501 1.8190 0.8120 0.0098 -1.0469 -1.0968 -2.2589 0.6262 -0.4009 1.0867 1.1642 -0.1896 0.3471 0.4021 0.5222 0.1283 -0.7404 -0.2719 0.4274 0.9424 0.5179 0.8437 -0.2466 0.2261 0.0808 -0.0488 0.8793 0.2971 0.1401 -1.8003 -0.2123 0.3960 -0.1212 -0.4972 1.0241 -1.6893 1.2320 -0.4413 0.1408 -2.3090 0.1137 0.5148 0.1932 -0.1436 -2.1222 0.9726 0.3447 -0.2438 0.1099 1.0388 0.2255 -0.0505 0.7270 0.0625 -0.5359 0.6273 -0.0583 -0.0746 0.2371 0.4848 0.3921 1.6711 -2.1634 -0.1380 1.4599 0.2906 0.5180 -2.5333 -0.5003 0.9903 0.9791 1.0205 0.0143 -0.5923 0.4572 1.2002 0.9496 1.4463 0.6182 0.5409 0.7618 -0.1288 0.1049 -2.4204 0.0837 0.4125 1.9723 0.6040 0.8157 -1.5432 0.4013 0.0548 0.9422 3-methylcytidine -1.1476 0.6738 -1.5438 -1.3645 1.6088 -1.5931 0.3302 -1.6573 -1.5520 -1.0907 -1.3332 -1.6705 1.3029 0.0025 0.0767 0.2096 -1.7251 0.6480 0.5494 -0.3058 0.2608 1.0987 0.0289 1.7600 -1.4451 -0.3555 -0.8687 0.0319 -0.4043 -0.3273 -1.7045 1.5009 1.8551 0.8451 0.2867 -0.1536 -1.4211 -0.2517 0.2321 -0.1225 1.0370 0.7668 -0.2447 1.0773 0.5862 -1.7403 0.9703 -0.8199 0.9657 -1.4468 -0.5344 0.7848 0.3527 -1.6016 1.3229 -1.6625 0.6458 1.0454 1.0550 0.5279 0.8937 -0.3007 0.5062 -1.3662 0.1416 0.8871 0.4665 0.2854 0.1061 -1.2713 0.4029 1.3680 0.5431 -0.1751 1.4418 -0.0600 0.8827 0.8890 0.4283 -0.0881 0.8336 -1.3969 -1.4785 -0.3569 -1.3735 0.4584 1.4848 0.2436 1.1775 0.4655 -0.3943 -1.4007 1.0329 0.0478 -1.4455 0.1198 -0.6186 0.6355 0.2461 0.7220 -1.6640 -1.8168 -0.2682 0.9895 0.3645 -1.3814 -1.5585 0.9913 0.4964 -0.3312 -1.7156 -0.3440 1.3495 -1.4958 -1.4975 1.4570 1.0929 0.0447 -0.6711 1.0554 -1.3403 -1.4287 1.2281 0.4870 0.5442 -1.5820 1.0220 -1.5489 0.4539 0.1332 -1.6523 -0.9067 -1.1512 0.6940 -1.5480 -1.1592 0.4289 1.0702 0.8615 0.9914 -1.2501 1.3080 0.9073 -1.5214 0.3038 0.9238 0.7183 -1.5512 0.8895 1.4626 0.3571 1.2265 1.1147 1.6155 0.2587 0.3434 0.4102 -1.2580 0.0543 -0.9789 -1.4380 -0.4405 0.7997 0.5511 -1.4148 0.2170 -0.4347 -0.3103 -1.6809 0.5113 -0.0351 -1.5123 -0.4475 0.4723 -1.7042 1.3437 1.0600 -1.2689 0.4677 0.3625 -1.4060 -0.0955 0.0449 -1.5313 0.7762 -0.8900 0.4066 -0.1601 -1.2565 0.4519 -0.5330 -1.2936 0.1926 1.4642 0.8586 1.0280 0.6793 0.1568 0.9313 1.2243 -1.6463 0.9534 -1.3211 0.4113 0.8649 0.7687 1.2994 0.4927 0.7583 0.5668 -0.1661 0.9410 -0.4264 1.3321 1.1049 0.4284 -1.8016 -1.0062 -1.8351 -1.0433 -0.0437 -1.6343 0.2789 0.2714 0.5291 0.2719 -0.7304 0.5867 0.5448 1.3061 -0.7190 1.2096 0.6784 0.6566 0.0399 -1.7501 -0.6732 0.7184 -0.0322 2.0307 -0.4010 -0.0447 0.5750 0.8483 0.6114 -1.5183 0.1116 -0.2539 -1.7362 -1.6205 0.5033 -1.6815 0.1257 -1.5602 0.4978 -0.0029 1.3257 0.7505 0.3785 0.5873 -0.2414 0.5368 -0.1925 0.1153 1.1482 1.0955 0.2972 -1.7583 -1.4604 0.8542 1.0910 0.3502 0.8531 0.9855 -1.6323 -1.5920 0.5793 1.4432 -1.7297 0.9613 0.7775 0.7510 0.9639 0.9304 0.8858 0.5580 0.3354 0.8583 0.1427 0.5611 0.7165 1.0463 0.5837 0.1289 -0.2325 0.1145 -1.6413 1.0132 0.7660 0.3441 -1.5085 1.1083 -0.1402 -0.1777 0.6134 0.6165 -1.6589 1.3450 0.0852 -0.1268 0.8038 0.9271 -1.6122 -0.2316 1.0152 -1.5716 1.3015 -0.2066 -0.2157 -1.6757 0.8281 -1.6921 0.9551 0.8666 0.6101 -1.9006 0.6610 -0.3873 0.5720 0.8561 1.3021 -0.0738 0.4760 -1.3246 1.5145 -0.4839 -1.2600 -0.0180 0.0073 0.2813 0.3730 -0.0618 0.4211 0.6437 -0.3145 0.2498 -1.3526 1.4623 1.3811 0.8103 1.1255 0.2492 -1.6440 0.5361 -1.6576 -0.0910 0.7160 0.3175 -0.4470 -0.5006 0.1265 0.6877 0.8234 0.0332 0.8209 -0.2224 0.5587 0.4101 -0.0846 -1.8330 -1.4005 -0.1520 0.9609 -0.1552 0.3791 -1.3774 -2.0326 -1.7862 -1.7353 1.0452 -1.5620 0.6788 0.6261 -0.0372 0.7087 0.5410 0.0994 0.2343 0.7712 0.2410 1.2233 -1.5070 -1.0705 0.6302 -1.7709 0.3114 0.4470 0.9705 0.7577 1.1982 -1.2054 0.0363 -1.4756 -1.7520 0.3979 0.2124 0.1634 1.3289 -1.5739 -1.9155 3-methylglutaconate -0.9782 0.2609 -1.3397 0.1135 -0.2115 -0.8436 -0.5552 -1.4746 0.4706 -1.4397 -1.1997 -0.1417 -0.1128 -0.5350 1.2787 -0.2834 1.4409 -0.5870 -1.2372 1.6234 0.1751 1.4820 0.6358 0.1129 -0.0039 -0.4757 -0.6238 -0.2327 0.3873 -0.0760 -0.0083 1.3376 -0.0327 -0.6529 -1.6129 -1.0480 0.9329 -1.2865 -0.6000 -0.6152 1.3010 2.0763 -1.3158 0.4798 -1.3209 -0.2008 0.9471 -1.4056 1.6393 -0.3396 -0.1791 -1.3311 0.9055 -0.0989 0.5963 -1.2536 1.7563 1.0778 -1.2815 0.5366 0.3814 0.5312 1.5502 -0.6267 -0.4157 -0.3286 -1.2281 -1.9241 0.3920 -0.4757 1.4155 0.8926 1.4471 0.4274 0.4639 -1.7415 0.4511 2.2330 -0.5965 -0.6376 0.3193 -0.0362 -0.5378 1.2875 -1.6083 -0.4593 0.1464 -0.8465 -1.2424 1.3379 -1.6818 -1.4948 0.2867 1.4189 0.9680 -1.7668 1.1407 -1.7795 0.2272 -0.1193 1.9380 -0.4844 0.3877 -1.1750 -0.2761 -1.0167 1.1321 -0.3553 -0.8306 -1.6010 0.6424 -0.8448 -1.7158 0.8958 0.6207 -0.0854 0.2544 1.1215 -1.9563 -1.5141 -0.8598 -1.0433 1.9745 -0.6046 -0.2484 -1.6863 1.6040 0.5535 -1.1798 0.6382 0.1364 1.0874 0.4359 -0.0877 0.5291 -1.1698 0.9718 -0.1168 0.2957 2.4079 -0.1857 1.3860 -1.2433 1.0073 -1.7029 1.9013 -1.0296 0.2543 -0.8033 0.5233 0.6372 -1.2258 0.1758 -1.3834 0.4489 -0.7544 -0.2384 -0.1785 -0.9093 -1.2984 0.4602 -0.6103 -0.9225 0.7641 1.2440 1.3157 -0.9650 -0.9131 -0.3380 0.0943 -0.1426 -0.0398 0.0392 2.1015 0.1505 0.3667 -0.1693 -0.2803 1.3538 0.2376 -1.2540 -0.3510 -0.1302 -0.0547 0.9355 -1.6489 1.0781 0.3395 1.2047 -1.4708 -0.8275 -0.3885 1.7173 0.2485 0.6389 -1.4277 0.3455 0.7998 -0.1428 -1.9134 0.0356 -0.9719 -1.1499 -0.6808 -0.4262 0.9986 -0.7609 0.8177 1.2707 0.5428 0.5210 -0.5776 1.6868 0.7847 0.2391 -0.2729 -1.1814 0.5707 1.3071 0.5367 -1.4182 -0.6628 0.7558 0.2808 1.1997 -1.0628 -1.4723 -0.8751 -0.4962 -0.2233 0.4391 -1.0517 0.3864 0.6421 -1.3106 0.6661 -1.7118 -0.1105 0.6307 1.3928 1.6150 0.1624 1.1723 -0.4532 0.2481 -0.4325 -1.0559 0.8827 -1.2207 1.0240 0.5122 0.5542 0.9752 0.1734 0.6334 -0.8691 -1.9404 1.3061 -0.0038 -0.2915 -1.4620 -1.2077 0.4767 -1.5568 -1.5633 0.4094 -1.5916 -1.3122 -0.9199 0.0911 0.9570 0.6026 0.3429 -0.1858 0.2668 0.0775 0.4501 -0.1895 -0.3534 1.7975 0.8674 0.7487 -0.1595 -1.0193 -1.6168 0.5223 1.1166 0.3217 0.0961 0.1471 -0.1065 -1.8503 1.9053 -0.5783 0.7554 0.2852 -0.9483 0.4182 -0.6774 0.5303 1.7168 -0.3193 -1.4884 1.2382 1.3970 -0.6190 -1.1155 -0.2284 -1.3500 -1.0935 0.5593 -0.3329 -0.7597 0.7860 -0.1557 -1.0255 0.5777 1.6692 1.3996 -0.0280 1.5347 0.2052 -1.1900 -1.7043 1.3220 1.1959 -1.7024 0.0566 -0.0220 1.2829 -1.1334 0.7842 -1.4292 -1.0512 -1.6062 -0.2199 0.1769 0.4854 -0.5494 0.2839 -1.7302 -0.0919 2.2271 0.5759 0.4899 -1.2347 0.7668 0.8639 -0.2495 0.7186 -0.0137 -0.3646 0.6334 1.3288 -0.3713 -0.4134 0.8857 0.6757 -0.8440 0.3291 0.7028 1.4132 0.9374 -0.7040 1.3852 -0.1324 -0.7195 -1.7250 0.0542 -0.0327 1.1320 -0.1278 0.9615 0.5149 -0.9201 -1.1404 -0.2874 -0.8989 -0.1642 1.5461 -0.1919 -0.5831 1.6129 -0.8320 -0.8753 -0.8507 0.2366 -0.1310 -1.1664 0.9305 0.4369 0.6802 0.3196 -0.3435 2.5031 1.6847 -1.7535 -0.3715 0.1853 1.1564 0.0614 -0.8291 -0.5522 1.8660 0.1069 1.7231 0.5795 1.3177 1.8701 1.5135 3-methylglutarate/2-methylglutarate 0.6203 0.4444 0.0608 0.6103 -1.9142 0.6755 -0.0206 0.1093 0.2915 -2.0146 -2.1934 0.0214 1.2805 0.5446 0.7886 0.0734 0.9084 0.0871 -0.0757 1.0555 0.5830 1.1750 0.5230 -0.3506 0.0973 0.5308 -0.0286 0.0122 0.0169 0.4128 0.3218 -2.1898 0.3028 0.7162 -0.1217 0.4723 0.5810 -2.1067 0.0028 -2.5189 0.8363 1.3802 -0.0800 0.3333 -2.1908 -0.3344 0.4696 -2.3174 0.6987 0.2468 -2.3117 -2.5252 0.6869 0.5518 0.5203 -0.1528 1.0537 0.4682 0.4331 0.7453 0.5200 0.1840 -2.4674 0.6638 -2.3049 -0.1818 -0.1333 -2.6034 0.1805 -2.1715 0.4648 0.7151 0.8514 0.2255 0.6363 -2.4901 0.5657 1.3339 0.3289 -0.0221 -2.3825 0.5924 -0.1840 0.8033 -2.2393 -2.4476 0.4935 -2.2698 -2.2208 0.4562 -0.4373 -0.1108 0.4042 -2.0278 1.0321 -0.0529 0.5196 -2.2875 0.5437 0.5276 1.1143 -0.3031 0.4472 -0.3333 0.3222 0.3237 0.6901 0.4523 0.9498 0.5217 0.6249 -0.0338 -2.1831 0.9891 0.5681 0.5290 -2.1702 0.5193 0.1815 0.1064 -2.2195 -2.2861 1.2762 0.3168 0.1198 -0.3057 1.0198 0.7349 -2.4317 -2.5552 0.0070 -2.2122 0.3549 0.3378 0.4741 -0.2289 0.5379 0.3059 0.5283 0.9359 0.8885 0.7648 -0.3296 0.5546 -0.7417 1.3990 -0.0305 0.4175 -0.0009 0.1375 -2.1385 0.2351 0.6624 0.1416 0.6998 0.6934 0.3490 0.1639 0.4283 -1.9532 0.9641 -0.7126 0.2759 0.6944 0.8832 1.0867 -0.1238 0.1379 -0.2284 0.2820 -0.2361 0.3459 -0.9868 -2.1449 -0.0363 1.1166 0.5063 0.4704 0.8067 0.7566 -0.0546 0.0970 0.4913 0.3401 0.7587 0.1731 0.9718 0.6601 0.4612 0.2799 -0.2634 -2.1738 0.7249 0.4998 0.7160 0.0922 0.7311 0.5184 -0.2204 -0.0653 0.0882 -2.1651 -0.1229 0.3816 -0.4585 0.7908 0.0687 0.8115 0.8910 0.6068 0.2297 -2.3520 0.8425 0.7618 -0.0806 0.4907 -0.3045 0.3623 0.8139 0.5821 -0.7110 -0.1339 0.5587 -2.5955 0.9091 -2.5899 -2.5090 -0.1781 -2.4468 0.3317 0.3252 0.1275 0.4255 0.5997 -0.4031 0.5395 0.0437 0.5003 -0.5877 1.0566 1.1035 0.1592 -2.3834 -2.6428 0.1760 -0.4786 -2.4003 0.3006 -0.0686 0.8684 0.5971 0.6372 0.1191 0.1419 0.7595 0.0102 -0.0759 0.1383 0.5264 0.0984 -0.3428 -0.1548 0.6727 -0.2619 -0.3605 0.5820 0.5085 0.4910 -0.1142 0.2835 -2.4700 0.4976 0.4045 0.0173 0.6051 0.3166 0.1819 0.2525 0.2323 -2.1500 0.4130 0.4717 0.1036 -0.0477 0.2441 0.4306 0.6195 0.6756 0.3368 -2.6070 -0.0647 0.0261 1.3073 0.1676 0.7646 0.2895 0.1281 0.3247 -0.2490 -2.4907 0.6589 0.0348 -2.4125 0.8343 0.8984 0.4475 0.4339 0.5511 0.2017 -0.1266 0.8938 -2.5208 -0.6596 0.5482 -0.1356 -0.3077 0.5136 1.3016 0.5936 -0.4598 0.7986 0.8251 0.2077 -0.9203 0.9187 0.7411 -0.2508 0.3897 0.1462 -0.4414 0.0496 0.5595 -0.4940 0.1853 0.0906 0.1385 0.6507 0.8070 0.0319 -2.2067 -0.3731 -2.7021 1.3298 0.4093 0.2759 -0.2247 0.3320 0.8363 1.0982 0.6712 0.9272 0.4380 1.3006 0.7833 0.3335 -0.1775 -2.5868 0.2751 0.3429 0.4173 0.1836 0.7260 0.5030 -0.3724 0.5453 -0.0191 -0.0212 -0.3306 0.3765 0.2270 0.6255 0.5917 0.6689 0.8464 -0.2852 -2.2130 0.0161 0.4913 0.5825 0.6439 0.3207 -0.2259 1.0544 0.2064 0.3343 -0.3017 0.3659 0.1312 -0.0467 0.4960 0.4047 0.2761 0.8456 0.0746 1.5411 0.4872 -0.6701 0.1305 0.4207 -2.5006 0.2164 0.1401 0.5354 0.6862 0.1289 0.8892 -0.0339 1.0133 -2.3972 1.0801 3-methylglutarylcarnitine (2) -0.0017 -0.5613 -0.6560 0.4424 -0.0403 -0.3488 -0.8442 -0.0410 -0.0625 0.3790 0.2120 0.8536 0.0785 -0.6199 1.4718 0.5687 0.7449 0.1569 -0.0018 1.6216 0.0425 1.7139 0.8729 -0.2875 0.1899 0.3924 -0.5563 0.6588 -0.1465 0.5238 0.2814 0.8830 -0.7599 -2.0430 -1.8895 0.1542 1.2774 -1.0735 -0.2270 -0.8870 1.8777 2.1099 -0.8960 0.0784 -0.3888 0.4482 0.2335 -0.2820 0.7292 -0.3097 -0.7293 -1.2408 0.7892 -0.1073 0.5421 -0.3515 2.1199 0.5204 -1.3340 0.0152 0.9524 1.0652 0.9796 -0.2753 -0.8922 -0.0666 -1.0880 -1.6102 0.4691 -0.3285 1.7868 -0.0312 1.3866 -0.2769 -0.4760 -2.6894 0.4843 2.4089 -1.1064 -0.1715 0.9839 0.4063 -0.4529 0.8560 -1.0868 0.4696 0.7275 -0.2764 -1.0229 1.4197 -0.1501 -0.0328 0.4253 -0.0517 1.0176 -1.1168 0.2372 -0.7740 0.4741 0.0236 2.1027 0.3746 1.6702 -0.3609 -0.3646 -0.7639 0.5402 -0.6806 -1.2221 -0.8085 0.3869 -0.1056 -0.9665 0.1200 0.1153 0.3414 0.2657 0.4193 -0.0972 -1.2447 -0.2669 -0.0340 1.7863 -0.0056 0.2972 -1.3124 1.4655 1.5999 -1.0088 0.0807 0.0917 0.7887 0.4214 0.0756 0.2615 -2.6789 0.0687 0.3263 1.0592 1.6905 -0.3981 1.3143 -2.4887 0.2822 -1.3827 1.5946 -1.2738 0.3797 -1.1582 1.2583 0.6213 -0.6866 -0.7756 -1.5607 0.8861 -0.6258 -0.1470 -0.2169 -0.3527 -1.4230 0.6676 -1.3605 -0.4898 0.8753 0.7287 1.5669 0.0017 -0.0528 0.7373 -0.3066 0.3775 0.5113 0.1180 1.7380 0.5356 0.2367 -1.2014 -0.0262 0.5512 0.5709 -0.3459 0.1125 0.2015 -0.2874 0.1635 -0.2490 0.9198 -0.2871 -0.0869 -0.8495 -0.6089 -0.4837 0.9914 0.6743 -0.0126 -0.5424 0.8783 0.8464 -0.1959 -2.2936 0.6403 -0.2750 -2.4216 -0.2586 -0.8625 0.6310 0.5113 0.7071 -0.0402 1.1283 1.0241 -2.5472 1.4651 0.0956 0.0877 0.2132 -0.3314 1.1570 0.8886 0.4687 -1.6371 -0.2872 -0.1998 0.4792 1.0324 -1.2852 -1.0251 -0.6184 -0.1127 0.6553 0.4528 -2.4389 0.4209 0.5083 -2.7282 0.3032 -2.6084 0.2771 0.5726 1.0251 0.5591 -2.7832 1.2236 -0.8093 0.7911 0.0778 -0.8187 -0.2358 -2.7411 0.7556 0.4293 -0.4756 0.5198 -0.1033 0.3167 -0.6475 -2.6305 -0.2325 -0.3726 0.4863 -0.1302 -0.2491 0.6480 -2.8064 -2.6558 0.3902 -2.6792 -1.3800 -0.4151 0.1510 1.0397 1.1754 0.3561 -0.0434 0.9431 -0.1176 0.2273 0.1806 -0.4902 0.9287 0.6013 1.3648 -0.1135 -2.6978 -2.8386 0.5213 0.4696 0.1987 -0.4797 0.1746 0.3764 -1.1092 1.5091 -0.6342 0.3881 0.6015 -0.6195 0.2884 -0.1667 0.1127 0.7836 -0.5781 -1.2715 1.2244 1.5829 -0.9953 -0.0771 -1.0012 -2.7283 -2.7788 0.0660 -0.4303 -0.7424 0.0043 -0.4066 0.0373 0.3471 1.9787 1.5216 -0.7120 0.6990 -0.3026 -1.5818 -1.0720 1.3678 1.0031 -2.2844 0.3207 0.6515 1.6897 -0.4106 1.0027 -0.9774 -0.6026 -1.5525 0.3795 0.7173 0.4393 -0.0141 0.5576 -1.0795 -1.0600 1.4854 0.4646 -0.2486 -2.5324 -0.1559 1.0672 -0.1153 0.9195 -0.1013 -0.0478 0.5670 1.0423 0.4707 -0.2150 -0.3793 0.5696 -1.3814 0.7007 0.1049 1.3548 0.3140 -0.4074 0.5024 -0.1766 -0.7090 -1.9222 0.4239 0.7425 -0.2248 0.0891 0.4570 -0.0819 -0.1272 -0.7533 0.3994 -0.1312 0.4203 1.5241 0.2054 0.2798 1.2502 -0.5578 -1.2645 -0.1505 0.6675 -0.4052 -1.3363 0.8815 -0.8477 0.6970 0.6585 0.1273 1.8661 0.5575 -0.7780 -0.5228 -0.1133 0.7815 0.4711 -0.4102 -0.3894 1.1623 0.4396 1.3614 0.7596 1.4584 1.3977 1.2403 3-methylhistidine 0.4145 0.4409 0.5877 -0.6338 1.6298 -0.4945 1.9423 -0.4142 0.5446 -0.5083 -0.0718 -0.3013 1.2562 1.8553 0.1077 -1.2033 -0.1509 -0.6528 0.5759 0.2398 -0.7202 -0.6291 -1.2617 1.2088 0.2001 0.7075 -0.7946 0.4619 -0.1295 -0.2122 -2.4987 -1.3405 -1.4265 0.2839 1.0578 -0.8682 -0.6266 0.4086 0.0285 0.1851 -0.3750 0.1602 -1.7322 -1.2027 -0.1082 0.0290 0.0738 0.7611 -0.1904 -1.2869 -0.7739 -1.2039 0.8936 0.8188 -0.8612 0.0589 0.6146 -1.2728 -1.2535 -1.6573 -0.2200 1.9577 1.5878 -1.0655 1.1476 0.1327 0.7578 -1.7862 -1.1802 -0.4390 -0.5479 -1.2126 0.3443 -0.7587 -0.7770 0.1693 0.6554 -0.2617 -0.3199 0.6152 -1.0065 0.5300 1.5153 -1.2799 0.8851 -1.0219 -1.3003 -0.6744 -3.0894 0.1003 0.7530 -1.4362 -0.7079 -1.1286 0.6855 -0.3771 0.3684 0.2869 1.5109 -0.8937 0.8228 1.5363 -1.6002 1.0414 1.4402 -0.6378 -0.7174 0.3242 1.3879 -0.2725 -0.5475 0.0014 -1.3597 -0.1507 -1.2235 -1.4426 -0.3654 0.0226 -0.5000 0.3874 0.3935 0.5766 -1.4134 0.7776 -0.8068 0.1188 -0.3169 -0.7908 -0.7206 0.6943 2.5485 1.3280 -0.5336 1.3806 0.5950 2.5430 -1.1316 0.1075 -0.7435 -0.5297 0.6829 0.4783 -0.2891 1.5176 -1.1311 0.4521 -0.8232 -0.0314 -1.8585 -0.3226 -0.9043 0.4757 1.1656 -0.0279 0.9884 -0.9142 -0.3817 0.5738 -0.9434 -1.0583 -0.3861 -1.0260 0.6499 0.1503 -1.2871 0.2785 -0.2136 0.1539 0.6225 0.7919 0.9650 0.7687 -1.6725 -1.0885 0.5187 0.3958 -1.0349 -0.6032 -0.3348 0.4097 0.3687 -2.7282 0.7270 -0.4966 0.6923 0.6065 -2.3270 0.5953 -0.5247 1.0020 1.8616 0.2828 -1.0311 -0.3448 0.5170 -0.9367 -1.7199 -2.3724 0.3208 -0.6553 -0.0437 -0.2744 0.0094 -0.0291 -0.4034 -1.2907 -0.1965 -1.3513 -0.0807 0.7564 -1.1728 1.0857 0.1481 1.7301 2.0503 0.0057 0.4555 0.6325 -1.5744 2.2997 -0.2570 0.2354 -0.4275 0.5498 0.5074 2.7113 -1.4338 2.6089 0.8865 -0.0132 0.1296 -0.1981 -2.2969 -0.2354 1.1880 0.2712 0.8951 -0.0742 1.8151 -0.4681 -0.4330 -0.0047 -0.9674 1.5603 2.6715 0.7443 0.9240 0.2011 0.2350 -1.6678 -1.1158 -1.0112 0.3857 -0.3604 -0.9653 1.3472 0.7833 -1.4865 -1.2585 -0.1802 -0.3191 0.1099 2.2294 2.7065 -0.4592 0.9990 -0.5504 0.1843 -1.6010 -0.5502 -1.5252 0.6773 0.3860 -0.1768 0.6617 0.5071 -0.0578 -1.6855 -0.5812 0.9146 0.2757 -0.4353 -0.9570 0.0282 1.4264 0.1213 -0.4242 -0.2802 -0.1874 0.8895 0.1106 0.9906 1.2302 0.1239 0.6102 0.5122 0.2630 0.9537 -0.0636 -1.7514 -2.0504 -1.0750 1.8125 -0.0574 -1.4966 0.3831 -1.3039 0.7680 -0.7223 -0.8388 -1.0002 1.4186 0.1985 -0.4879 -1.2693 0.4471 -0.7662 -0.9599 -0.4073 -0.6796 -0.5350 1.3262 1.4049 0.4439 -0.8508 -0.3502 -0.6714 -0.0466 0.1369 -1.0142 -0.6625 1.2033 0.9265 0.4223 -0.0864 -0.2477 0.4481 -0.9536 1.2805 -1.5389 1.4738 0.4757 -0.3322 0.5056 -1.8399 -0.5091 -0.3089 -0.7931 1.3168 -0.8577 0.1371 0.9508 0.7023 0.8655 0.9720 1.2292 -1.5476 1.5283 -1.3922 0.7542 2.0226 -0.6742 -0.3612 1.6761 0.2943 0.9782 1.2436 0.1564 -1.0374 -0.2887 0.2502 0.2956 0.7666 -0.2061 0.8973 -0.9817 -1.0654 0.1172 1.0223 0.4318 0.2571 1.7211 0.8619 0.1114 0.6215 -0.7136 1.5831 0.3948 -1.4709 1.7904 1.3765 1.3996 0.0119 0.3700 -0.4191 1.3942 0.8517 -0.4298 -0.3498 0.0057 -0.4776 -0.3746 -0.6603 0.0906 0.5823 0.5735 0.9389 0.9801 -0.6351 -0.6363 3-methylxanthine -1.3036 0.6990 0.4606 -1.4254 -1.1422 0.6013 0.4894 0.0308 -0.2485 -1.2733 -1.4491 0.8861 0.7125 -0.1834 0.7138 1.0088 -0.0750 -0.9736 1.2701 0.1790 -0.5044 0.8243 0.3430 -1.4751 0.0798 1.5476 0.4299 -0.5596 0.1109 -1.5369 1.8000 -0.1215 -0.0013 -1.7255 0.3468 0.2818 1.1302 -1.3141 -1.4346 0.1457 0.7694 0.5820 -1.0120 -0.4351 -1.3914 -1.6868 0.7837 -1.4678 0.0058 1.0886 -0.7094 1.2843 0.6295 0.9281 -1.2839 1.5926 0.4960 -1.2556 -0.6169 -0.1040 2.0825 -0.2946 1.1147 -0.6714 0.4413 0.7558 -1.5133 0.7116 0.2612 -1.3719 0.3114 0.1645 0.0061 -1.6831 -1.5035 -0.4344 0.2493 -0.5342 -1.3744 -1.5481 0.6595 0.0288 1.0020 0.7982 0.6823 0.9665 -1.3990 -1.4606 0.6813 1.9356 0.9026 -0.2358 0.3606 0.7053 1.0265 -1.4544 -1.5050 -1.4893 1.4893 1.8950 0.1161 0.3918 -0.2543 0.6172 1.5027 -0.7638 -0.3191 0.1222 -0.1442 -0.1746 1.1161 -0.2519 0.4715 -0.5407 0.5672 -0.0325 0.4942 -0.5482 0.1009 -0.0161 -0.7002 1.1932 1.0287 -0.6465 0.1148 0.3411 1.6677 1.5131 1.2369 1.4199 0.7726 0.2709 -1.3034 -0.3077 -0.3190 -0.1605 -1.4837 0.4823 1.3196 0.0927 -0.5521 2.1037 -0.5427 0.8560 -0.1683 0.8404 -1.4943 0.3234 1.3795 1.1994 -1.3507 -1.3683 -1.4193 0.1894 0.6638 -1.3775 0.1342 -0.1474 1.0358 0.7116 1.3350 -1.6820 0.5476 -0.1383 -1.4860 1.6934 1.3583 0.9309 0.0553 -0.0737 -1.6510 1.2081 0.8677 -0.6103 -0.3676 0.4684 -1.3476 1.2054 -0.3175 0.0235 0.6584 0.8389 1.4516 -0.1801 0.6247 0.8509 1.4490 1.0608 0.8947 0.3978 -0.5154 -0.3221 1.2879 -1.4176 0.4175 -1.6063 -0.4541 1.8045 -1.5231 0.0263 0.0201 -0.0379 -0.2414 0.1952 0.0776 -0.1366 0.7136 -0.1851 1.2163 0.8307 -0.5306 0.4337 2.0836 0.2719 0.5909 0.5190 0.7359 -0.6713 -1.7462 0.1479 -1.0975 -0.4661 0.1756 0.6083 0.7935 -0.2868 -0.6640 0.1402 1.3448 -1.5129 0.6706 -1.4239 1.7898 0.0557 -0.8076 1.2724 -1.5683 -0.4052 0.1407 -1.4436 0.3626 -0.7957 -0.6471 -1.7618 -0.4756 -1.5464 0.5456 1.4160 -1.6875 0.0373 -0.1634 -0.0830 1.7170 -1.2457 -0.4737 0.6885 0.5237 -0.1559 -0.6208 0.8431 -0.0244 0.3181 -0.9371 -1.7381 -0.9501 0.2512 1.0250 0.3665 -0.7796 -0.6172 0.5920 -1.4644 -1.6755 -0.1741 -1.6048 1.6737 -0.2839 -0.2915 0.2172 -0.4435 0.2246 -1.6885 0.0872 -0.0299 -1.0756 -1.5118 -1.6197 -0.7368 -0.6810 0.8705 -1.0314 -1.6865 0.8627 -0.7004 0.4701 1.1096 0.9432 1.1211 1.8995 0.3342 2.5520 0.4399 0.8185 1.6837 1.2263 0.0053 -1.6381 -1.3462 0.1767 -1.7167 -0.4553 -1.6471 0.1592 0.8771 -0.7397 -0.3008 0.2061 0.4718 -1.4825 -1.6502 -1.5211 0.5008 -1.9119 -0.5087 -0.5795 1.0327 0.0946 -1.5604 0.7014 1.0760 0.4151 1.1644 0.5129 -1.4249 -0.8389 0.6247 1.0381 -1.6184 1.0960 -1.4416 -0.0705 0.9924 -0.0878 0.0941 -0.2280 1.0226 -0.3681 1.6218 -1.0923 0.4680 -1.3888 0.9186 -0.2602 -1.7969 0.4537 -0.3136 -1.0893 -1.6215 -0.7052 0.9219 -1.6589 0.5176 0.3206 0.4617 0.1177 -0.0514 -0.5185 -0.0928 1.0736 0.2641 0.3250 0.1132 -1.5417 -1.5495 0.4567 0.7712 1.3304 1.7988 -0.0061 0.9620 -0.1347 1.7912 1.6647 0.5506 -1.1595 -1.8772 0.5424 0.8870 0.3602 1.3782 -1.3912 -0.8427 0.5579 -1.6062 1.4370 -0.9176 -0.8203 -0.1058 -0.4539 1.2202 0.7163 0.7882 -1.5183 0.9616 1.3714 -0.2014 -0.6058 0.3441 -1.5878 0.8273 3-phenylpropionate (hydrocinnamate) -0.2762 0.2345 0.2425 0.7073 -0.9587 0.5214 1.2055 1.1813 -0.9427 -0.2800 0.4450 -1.3905 -0.9461 -0.8716 0.1510 0.6823 0.0352 0.5517 1.5765 1.2374 0.7201 1.7213 1.6297 1.1100 0.3194 0.8538 1.0983 -1.5300 0.9210 -0.5277 2.1675 -1.9317 0.1479 -0.8552 -0.8873 0.4113 0.7387 -0.9189 0.7900 0.7900 1.2732 -0.1676 -1.7452 -0.2110 0.8584 1.3037 -0.2070 0.7825 1.9692 -0.6778 1.1829 -0.7456 0.4556 0.1519 -0.9279 1.1896 -0.1007 0.1537 -1.1601 -0.9995 1.9447 0.4806 1.2461 0.4577 0.6931 0.2503 0.5627 1.2671 -0.5116 1.2346 0.7170 0.6214 0.1872 0.1392 -0.6482 0.3262 -1.0994 3.0491 -1.9141 0.2006 0.9808 0.6312 0.4008 -0.3821 -1.3144 0.3806 -1.0350 -1.4396 -0.1133 -1.8061 -0.2434 0.8089 -0.9748 0.4094 0.3028 1.2035 -1.5589 -0.7461 1.0504 -0.9925 0.8065 0.8390 1.7686 -2.3112 1.1579 -1.2872 0.0754 -0.1065 0.4857 -0.8185 1.2227 0.1826 1.3594 -0.3775 -0.1324 0.9682 -1.8964 0.0134 -0.4567 0.5164 -0.1473 -0.9563 -0.2573 0.5067 0.4043 1.3902 -0.8510 -0.3284 0.0522 1.1924 -1.4380 -1.5561 -0.1648 0.1184 -1.0535 0.0482 1.0816 0.4161 -0.8982 3.0463 0.6285 0.6249 0.0247 0.2838 -0.8830 -0.5219 0.5462 1.4591 -1.5438 -1.9312 -1.8791 -1.9004 0.1535 -0.6504 0.7863 -0.4129 -0.4717 0.3123 -0.1863 -0.9079 -1.0813 0.6195 -1.9290 -0.4826 0.0179 -0.6839 0.2923 0.3871 1.0227 -1.3436 0.4125 1.1038 1.6210 1.1780 0.3729 0.1621 -1.0978 0.0831 -1.4179 -0.9051 -2.0181 1.1904 0.9743 -0.3111 -0.0601 0.4111 -1.1589 0.4186 0.8554 -0.8032 1.7713 0.8863 -1.0155 -1.9590 -1.9120 0.9697 -0.1880 0.8857 0.8355 0.1304 1.0629 1.5266 0.9286 -2.0234 0.4829 0.8909 -2.1482 1.2206 -0.6325 0.1228 0.0603 -0.0984 1.4334 -2.1592 -0.4139 0.3965 -0.1251 1.0558 -1.1101 -2.2679 0.3191 0.6383 1.0582 -0.1876 0.5310 0.0562 1.1412 0.6864 1.4571 0.9926 -0.8490 0.9708 2.2084 0.0653 1.0790 -1.4923 -0.1139 -0.7567 -0.1779 0.1091 0.3266 1.2130 1.0932 0.6497 0.0511 -0.6735 0.9400 0.0700 0.6885 0.9946 0.9225 0.9784 -0.9920 -2.1590 0.7643 -1.1647 0.9648 0.7550 -1.3334 1.0571 -0.3937 0.4629 0.8891 -0.7047 0.5585 -0.5346 0.8618 0.8964 -2.0774 -1.1412 -0.2343 -0.5260 1.4172 0.1352 1.1136 0.2407 -0.2002 0.7888 -1.2440 -1.8729 0.4594 0.0781 0.2821 0.1459 0.1032 -0.3276 0.7281 0.3085 -0.7682 0.7617 -1.1750 -0.1506 -0.9726 -0.5089 -0.2845 -0.0963 -1.2226 -0.4891 -0.8259 -0.0085 0.2405 -0.2943 -2.1418 -0.3981 0.6308 -1.6652 0.6473 -1.8816 0.4057 0.8380 -0.0783 -0.1312 0.3728 0.3559 -2.4123 0.6074 -0.8415 1.0501 -1.6003 -2.2615 0.4581 0.0278 -0.6491 0.3394 0.5219 0.1779 0.9932 -1.2089 -1.0332 -0.0693 0.8097 0.3873 -2.1385 1.0547 0.6178 -0.7355 0.6910 0.4092 0.4919 1.1092 0.1648 -0.2189 0.8695 0.3765 1.0136 0.1700 -0.6944 -0.1491 -2.2350 -1.4814 -0.0736 -1.5400 -1.1594 0.1763 -1.2221 -0.2006 0.7194 0.4059 -0.4994 -0.3711 -0.0002 0.1407 0.3313 0.1780 0.2766 -0.0604 -0.1214 0.4953 0.6381 0.3549 0.9013 -2.2416 -0.6355 -0.7319 0.4694 -0.0698 -0.9300 0.1684 -0.7053 -0.7673 1.3073 -0.7216 1.1546 1.4480 -2.5438 -0.3377 -0.0972 -2.2245 1.2464 -0.1687 -1.9332 -0.3140 -1.0016 -0.3496 -0.3287 0.2461 0.9877 0.1372 0.6916 0.1693 -0.2039 -1.0224 1.2172 0.7107 0.1956 0.4711 -0.3709 -2.2109 0.7406 0.7121 3-sulfo-L-alanine -0.4711 -0.2750 -0.9120 1.0750 -0.2655 -0.9657 -1.1337 1.4106 -0.9327 1.8522 -0.6459 0.9231 -0.7789 -0.9294 0.6801 -0.9771 -1.1238 1.6019 -0.8017 0.8337 0.9510 -1.3836 1.8944 -0.8333 0.5605 0.5460 1.4987 -0.7151 -0.6376 1.4485 0.5399 -0.6508 -0.3541 -0.1612 -0.3013 1.4528 -0.7865 0.4651 -0.7060 1.8566 0.9320 -0.2529 -0.8644 1.1333 -0.6522 0.7580 1.4206 0.8160 0.8403 -0.8049 0.6933 1.5793 0.7848 -0.9759 -0.4464 1.2883 -0.8717 -0.4401 -0.1622 -0.9932 0.8174 -1.0735 -1.0404 -0.7198 -0.8162 -1.1436 -0.8952 0.6430 0.9324 1.2083 -0.8652 0.2346 0.6655 -1.1031 0.8429 -1.0746 -0.6576 -0.8370 -0.0734 -0.9219 0.6337 1.7653 0.9601 0.7802 2.0543 0.3228 -0.6523 -0.7630 0.4904 1.2763 0.9236 0.6639 -0.7753 1.1089 0.4450 1.2290 1.0654 -0.7854 -0.7678 -1.0169 2.0077 -1.2465 -0.6803 -1.1683 -0.7116 1.5558 -0.9292 -0.9181 -1.3309 1.0292 -1.1195 -1.0866 -0.6419 -0.8592 1.4696 0.5860 0.3256 1.4703 -0.9882 0.5800 3.0513 1.4005 -0.9166 0.5720 -1.1625 -0.1338 0.6482 0.3598 0.9268 -1.1673 0.9900 -0.6770 -0.4784 0.9089 1.7054 2.0055 -0.8122 -0.4258 0.6059 -0.2598 0.6658 0.3194 1.3949 0.7716 -0.6834 -0.9461 0.8083 -0.9385 -0.7248 1.2560 0.6574 -0.6006 0.7368 -1.4451 0.3983 0.4251 -0.8355 -0.6162 -1.0233 1.1837 -0.8143 -0.0169 1.6258 -0.8541 1.6999 -1.1106 0.5356 1.5248 0.4801 1.2327 1.3003 -0.8867 0.3837 1.8467 -1.0819 -0.5008 1.0235 -0.5996 0.7623 -0.5730 1.0717 -1.2363 -0.9353 0.8853 0.3798 -1.1791 -0.8987 -0.7609 1.8726 -0.7217 0.1798 1.9908 1.4969 1.3843 -0.6393 -0.9843 -0.7690 0.5481 0.9374 0.6928 1.3026 -0.6191 -0.6810 -0.8317 1.9823 0.0478 -0.9428 0.0254 1.3572 -0.8551 0.9162 -0.8820 -1.1944 -0.9578 -1.1129 1.7239 2.0758 -1.1772 -1.2463 -1.0818 -0.9461 0.1447 -0.6227 1.4227 -1.3186 -0.4832 -1.0968 0.1178 0.9938 0.3663 0.8289 -0.6827 0.8310 1.2799 0.0029 -1.1583 -0.9518 -0.7677 1.0182 0.4106 -0.9514 0.4745 1.4167 -1.2906 0.8832 0.8482 -0.9466 -1.1570 -1.1281 -1.0012 -0.9916 0.4025 -1.1088 1.4382 0.4126 -0.8158 -0.9877 1.1260 -0.8462 0.6769 0.1436 1.3068 0.9466 0.7326 1.3971 -0.4862 0.6939 0.6387 0.8536 -1.0387 0.4601 1.9187 -1.1030 -1.0392 -1.0321 0.5695 1.2036 0.1101 -1.1105 1.1637 -1.1591 -1.1157 0.4388 -1.1377 -1.2563 1.2981 -1.0540 0.6140 0.0669 -1.2415 0.4305 0.8556 0.0769 -0.2100 -0.8626 -1.3529 1.3682 -1.4372 -1.2173 0.8883 0.7086 0.2510 0.9932 -1.0882 -0.9164 0.2873 2.2835 -0.6101 0.2629 -1.2036 -0.8354 -1.1209 0.4688 0.7821 0.1419 0.8685 0.1963 -0.9306 -0.8112 0.7310 0.2944 -1.0773 0.3314 -1.1835 -0.0270 0.2639 -0.9649 -0.9179 0.6011 0.1100 0.9693 1.1240 -0.8939 1.6243 0.2450 -0.0605 -1.0200 -0.9886 -1.1928 -0.6680 -0.9054 0.3503 0.5883 -1.1072 0.6687 -0.8204 1.0621 -1.1211 -1.0428 1.0952 -0.6424 -0.1792 -1.0284 -1.3010 0.3222 0.4867 0.5680 -0.3780 -0.2261 0.1605 -1.0665 -1.0198 0.5971 -1.3794 -0.4389 0.6426 -1.1884 0.7756 1.2464 -1.2263 -0.7696 -1.0585 -0.8866 -0.8768 0.7472 -0.6678 -1.4461 -1.1694 -1.1185 -1.0801 1.0281 -1.3447 0.8318 -1.3676 -1.4591 0.7116 0.4463 1.2525 -1.3358 -0.1279 1.5799 -0.9102 -0.3915 -1.0593 1.3443 -1.1785 0.1281 -1.0428 0.1719 0.5249 -1.3221 -1.0739 2.0816 -1.1434 0.4889 -1.4191 2.2793 0.4150 0.8676 0.5257 3-ureidopropionate 0.3669 0.1382 -1.1505 -1.6659 1.3018 -1.0638 0.2259 -0.0104 -0.1362 1.1708 0.1501 -0.3857 -0.6153 -0.8492 -0.3057 0.9040 -0.9358 0.0703 0.3635 0.0861 0.4898 1.3261 -1.0323 0.7057 0.1424 0.1763 0.8119 0.5321 0.6006 -0.4305 0.0571 0.6481 2.2290 -0.8269 -0.5350 -0.1206 2.0717 0.7782 2.2121 -1.0839 1.6341 2.4216 -0.2613 -0.1251 1.1648 0.5036 0.4318 0.6797 1.1268 -0.9467 1.5769 0.2576 0.1722 -1.5855 1.0771 0.5806 1.1790 0.6352 1.0981 -0.3718 0.2694 0.0195 0.3711 -0.2651 -1.7219 -0.2110 -0.2479 -0.9075 -1.1037 2.0501 -0.8286 0.0454 0.3181 -0.8576 -0.7994 0.0795 0.8304 -0.9086 -0.2234 -0.1777 0.0708 -0.2588 0.0312 0.0844 -0.3948 -0.5688 1.9556 2.4950 0.2492 -0.5157 -1.3629 0.8693 -0.1917 0.6344 0.2729 1.4385 0.9707 -0.3436 0.2735 -1.0692 -0.1176 0.5911 1.4179 -1.0794 0.1104 0.0104 -1.4706 0.0911 -0.8008 1.0544 0.0583 -1.0042 0.6463 0.8497 -0.3459 -0.4358 0.2829 0.0961 -0.4236 -1.0915 0.6819 -0.2860 -0.0254 0.8000 -0.0292 -0.0844 -0.3177 0.2300 -0.4973 -0.3871 -1.3253 -0.9472 1.6131 -0.2195 0.6736 0.0056 1.7539 1.1232 0.8690 2.1026 0.2653 0.3357 1.7662 -0.7008 0.1937 -0.1829 0.7013 0.3310 -0.1156 1.2050 0.8567 0.8879 1.4851 -1.2775 1.0205 0.3179 -0.9701 0.4127 -0.9534 0.4292 0.2181 0.6201 0.4929 0.2549 1.4170 -0.9169 -0.3236 -1.1681 -1.5233 -0.0099 0.0492 -0.8321 -0.7489 0.6245 -0.3049 1.5066 2.3595 0.4299 0.9275 -0.1914 0.6081 -1.3597 0.3570 -0.8193 1.7467 -0.7484 0.0508 1.2581 1.0487 -1.2404 0.7255 2.2132 2.2112 0.3806 -0.5119 1.0711 -1.0190 -0.4410 2.3053 1.2563 -0.0036 1.4248 -0.2260 -0.6619 0.2239 1.2363 -0.0383 3.1114 0.0108 0.8342 -0.4573 0.0599 1.0178 0.6560 -0.6060 1.9783 0.2999 -0.6352 -0.1629 -0.1363 1.0035 1.0630 1.0448 -0.9402 -0.8269 -1.6261 0.4427 -2.9565 -0.1379 0.4329 0.5719 1.0931 1.8278 -0.6427 -1.6725 -1.3151 0.1866 0.4497 -1.5367 -0.3512 0.1053 -0.0814 -0.6740 -1.0185 -0.2984 -0.6730 0.8454 -0.9483 -1.1491 -0.8116 0.1635 -0.3747 -1.5548 0.4207 -0.3283 -0.1500 -0.5888 0.2665 -0.7373 -0.0223 -1.2591 0.2248 -0.7842 -1.8135 0.1300 0.5363 -0.1231 -0.0288 -0.3413 0.0253 0.0892 1.1846 -0.3995 0.9617 -0.6643 0.2300 -0.7967 0.9345 -1.5494 -0.4284 -1.2691 -0.4532 0.1592 0.5733 -1.5097 -1.2244 0.5059 -0.6364 -1.7705 0.5651 0.0591 0.3484 -1.1781 0.1259 0.2167 -1.3604 0.3356 -1.1842 -0.8592 0.3028 0.3333 -1.5593 -0.7350 -0.8907 0.2099 -2.5715 0.4051 1.0567 -0.0626 2.4646 0.1887 1.5753 -0.3416 -0.3564 -1.3456 0.8042 0.0816 -0.2980 -0.5665 -1.2171 1.4087 0.3221 -0.8825 0.4150 -0.3369 -0.0184 1.6689 -0.3152 1.1702 -0.6948 0.2559 0.6406 0.4025 0.2625 0.8214 -0.2162 -0.7122 1.3055 -0.9524 -0.0508 1.8209 -1.4204 -0.6458 0.4298 -0.6082 -0.2747 -0.2001 0.8151 -0.3131 -0.6914 -0.5299 -1.7276 -0.4205 -1.1198 0.0611 -1.6113 -0.1867 1.1352 -2.9752 -1.3662 -0.4383 -0.7135 1.8650 -1.4484 1.1686 -1.4369 -1.0319 -1.0421 -0.9582 -2.0000 0.4160 0.2724 0.5421 -1.7461 0.6579 1.7660 -0.9124 -0.3782 -1.2985 0.4477 1.4758 -1.7896 -1.6825 -0.7790 -0.0395 -1.0101 -0.9735 -0.3914 -1.6293 -1.5764 -1.1537 1.3897 1.4678 -1.0563 -0.2091 0.9433 -0.0099 0.5636 -1.4041 -0.8763 -0.3238 1.2166 3.0455 -1.4978 -1.3578 0.4776 -1.9955 -1.4217 0.8703 -0.3322 4-acetamidobutanoate 0.3329 1.1670 0.0019 0.2111 0.6058 -0.0168 0.2437 0.1087 -0.5477 0.0343 0.2245 -3.8234 0.1835 0.7428 -0.2470 0.3926 -0.0447 -0.2751 0.8751 0.0794 0.5883 0.5296 0.2190 0.9145 -0.0736 0.6932 0.2036 0.3532 -0.0279 -3.5814 0.7915 0.3919 0.8690 0.5006 0.2260 -0.3091 0.2613 -3.0771 0.3270 -0.9283 -0.0178 1.0109 -1.9269 -0.2431 0.3000 -0.1212 -0.4531 -2.0641 0.9489 0.3376 0.2631 -1.4606 0.3867 -0.2020 0.4572 0.0508 0.5928 -0.4523 0.3092 0.2202 0.3627 -0.0610 0.8980 -0.1952 -2.7695 -0.0351 -0.5235 -0.0667 -0.3175 0.2844 0.0534 0.3570 0.1700 0.5123 0.2512 0.1106 0.4313 0.3810 -2.3872 0.1774 -0.6944 -3.3691 -3.5175 -0.4800 -0.3224 -3.7511 0.8290 -3.4010 -3.7943 -3.0514 0.1198 -0.0464 0.2299 0.1821 0.6754 0.3328 -0.1748 0.1802 0.1078 -0.0009 0.3398 0.7338 -0.0299 -0.4217 0.6571 -0.0315 -0.5576 -0.0016 0.1958 0.1111 0.2032 0.4061 0.5722 0.1942 0.3661 0.2517 0.3017 0.4535 0.1187 0.1504 -3.3323 -0.0579 1.2796 0.1734 0.1828 -0.2778 0.1173 -0.0820 -0.4460 -0.5811 0.4597 0.5546 0.0896 0.3098 -0.0400 0.6528 0.5193 0.1643 0.7655 0.5329 -0.1044 0.4281 0.0150 0.3452 0.4767 0.9278 -0.5430 0.6811 -0.1968 -0.1530 0.1018 0.3307 0.1842 0.3090 -0.1325 1.0043 0.4439 -0.2253 -3.6858 -0.1398 -0.3315 -0.7232 0.3190 -0.0677 0.0681 0.5343 0.1516 0.6669 0.1723 0.0909 0.7277 0.3338 0.8471 0.4887 1.0049 -0.0068 -0.2012 1.2441 0.3988 0.2900 0.8410 0.3766 0.2500 0.2187 -0.0692 0.7626 0.2211 -0.2620 0.5610 0.1259 -0.8443 -0.2380 0.2617 0.0902 0.4289 0.3204 0.0492 0.2336 -0.3096 -0.7186 0.0407 0.0515 0.2338 0.0568 0.0769 0.3802 -0.3191 0.6479 -3.5084 0.7644 0.4601 -3.4954 0.9519 -0.0416 0.3755 0.2217 -0.1145 0.1483 1.2270 0.1854 0.2906 0.3524 0.4506 -0.1399 0.5037 -3.9070 1.1093 0.6237 0.0986 0.7664 0.0413 0.0184 1.7348 -0.3153 -0.2693 0.3553 0.4482 -0.0446 0.2328 0.3401 0.1891 -0.8418 -0.1059 -0.6484 0.4640 0.2287 -0.1443 0.6219 0.2390 0.6646 0.6631 -0.0602 0.5481 -0.2074 -0.1683 0.4181 0.5693 -0.3731 0.7368 0.5278 -3.6639 -0.1726 0.1802 -0.5504 -0.6333 -0.1814 -0.0258 0.2429 0.2762 0.3693 -3.7825 0.5218 0.2794 0.5744 0.4685 0.2823 0.1849 0.2602 0.0661 0.6968 -0.1207 0.2227 -0.3643 -3.7462 -0.5591 0.0767 0.2533 -3.5381 0.4560 0.6365 0.1782 -3.8729 0.2892 0.3188 0.2463 0.2567 0.6437 1.2544 1.5428 0.6671 -0.3613 0.1663 -3.5475 0.5255 0.1883 0.1820 0.0612 0.0723 0.6492 0.1548 -0.0691 0.6928 0.1814 -0.0976 0.5473 -0.3022 0.0560 0.4476 0.4654 0.1593 -0.1691 -0.0019 0.5473 0.8844 0.6123 -0.0717 0.8278 0.8494 -0.4543 0.0780 -0.3657 0.0168 1.0132 -0.0022 0.0326 0.6804 0.1101 -0.0358 0.1633 0.1463 -0.2250 0.4356 -3.9165 -0.0552 0.3786 0.6682 0.2719 0.6116 0.4484 0.0938 -0.0322 1.0844 0.2016 0.7371 0.7369 0.2629 0.2935 0.3069 1.0759 0.4158 0.5365 -0.1365 -0.2654 0.9970 -3.7424 0.2524 0.6275 0.1123 0.1820 0.3144 0.0904 0.6425 -0.2493 -2.8068 0.2278 0.2291 0.5700 0.1307 1.1033 0.8156 0.1502 1.2701 0.8495 0.7144 0.3053 0.4002 0.1152 -0.1720 0.4915 -1.6351 0.3043 0.3727 0.7228 0.3135 0.3365 0.2450 -0.1942 -0.2049 0.5581 0.7501 0.2388 0.2896 -0.4454 1.3017 0.4780 0.9569 -0.6065 0.4094 -0.1556 0.6771 4-allylphenol sulfate 0.2454 1.4473 -1.2632 -1.8295 0.2485 -2.3643 0.7055 0.1147 -0.0256 1.5394 -0.0160 0.0245 -1.4263 -0.7891 1.0124 0.5830 -1.4558 -0.3045 1.0720 0.0656 0.2733 0.3506 -0.2435 1.4597 1.2073 1.6331 0.6159 0.5530 1.7926 1.4103 1.2075 0.1342 0.5150 -1.8521 1.1431 -1.4915 1.1075 1.7083 0.7842 -0.8728 0.8646 0.2976 0.0330 -0.6299 -0.0145 -0.4488 1.3211 0.1563 0.5605 0.1016 0.9743 0.4301 -1.3946 0.5335 -0.2942 -1.0633 0.2233 -0.6839 -0.5213 1.4996 -0.7343 -0.2732 -2.1360 0.6988 -1.4693 -0.2412 0.2192 0.7340 -0.8269 0.3482 1.3288 -0.5408 -1.7009 0.9554 -0.1527 -0.2736 -0.8276 0.5919 -0.7869 0.2152 0.8639 -0.9616 -0.6938 -0.1049 1.0610 1.0893 1.0573 -1.0310 0.1996 0.1397 0.7779 -1.2134 0.2749 -0.3073 -0.3336 2.1545 0.1572 -0.0506 0.6081 1.1418 1.2371 0.6295 0.6370 -1.1449 0.6326 -2.4777 -1.0414 -0.4245 -0.0802 -1.4790 0.3759 -1.0130 0.2879 0.1638 -2.5602 1.2409 1.7459 -0.9844 -2.2310 0.8809 -0.1326 -1.0872 0.1095 0.5676 1.6662 1.5955 -1.0749 -1.6574 0.2032 -1.5166 -0.3711 -0.3120 1.0586 0.3104 -1.0494 -0.5605 1.4111 2.0261 -0.4820 0.3378 -0.0331 0.7283 -0.0969 -0.5615 0.4784 -0.2665 -0.4462 1.9157 0.6191 0.8932 -1.0070 -2.3925 -0.0477 -0.3998 -1.1168 0.5081 -0.4606 -1.1538 -0.1934 1.6467 -0.6338 -1.3786 1.5226 -0.5375 0.1526 2.3076 -0.0917 -1.2397 0.8795 0.1454 0.2110 0.8309 0.9682 -0.4324 0.9080 -0.3696 -1.8538 0.8119 0.0791 -0.7124 0.0302 -0.6129 0.0454 0.2413 -0.4530 1.1122 -0.1059 -1.4533 -0.5402 1.5054 -0.4520 0.6984 0.8008 0.4440 -1.3462 0.3213 -0.9052 -0.1712 1.0745 -1.0357 -0.0755 -1.0427 1.3584 -0.8302 -0.5819 -0.5312 1.7684 -0.6167 -0.6442 1.3959 0.0617 0.2564 0.5981 0.8352 -2.7184 0.0541 -0.5575 -0.5099 0.8211 0.1522 -1.4392 -2.1574 0.2679 0.2103 0.4727 -0.0368 0.4684 -2.2062 -0.7580 0.5885 -0.6947 -0.0585 0.2544 0.1462 -0.1417 1.0063 -0.5466 0.8694 0.0739 0.8187 0.3219 0.1898 -0.6339 0.9964 0.3172 -0.2469 0.8839 0.8682 0.3743 -0.0885 -0.5744 0.8834 -0.7524 0.5241 -2.6514 1.5105 -0.4151 1.9752 -2.5504 -0.2469 -0.6602 0.9782 -0.5539 -1.3095 0.4078 -0.2306 -0.1603 -0.8414 -1.2417 -0.1477 -0.4941 -0.2463 -2.0827 1.1254 0.0418 1.0168 -0.7417 0.5792 0.8803 0.2379 0.8546 1.4420 -0.3108 0.5275 -0.9274 2.2074 1.0003 0.1188 -0.7581 1.5595 -2.7578 0.4502 -0.2208 -0.2451 -0.2220 -0.6812 0.1253 0.5641 -0.2354 0.5098 -1.2098 0.7976 0.3254 -0.3583 0.1580 0.6737 0.7575 0.4714 -0.4700 1.0448 2.1743 -0.1554 -0.9989 0.8169 0.4604 0.5083 -0.2984 0.1454 0.7387 1.1280 1.6284 -2.6989 -0.4807 -1.0734 0.0843 0.0570 -0.8901 -2.5962 -0.5857 -0.2388 -1.3698 1.0681 -0.8127 0.4878 1.0347 0.9230 0.7004 0.9067 0.4729 0.5884 1.4637 0.4996 -0.4412 0.9122 -1.2573 0.9899 0.9629 -1.3464 -0.5168 -1.9553 -2.4189 -0.3324 -1.1595 -0.3164 -1.3132 -1.2998 0.4284 0.5500 -0.8401 1.1921 0.9996 0.9471 -0.9111 0.3772 -1.6344 -0.7420 0.2635 -0.3275 1.0462 0.3329 0.0304 -0.7853 -0.4420 -2.5712 0.0372 0.3623 -1.2146 0.6900 0.9551 0.5569 -0.2904 1.3313 0.2935 2.1242 -0.0184 1.3371 1.0242 0.5414 -0.2911 -1.0078 -0.8399 0.5433 -0.6771 -1.8597 0.7506 -0.1070 -0.1254 0.8327 0.7389 -0.1662 -0.1316 -1.4531 1.6836 -0.8582 -0.7235 -0.1408 -0.4454 -0.0650 -0.8266 0.8279 4-cholesten-3-one -4.0242 0.5284 -2.6940 -1.5509 -1.6532 -3.1197 -1.5164 -1.1343 -1.8156 -1.0150 -1.8861 0.7438 -0.3002 -3.0049 -1.8191 -1.2632 -0.3720 -2.4154 -0.0973 1.2716 -0.3763 0.2552 0.8258 -1.1163 -0.2993 -0.6444 -1.3786 -0.1848 -0.6740 -0.0219 -0.6993 -0.2117 -0.0821 -0.5747 -1.7192 -0.2834 -0.4217 -0.5536 0.8425 -1.0916 -0.4730 -0.6615 -0.9466 -1.0775 0.8072 -0.1668 0.5740 -0.9428 0.2038 -4.9990 -0.9309 -0.7238 -0.9278 -2.1026 0.1305 0.2515 0.1988 0.7035 -0.8815 -0.4460 -0.1551 -0.9711 -0.5858 -0.6389 -0.2261 0.0726 -0.1770 -0.9101 -0.3742 -0.0132 -1.1080 -0.8582 0.1499 0.0054 -1.0701 -0.5307 -1.1972 -0.1583 -0.1025 0.5652 0.0833 -0.8898 -0.5684 0.2670 0.7186 -0.1448 -0.1342 -0.2320 -1.8345 0.7806 -0.6018 -0.7267 0.2041 -0.5556 0.1300 -1.4692 1.1988 -0.2922 0.4160 0.4657 -0.2674 -1.3854 -0.9384 -1.5954 0.2657 -0.6038 -0.1828 -0.4664 -1.3262 1.0031 -0.3938 -0.9067 -0.2390 -0.1975 -0.7918 -0.2253 0.3642 -0.7700 0.3928 0.4693 -0.0890 0.0223 0.7270 -0.7203 -0.0064 -0.2637 0.0903 -0.0359 -0.1196 -0.1866 0.2358 -0.6472 0.0699 -0.0978 -0.8725 -0.7667 1.0177 0.4845 -0.3741 1.3364 -0.7787 1.0594 0.6132 -1.7172 -0.1570 0.0759 1.3698 -1.1246 1.3043 0.8636 0.1439 0.9700 0.6533 0.1693 0.0220 -0.5575 -1.6145 -0.1517 -0.2736 -1.2858 -0.0473 -1.2066 -0.2007 0.8643 -0.4917 -0.3124 0.4882 -1.4871 -0.6329 0.2569 -1.5715 -1.8888 0.2123 -0.0661 0.0374 -0.3729 0.1060 -0.4330 1.0954 -0.6060 -0.8090 -0.2832 -0.6834 -0.9512 0.7872 -1.2506 0.0637 1.3970 0.7735 0.5420 -2.0985 -1.2781 0.9078 0.4733 0.7167 -0.4605 -0.2965 0.2076 1.1005 1.6071 -1.2046 1.1085 0.2153 -0.0257 1.2865 0.6447 -0.1073 1.8079 -0.0413 -0.7368 1.7664 0.4596 0.1297 -0.2650 -0.3925 -0.2237 -1.6866 -0.3505 0.1179 -1.1338 0.1058 0.2090 0.7842 0.5712 0.6961 -0.6816 0.9391 0.5070 0.0206 0.8390 0.0875 1.2354 0.1777 0.0488 0.3305 0.3532 0.3326 -0.3089 0.0829 0.1577 0.6559 2.5940 0.5209 -5.1566 0.4611 -0.1083 -1.4327 0.1399 -0.3817 -0.3272 -0.3560 0.1522 0.9407 0.4189 0.1927 -0.0329 0.2935 -0.7793 1.7675 -1.1082 -0.5777 0.4934 -0.4103 -1.1679 0.9971 1.3634 0.5628 -0.1261 0.4758 1.3820 -1.0150 1.2029 0.5285 0.1898 -1.2821 0.8935 -0.9867 1.9027 0.2858 -0.2040 1.0300 0.5488 1.2411 0.5843 0.3747 1.1541 -0.1786 0.2651 1.0930 0.0840 -0.5679 1.2380 -0.4312 -0.2639 0.6039 0.5753 0.2942 -0.8695 1.2255 0.9691 0.1501 0.7148 0.3525 0.3107 0.9509 0.4803 0.2906 0.5464 1.0998 0.4427 0.3951 2.0836 1.2133 0.7505 1.8306 0.8927 1.3274 0.8189 -0.5419 -0.4839 0.0046 1.2627 1.9879 2.1921 0.3815 0.4285 0.9154 0.9633 1.6234 -0.1855 -0.0240 0.8940 0.5345 0.6032 0.2997 1.6561 -0.4626 1.2908 -0.6326 1.1451 -1.6487 -1.1201 1.1410 0.3741 0.9161 0.4965 0.3039 0.7726 0.5841 -0.0274 0.2860 1.7559 0.5738 0.4767 0.4162 -0.5609 1.2239 -0.5179 0.3932 1.4460 -0.7110 1.8465 1.3896 0.3783 1.3420 0.6546 1.1584 0.2607 0.6738 0.7489 0.1201 -0.6418 2.5761 1.1146 1.9315 -0.4745 0.2382 -0.5158 2.0127 -0.2947 0.3099 0.4045 0.4144 -1.7705 0.1926 -1.0600 -0.5007 0.0312 0.3127 0.3322 2.1545 0.9066 1.0164 -0.1536 -0.3766 1.7327 0.9805 -0.2581 0.0636 1.3926 1.4697 0.3500 -0.7809 -0.0568 -0.0721 -0.7192 -1.3517 -0.3134 -0.1992 -0.2124 4-ethylcatechol sulfate -0.6137 -0.4196 0.7199 -0.6247 -1.4739 -0.0234 1.3243 0.1296 -1.4453 -1.5617 0.0380 -1.4174 -0.3641 -0.8746 2.5851 0.3668 0.6016 0.7934 0.1444 -0.3568 0.2403 1.0982 0.9449 -0.6856 -0.2296 -0.6281 0.9874 -1.7515 0.2288 -0.1950 -0.2919 -0.7811 -0.0802 -0.0537 1.1642 -0.2304 -0.1417 0.3865 -1.0635 1.6021 -1.6326 -0.9580 -0.1275 1.2248 -1.2563 -0.4131 -0.3715 -0.0406 0.5692 1.1175 -0.6012 -0.3411 -0.4655 0.4308 -1.0254 -0.0725 -1.8490 0.5912 -1.1692 -0.2995 0.1365 0.8210 0.6541 0.3005 0.6797 0.2554 0.4010 0.0502 -0.2043 -0.2130 0.3281 -1.9449 -0.8381 0.0795 -1.0234 0.1477 0.3366 0.8112 -1.1597 2.3307 -0.8282 -0.6370 -0.6619 -0.6975 -0.3281 1.3862 -1.7151 -1.7828 -0.8758 -0.2738 -0.0866 0.6557 -1.7909 -0.6071 0.2535 -0.0179 -0.2396 -0.1359 0.5483 -1.5593 -0.2691 0.2399 1.4359 0.0755 -0.1952 1.3019 -0.3881 0.2530 -0.6363 -1.7524 -0.2347 -0.0962 -0.7469 -1.8435 -1.8446 0.5877 -0.3935 2.0334 0.8488 0.4619 0.3627 -1.4689 -1.8743 -0.3315 -0.5138 -0.1053 -0.1121 0.1377 -0.7014 0.6247 0.5130 2.3211 -0.3438 -0.0352 1.2078 0.1289 1.0629 1.3724 1.1105 -1.4738 -0.3533 0.3899 -0.0851 0.6629 -1.0082 -0.9400 -1.8331 0.6042 -1.7601 0.2258 -1.1338 0.1087 0.4532 -0.1177 -0.9682 -1.7027 -1.8260 -0.9003 1.7102 -1.5075 -0.0872 1.1304 -1.3755 -0.6458 -0.2243 -0.2249 2.2049 -1.3010 -0.1333 -1.8404 1.3718 0.3028 1.4177 0.2025 0.6340 -1.6188 0.1116 0.2414 -0.4658 -1.6629 -1.7945 0.8562 0.2085 1.7049 -0.4963 -0.4444 -0.1413 -0.0922 -0.9514 -0.2413 -0.5110 0.1726 0.1502 -1.7207 -1.7049 0.6455 0.1184 1.0817 0.2077 -1.6187 1.9205 -1.6915 1.6952 0.1220 0.2116 0.9540 0.9938 -1.2972 -0.5551 -0.0953 1.0009 -0.5507 1.4499 1.4748 1.6824 -0.4546 0.1650 0.9604 0.7579 -0.0166 0.2311 1.3649 -0.1009 -0.4426 -0.0095 -1.5808 0.9210 1.0480 0.2333 0.0348 1.5753 0.4556 -0.1470 0.0297 -0.8652 0.1565 -0.8457 -0.8385 -0.8782 0.5125 -1.8991 0.0024 -1.8812 0.5715 0.9551 0.0977 2.1540 1.4052 -0.2287 1.6322 1.6551 0.4543 1.3891 -0.2331 0.8048 0.0720 0.1762 0.1455 -0.6089 1.4068 -0.9015 -1.7492 0.2141 -2.0864 0.0126 -1.6115 -0.1227 -0.0645 -0.8774 -0.0145 0.6896 0.3946 1.4435 1.4187 0.5190 -0.1074 0.0675 0.2165 -0.2719 0.0339 1.7096 -0.2687 1.8259 1.7375 -0.2452 -0.5312 -0.3628 0.1228 -0.1552 0.6800 1.4332 1.1304 -0.2369 0.9691 -0.2500 2.1600 -0.4314 -0.1659 0.8872 -1.9744 0.3624 -0.7932 -1.9059 1.4391 -0.9718 1.3864 0.9754 -1.6860 -0.2931 0.2446 0.0015 1.7297 0.6178 1.2695 0.8230 0.6166 -1.8422 1.4387 -0.1378 -0.0513 -0.7123 -0.0153 -0.1963 1.6260 -0.3250 -0.4759 -0.5516 0.0080 -0.3215 0.5289 -0.1108 0.2961 -1.8654 0.7508 0.1201 0.4942 0.8964 -1.2228 -0.0094 1.0947 0.2940 1.2852 -0.0808 -0.3211 0.2003 -1.8194 -0.8668 -0.5496 -1.9549 1.6849 -0.6196 -1.4194 -1.6807 -0.8928 -0.9774 -0.1806 -0.5104 1.4508 1.0034 1.3957 -0.3303 0.1478 -0.8730 0.3167 0.4224 0.7313 1.0233 1.1857 -0.8088 2.0496 -0.6484 -0.6402 0.4678 -1.3557 1.2755 0.8338 1.4308 -0.4926 1.7730 -0.9202 -0.6554 0.6396 2.5122 0.2538 -0.3415 0.6743 2.2352 -0.9250 2.2529 -0.1159 -0.2567 -0.6608 -0.8265 0.3764 -0.2981 1.4596 -0.1504 0.3822 -0.0808 -0.0566 -0.6471 -1.0820 -0.0932 -0.5296 0.2376 -0.0046 -1.9227 -0.4132 1.8771 0.8901 4-ethylphenyl sulfate 0.8439 -0.2358 -0.3330 -1.2814 -1.0070 0.1303 0.9143 0.6453 -0.5371 -0.9238 -0.1200 -0.3376 -0.5833 -0.9071 0.4427 1.3911 0.3816 0.6501 0.5986 0.2038 -0.2814 3.2889 -0.2123 -0.1580 -0.4635 1.5788 1.4281 -1.2204 0.6375 0.3401 -0.3866 -0.0091 0.3850 -0.7771 0.0494 -0.2916 0.0884 0.9921 0.2959 -0.0480 0.1646 1.2725 -0.1942 0.3221 -0.6212 0.3819 -0.7570 -0.1737 2.7663 1.2492 -0.1440 -0.4297 -1.3285 0.9282 -1.4693 -0.2785 -1.0598 0.3228 -1.3224 -1.4177 1.6425 -1.0736 0.4570 0.8565 -0.0497 -0.6183 0.9822 1.1573 -0.7269 -1.3049 0.7192 -0.5634 -1.5966 0.8527 -1.4064 -1.5727 0.1717 0.6401 -0.0482 0.0091 -0.0437 0.3914 0.3509 -1.4802 -0.0200 2.7561 -0.9527 -1.8474 0.6815 0.3688 0.4069 2.1926 -0.6645 -0.2812 0.3185 -1.3312 0.5270 -0.4998 0.2238 -0.4593 0.1799 -0.5038 4.1242 0.5038 -0.5829 -1.1153 0.7013 1.0080 -1.5002 -0.7084 0.2869 2.0728 0.2744 -1.3780 -0.7954 -0.8764 0.7428 0.0971 -1.2585 2.7370 0.0429 -1.0398 -0.7528 -0.4912 0.8911 -0.6823 0.4399 1.0745 0.2891 -0.8316 0.4089 0.8162 0.0882 0.3418 0.3950 0.4620 0.2077 3.3812 -0.1019 -1.7378 -1.7810 0.1870 1.3859 0.7740 -1.7453 -0.3306 -0.3639 0.1818 0.2370 0.7449 -0.8015 0.6356 -0.2475 0.7118 -0.4994 -0.4396 -0.2616 -0.3903 0.0198 -1.2532 -0.4116 -1.2262 -0.0925 -1.9131 -0.4713 0.4777 0.3518 -1.7771 -0.8799 -0.4349 -0.2393 1.0541 0.2536 -0.2825 0.7054 0.2988 -2.2546 -0.5878 0.2155 -0.7172 -1.2194 0.2064 -0.5086 3.8067 0.1607 0.0049 0.4663 -0.5476 -0.4360 0.5440 -0.3083 -0.0606 -0.5456 0.4201 -1.7724 0.5065 -0.6037 1.0490 -0.1643 -0.7879 0.0278 -0.5999 0.4595 0.3869 0.3947 -0.1328 0.4927 -1.8235 0.4044 0.8254 -0.3498 -0.2706 1.1712 -0.2704 -0.5111 -0.0318 -1.3216 1.7669 0.6468 -0.4685 -0.1319 -0.8757 0.1227 0.2367 0.7629 -1.1860 3.4289 1.8682 0.2471 0.2806 0.6970 2.8782 1.0469 -1.0019 0.9590 -0.1001 -0.2680 -0.3334 -0.9051 0.1391 -0.5504 -0.9963 -0.4491 1.7219 -0.8161 -1.2114 0.7588 1.1853 -1.6705 -0.6654 -0.3865 -0.9884 0.2495 1.1980 -1.9748 0.3086 -0.6632 0.3597 -2.1459 0.2205 -0.3254 -2.3387 0.2526 -1.7372 -0.0193 0.1058 0.0590 -0.4035 -1.2258 0.6985 0.3983 0.1954 -1.3225 0.4487 -0.5568 0.1847 0.6637 0.7703 0.4565 -0.0679 0.0654 -0.4367 -1.1500 0.9467 -0.4234 0.1372 0.6802 2.2182 -0.2028 2.1717 -2.6686 -0.7274 -0.0235 0.3315 -0.2737 3.3021 1.1354 -0.5485 0.1050 -1.1339 1.2287 -0.5259 -1.2599 0.3462 -1.3724 0.8046 1.6084 -1.2586 -0.2599 0.2335 -1.1991 -0.9686 0.0867 0.7921 0.0077 -0.1344 -0.1697 2.5998 0.5189 -0.5694 1.2261 -0.5633 -0.1072 0.1766 -0.0884 0.0574 -0.1115 -1.3441 0.1741 0.7747 0.0795 -0.3105 -0.5534 -0.3110 0.5461 -0.4241 0.4391 -1.4189 1.4427 -0.1937 -0.0502 0.3050 0.0892 -0.1182 -0.5291 -0.3835 -0.4402 0.0423 0.5700 -0.0371 -2.2955 -1.5717 -0.1042 -0.3198 -0.2941 -0.0098 1.0381 -0.6762 -0.9068 0.5681 -0.3089 1.3817 0.2676 1.4677 -0.8139 1.7913 -2.1561 -1.0669 -0.5498 0.2194 0.0129 -0.4361 -2.4705 0.0245 1.2170 0.0982 0.0091 0.0728 -0.1250 -0.0255 0.0332 0.5863 0.2706 0.6281 0.8909 0.5739 0.5610 -0.1233 0.1144 0.4009 -1.6286 -0.3243 -0.4790 1.3676 0.2351 0.5978 1.9690 0.4559 0.1875 1.5330 -0.9351 -0.3209 0.8596 -0.9329 -0.8259 0.0412 -0.2275 0.2114 -0.1667 0.2728 4-guanidinobutanoate 0.3493 -0.0454 -2.8389 0.0922 1.5238 -1.6041 1.5523 0.6437 0.7539 -0.7032 -1.0618 0.5419 -0.7111 1.5950 0.1995 -0.6000 -1.8517 0.0867 0.0686 0.6239 -1.3630 -0.4996 -0.2607 -0.0241 0.0158 0.4281 -0.0302 -0.8550 0.4471 -0.1516 -2.9035 -0.0983 1.1283 0.7692 0.6803 -0.7055 -0.4977 1.6445 -0.6390 -0.0243 0.1939 0.0769 1.2375 -0.0805 -0.1084 -0.1246 -0.1531 0.6781 -0.4804 1.4310 0.7025 0.2909 -1.1170 -1.2475 -1.7610 -0.3985 0.9731 -1.1949 -0.5673 -1.2408 -0.2524 1.5835 0.0788 -0.7157 1.7439 0.8170 1.0846 -0.1750 -0.4407 -0.3541 0.6228 -1.7057 -0.1862 0.4442 -1.0742 -0.2506 0.7039 1.6171 0.4016 1.4674 0.5052 -0.1732 0.4945 0.5681 0.9780 1.2549 0.3117 -1.5836 -0.3612 0.2992 -0.0583 -0.3195 0.6107 0.7581 -0.5049 0.5795 2.0678 -0.0321 1.2165 -0.4394 0.1869 1.4411 -1.0276 -0.2940 1.4700 0.9441 -1.1199 0.4037 -0.3641 1.3635 -2.9592 1.2063 0.3974 -1.2905 -0.0317 -0.9643 -0.4210 -0.0882 -1.2087 -0.1721 -0.3155 -2.7072 -0.1293 0.3195 0.0407 -0.5067 0.4278 1.0450 0.9126 0.8295 1.4331 -2.6548 1.7864 0.5285 1.5258 1.4664 0.5081 -0.2586 -0.1490 -0.2248 -1.6196 -0.7223 -1.1261 0.6074 -0.4126 1.4162 -1.3927 -2.7587 -1.0107 -0.5712 0.6576 -0.9203 0.0949 -1.3903 -0.2624 -2.4518 -0.2088 -0.5336 0.7093 -0.1672 0.6279 -0.7210 2.0696 -1.7294 -0.9496 0.5453 0.9803 1.6253 0.3555 -1.2581 0.4729 0.2585 0.3811 -0.4913 -0.3021 -0.6073 -0.2689 0.0295 0.3251 -0.5394 1.1620 0.4975 1.1160 0.1436 0.3675 -1.0181 1.2132 -1.3055 -0.4646 1.4954 0.6791 0.7290 0.1541 0.1222 -0.3427 -1.5257 0.7276 0.7198 -0.0421 -0.2812 -0.0533 1.4421 -0.3217 -0.5455 0.9209 -0.8752 0.0926 0.2183 -0.1915 1.0784 -0.6676 0.6772 0.8163 -2.7715 2.0351 0.4551 0.1562 -0.5407 -0.9767 0.7715 -1.7202 -1.3380 -2.5098 -0.2542 -0.2877 0.7235 -0.7456 0.9604 0.6040 0.7111 0.7895 1.7345 1.2437 0.4891 0.3065 1.0007 1.4474 -0.1366 0.9820 0.5068 -2.8322 -3.1745 -1.1202 -0.3633 0.4526 -0.9740 -0.5664 0.1635 -0.2928 0.7399 -1.3190 -1.3587 -1.5169 -0.3929 -0.7454 1.0448 0.1743 1.2519 -0.8552 -0.8786 -0.7196 0.8960 0.2684 0.9361 -1.3805 -0.5072 0.7487 1.0551 0.6025 -0.2334 0.7450 1.9311 0.5190 -2.8881 0.6838 0.1888 0.1272 0.4528 0.3948 -1.5749 1.4411 0.4737 0.1920 0.3711 0.7977 1.6672 0.0594 0.7035 0.8914 0.9081 -0.6893 0.5508 -0.3394 -0.6929 -0.5117 1.6861 1.1625 0.2555 0.4213 0.3207 0.2194 0.1757 -0.1950 0.0017 1.2312 0.5230 -0.3802 -0.3252 0.3765 -0.4728 -0.5951 -0.5597 -2.9219 0.5772 0.0115 -0.2873 -0.0938 1.6627 1.0499 0.7815 -0.3295 -0.8340 1.5615 -1.1952 1.0390 -0.5563 1.5375 0.5526 0.1383 -1.1133 -0.0940 -0.1049 0.7915 -0.1881 -0.5803 0.0569 -0.9826 -0.3764 1.4443 -0.8290 0.9011 0.8814 0.7659 0.5794 0.9404 0.4054 -2.5274 -1.0831 -0.7240 -0.1309 -0.3535 -1.8425 -1.0816 0.5277 0.3218 1.0280 -1.4244 -0.2665 -1.0167 0.9109 -1.2899 -0.0106 0.2893 1.1511 -0.2514 0.2319 1.0839 0.8165 -0.1042 -1.4100 -0.4126 -0.2897 -1.5806 0.5962 -0.3612 -0.5979 -0.6150 0.0880 -1.7499 0.6479 -1.1268 1.0007 0.0325 -0.0868 0.1596 0.8338 0.5070 0.4375 -0.7894 -0.3423 -0.7677 1.3737 -2.2594 1.1496 0.0599 0.7030 1.0671 0.5822 0.7207 -0.7671 -0.0272 -0.5577 0.5657 2.0370 0.2543 -1.1261 -0.9003 0.7276 -1.1208 -0.2840 4-hydroxy-2-oxoglutaric acid 0.5577 -1.9067 2.3813 -1.3390 -0.9249 2.8607 -0.6045 1.9875 0.7724 2.0281 2.1216 0.0616 -1.3939 -0.4807 0.9101 -1.5424 1.5793 -1.4219 -1.3985 0.1562 0.7029 0.4793 0.3096 -1.4170 0.1203 0.1142 0.2238 0.7915 0.3493 0.6085 -1.6674 0.1616 0.1567 -0.4302 -1.8169 2.1477 1.7071 0.2210 0.6465 -0.8655 -0.1485 -0.9324 -1.4571 -0.5730 0.0688 -0.3046 -0.0790 -1.4137 0.4761 -1.4180 -0.0915 0.3785 0.6742 1.9482 0.8969 0.4592 0.2785 -0.5941 0.5744 -1.5854 -0.4109 0.1827 0.3382 2.3194 -1.4045 -0.0558 0.3758 0.0309 -1.6440 0.3316 0.3057 0.2271 0.3557 -1.6823 1.5106 0.9749 -0.4395 -0.6457 -1.2569 -0.1525 0.0699 1.5390 -0.8481 -1.6578 2.3218 -0.1423 -0.6837 -0.0012 -1.6724 -1.1258 -0.7857 1.2954 1.2335 -1.0641 1.8447 -1.3629 -1.4303 -1.4022 0.6644 0.1681 0.7516 -0.3802 0.2739 -0.0874 -0.7964 0.6784 2.0701 -0.0077 -1.8865 0.0628 -0.1373 -0.7990 0.4188 0.6478 1.7430 0.6811 1.0907 1.0504 2.1457 0.0166 1.1518 -0.2142 -1.4896 0.1130 0.0858 0.8479 0.8941 -0.5582 -0.1567 -0.4481 -0.1341 2.0956 0.0164 0.1275 0.6411 -1.6267 0.1327 0.8591 0.7540 -0.2896 1.7533 0.4876 0.4288 0.3394 0.7817 -1.5377 -0.0784 0.8311 0.3287 -0.4141 -1.2117 -1.2340 0.3157 0.5364 -0.1217 -1.2565 0.6286 0.6620 0.9036 -0.9667 0.9625 -0.0570 0.1845 -0.2689 1.1735 -0.5810 -0.0668 -0.2775 0.0278 0.2329 -0.4334 -0.2809 0.4872 0.5666 -0.2941 -1.1304 0.9441 -1.2459 -0.0355 -1.1914 -1.3791 -1.7741 -0.3566 0.8022 0.1645 -0.2024 0.3720 -0.1261 -0.1734 0.3587 0.0382 1.9478 0.6426 0.0382 -1.2556 0.6309 -0.7072 -1.7490 -1.4799 -1.1351 0.7167 -0.1497 1.2570 0.7908 0.6313 0.1340 -0.0079 -0.6848 0.1205 -1.4275 -1.4112 -1.4640 -0.0951 0.8643 -1.6645 -0.1270 1.8690 1.3599 0.2491 0.7660 0.4623 1.0298 -1.2566 -0.4941 -0.0148 -1.7528 1.8365 -1.7866 0.1004 0.3334 -1.5321 -0.2498 -0.0968 0.2335 0.1319 0.7274 -1.5347 0.0341 -1.6597 0.2955 0.0064 0.6990 1.6998 0.4530 -0.0856 1.5675 -0.0185 0.2001 0.4723 -0.1294 0.9159 0.1167 0.6396 0.7137 -0.3034 -0.1601 0.3124 0.1406 -1.4514 -0.7128 -0.0621 -0.4104 0.7412 0.6966 0.1358 0.2430 -0.3322 -1.7193 -0.7343 -0.1499 -1.6224 0.1740 0.4772 0.8173 -1.5976 0.3164 -1.5529 0.3297 -0.2068 -0.5107 -1.7204 -0.3909 -0.2008 -1.6700 -0.6652 -1.4489 -0.3139 -1.4995 1.2876 -1.1270 0.5464 -0.2321 1.0106 1.1467 0.8975 -1.8840 1.4048 -0.0468 0.1082 0.6185 0.3030 0.2190 -1.5278 -0.1844 -1.4942 0.2235 1.5927 0.6792 -0.1412 0.2988 -0.0764 0.3675 -1.5777 -1.6681 -1.8110 0.5402 0.4385 -1.5163 0.3522 0.2269 -0.3847 1.9854 -0.1886 0.2885 -1.1831 -0.1128 0.4465 -1.5129 0.0083 0.1697 0.4811 0.8965 -1.4982 0.2581 0.0372 0.2570 2.0113 -0.3354 -0.7238 0.6687 -0.3727 0.2548 0.0194 -1.6790 0.3590 0.4069 0.1651 0.2405 0.4307 -0.2471 -1.2677 3.2669 1.0662 0.3116 0.8582 -0.0084 0.3266 -0.8306 1.2560 0.3138 0.8120 -1.6106 0.0347 -0.3801 -0.2029 0.2342 -1.7511 -0.3329 1.1429 0.2382 -1.3736 -0.3264 -0.1142 0.2554 -0.2727 2.7561 -0.4554 1.7511 1.8932 0.3207 -0.1550 -0.1218 -0.4659 0.0309 0.5943 -0.0162 -0.7708 -0.4249 -1.8843 -1.8642 -0.1681 -1.4768 2.0033 -0.9152 0.2062 -0.3556 0.3721 0.5739 -0.6504 -0.5940 0.2634 1.2302 0.8705 -0.4104 0.1163 1.8700 -0.4155 -1.5911 0.4460 1.7250 4-hydroxychlorothalonil -0.4003 -1.0584 0.7385 -0.6300 -0.4525 -0.0798 0.9225 0.9088 -0.5581 -0.5440 -0.1138 -1.2484 -0.6321 -1.3561 0.5174 1.4882 0.8613 -0.3262 1.0200 -0.7228 0.6177 1.6117 1.6953 1.0687 1.8673 0.4286 0.6819 1.3973 0.0249 0.4904 1.4938 1.7394 1.4344 -0.5450 -0.6820 0.6926 0.7226 -0.6551 -1.1920 0.3034 0.7614 0.9133 1.4078 0.4527 -0.3264 -0.3393 -0.7792 0.1157 0.7753 0.0743 1.0562 0.6786 0.1149 -0.4236 3.1288 0.5349 0.8620 -0.2094 0.1961 1.2433 1.0342 1.0437 -0.7522 0.3498 0.5730 -0.8164 -0.3579 1.4709 1.8560 0.9639 2.1026 0.2725 -0.5638 1.0279 -1.1909 0.9526 1.3169 1.2992 -0.0646 -0.0122 1.7027 0.2413 0.2050 1.0465 0.0579 1.2932 1.2562 -0.2891 -0.7613 0.2457 0.6595 0.3936 -0.3967 -0.0462 -0.5732 0.3822 0.1630 -0.6858 0.5106 0.6854 1.9772 1.4712 0.9137 0.2774 0.8012 -0.2992 -0.8857 -0.2873 -1.3440 -0.4660 0.8506 1.0407 0.0502 -0.7448 -1.7295 -0.2365 -0.8840 -0.9846 -0.9959 0.7396 0.0036 0.3061 0.3713 -1.3562 0.4316 -0.3321 1.0692 1.2819 0.0821 -0.7505 -1.3948 -0.7731 0.4486 1.1313 -0.4637 0.5140 1.3322 1.4047 0.1970 0.1773 0.4294 1.1399 -0.3575 0.4743 1.2143 0.8713 -0.8563 0.4161 -0.4607 1.0492 1.0942 -0.0151 -0.8058 -1.3542 -0.6055 -0.5105 -0.9400 0.0977 -1.5021 -0.0331 -0.6594 -0.7685 -0.6413 0.1243 -0.2011 -0.6004 -0.2534 -0.2592 0.8301 -0.7057 -0.7862 0.3105 0.3729 1.3766 -0.1629 -0.6087 -0.8098 1.4372 1.3893 0.0557 -0.7531 0.9712 -0.3478 0.7060 -0.3586 -0.1094 -0.1637 -0.6735 0.9091 -0.5485 0.5223 -0.1168 1.9600 1.5963 -1.3587 -0.4535 -0.1104 1.0265 -0.1359 0.7145 0.9648 -0.6618 -0.3147 -0.6347 -0.2568 1.7260 0.4196 -0.2739 -1.4163 0.4967 -0.3635 4.1121 0.7010 -0.1637 -0.6157 0.8617 -0.3800 0.9641 0.2208 -2.0984 1.2916 -1.0221 -0.0370 -0.7820 -0.2249 0.2639 0.5803 -0.4146 0.2255 -0.5876 -0.1957 0.1456 -0.9801 1.5875 2.3134 -0.4690 1.0145 -1.2257 -0.0216 0.3634 -0.2270 0.5295 -0.2204 -5.1370 -0.8661 -0.0351 -0.2810 0.4595 0.7342 -0.7727 0.1446 0.0560 -0.4915 -0.6192 -0.5603 1.0583 -1.0180 0.8464 0.7755 0.7142 -0.5329 -0.9026 -0.2278 -0.7862 0.2550 -0.0095 0.0510 -0.8312 -1.1806 -0.6065 -1.3125 -0.0189 -1.0873 -0.8463 0.6845 1.5988 1.2190 -0.3387 -0.1553 -0.9128 0.1374 0.3258 -0.2829 0.9261 -0.6230 -0.2722 -0.0956 -0.0021 -1.2542 0.9176 -1.8078 0.6920 0.1766 -0.1398 0.1639 -0.5209 0.8453 -1.3109 -2.6479 1.0511 -1.0570 1.3418 -0.2557 -0.3902 -1.2813 -1.0953 0.1950 0.5763 0.4126 1.0717 0.1798 -0.5195 0.7736 0.2967 -4.7627 0.4374 0.2675 0.7935 0.0661 -0.3063 0.0050 -0.7245 -0.9551 0.4415 0.4715 1.4257 0.2863 -1.3267 -0.2636 -0.6105 -0.5277 -0.3791 -0.6861 -0.3011 1.1579 0.4051 -0.5471 -0.4368 -0.6503 -0.4222 0.1532 -1.1535 0.3285 0.4362 -1.5875 0.1344 -1.0911 0.8186 0.0568 -1.0643 -0.3519 0.2806 -1.4033 2.5854 -1.2661 -1.9503 -0.1926 -1.0101 -1.2633 0.2365 0.5120 0.8669 -0.4275 -0.7915 -0.2710 -0.0555 -0.2340 -0.2113 0.4752 -0.3250 1.4593 -1.9463 -0.3379 -1.1723 0.4183 -1.4712 -0.0950 0.3694 -1.3227 0.1413 0.2535 -4.6406 0.5040 0.0502 -0.7001 -0.3363 -0.3374 -0.3626 0.1717 2.5687 -0.3506 -0.8777 -0.9075 -0.4849 0.5802 -1.1263 -0.9072 -0.5271 0.3679 0.2159 -1.5764 -0.9445 0.7970 -3.4567 -0.5316 -0.9389 0.3234 -0.4226 -0.5680 -1.1293 4-hydroxyglutamate -2.0183 1.2372 -2.9405 -1.3562 1.5325 -2.9964 -1.5106 -0.0437 0.0212 -2.4350 -2.7181 -1.0217 -1.1304 1.1419 -1.1929 -0.6403 -0.5740 0.8647 -0.8431 -0.8502 -0.5835 -0.7853 -0.2206 -0.7196 -0.9962 -1.0680 -1.7723 -0.7275 -0.1307 -1.1073 -1.2114 -0.6719 0.0754 -1.4308 -0.3083 -0.5534 -0.4001 0.1136 0.7201 0.5178 -0.4105 -0.3850 -1.6885 0.1078 -0.7113 -1.2160 0.2150 -0.7706 -0.8645 -1.3289 -0.1691 -1.3442 -0.2590 -3.0057 0.0336 -0.9906 -0.8164 -0.1520 -0.5601 -0.5686 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0.1415 1.0575 2.0796 0.5755 -0.0021 -0.3756 0.3795 1.2618 1.2064 0.0714 0.3010 1.4180 0.8222 -2.7134 0.1332 0.1999 -0.9023 1.2649 -0.2195 0.2822 1.4883 1.7582 -0.7995 1.6322 -0.2197 0.2380 1.8327 1.2215 2.3734 0.4241 0.0789 -0.1014 -1.1635 0.1822 1.2261 0.9960 -0.0527 0.5351 -0.0491 0.5588 0.4406 1.9351 0.4901 0.0835 -0.2940 0.2054 2.3630 0.8124 1.5075 -0.8647 1.2662 -0.7974 -0.3698 0.6243 -0.8131 1.5105 0.6064 0.4292 -0.3202 -0.3661 3.0977 -0.6619 -0.1991 -0.0896 -0.8796 0.2557 -0.5754 2.4558 0.5008 0.4626 1.2677 0.8567 0.7477 -0.4989 0.9057 -0.1344 -0.0025 -2.8637 1.2029 -0.7487 0.5922 0.2852 1.1602 0.4481 1.0066 4-hydroxyhippurate 0.2541 -0.9693 -0.8876 0.2022 1.4257 1.1995 0.6990 0.7994 -0.5995 0.5019 -0.7284 0.7037 -0.6057 0.6129 0.9401 -1.1092 -1.9487 -0.5552 -2.3788 -1.5590 -0.5406 1.9516 -0.1399 -1.5455 -2.1307 -1.4163 -0.4793 -0.1628 0.8368 2.4471 -0.3480 1.2275 0.2354 0.8079 -2.4194 -0.7188 0.7746 0.7823 0.3965 -1.5796 -1.0316 -0.0118 -0.3998 -1.6298 0.4026 -1.4094 -0.1224 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1.2888 0.4844 -0.5394 -0.0198 -0.2111 -0.1397 -0.3384 0.4982 -1.1686 -0.5409 0.0227 -0.4685 -0.6464 0.7992 -0.8127 1.6423 -0.9227 -0.0605 -0.1101 -1.4620 -1.2409 -0.3925 -1.7294 -0.2625 1.3164 -0.2450 -0.9040 -0.4201 -0.8502 0.0363 1.4539 0.2717 -0.4192 1.0468 0.9737 -1.0771 -0.3090 -0.3986 0.1885 1.1099 0.2756 0.1659 -0.3660 -1.3407 1.0468 0.4407 0.6526 0.1275 0.0065 0.9709 -1.3475 -0.3537 0.6466 1.0822 -0.6888 -0.6383 0.7714 0.8878 0.0579 1.7570 0.1455 -0.7191 -0.3436 -0.3548 0.6605 1.6201 0.7115 1.0708 0.3843 0.4410 -1.2800 -1.1847 -1.6781 0.9331 1.3069 -1.0245 -0.1249 -0.6199 -0.6578 0.3347 -0.0777 -0.7547 0.7751 -0.2601 -0.7501 -1.6887 0.6627 -0.9588 0.2902 0.7116 0.1659 1.1654 0.6219 0.9762 -1.0503 -0.0346 -0.8944 -0.5988 1.1164 1.6774 1.8254 -0.6059 0.5648 0.7391 -0.7229 0.9065 -1.6028 -3.0508 -0.4381 0.9731 0.7150 0.6260 0.1944 2.7297 0.9255 0.8418 -0.4815 0.5923 0.0547 0.1203 0.7927 -0.6938 0.4152 0.6272 -0.5237 -0.4436 1.5438 0.1744 -0.3099 -0.8035 -0.3350 -0.1653 -0.0941 1.3163 -0.0507 -0.5184 1.4271 0.7354 -0.2113 1.7770 1.8988 -1.2527 -1.3376 0.0746 -0.7031 0.8035 -1.4687 0.6343 0.5338 0.6503 -0.7339 -1.0681 -0.6660 0.8338 -0.7486 0.3782 -0.0546 -0.8427 -1.8314 0.1336 0.1671 -1.0464 -0.2106 0.3796 0.1125 0.6912 1.6448 0.9203 0.1839 1.7643 1.4503 -0.9012 2.0624 -1.4219 -0.3321 -0.2314 0.0025 1.1818 -1.3471 0.6150 0.8148 1.7104 0.0920 -0.0178 0.6296 -1.0144 1.2010 1.2011 1.7043 -0.0388 -0.2447 -0.4811 1.2302 -0.9583 -2.9057 0.0077 -0.9434 1.8024 -0.4352 2.2330 0.3773 -1.0361 0.9833 0.3506 -1.1573 0.2615 -0.5617 0.7572 0.0564 -0.8068 -1.1180 0.6274 -0.5450 0.2738 0.6805 1.0310 -1.1552 -0.2956 -1.2029 -1.0601 0.0758 -0.3173 -0.0077 -0.3589 0.5619 -0.9531 -0.6901 -1.7862 -0.1627 -1.0979 2.1982 4-hydroxyphenylpyruvate 0.9142 0.7175 0.1675 -1.1797 1.0496 0.4093 0.8008 -0.2445 1.1931 -0.8401 2.5181 -1.5647 -1.2532 -1.4078 1.7501 0.7858 0.1050 0.6109 1.0260 -1.0186 -0.5848 0.0188 -0.8174 -1.2802 0.8979 -0.2217 -1.5829 -1.1575 -1.0710 0.3946 0.6607 -1.0955 1.0580 -0.2094 0.1058 -1.3507 -1.2517 -0.9581 0.4805 -1.6017 -0.9498 -0.6554 1.3777 0.1841 0.4194 0.6932 -0.4095 1.1043 -1.2934 0.8117 -1.2841 -1.6617 0.5034 1.0314 0.4635 0.2333 -0.1743 -0.8491 -1.4019 0.1160 -1.0896 -0.2260 -1.5438 0.4900 0.5625 -0.2260 -1.3514 0.5011 -1.5742 -1.0638 -1.3432 0.7549 0.8732 0.3872 1.0171 1.2507 1.4059 -1.3102 -1.0740 0.3941 0.2797 -1.2206 1.0336 0.0236 1.9205 -1.5156 -1.1041 -1.2252 -1.6112 -0.9058 -0.3778 -1.2258 0.0633 -0.8236 0.7961 0.5244 -1.3002 -1.2643 -1.2130 -1.4917 -1.5557 -1.7448 -1.1038 0.9967 -1.1809 0.7803 1.0254 0.1446 0.1189 -1.1635 -1.6194 0.9972 -1.0827 -0.2079 1.0734 0.5393 0.6838 0.2839 1.6080 0.0116 -1.1511 0.0960 -1.3742 0.2084 0.3137 0.5310 -1.5332 0.4106 -1.4514 0.2049 0.4936 1.8012 -0.9147 0.5989 -1.4104 0.6884 -1.2753 -0.8572 -1.3720 -0.6639 0.2402 -0.2912 -1.2409 0.5108 -1.1571 0.5807 0.8076 0.5150 0.5276 0.0496 -1.0164 -1.0457 0.5176 0.4804 0.5234 -1.0741 1.0290 -1.0469 -1.5039 -0.6966 1.0916 0.8168 1.0672 0.2545 0.5608 -1.6013 0.7115 0.3522 0.2180 1.3300 0.0412 1.2132 -1.7801 -1.0422 -0.1136 -0.9095 1.1136 -1.0626 -1.2346 0.5459 0.9470 1.5283 -0.2652 0.7282 0.4538 -1.6913 -0.0455 -1.2359 -1.0462 0.8924 0.1573 1.8116 -1.1909 0.2229 0.7918 -1.4877 -1.2383 0.6717 0.3140 -0.9164 0.1506 0.5950 -1.1261 0.5996 1.0972 -0.8847 0.1297 -0.3343 0.4890 -0.2292 0.0824 2.1899 -0.2151 0.8225 0.6808 0.7459 1.4598 0.7550 -1.7693 0.6423 -0.2176 0.1689 1.3021 0.1570 0.8843 2.0994 0.6454 1.2851 -1.4983 0.6456 0.4640 1.1806 0.1360 0.5883 1.3345 0.9344 1.6766 0.2013 1.0286 -1.1909 -1.4404 1.1087 1.1545 1.9565 0.8283 0.3088 1.1634 0.5349 0.6099 0.6746 0.2392 0.0925 0.7173 0.7448 -1.4858 0.9256 -1.4724 0.9373 0.5950 -1.6324 0.0945 -1.1514 0.4868 0.8002 0.2984 -0.9066 -0.2877 0.7726 0.6153 -1.5396 -0.0966 0.9756 0.8274 0.9653 0.9650 0.5124 -1.4566 -1.4671 0.8573 -1.0185 0.7397 0.4370 -0.2082 0.2889 0.5304 1.4316 -0.1149 -1.3872 1.3491 -1.7461 -1.6844 -1.6759 0.8750 0.9950 0.6989 0.5411 -1.5276 0.8431 1.6211 -0.3616 0.8296 1.0894 -1.4225 0.8889 0.7062 0.7055 0.7603 0.4886 -0.3707 0.8199 -1.3051 1.4190 1.3508 0.6101 -1.7933 0.5149 0.2845 -1.4105 1.7562 1.0650 1.0579 -1.5912 -0.4187 0.1319 0.7809 -1.8508 0.5778 0.5206 0.3243 0.5303 -0.1985 0.8279 0.1638 0.6472 0.6045 -0.3972 2.9289 0.2240 -1.6874 0.6039 0.4049 0.2509 0.8825 -1.6221 0.4848 0.0982 0.6773 -1.6171 0.5157 -0.5804 0.5536 -0.5355 0.5306 0.2104 -1.5480 0.3777 -0.7890 -1.5602 0.4574 0.4338 0.3709 0.9771 0.3710 -0.4457 0.2210 1.1632 0.5201 0.4760 -0.2297 -1.7681 0.4589 0.9995 -1.3716 0.6282 0.0408 2.2315 -0.0673 -0.5039 -1.6458 -0.3147 -1.4288 0.4322 -1.9187 -0.0208 0.1294 -0.1078 0.0233 0.1105 0.7577 -0.0233 -1.0982 -1.3568 -0.8137 0.6716 1.0002 -0.1997 -1.8735 1.0385 0.3484 0.2982 -1.8735 0.3178 0.4507 0.4204 -1.8013 0.7252 -1.4727 -0.1079 0.3183 1.3338 4-imidazoleacetate -0.5350 0.0107 -1.0396 -0.3192 2.6892 -1.2924 0.0700 -1.7016 -0.9843 -0.3412 0.5426 -0.6176 -0.8403 -0.8874 -0.2722 0.8792 -2.1668 -0.3023 1.4691 1.3693 -0.3459 -0.3089 -0.1764 -0.1274 -0.2368 0.2506 -0.3546 0.6195 0.1003 -0.1756 0.4534 0.8160 1.5815 -0.7625 0.0854 0.5773 0.2110 2.0646 -1.0018 0.0542 1.7959 0.4084 -0.1141 -0.4224 0.2282 -0.6665 -0.4923 0.6180 -0.0859 1.3222 -0.0019 -0.1882 -0.4525 -0.3533 -0.4572 -0.1548 0.7738 0.9987 -0.1790 -0.6189 1.4329 1.4022 0.8478 -0.1679 2.4323 -0.4828 0.1873 -1.1327 -0.3321 -0.3209 0.6245 -1.0377 -0.5963 -0.2456 -1.3761 0.6286 1.8152 1.8764 -0.4880 0.1857 0.9472 -0.8905 0.0346 -0.1189 0.5239 1.2905 -0.5648 -2.0298 -0.5475 2.1100 -0.4661 -1.3262 0.0593 2.0687 1.0785 0.6028 0.6563 0.0625 0.9583 -0.5975 -0.3207 0.8374 0.7493 -0.9650 2.6069 0.0467 -3.2492 -1.0621 -1.0104 0.6296 -0.1133 -0.7706 -0.1563 -0.9073 -0.7779 -0.4262 0.2878 1.7138 -1.9591 -0.6929 -0.0194 -0.7496 0.3552 1.1554 -0.6874 -0.7071 0.9546 0.5526 1.1054 -0.4347 0.5083 -1.5449 1.0563 0.3489 0.1255 0.8101 -0.4631 0.0690 -0.8013 -0.3339 -0.9210 -0.6621 -1.0896 -1.1694 -0.2108 1.4305 -0.8342 -0.5858 -1.6748 -0.2284 0.1445 -1.8966 -0.7288 -0.6178 -0.1529 1.5549 0.3099 0.3587 0.1058 1.0313 -0.6000 -0.6513 -0.4194 -0.1282 0.8058 0.3691 1.2103 0.3654 -0.7716 -1.4008 1.4332 0.6394 0.8880 1.0272 1.4767 0.1161 0.4684 0.3123 0.8074 -0.4804 0.2939 1.8501 0.4257 0.4228 0.8625 0.5054 0.3308 -0.1568 -0.6525 0.0189 -0.3801 0.1428 -0.3883 0.6114 -0.5242 -0.6558 -0.1685 0.5964 -0.2177 1.2451 0.1408 2.3147 0.1599 -1.0394 0.2191 -0.2330 0.0632 1.6566 -1.4253 -0.0703 0.1443 0.2850 -0.4384 0.0356 2.3535 0.7870 -2.3527 -1.8303 0.1844 -0.4790 -0.9387 -1.0913 -0.0110 -0.6357 -0.3411 3.0668 -1.1512 -0.2326 0.8378 0.3043 -0.7607 0.4059 0.9978 -0.6693 0.1888 -0.1899 0.2773 1.4627 -0.5847 0.2091 0.3266 -1.5739 0.1328 -0.8802 0.7614 -1.4814 -0.3676 -0.1924 -0.7018 1.1284 -0.3242 -0.7305 -0.7850 -0.4401 -1.3841 0.9587 -1.0471 0.1462 0.2008 -0.4516 0.0667 0.2135 0.2946 -0.2237 -0.9708 1.0096 1.4185 -0.1637 0.3671 -1.0815 0.2661 -0.1387 -0.1456 -0.5569 -0.3816 0.0685 0.4081 1.2738 0.6665 -0.3847 -0.1692 -0.1980 -0.3951 0.6212 0.1220 0.2998 0.1756 1.0894 0.2769 1.5544 0.0462 0.0215 -1.6973 -0.6214 0.7076 0.3359 0.1359 -2.4173 -0.2673 -0.0843 -0.7362 0.0389 -0.1892 0.2274 -0.1429 -0.9907 -0.7431 -0.2937 -0.3330 -2.1173 -0.7158 -1.7953 0.5891 0.1749 -1.4396 -0.3478 1.1635 2.3997 1.7442 1.3036 0.2432 -1.4910 -0.4667 -0.9125 0.4152 -0.6518 0.1799 -0.5983 1.0677 -0.8043 0.8478 -0.1110 2.9135 0.4843 -0.4139 1.2839 -4.5194 0.0312 2.2744 0.1690 -0.0852 0.5430 -0.2496 0.7723 0.3874 0.0221 -0.8676 -0.9431 0.1601 -0.0611 0.5833 1.1122 0.3331 -0.6736 0.6966 -0.1947 -0.7257 0.2488 -0.8238 -0.2865 -0.3069 3.3024 -0.1737 3.3973 0.4808 -0.0668 2.1681 -1.8794 -1.2144 -1.2964 -0.2064 -0.2825 0.0584 -0.4610 -0.1522 2.7856 -0.9756 -0.2637 -0.3313 0.9971 -1.1244 -2.0471 0.6937 -1.5051 -1.0458 -0.8467 0.0284 0.6352 -0.3265 0.2665 -0.1966 1.9089 0.5007 -0.5736 -0.6947 2.0444 -0.0899 -0.6122 1.0716 -1.5650 -1.5835 -0.2950 0.0888 0.9302 -0.7387 -0.6814 -0.6086 -1.6357 -0.7688 -0.6226 4-methoxyphenol sulfate -0.5118 -1.2589 -0.8762 1.1128 1.2922 -0.9205 0.0911 1.4245 -0.8948 -0.4508 -0.6523 1.3166 -0.7666 -0.8925 0.6033 1.6616 -1.0526 -0.8164 -0.7877 -0.5947 0.4636 0.8065 -0.4498 1.8233 0.5448 -0.8025 0.6732 0.0541 -0.6523 0.8827 1.8882 0.2675 0.8976 0.5439 -1.1765 -0.8478 0.8313 0.9355 -0.7067 -0.3999 2.3090 -0.3325 -0.8389 -1.0459 -0.6633 0.3786 -0.8419 0.3555 1.3455 2.1539 3.0127 -0.3380 -0.7466 0.1086 1.4257 -1.0035 -0.8449 1.0664 0.1379 0.0940 0.7689 -1.0108 -0.3657 1.1059 -0.8006 -0.4381 0.3363 -1.1487 -1.0299 1.2061 -0.8387 0.1765 0.5279 -1.0334 2.2451 1.5110 -0.6688 -0.8155 0.3817 0.6532 2.4705 0.6324 -0.8245 0.6465 -0.7137 1.9661 0.3105 -0.7545 -1.0550 -0.5154 -1.2090 -0.7588 0.4903 -0.4782 1.1905 0.3702 0.0676 -0.7715 0.7987 -0.9663 0.1184 -1.1566 0.8101 0.6206 0.3119 0.2879 -0.8906 0.3122 0.1473 0.6798 0.5710 -1.0244 -0.6550 -0.8327 -0.8340 -0.1124 2.3203 -0.7637 -0.9389 0.7123 0.2705 -0.7700 -0.8840 -0.8891 0.6634 -0.9127 -0.9930 1.1664 0.9264 0.1795 0.6432 -0.6807 -0.5183 1.3918 0.8454 0.6825 0.3705 -0.4747 -0.8657 -0.3382 -0.5947 0.9181 -0.7763 -0.8639 0.6542 0.0380 -0.8262 0.4515 -0.7223 -0.6834 0.5222 -0.6199 -0.7297 1.1209 -0.8932 -0.6488 0.4301 -0.6346 1.0636 -0.3939 -0.7981 -1.1078 -0.6665 -0.8287 1.9213 -1.0433 1.9095 -0.9461 1.3817 0.4528 -1.0482 -0.8566 0.2307 -0.6040 1.0329 -0.5401 0.7009 2.0349 -0.0503 -0.5999 -0.7756 0.9765 -0.8970 0.9099 -0.6508 -1.0986 1.9159 -0.0078 0.3661 -0.7210 0.2156 1.4489 1.9539 -0.6665 -0.6538 0.3466 -0.7587 0.4852 -0.8683 -0.5374 0.8450 0.2338 1.1449 0.5825 -0.9064 2.0265 1.0686 -0.1035 -0.8111 0.9522 -0.7912 -0.8547 0.2678 -0.9166 -1.0455 0.8646 -1.1060 -1.0978 1.1560 -1.0177 -0.9047 -0.9693 -0.6377 2.1050 0.6304 1.2128 2.1023 1.8769 0.9436 0.2790 -0.9060 -0.6871 1.6055 0.7183 0.2270 -1.0820 2.4544 -0.7562 -0.1218 -0.7278 0.5075 0.2799 -0.8882 1.0244 -0.9912 -0.8527 -0.9060 1.0870 -1.0551 -0.9505 0.8971 -1.0084 0.0611 -0.8988 -0.9584 0.9393 0.7319 -0.9320 -0.8223 0.9489 -0.9722 0.2124 -1.0624 -1.1661 -0.9741 -0.5266 0.6935 -1.0969 0.3775 -0.9819 0.8157 1.3831 0.7025 0.6007 0.4407 -0.1697 -0.9399 1.3556 1.1475 -0.6201 -1.0814 1.8229 -1.0952 2.3610 -1.1599 -0.0179 -0.9961 -0.3305 -1.0242 0.9451 -1.0920 1.1044 -0.9664 -1.0734 -0.8369 0.9359 0.8713 0.4114 0.4715 1.3995 -0.8384 0.8306 -0.9299 -1.0219 1.3639 1.5571 -0.9825 -0.6305 1.0256 1.3963 -0.8145 0.0434 -0.9385 -1.0427 0.3976 0.8249 -0.8300 -0.8933 -0.1484 0.4596 0.5523 -1.0129 0.8876 -1.1032 -0.9596 -1.2182 -0.9236 -0.8817 -0.9538 0.1547 -0.7710 -0.7781 -0.8609 -0.6679 -0.9253 0.6093 0.0669 -0.9386 1.8001 -0.6724 2.1206 1.3557 0.9567 1.9427 -1.0264 0.9077 -0.7180 1.2559 -0.9857 -1.0996 -0.6549 -0.2756 0.2699 -1.1973 -0.9827 -1.1631 0.5423 -1.0214 -1.2486 0.1005 -1.0035 1.2089 -0.9068 3.3588 -0.9582 -1.0920 0.5797 0.0960 -1.1190 0.9181 -0.7607 -0.9993 -0.8558 -0.8465 1.0868 -0.6669 -1.3164 0.6158 0.5033 -1.0168 1.4571 2.0811 1.1385 0.3101 1.5815 1.1083 1.5558 -0.1899 -1.2258 0.1032 0.8630 -0.8797 -0.4468 0.3804 0.6356 -1.0965 1.8004 -0.9878 0.5832 0.1044 -1.2145 -1.0125 2.0228 -1.0674 -1.1637 -1.2968 -0.9455 -0.9660 -0.8976 -0.2683 4-methyl-2-oxopentanoate 0.4647 0.3427 0.7488 -0.2583 0.0256 1.4292 0.4431 2.1423 -0.4752 3.3626 2.4535 -0.9545 -0.0451 0.7394 1.1350 -1.0190 1.0300 0.5288 -0.0600 0.9536 -0.5296 1.0543 -1.4830 -0.5757 0.5174 0.2260 0.4512 0.3867 -1.2613 -1.2905 -0.7022 0.5572 -0.3475 -0.0291 -1.1079 1.5827 -0.0480 -0.7146 -0.3844 0.1140 -1.5875 -1.2788 -0.1625 0.5068 0.3113 0.8954 0.5978 -0.5825 -1.0033 -1.0094 -0.2291 0.4585 -0.0270 1.3714 -0.8524 0.1838 -1.0061 0.2649 -0.2625 -0.2893 -0.9304 -0.8458 -1.4281 -0.0197 -0.8211 -0.4951 -1.0870 0.7156 -0.3519 -0.6267 0.4021 0.3912 0.4761 -0.0452 1.0456 1.4879 -2.4401 -1.2570 1.2786 0.6498 1.1030 1.8671 -0.9683 0.0463 1.6277 -2.6731 -1.3800 0.4392 0.9618 -0.6699 0.7467 -0.0704 -1.2281 0.1008 0.2199 -0.1352 0.7910 -0.7169 0.3135 0.4129 0.0705 0.0814 0.6216 0.2222 -1.5492 -0.0011 0.6057 0.7237 -0.5682 -1.1505 -1.6516 -1.5023 0.7105 -0.0879 1.7867 -0.5137 -0.0685 0.0356 2.3772 0.8240 1.1079 0.5599 0.4501 -1.1440 -0.0380 1.1243 1.4899 0.9267 -0.1762 0.7287 0.3647 2.0324 -0.5224 -0.3423 -0.2836 -0.4210 -0.6926 -0.0276 0.2349 -1.5626 0.3382 0.2666 0.8642 0.5893 0.3286 -1.3371 -0.0141 1.1071 -1.3003 -0.5836 -0.2625 -0.0265 0.1611 -0.9343 0.0456 0.6011 0.7182 1.1638 0.5047 -0.9723 0.5707 -1.1002 0.9998 0.3446 0.9302 -0.4526 -1.0081 -0.3523 -0.8378 0.2220 1.3570 0.0842 -0.2181 -0.9123 -1.7138 -0.0416 -0.3429 -1.1395 0.2649 -2.1018 0.3344 -0.0797 -0.1870 0.6272 -0.3004 0.0631 0.0065 0.0253 -1.5573 1.0528 -0.8941 1.6661 -0.5646 -0.5895 0.9220 1.0933 0.2695 -0.2999 0.5532 -0.4750 1.8016 -1.7168 1.5813 1.3504 0.2597 0.5439 0.4305 -0.7768 -0.1472 -0.5472 0.3509 0.6974 -0.5209 -0.7660 -0.7982 0.0282 2.6245 2.5207 -0.8910 -0.6100 -0.6507 -0.0769 0.0108 -0.5431 0.2675 0.3239 1.3081 0.5777 -0.8484 2.0675 -1.3882 -0.4293 0.7313 0.7436 1.4917 0.3483 -0.6195 -0.9455 -0.2498 1.6027 -0.8046 0.4443 1.4396 2.5769 -0.2880 0.9509 0.8566 -2.8823 0.9268 -0.5845 0.3663 1.6239 -0.7918 0.7777 0.9849 0.0579 0.7641 0.7164 1.3775 0.0952 -0.5128 -0.7759 0.3852 0.9220 0.2521 0.5855 1.1124 -0.3740 -0.6061 -0.6549 -0.3730 -1.2573 -0.2910 -0.3471 0.1435 -0.5573 1.0353 -1.2059 -1.4879 0.8837 -0.8179 -1.3419 0.4336 -0.3147 0.3695 -0.7216 -1.1414 -1.4446 2.7057 -2.1660 0.8642 -0.1120 0.5502 0.2314 2.3829 -0.8034 0.9405 -1.2166 0.4305 -0.4537 1.3817 1.2315 -0.6552 -1.0876 -0.1178 0.9084 1.0725 -0.0549 -1.4990 1.6384 0.7485 0.7048 0.2735 -0.3058 -0.0786 -0.0417 1.1185 -1.1884 0.0218 -1.7931 0.6200 0.5205 0.1602 -0.5318 -1.4725 0.4641 -0.8416 1.2764 0.3064 0.1972 0.0708 0.2749 -0.1088 0.1017 -0.5911 -1.6787 1.3206 0.0649 -1.4912 0.3195 0.4527 -0.1429 -1.2927 -1.1074 0.1662 -1.4065 0.1892 0.0275 0.4315 -0.6298 -0.5061 0.5588 -0.4858 -0.6429 -1.2394 -1.3323 -0.5615 -0.1735 0.5509 -1.5850 1.2944 -0.4895 0.3928 0.2293 0.9409 -1.4814 -1.1761 -0.2964 0.1062 -3.0524 -0.1045 0.0633 -0.7265 -0.0177 -1.2343 4.7944 -1.1201 -0.0329 -1.7354 0.6747 -0.4474 -2.0808 0.2506 0.7726 0.5704 0.3572 -0.6766 -0.0306 -0.4374 -0.1356 -0.0877 0.2477 0.8315 -1.2541 1.7042 -0.7014 0.2946 0.8096 -0.0858 -0.6210 -1.2281 -1.6350 -0.3981 -1.8029 -1.8013 1.0264 -0.8503 0.5844 0.0625 -0.6330 4-methylcatechol sulfate -2.4493 0.8439 1.0829 -0.3454 0.2601 0.6826 -0.0094 0.0745 -1.0201 -2.3519 -1.4536 -0.8893 0.9627 -0.2207 0.2514 0.5454 0.6360 -0.7056 0.9888 -0.6396 0.4357 0.6055 -0.2808 -0.3705 -0.1123 0.2459 0.9686 1.0850 0.2017 0.0954 2.0883 1.1837 0.3200 0.8119 -2.0883 0.4920 -0.3212 -0.7339 0.4810 0.4325 -0.0594 -0.5039 -0.1191 -0.9157 0.6001 0.7774 1.6473 0.6524 0.8424 -0.6817 -0.2386 -1.2474 0.3146 -0.2530 -0.3111 0.1425 0.4184 -0.3634 -2.6948 0.2734 0.3468 0.5381 1.5950 -0.0317 1.0027 -0.3435 1.2750 0.7304 1.3948 0.4786 0.8220 -0.0981 0.2580 -0.7389 0.2294 -0.2110 1.5450 1.1263 -2.2526 0.2142 -0.0329 -0.3196 0.7917 -0.6651 0.0868 0.5159 -0.8638 0.7123 1.3296 0.2185 0.3391 1.6233 -0.0402 0.8428 0.1455 -0.4300 1.3257 0.4042 0.8604 1.1717 1.1025 0.8769 1.0232 -0.4427 1.4265 1.0257 0.5262 -0.9384 -0.1499 -0.2871 0.2914 0.3406 -0.5120 -2.5789 -3.6490 0.9306 -1.1245 -0.1553 -2.2821 -0.1035 -0.1388 -1.5083 0.4408 0.5092 -0.5432 1.3141 0.7937 -0.5852 -0.5067 0.3853 -0.2002 -1.7899 0.7911 -1.1515 1.1331 1.5727 -0.0605 0.3159 0.1921 -0.6027 -1.9284 -0.3786 0.8591 1.0962 -0.4962 0.9131 -1.0835 0.5838 -2.6138 -0.3434 -0.0321 0.1982 1.0393 -0.2177 0.8419 -1.0307 -1.4447 -0.3710 -0.7722 -0.7188 1.2954 0.7618 -0.8869 0.6279 -0.1142 -0.7101 0.2771 1.7671 0.9633 -0.4293 0.3872 -0.1292 -0.3628 -0.3788 -0.0757 -0.2131 -1.6501 -0.1332 0.3618 -0.4630 -1.2003 -0.3498 0.0789 0.4998 0.4062 0.4283 0.0789 0.2862 1.4030 -1.0107 1.2505 -0.5345 -0.8333 -2.6036 -0.1776 1.5358 -2.8295 0.1055 0.0369 -0.9708 0.4329 -0.6172 2.3334 1.9771 1.3639 1.5297 0.1981 -1.3456 -0.2796 0.6036 -0.8381 -0.1457 1.2993 1.1891 1.4605 -0.2203 -1.6074 0.4946 1.2679 -0.5194 -0.9769 1.0419 0.7714 -1.4529 -0.0890 -0.9490 0.0933 0.2573 0.8249 0.2521 0.3735 0.3224 -0.1056 1.8092 -0.6856 1.4813 -0.2795 -0.9924 -0.8819 -1.1879 -2.4095 0.1187 -0.3532 0.9533 -0.5999 -2.1921 -1.3115 1.4211 -1.2361 1.5123 0.9594 0.4457 0.2551 0.9480 0.3034 -1.8890 0.1175 0.0391 1.8456 1.5693 1.3683 -0.3002 0.0142 -2.9512 2.1247 0.0091 0.4044 0.7893 -1.7758 -0.8438 0.9577 0.4464 -0.3848 -0.9149 0.9501 -1.2923 -1.7489 -0.2158 0.7877 -1.4770 0.2549 -0.6202 -0.6715 -0.2257 0.3126 -0.0317 -0.4977 0.3787 -0.5655 0.4784 -0.9382 -0.4489 0.3579 1.0868 -1.1452 1.0428 -1.3917 -0.1412 -0.0103 -1.1656 1.9441 -1.2714 -1.2011 -0.4008 0.0686 -0.0885 -0.2556 -2.1979 -0.7216 1.7325 1.9618 -0.7676 0.4403 1.4860 -0.4270 -0.0136 -0.8587 1.1978 -0.0560 0.8174 1.0951 -0.5070 -0.5412 0.6600 0.2292 0.4035 1.5019 -1.4240 1.1509 0.7595 0.2742 0.5989 -1.7573 0.1428 0.5538 0.0116 -1.7079 -0.7751 0.1088 1.4900 -2.7115 -0.4129 0.8770 0.2063 1.1931 -1.5088 -0.1577 -0.5356 0.3386 0.3305 -0.3093 0.7058 -3.0284 0.4076 0.0037 0.7480 -0.4924 0.5865 -0.4094 0.8374 -2.2055 -0.0413 0.1702 1.3722 -0.2346 -0.1911 -0.4398 -0.9191 -0.6369 0.2772 -0.1014 -0.3633 -0.8942 -0.3702 0.0423 -0.9043 -0.7948 -0.5316 -0.0092 0.6062 1.2199 -0.6917 1.2598 -0.0698 0.1055 0.6948 0.3220 -0.9284 0.2762 0.0429 0.3318 -0.2675 -1.2328 0.7140 0.2236 -0.4736 1.1024 -0.7240 -0.1454 0.4452 -1.5461 0.9273 0.4059 2.1692 -0.4683 0.5158 -0.1411 -1.5664 0.3304 0.0685 4-vinylguaiacol sulfate -0.6253 -1.1207 -0.8677 -0.7692 -0.5082 -0.8974 0.6553 1.1331 -0.8775 -0.5867 -0.7257 0.0107 -0.7942 -0.3478 1.8817 -0.8994 -0.7168 0.9483 -0.8043 -0.6797 -0.7164 -1.1263 -0.5826 -0.8202 -0.8131 -0.8160 -0.9652 -0.7564 -0.7138 -0.8374 -0.9764 -0.7222 1.3732 1.6091 -1.0651 -0.8461 -0.7972 0.8709 -0.7537 1.1392 -0.6501 -0.5042 0.5665 -0.4320 -0.7230 0.2001 -0.8379 -0.8207 -0.8179 0.6400 -0.8166 -0.9829 -0.7801 -0.9029 -0.6112 -0.9481 -0.8434 -0.6052 -0.8717 -0.9129 -0.7242 -0.9553 0.7878 -0.7613 -0.0732 -0.1285 0.9519 -1.0426 -0.9634 -0.7079 -0.8408 -0.9292 -0.8780 1.5696 -0.8382 0.4648 -0.7247 -0.0118 2.7896 0.8477 0.8113 -0.7867 -0.8314 -0.9647 2.2519 0.3367 -0.7238 -0.7843 -0.9805 -0.6262 -1.0865 -0.7863 0.2719 -0.5963 -0.8009 -0.7775 -0.8177 -0.7982 0.0344 -0.9217 -0.9441 1.4775 -0.7356 -0.1506 -0.7576 1.7498 -0.8770 -0.8690 -1.0998 0.5295 0.5619 0.6795 1.6144 -0.8386 2.3936 0.2245 -0.7067 1.0335 2.5585 0.2997 0.8364 -0.7971 -0.8661 -0.8827 0.6413 0.7044 -0.9403 1.3186 -0.9093 2.3644 1.6587 1.7196 -0.6289 0.3227 0.9545 -0.9469 0.4588 -0.6001 0.9548 -0.5081 -0.6831 -0.8842 -0.7965 -0.8576 -0.7430 -0.8859 -0.8293 -0.8798 -0.7640 -0.7331 -0.0332 -0.6953 -0.7641 -1.1610 -0.8736 0.2358 -0.8229 -0.7020 1.1080 -0.5382 -0.8113 0.5774 0.7544 -0.8356 -0.3712 -0.9737 1.2847 0.5878 1.3712 -0.8358 0.9626 -0.8525 0.9462 -0.6877 0.8446 -0.6378 -0.6874 -0.6968 -0.7936 -0.6772 -0.7947 -0.7605 0.1134 -0.8684 0.5973 -1.0129 -0.8597 -0.7846 -0.6945 0.2738 -1.0478 0.4349 -0.7701 -0.7288 0.0478 -0.9075 0.8270 -0.2044 -0.8572 -0.6377 1.0014 -0.7027 0.9596 1.3581 0.8892 -0.6251 1.0237 -0.3503 -0.8230 -0.8308 0.9321 -0.8478 -1.0196 0.8245 0.8485 0.9218 0.6142 0.9648 1.7764 -0.4721 0.4313 3.2614 0.1563 0.5097 1.5766 0.7469 0.3859 -0.1994 2.2608 1.8445 0.5423 -0.4736 -0.4166 0.4350 -0.9909 -1.0008 0.3374 -0.7892 1.9412 -0.7668 -0.4351 0.3079 -0.8722 -1.0734 0.1066 2.5505 0.9920 1.9248 2.2820 0.2447 -0.0394 -0.6948 0.2886 -0.8810 0.7294 0.3060 -0.9072 0.5009 -0.8310 0.9593 -0.9253 0.1269 0.2933 -1.0557 -0.9291 -0.6312 -0.9528 1.4817 0.7878 1.1801 0.0955 1.1099 2.8905 0.6080 0.1507 -0.0022 -0.9043 -0.1154 0.1359 0.4397 0.5490 1.4036 0.1289 1.5378 -1.0579 0.7856 -0.9430 -0.8716 2.3990 0.4670 1.4781 1.4254 -0.0130 2.0108 1.9894 1.0782 1.2194 -0.1758 0.3306 0.2834 -0.8438 0.1240 -0.8943 1.0382 0.6237 1.2073 1.6801 -0.6978 0.2674 -1.0262 -0.8239 0.2056 2.2479 -0.0987 -0.3939 -0.8853 -0.8374 1.1711 1.6150 3.4746 -0.8620 -0.9585 0.0224 1.3232 0.2217 -1.0920 -0.8929 0.6928 -0.9143 0.7253 -0.7935 -0.7988 -0.8581 -0.7307 -0.4901 0.0798 1.1613 -0.9108 0.6606 2.6809 0.7562 0.5617 -0.0567 -0.9747 2.6302 -0.8170 -0.7584 -0.9799 -0.9381 0.8980 -0.7179 -0.4595 -0.9310 -1.0821 -0.9381 0.4014 -1.0304 0.5058 2.8366 1.2824 1.9439 0.4399 -0.8833 0.0586 0.4620 -1.0049 1.4758 1.3564 -0.2721 0.8818 -0.7871 -0.1454 -0.2523 -0.8491 0.6006 -0.4362 0.9029 -1.0109 1.7223 0.6397 -0.8776 1.8578 1.2332 -0.5683 -1.1660 -0.0812 1.1816 -0.9288 1.0854 -1.0944 -0.7239 -0.8614 -0.5807 -0.9443 0.7698 0.5678 0.5847 0.9092 -0.2322 -0.9627 0.5753 -0.9541 -0.8261 -0.3653 0.1223 0.1940 -0.9094 0.4134 1.0488 0.3564 4-vinylphenol sulfate -0.5900 -0.9580 -2.1000 -0.4120 -0.4990 -1.2400 1.2100 -0.2180 -0.3990 1.1600 0.7360 0.1890 0.0628 -1.2200 0.6080 0.9360 -1.9800 0.8000 -1.6300 -1.0600 0.9840 -0.3070 0.1030 -0.6830 -0.8530 -0.7380 1.8300 -1.5500 -0.5820 -0.2150 -0.1550 -0.9240 0.7120 1.5300 -1.5100 -1.4700 0.7740 1.9100 -1.0200 -0.5770 -0.4890 0.0081 -1.1500 0.3520 -2.5700 0.4890 -0.6760 -0.8390 -0.1150 3.0600 0.0351 0.2050 -0.7480 -0.4790 0.0483 0.0162 -0.8270 0.7850 -0.6910 -1.3100 -0.4660 0.2050 0.1620 0.3080 -0.9300 -0.3680 0.1860 0.2810 -2.3300 -0.1560 -0.0620 0.2870 0.0309 0.0949 0.8300 -0.9500 0.1340 1.0900 1.4200 -0.6680 0.4730 -1.1400 -1.8200 0.1020 0.4020 -0.0490 -0.9040 -1.8900 -1.0600 1.3400 -1.4700 1.3100 0.0504 -2.1300 0.4310 -0.5870 -1.4500 0.8380 0.7830 -0.3460 -1.2400 0.6930 0.8410 0.3630 -0.8680 -0.1600 -1.3900 -0.2860 -0.1080 0.6030 0.4010 -0.0938 0.2950 -2.0900 0.3130 -0.4650 1.0800 -0.4170 0.9700 1.2000 -0.0038 -2.6700 -1.0700 0.6790 1.5700 0.2200 1.3500 1.5900 -0.7370 0.8420 0.6300 1.4600 -0.4510 1.1200 1.1800 -0.6860 2.3000 0.1020 0.8010 -0.3570 -0.6660 -0.6730 -1.6200 0.0363 0.7830 -0.9280 0.4570 0.2740 -1.0200 1.3700 -0.2870 1.2100 -1.4400 0.1260 -0.2060 -0.4010 -0.2910 -2.1700 0.8080 -0.4620 -1.3800 -1.3000 0.6660 -0.0182 1.9700 1.9000 -0.0097 1.1000 -0.0602 0.0698 1.8800 -0.2270 -0.0905 -0.7620 2.6200 0.3920 -1.3200 -0.1060 -0.8500 -0.6600 -1.6100 -0.0001 -0.2580 0.0075 0.4000 -1.2400 0.0339 -1.2400 -1.8400 0.3460 -1.0900 0.5510 0.6500 0.2870 -1.1200 -0.1920 0.7360 0.5820 0.1650 0.9850 -0.1300 -0.6350 1.1300 1.0900 -0.0366 0.4830 0.8310 -1.1800 -1.4700 -0.8520 0.7980 -0.5710 2.2100 -0.1420 -0.0759 0.1180 -1.1200 -0.2140 1.9500 0.3000 -0.5820 1.0800 -0.8870 0.8680 1.2100 0.1730 0.5840 1.4000 1.1400 0.3650 0.7630 -0.6300 1.8100 -0.2190 -0.4790 -1.9000 0.1170 -0.3540 0.0568 0.9010 -0.8270 -0.5550 -1.4800 0.2600 0.0120 0.4200 0.0650 1.7900 0.1930 0.7320 0.0125 -0.2450 0.4510 -1.5100 -0.8330 0.6930 0.1760 -0.3460 -1.7500 -0.3530 -0.1210 -1.0900 -0.4700 0.1250 -0.7230 -2.0900 -0.4810 1.9300 -0.1740 1.3900 0.1900 1.2000 1.2500 -0.2140 -0.0821 0.3320 -0.0106 1.1000 0.9520 0.6210 -0.4980 1.7900 -0.1260 2.0100 0.3230 0.1120 -0.9250 -0.3860 1.1300 0.0205 0.7370 0.4160 -1.2200 0.7250 0.7650 0.5620 1.8100 -0.9570 -0.1880 -0.4070 -1.4200 -0.3860 0.2530 1.3700 0.6840 1.1400 1.1100 -0.7700 0.3000 -0.0003 0.4290 -0.0847 1.1200 0.2030 0.5640 -1.2700 -0.8630 0.6300 2.2600 0.9560 0.0049 -2.8500 0.8450 -0.2680 0.0100 -1.2400 -1.6700 0.0460 -0.6280 0.8480 -0.1060 0.4270 0.0350 -0.9600 0.3050 -0.4620 0.4750 -1.2400 1.3800 1.4700 0.3090 0.4450 -0.9480 -0.5690 1.4300 -0.3190 -0.1410 -0.3030 -0.4300 1.5600 -0.1260 -0.2630 -0.9140 -0.4720 -0.7310 -0.7710 0.3670 -0.2390 1.2800 2.0500 1.2500 0.8290 -1.4400 1.3700 -1.1000 -0.0631 1.2000 2.2500 -0.5860 0.2260 0.1640 0.0955 -2.7300 -2.7300 0.7690 -1.1700 -0.3600 -0.9100 0.7440 0.0678 0.9200 2.5400 -0.0184 -0.9620 0.2340 1.3300 1.0300 -1.2900 -0.2940 0.0685 -0.8090 -0.8590 -0.7050 1.4000 0.5970 0.5000 0.9630 0.5800 1.2500 -1.1700 0.4170 -1.4200 1.2100 -1.1100 -0.3860 0.0746 -0.1570 -0.3810 0.2290 0.2720 5_6-dihydrothymine 2.2664 0.4472 0.4136 1.0893 0.6579 0.0474 -0.6115 1.0193 0.8887 1.7915 1.2223 0.9037 0.3794 0.4339 -0.3820 0.6680 -0.4979 0.7252 -0.2045 0.0227 -1.4090 0.8972 0.9201 1.0721 0.9029 1.4271 -0.2594 0.8143 0.2773 0.0269 -0.5464 0.5077 0.9838 -0.4583 -0.7941 1.4443 -0.2454 1.2491 0.4649 0.7367 0.1906 0.5776 0.3063 -0.1408 0.2031 -1.5744 -2.1083 -0.6725 -0.1718 1.5347 0.1934 -0.2487 -0.5022 1.6275 0.2344 0.3224 0.6101 0.1750 0.7620 0.3354 0.2713 0.6831 -0.6802 0.0636 -0.8023 -1.2163 0.8229 0.1875 1.3113 -0.4034 0.3121 0.0153 -0.9801 -0.4659 0.4188 -0.8517 -1.4475 -0.2991 0.8505 -0.0825 -0.4017 1.0564 -0.2501 0.3348 1.0360 -0.4863 0.5099 1.0460 -0.2264 0.4362 0.0638 0.5733 -0.7811 -2.1245 0.5811 0.9062 0.7558 -1.0278 0.3347 -0.4840 -0.1967 0.4643 1.2740 -0.8627 0.5948 0.5555 0.7244 -1.2610 0.6864 0.6710 -0.0950 -0.6373 -0.0440 0.6338 0.7725 -0.4611 0.4706 0.2121 1.5789 -1.3789 0.1608 -0.5134 -0.1498 -0.5508 0.2104 -0.9326 -0.4173 0.2649 0.4250 -0.8799 -0.0481 0.4285 1.2147 0.0429 0.6358 0.0483 0.5888 1.5599 1.1138 1.1035 0.5947 0.2169 0.9001 0.6214 -2.6860 -0.9091 1.0984 0.4274 0.1965 0.8537 0.9498 1.4644 -2.7027 0.8761 -0.0762 0.1324 -0.0920 1.0276 1.0318 0.5550 0.4101 0.5022 0.4540 0.2252 0.2312 0.7063 0.6130 0.1082 -1.4820 -0.3483 0.2893 0.5092 -0.8557 0.0133 1.0996 2.7751 1.1324 -0.9598 -0.2160 0.3373 0.5338 -0.2384 -0.2139 -0.3262 -0.3387 1.0484 1.4012 -2.8174 -2.4992 -0.2630 -1.3852 1.2486 0.8237 1.1840 -1.2179 0.5578 0.0036 -0.3708 -0.9253 -2.2806 -1.1206 1.6766 1.8628 0.5358 -3.0878 -2.2269 1.4069 1.7980 0.3101 -0.8246 0.4571 -1.0530 0.3831 -0.8135 0.1062 -0.1837 -0.5080 -0.3150 0.4658 0.3142 -0.0209 -0.5078 -0.3518 -0.0446 -0.7734 -3.6168 0.7646 -3.6921 -0.2174 -0.4045 -1.3135 0.4111 0.1441 2.0278 -3.4898 -2.0132 0.0135 -0.1356 -3.4147 0.5046 0.5970 0.2052 1.5982 -1.1497 -0.9536 -0.0922 -0.5605 -0.9047 -0.1624 -1.5561 -0.5934 0.6494 -0.7292 0.2901 -0.6196 0.2929 -1.1791 0.7534 -1.2070 -0.2701 0.8751 -2.6736 -1.3321 -0.3245 0.1341 1.9794 -1.0142 -1.9365 -0.5411 -3.3250 0.4121 0.1682 0.7646 -0.7365 0.0359 -1.3325 0.1273 -0.1758 -0.3243 0.4825 1.2832 -0.1650 -1.1079 0.6466 0.7479 -0.1122 -0.3236 0.5132 0.3179 -1.2915 -0.7099 -0.3606 -0.3969 1.0449 -2.9846 -0.4521 -0.9305 -1.1349 0.6773 0.1403 -0.2004 -0.1567 0.7835 0.6567 0.3085 -0.2378 -0.3295 1.9537 -0.4169 0.0793 -2.9321 0.3209 -0.1237 -1.4155 0.2508 0.3305 -0.0460 0.2781 1.2799 -0.6535 -0.1929 -0.1798 1.1608 -0.2577 -0.9039 0.3875 -0.2147 0.6173 -0.4482 -0.9030 1.2043 0.3197 1.4150 0.1462 -0.3127 -0.8345 1.4872 1.1136 -0.0730 -0.7437 -0.2468 -0.3986 -0.1367 0.1577 -1.2945 1.8934 -0.7639 1.2720 1.0027 -0.2710 0.1708 1.5455 0.5516 0.0717 0.5974 -0.2650 0.7012 -0.4039 0.5790 -0.8200 -1.1641 0.0150 -0.4897 -0.0837 1.1696 0.3030 -0.5843 -0.6564 -0.3600 -0.7668 0.0564 0.0756 -0.2987 -0.2992 -0.6200 1.3664 -0.8876 1.4626 0.5249 -0.4465 1.0710 -0.6345 -0.8554 0.6251 0.6230 0.6289 -0.1444 -0.0595 -0.8706 1.0708 -0.3341 1.0164 -2.1099 0.5603 -0.4431 -0.9470 0.0784 -0.3392 -0.0310 -0.1798 0.3166 1.4382 -0.7241 0.3707 -0.3401 0.5360 -3.2119 1.0800 0.3828 0.0613 5_6-dihydrouridine 0.4196 0.2923 -0.7619 -2.3415 1.3989 0.0600 -1.7792 0.2649 0.6048 1.7611 -0.3576 0.7720 -0.4724 1.5248 0.6668 1.3482 0.3543 1.8750 -0.8210 -0.6289 0.8272 0.2958 -0.0588 0.5408 -0.6836 0.2377 1.7186 0.3227 2.3424 -0.8119 -0.8311 0.9178 -0.6180 -0.4988 -0.7007 0.2977 1.9136 0.4113 0.2298 -0.9766 0.8064 0.5328 -1.1086 0.5135 0.7448 -1.4708 1.1332 -0.5903 0.8515 1.0144 0.5425 -0.8791 0.7881 1.2866 -0.2327 0.1363 1.1351 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-1.5676 -0.8675 0.0243 0.8471 0.4031 -0.7575 -0.1573 -0.4110 -1.4531 0.4055 0.6792 0.2868 1.8789 0.0666 0.6321 0.9709 0.6702 -1.6515 0.7149 0.4590 0.3146 1.6511 -0.7317 0.3513 -0.0437 0.0896 -0.8554 0.3488 -1.3825 -1.0433 0.3455 -0.2072 -0.7902 -0.4026 0.1950 0.3359 0.0842 -0.0136 -0.5152 0.8907 0.3161 -0.6406 -0.9717 -0.6952 0.6766 -1.8578 -0.6432 -2.1883 0.3090 -0.1398 1.6736 0.6336 0.1791 0.3022 1.0376 -0.7754 -0.6993 -1.5996 0.5502 -0.3619 -0.8980 -0.5586 0.3311 0.0005 -1.4870 -1.7652 -0.3748 0.7605 -0.4568 0.2320 -1.3863 1.4411 -0.7348 -0.3311 -1.3901 0.1153 -0.0819 -0.6585 -1.6377 0.0491 0.7133 -0.0326 1.0817 -1.0260 0.7628 -0.7687 -0.7747 -0.5677 -1.0017 -0.3302 1.2659 -0.9274 -0.1906 -0.4788 1.2526 0.1918 -0.8995 -0.6061 1.4720 0.0320 0.4473 0.1920 -0.2467 0.8971 0.3824 -1.8660 -0.1859 0.0949 0.6943 1.6742 0.9947 0.1969 -0.5448 0.4374 -0.6279 -0.0553 -0.9689 -0.2612 0.8230 -0.0249 -1.2225 0.8886 -0.3704 -1.2079 0.5210 0.9702 0.2184 -2.0423 -0.4965 0.9357 -0.2092 -1.0150 0.6746 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0.4180 0.8579 0.1161 -1.8489 0.0841 -0.6522 0.0831 -0.1526 -0.1191 -0.1133 1.0039 -0.2799 0.1028 -0.5534 0.6306 -0.2089 2.0149 -1.8079 0.5234 1.2151 -1.7534 0.5333 0.9087 1.4749 -0.0291 0.9216 -1.7587 1.2395 1.0211 -1.9923 -1.7637 0.8735 1.0935 -0.4427 0.9652 -0.9523 1.0022 0.1784 0.6722 0.1807 -2.0687 -0.1858 -0.1024 0.1991 -1.6402 0.9399 0.9899 0.0945 -1.9304 -0.6513 0.0990 0.7878 0.3527 0.3420 0.5766 0.4484 1.1221 0.1875 0.5999 -1.8625 -1.2607 1.3512 1.4523 0.0913 0.5793 1.1139 0.7232 -1.8851 1.7471 0.8831 -0.4296 -2.1425 -2.1281 -0.0672 -1.9302 1.4831 -2.0789 -1.7457 -1.8673 -1.6178 -1.4671 -0.6887 0.1816 -2.0834 0.2045 -1.1566 -0.4530 0.7353 -1.9521 0.0912 0.4338 1.6838 1.4838 1.2285 0.8240 -0.1621 -0.1071 5alpha-androstan-3alpha_17alpha-diol disulfate -1.7740 0.3827 -2.1233 -1.9851 -1.6095 -2.1659 -2.2981 -0.6062 -0.8912 -0.0372 -0.6704 -0.5293 -0.5634 -2.1362 -2.3123 -0.2217 -0.5501 -2.0611 0.3734 -0.7470 -0.2064 0.9308 -1.4002 -0.5485 -0.2913 -0.8546 -0.8101 0.4565 -0.4384 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-0.1774 1.3778 -1.9189 -2.0774 -0.0965 -0.0426 -0.5733 0.5673 0.0933 0.3834 -0.7356 -0.5046 -0.8887 0.1995 1.1619 -1.7960 -0.9590 -1.8762 -0.6110 -0.6683 -0.1619 0.3792 0.1532 0.1093 -0.1001 0.3541 0.2040 0.3959 0.2707 0.2551 -0.3222 -0.3681 0.4971 0.2553 -0.1922 1.1523 -0.4864 0.0867 0.7020 0.2237 -0.6230 -0.5081 0.8743 0.7612 0.4214 0.1568 0.3232 -1.3799 -0.5093 -1.0083 0.3080 0.2090 -0.0684 0.4736 0.2420 -1.1158 0.1978 -0.6688 1.4269 0.5728 -0.2531 0.6975 -1.8939 0.6296 0.2767 0.5907 -0.7181 -0.7565 0.0131 -2.0648 -0.3173 0.4799 0.0760 0.9525 0.4862 0.1215 0.8810 1.5272 -0.6795 -1.9793 0.6207 0.5929 -0.1655 -2.4222 0.8868 0.6815 0.3613 0.4809 -0.3562 -0.4450 1.6970 -0.4587 -0.5122 0.1950 0.3395 -0.7871 1.0082 0.1724 -2.0710 -1.0119 0.2045 -0.1268 0.3639 0.3916 0.6614 0.0068 0.3266 0.6170 0.4409 1.0140 0.4372 1.2918 0.0426 0.7083 -0.4575 1.1173 -0.0310 -0.2070 0.3558 -1.0262 0.0544 0.5461 0.1196 -0.0490 1.7314 0.7576 0.5637 -2.1330 0.9529 0.1576 1.3753 0.0463 -0.4214 0.8944 0.6014 -0.4584 -0.6059 0.6859 -1.4248 -1.1633 -1.3776 -0.2899 0.4852 0.2761 0.3809 -0.3017 1.6445 0.4563 1.3802 0.9406 1.0152 1.5177 0.4131 0.4911 1.0552 1.1955 0.7255 -0.3342 -0.0948 0.8483 0.5657 0.7956 -0.0700 1.9521 0.2932 0.6971 1.3855 0.2848 2.1193 1.2294 0.1770 0.7460 0.5294 0.4803 0.1231 0.0083 0.6149 0.9323 -0.0103 0.3516 0.0790 0.3782 0.4997 0.4148 0.4090 0.3361 1.6147 0.3113 0.4000 1.7196 1.3227 -0.1531 -0.4318 1.3626 2.1736 1.2175 1.7989 0.8539 0.3780 -0.9850 0.3199 0.5228 0.1967 -0.3186 1.2401 1.1686 1.6900 1.3866 0.9030 0.6189 0.0570 2.5190 1.5214 0.5065 1.5845 -0.0704 1.1986 1.6211 0.7316 0.2131 1.6653 -0.2086 0.4032 0.6035 0.9936 2.6878 0.5057 1.0290 1.3369 1.6092 0.2090 1.3009 2.2607 1.6297 1.0398 -0.0253 2.5037 0.7672 1.2181 1.4243 1.6050 0.7508 -0.7705 1.2669 0.3225 0.4910 -2.1861 1.7274 0.5961 0.5727 5alpha-androstan-3alpha_17alpha-diol monosulfate -0.8070 0.8549 -1.2965 -1.1043 -0.5780 -0.1911 0.7095 -1.4416 -1.3193 -0.7267 -1.0018 -1.4480 -1.1487 -1.3155 -1.5626 -1.3681 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-0.4008 -0.0170 -1.1222 -1.0496 0.9190 -0.5218 -0.7324 -1.0568 -0.8324 0.4833 -1.1353 -0.9881 -1.1150 -0.8720 -0.8461 -0.6604 0.1954 0.4407 -0.5144 -0.8692 0.0816 0.5839 -0.0926 0.7369 -0.7102 -0.8979 0.3130 -0.7234 -0.4752 0.3109 -1.2386 -0.9096 -0.8363 -0.6260 -0.4324 -0.3236 -0.6152 -0.3965 -0.8993 0.0098 -0.7245 -1.1271 -0.8958 -0.8694 -0.8673 -0.8543 -0.1385 -1.1177 0.3013 0.3044 -0.5575 -1.0622 -0.9053 -0.5471 -0.9480 -1.0111 -0.7255 -1.0739 -1.0475 0.5006 -0.8558 0.7818 -0.9207 0.2865 0.1535 -0.7017 -0.9020 -0.4810 -0.9577 1.6625 -0.8968 -1.0729 -0.7265 1.1819 -0.7115 -0.9467 -0.9448 -0.8197 -0.8877 -1.0877 0.0162 -1.0248 -0.7262 1.1628 0.4459 -0.1138 -1.2707 -0.8196 0.8208 -0.5331 -0.8440 -0.8068 -0.8676 0.0591 -0.8166 -1.0220 -1.0572 -1.2103 -0.7418 0.7116 -0.7776 -0.7942 -0.9570 -0.9438 1.3249 -0.7755 -1.1096 -1.0784 0.3805 -0.8992 -0.9006 -0.8835 -0.6991 0.9760 0.9743 0.4612 0.1043 0.6338 0.2434 -0.9678 -1.1458 0.2370 0.2325 0.9485 -0.0368 -1.1482 -1.0450 -0.7520 0.2612 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1.3744 -0.8804 1.8243 0.9446 1.1409 0.2299 2.7848 1.0904 1.0021 5alpha-androstan-3beta_17alpha-diol disulfate -0.6819 0.6948 -0.5638 -0.8416 -0.5468 -0.9891 -0.2816 -1.0355 -0.4944 -0.6393 -0.7984 -1.0413 -0.8723 -0.9626 -1.0993 -0.9883 -0.2810 -0.9011 2.3486 0.3222 1.0821 1.5261 1.2679 0.7646 1.1641 1.2569 1.6399 -0.8276 0.0816 -0.9218 0.9080 -0.7899 0.3948 -0.3185 -1.1773 1.4558 1.0301 -0.7165 -0.8263 -1.0760 0.6787 0.3343 0.2081 0.2090 -0.7908 -1.0936 -0.9188 -0.8988 -0.8982 0.5008 -0.8960 -1.0877 -0.8560 1.4709 -0.6656 -1.0444 -0.9266 -0.6571 -0.9588 -1.0069 -0.7911 -1.0536 0.6391 1.2364 -0.8889 -0.1261 -0.9376 0.9831 0.0015 -0.7735 1.1911 -0.2232 -0.9662 0.3366 -0.9199 2.1839 -0.7919 2.5309 -0.7808 -0.9577 -0.9553 -0.8620 0.6602 -1.0639 -0.8356 -1.0169 -0.7923 -0.8603 -1.0802 -0.6822 1.9996 1.6337 0.8285 -0.6463 0.9122 -0.8528 0.3806 -0.8771 0.8163 -1.0139 -1.0411 1.2371 -0.1456 -1.1079 0.8274 -0.8436 -0.9660 -0.3651 1.0912 -0.8290 -1.0801 1.9595 -0.7838 -0.3229 -0.9237 -0.9101 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-1.2252 2.0876 -0.3019 -1.2905 1.0764 0.1582 -0.0282 0.1188 2.2349 -0.7917 1.3809 2.0214 -1.0388 1.5633 1.0396 2.1957 -1.0298 1.1150 -0.1604 -1.2114 1.6754 -0.9085 1.8914 -0.4291 1.7493 -1.0006 0.6565 -0.1503 -1.2015 5alpha-androstan-3beta_17beta-diol disulfate 1.8887 0.1296 1.8913 -0.8874 0.5722 0.8182 -1.0742 -0.4422 1.1514 -0.9882 -0.0583 -1.5154 -2.3523 1.0944 -0.0614 0.2970 -1.3447 -0.7088 0.3510 0.3428 -0.1278 0.3819 -0.6009 -0.0622 0.1943 2.3908 -0.1715 0.7965 -0.9736 0.4724 0.1925 -0.1020 -0.2659 -0.4058 1.0865 0.1362 -0.1735 0.7216 -1.1238 0.6504 -0.5150 0.7419 -0.4190 0.2641 -0.5349 -1.1390 -0.3981 -1.1570 0.0634 3.2613 0.5065 1.1149 0.6845 0.8560 -1.3014 -1.7677 -0.6590 1.4383 -1.4154 -0.7644 -0.9909 -1.2345 -1.3523 1.0926 1.0820 0.4766 -0.6658 -0.2711 0.0093 -0.2222 1.0907 -0.2476 0.1449 0.7317 -0.0093 0.9187 0.2054 0.7353 -0.1087 -0.4910 -1.1449 -0.5768 -0.4748 -0.3011 0.4312 0.5203 -0.5492 0.2663 0.5211 0.0051 0.3323 -0.0455 1.5431 0.9321 -0.0497 -1.1028 -0.3881 0.5418 -0.1458 -0.6951 -0.5472 -0.0253 -2.8501 0.3354 -2.9055 -0.0170 -1.8061 -0.3098 1.9520 -0.1551 -1.2575 -0.1197 0.4515 0.0321 -0.6300 -2.2684 -1.4321 1.1265 -0.3726 -0.1116 1.0568 1.2694 -0.3178 -0.0279 -0.5059 0.0384 0.1507 0.2291 -1.2468 0.3663 -1.1346 -0.5742 0.5048 1.4199 -1.1026 0.0400 -0.6053 -0.7735 -0.5006 0.1392 -2.7733 -0.6968 -1.4238 -0.4148 0.3732 0.1039 1.3965 -1.3978 -0.5768 -0.2024 -0.5930 -0.0203 0.2813 0.6857 -0.7204 0.4175 -0.1772 0.7591 0.2206 0.4456 -0.1234 -0.1934 -1.2132 -2.6211 0.3523 -0.0077 -0.8763 0.8364 1.2053 0.2076 1.9976 1.1354 0.0866 0.3595 0.5337 -0.8480 -0.6720 -1.1036 -1.0093 -1.0387 0.7356 0.4323 -0.1171 0.8223 -0.8480 0.1433 0.0325 -0.0510 -0.1954 0.3239 0.1378 0.1172 0.6135 0.7513 0.0401 0.1363 0.2047 0.1589 0.8968 0.0084 1.3075 -0.9441 1.1609 0.7030 -1.0511 0.6358 1.2018 -2.1488 1.4948 0.6505 -0.3918 0.2761 -0.3019 -0.5678 0.1823 0.1830 1.2755 0.0117 0.8736 0.2579 0.2685 0.0141 -2.8123 -0.1082 -0.0930 0.6265 -1.5021 -2.0113 -1.2995 -3.0303 0.8070 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-0.9364 0.6663 -0.1934 -0.4135 1.2439 0.5179 0.5764 0.0371 0.0939 0.6197 0.7820 0.1915 -0.0852 0.4273 1.0533 0.7160 -1.9862 1.5011 -0.3334 0.5270 -0.3925 1.0469 0.9293 0.3860 1.2059 0.7700 0.8761 -0.4722 0.4837 0.7537 2.6781 -0.3061 0.5980 0.8269 0.5539 0.5860 1.0041 0.4424 -0.2051 -0.8809 1.2129 0.9078 -2.4133 0.5140 0.8015 1.0216 0.4397 0.0533 1.2255 -1.1202 -1.0205 1.0762 0.8215 0.6316 1.0033 0.8137 -1.1255 0.3525 1.3290 -0.0133 0.3873 -0.1424 0.4964 2.0175 1.8299 0.6630 1.0020 1.7182 1.0930 1.6402 -0.1758 1.6777 0.8339 2.2399 0.0958 0.0287 1.6154 -0.8032 0.5033 0.2876 2.1863 0.2289 1.0246 -0.3175 1.5336 -0.2959 0.4339 1.0504 0.9067 0.6668 -0.4283 1.6180 1.1260 1.9779 2.4189 0.8205 1.3773 0.5051 0.5380 0.9396 2.4176 1.8524 1.6840 2.6799 -0.7131 0.8843 -0.7269 1.4053 -1.0679 -0.9008 -0.2289 1.9331 5alpha-pregnan-diol disulfate -1.4354 -0.1426 -0.1891 -1.5017 -0.7291 -1.9448 -1.1809 -0.7608 -0.4100 -0.0087 -0.9734 -0.1748 -0.8931 -1.0351 -0.9418 -1.2599 -1.5552 -1.3051 0.3288 0.1310 0.1780 -0.4056 -0.3005 -1.3443 -0.3469 1.2307 -0.8517 0.0402 -0.7247 -1.0750 0.1898 -1.1385 0.4266 0.7608 -0.2874 -0.3392 -1.6866 -1.4874 0.8812 0.6129 -0.2465 -0.2866 -2.1732 -0.6340 0.0867 1.1599 -1.0958 -0.8216 -0.6230 -4.0057 -0.2110 -0.1512 -0.6489 -0.3496 -1.4475 -0.7991 -1.0833 -0.1480 -1.1485 0.3744 -2.4364 -3.0483 -0.6311 -0.0952 -0.9547 1.0605 -1.2060 -0.3292 0.3255 0.7818 -0.6761 -0.4523 0.2249 0.5243 -0.4659 0.8089 -0.2834 0.0557 -1.1815 -0.3652 -0.9924 -1.7104 -0.8279 -1.7784 -0.4945 0.0143 0.3577 0.1201 0.5105 -0.3875 -0.2991 0.1496 0.9611 -0.8779 -0.5920 0.2282 -0.1918 0.3811 -0.5410 -0.9143 -1.0434 -2.3011 -2.4802 -0.6816 -2.0511 -0.3310 0.4049 -0.1673 -0.2686 -1.2520 -1.2424 0.3147 -0.0802 -0.8688 -0.9497 0.3069 -0.9705 0.1485 -0.5175 0.2083 -0.2892 -0.5993 0.1112 -0.9693 -0.7244 -0.5937 0.0673 0.5313 -0.5464 -0.5263 -0.5936 -1.0992 0.0691 -0.1076 -0.3726 -0.2166 0.3335 -0.0672 -0.0421 -0.3218 0.2786 -0.0680 -0.5632 -1.8935 -0.3088 -0.3602 0.5466 -0.7124 1.1085 0.4292 -1.1035 -0.6673 -0.9008 1.3431 -0.4389 -0.4018 -0.4800 -0.8115 0.3370 -0.8412 -0.4132 2.2149 -1.5154 -0.8265 0.4423 -1.2297 -0.6919 0.7495 0.5447 0.2883 -0.6081 -1.0103 -1.4535 -0.6140 0.6989 -1.4988 1.2415 -1.0656 -0.7809 -0.4452 -0.4169 0.4960 -0.0341 -0.0873 0.0772 0.9986 -0.5351 0.8171 0.7271 -0.6200 -0.8128 0.1099 -0.2519 0.5585 0.1256 -0.1182 -0.8270 -0.8775 1.0769 0.1328 0.1666 -0.7931 1.1952 0.5932 -0.7413 0.3960 0.1303 -0.3670 0.1661 -0.0643 -0.2912 0.1891 0.1251 -0.8389 -0.7993 -0.8194 -0.0267 -1.3196 0.8994 -0.0901 0.6059 0.6273 -0.7054 -0.6375 1.7216 0.6437 -1.3610 -0.9715 0.1180 -0.6194 -0.0898 -0.2263 1.3670 0.5153 -0.4091 0.5305 -0.7136 1.5615 0.1401 -1.4812 1.6111 0.3899 -0.3801 -6.8649 1.8394 -0.2911 0.8031 1.1772 0.2472 1.1336 1.5429 0.9195 -0.0386 -0.2437 -0.2507 0.1678 0.2007 -0.2303 -1.0011 -0.5399 0.3668 0.6333 0.2856 -0.5530 0.6037 0.4008 -0.8949 -0.3784 0.1826 1.0287 0.5545 1.5375 0.6815 -0.0367 -2.0199 0.9743 0.0170 -0.7666 0.2646 1.2894 0.3570 0.5641 1.1531 -0.1151 1.0435 0.3470 0.6681 1.2458 0.9854 0.9220 1.2682 0.3620 -0.2780 0.0059 1.0758 -1.1877 -0.2580 1.3175 -2.0429 -0.1464 0.7962 0.2622 1.1507 0.7678 0.6671 -0.8849 0.8218 -0.2740 2.4179 1.0277 0.8074 1.3862 -0.3066 0.3240 0.2783 -0.4441 -0.0618 -0.4333 1.0256 0.4537 1.2012 1.1991 0.9201 3.4759 0.1943 0.2304 0.4650 0.5114 1.0668 1.0333 0.2453 -0.4482 0.7817 -0.4485 0.7161 -0.9734 -0.1218 0.9215 0.0344 0.6036 -1.0445 0.2323 -0.6412 -0.2042 0.1474 0.6448 1.1187 1.2467 0.9039 1.4055 1.0438 1.7364 0.3938 2.0621 1.6559 1.3147 0.9634 0.0565 0.9486 -0.6191 -0.0157 0.6125 1.1599 -0.7088 1.5113 1.1351 1.7802 1.0601 0.2736 0.5833 0.6475 1.8624 1.9087 0.0981 2.0104 -0.4034 0.0773 0.7799 0.8104 0.8160 1.3541 -1.0122 0.3480 0.5179 1.1076 1.3264 0.0965 0.4345 1.0498 1.3149 0.0703 1.9747 1.4780 1.7681 1.1870 1.0777 1.0020 0.2776 1.6261 1.6597 1.1040 1.3246 -1.3902 0.5568 -0.4429 0.2878 -0.8987 1.0399 0.3910 0.4900 5-dodecenoate (12:1n7) 0.6644 0.5677 0.6967 1.8401 1.0183 1.3153 0.3328 0.4573 1.3897 -0.0449 1.0248 0.6957 1.0848 -0.1209 0.1038 0.0733 0.8711 0.7785 -0.1967 0.5421 -1.9772 0.1256 -1.3189 -1.8182 0.7796 0.7216 1.0003 -0.5911 -1.3887 -0.2725 -0.0876 -1.2222 0.2578 -0.2399 1.3081 -0.0712 -0.0888 -2.8870 -0.9452 -0.2750 -2.8895 -1.7157 0.3913 1.2643 1.3475 0.9456 -0.7005 -2.1586 -3.1865 0.0608 -0.4209 0.2519 -1.6480 1.1574 -0.4071 0.0589 -3.2240 1.4836 -0.4658 1.1455 -0.7419 0.5520 -0.3896 0.1005 -0.1799 -1.8421 1.4672 0.4173 0.2534 -2.2900 0.7267 -0.2789 0.1563 -0.0864 0.8618 0.2165 -1.3577 -0.8631 -0.4302 -0.0754 0.4712 0.9006 -0.0495 1.6843 0.8026 -1.1091 -0.6509 0.7730 0.3995 -1.0444 0.5640 -0.2472 -3.1486 -0.6489 0.5795 -3.1185 -0.1165 -0.4283 -1.4782 0.6146 -1.2011 -0.3646 -0.8081 -0.5286 -0.4639 0.8966 -0.0176 0.0674 1.6111 -1.6476 -0.4263 -1.8958 0.4289 1.0972 1.0328 -1.6902 -0.9468 -1.0616 -0.1456 0.7051 -0.0960 0.7111 -1.4644 0.8950 -0.2403 0.4304 -0.2873 -1.1666 -0.0092 0.6221 0.5441 0.6605 -0.4745 -0.7260 -0.9197 0.3922 -0.0412 0.2751 -1.0249 -2.6485 0.5232 -0.8985 0.3997 -0.5555 0.1717 0.4957 0.9894 0.5366 -0.8863 -0.6460 -0.1934 0.8414 -0.2728 -0.0837 0.7271 -0.2867 0.7403 -0.5284 -0.6442 0.9349 -1.0984 0.0551 -0.4260 1.0486 -0.1506 -0.0357 -1.2022 -1.1173 -1.2511 -0.5599 0.1433 0.1399 0.9744 -1.8126 0.5342 1.5922 0.6324 -0.7353 0.6613 -0.9705 -1.4057 0.1849 -0.9735 -0.0734 -2.9748 -0.1987 -3.2731 -0.2548 -0.7835 0.1852 -0.4927 -0.1318 -3.0919 0.0803 0.3414 0.6945 0.5263 0.5148 1.1431 0.4016 -2.9010 -0.8840 0.6112 -0.7703 -0.0009 1.0932 0.5227 -2.3549 0.3710 -1.2346 -1.6211 -0.1685 -0.1007 0.0110 0.7015 -0.8702 -1.4199 0.6286 1.0004 0.3287 0.8914 0.2878 0.9568 0.1243 0.3574 -0.0532 1.0515 -1.3773 -0.6483 0.3759 0.6027 -0.1544 0.2059 -0.4724 -0.0290 -0.0383 -0.0282 0.7432 -3.4236 0.6558 1.4061 0.6227 0.6167 0.6517 -0.4873 -0.1011 1.1246 -0.6606 0.1133 0.4350 0.7722 0.8070 -0.4512 0.8508 0.2467 -0.3148 0.4943 0.7576 0.8305 -0.2789 0.2514 -1.3156 0.3455 0.6489 1.1589 0.8086 -0.6904 -0.4025 0.0542 0.2915 -0.0188 -3.1343 0.0870 1.0382 0.3758 0.3936 1.9124 0.1757 0.6488 1.4404 0.2075 0.1923 0.0214 0.1529 1.0359 -3.2129 0.2232 -0.3993 0.7596 -0.2012 -0.3468 0.1522 -0.4005 1.0673 -0.0543 0.7565 0.3367 0.1083 0.7983 1.1180 0.1608 -2.3234 -0.5737 0.1236 -0.5752 -0.3361 -0.1391 0.2913 1.6032 0.2732 0.6216 0.1961 1.0188 -0.0811 0.1879 0.2785 0.9571 -0.3143 0.4134 0.2443 0.2576 0.9482 -0.0181 0.0026 -0.4460 0.6665 0.6526 0.5007 0.3613 0.3262 -0.2865 -3.1433 1.4123 0.7092 -0.0131 -0.1598 1.0279 2.3092 -0.7740 -0.2118 0.2893 1.0152 0.5049 0.4934 1.0805 0.2860 0.2122 -0.0317 0.5422 -0.4355 0.7626 1.6632 0.4078 0.4175 1.2674 -0.8784 1.4058 0.1762 0.8583 0.3758 -0.6843 -0.0909 -0.2275 0.9113 1.1860 -0.6121 0.5625 -0.1325 0.9793 0.0879 0.2192 -0.3869 0.6204 0.5888 0.3874 1.0531 0.2924 0.5313 -1.6530 -0.3653 0.8239 -1.5476 -0.6716 0.8511 -1.0956 0.8869 0.6400 1.0512 0.5307 2.0812 0.1551 -0.2502 1.1936 -0.0237 0.0434 1.6910 -0.5696 0.3149 -1.4615 -1.1101 -0.1412 0.7361 0.4154 -0.3644 0.5349 0.7656 1.3124 0.3539 0.8253 0.7731 5-dodecenoylcarnitine (C12:1) 1.1016 1.0222 1.9973 1.7718 0.6029 0.4698 1.3415 -0.9544 1.2973 -0.3606 1.3539 -0.0404 1.8064 0.4906 -0.2685 -0.4438 2.1565 1.4451 0.9152 0.3845 0.1261 -0.5829 -0.8383 -2.0510 0.5885 0.6122 1.3915 0.3378 -1.9265 -1.1555 -0.7592 -0.9266 -0.1706 -0.2460 0.0676 -0.9267 -1.0286 -0.0133 -0.1721 0.9118 -0.4548 -0.4918 0.4348 1.3308 1.0189 0.0792 -0.7539 -0.6988 -1.0920 0.3134 -0.4648 0.2878 0.1729 1.4794 -0.6104 1.9409 -0.0171 1.2561 -0.1284 1.8752 -1.7567 -0.1557 -0.6668 -1.6308 -1.7101 -1.0083 0.0900 0.1951 -0.4819 -0.2859 1.2490 -0.6547 0.4404 -0.9422 0.7826 -0.9070 -0.6286 0.2062 -1.3843 -1.1729 0.2717 -0.2035 -0.8112 0.9905 -0.7942 -1.4685 -0.9698 2.1030 0.6822 -0.4510 1.1370 0.2956 0.4272 -1.0974 -0.3690 0.2357 -0.3650 -0.2567 0.3429 0.0892 -0.5114 -1.9294 -1.5709 0.4395 -0.2653 -1.6026 1.4824 0.6538 2.2976 -0.3208 -1.7874 -0.0476 -0.3986 1.5545 0.5669 -1.5424 -2.9876 -0.8366 -0.2939 0.9112 -0.8281 1.2869 0.6073 -0.6962 0.3870 -1.4394 0.4264 -0.6305 1.3457 -1.1087 -0.9422 -0.3485 -1.0227 -0.5834 -2.6701 -0.6915 1.1255 0.0694 -1.2612 0.0150 0.9736 -1.1212 0.3820 0.1036 1.1381 1.1279 0.4776 0.1400 0.7064 0.2176 -0.0953 2.2445 0.6684 1.7878 1.0069 -1.5006 1.7075 0.6543 -0.4836 1.5155 -0.2729 0.6359 -0.2411 1.6310 -1.6879 -1.5802 -1.7138 -1.8257 -0.8357 0.3643 -0.2894 0.0247 -0.5490 -0.7483 1.4126 2.4858 0.8523 -0.1245 0.9732 0.4829 -1.0769 0.3327 -0.7341 -1.9031 -1.4842 0.6543 -0.1114 0.6984 -0.4680 -2.2784 -0.4130 -1.1125 0.3417 0.5966 -0.1871 -0.3218 0.6116 -0.3146 -0.0162 1.4220 -0.5927 -0.7762 -1.1124 -1.0905 -0.2992 -0.0606 0.4232 0.6388 -1.7458 -1.8118 -0.0996 -0.9510 -0.8254 -0.7356 0.3481 -0.6752 0.4256 -1.0693 -0.2642 -0.8911 0.6644 -1.3063 -0.3137 -1.2530 -0.9412 0.2711 -1.2167 -0.5351 -1.0142 -0.2404 -0.7299 -1.5429 -1.1616 -0.1084 0.3944 0.1702 -1.4173 1.3538 -0.8082 -0.1603 1.2110 -0.6392 -0.1296 0.9886 -0.1400 0.2063 0.3705 1.4670 -1.1711 -1.0623 0.4878 -0.9284 -0.2006 0.5200 1.3044 -0.5360 0.4461 -0.3079 0.5264 0.4019 1.3386 -1.4797 -0.6977 0.5420 -0.4523 1.0037 -0.0815 -0.5723 -0.1349 0.3173 0.2002 -0.5909 -0.9937 1.6256 -0.8478 0.6138 1.1757 -0.2747 1.4467 0.9925 0.5072 -0.4518 -0.1206 0.6776 2.6695 -1.4566 0.0820 -1.1617 -0.7362 -0.2905 0.8670 -0.5714 -1.1817 0.2731 -0.4962 -0.6602 -0.4421 0.3643 0.0089 -0.1441 1.1172 -1.8502 0.3213 -0.0221 0.5393 -1.1504 -0.7488 0.9738 0.9523 0.4476 0.3204 -0.7865 -1.0952 -0.2085 1.3602 -0.8125 -0.3493 -0.8389 0.5949 -0.2720 0.5699 1.2443 -0.0202 0.7832 -1.3723 0.5905 0.4482 -0.5721 -0.2057 -0.0089 -1.0189 2.1828 1.7749 0.2601 1.3902 0.9411 -2.3886 1.7217 -0.4378 -3.3387 0.1658 0.6995 -0.0301 0.0306 -0.5475 -0.3204 0.0785 0.1354 0.4293 -0.1533 1.5857 1.5423 -0.1891 0.6801 1.4349 -0.5880 1.7381 0.7552 0.2920 -0.7157 -0.8138 0.1487 -0.3877 -0.0059 0.6855 0.4785 -0.3884 -0.4257 -0.3238 0.4714 0.0210 2.3448 0.8375 1.1844 1.2391 0.0936 0.2518 -0.5331 -2.3444 0.2713 1.4664 -1.3740 -0.0873 0.9305 -0.7874 0.6239 -0.5438 0.2867 1.1361 2.8835 -0.3579 0.9695 1.1121 1.4527 0.5676 0.9747 -0.4127 -0.3235 0.4373 0.7209 0.2363 1.1075 -1.2455 -0.3743 0.9220 0.6382 0.9567 -1.0260 -0.2267 -0.0534 5-(galactosylhydroxy)-L-lysine 0.6680 0.6835 -3.5444 -2.5279 0.1101 -1.6982 -0.8125 -3.7288 -0.6823 0.2849 -1.0394 0.9754 0.9613 1.4344 -0.3573 0.0229 -2.7239 -0.4007 -1.6624 -0.5183 -0.3587 -1.7015 0.4476 -0.0473 0.0181 0.9424 -1.2458 -1.2221 0.3601 -1.4278 -0.9646 -0.0851 0.1127 -1.1942 -1.3900 -1.6495 0.3761 0.9684 -0.1178 -0.5983 -0.5867 0.1844 -0.2845 -0.6124 0.4835 0.0100 0.3444 0.7288 -1.0634 1.3270 -0.0175 0.0569 0.7197 0.3460 -1.7435 -1.1792 0.5852 -0.6914 1.1793 -1.7433 0.4045 -0.1002 -0.5569 0.9722 -0.6758 -0.6466 -0.1284 1.1025 -0.4599 1.1922 0.0994 0.1860 0.9261 0.5563 0.9684 -2.0527 0.7407 0.0306 0.1895 0.9513 -0.1524 0.0931 -0.7978 0.5005 -0.2974 0.2739 0.3699 0.2186 0.1738 0.7628 -1.0083 -0.2461 -0.1311 0.3545 -0.4134 -3.2761 0.4265 1.0374 0.2212 -0.8212 1.5539 -0.4783 -0.0773 0.9049 1.1045 -0.8946 -0.6168 0.1905 1.1388 1.3783 -1.1082 0.8680 -3.0970 0.5640 -0.7254 0.3484 -0.1058 0.4062 -0.2373 -0.4516 -3.1995 -0.5153 0.0044 1.4019 0.1104 -0.7047 -0.1626 0.0674 -2.6322 -1.0678 -1.2462 0.2418 0.3607 0.2702 -1.2378 -0.4297 -0.3186 1.1802 0.7159 0.6191 1.3653 0.8282 0.6790 -0.3049 1.0700 -0.9453 -3.3878 -0.3138 1.0567 -1.0946 0.0324 0.2816 -0.8085 0.5110 -1.0445 -0.5193 -0.7339 -1.6595 -0.4771 -0.1400 0.3558 0.1459 0.8414 0.4969 -0.3259 -0.4251 -1.5655 1.0283 -0.4364 -0.0878 -0.6683 -0.4964 -0.4193 -0.1286 0.6987 -0.1238 2.0230 1.6974 0.5438 -0.4994 -0.2247 -0.1547 0.0941 -0.1802 0.2947 1.2314 0.5181 1.5479 -0.0600 0.6230 0.2524 -0.0924 -1.1485 -0.0050 0.9840 0.0216 0.1974 -0.1648 -0.4597 -0.6165 -0.4169 0.1171 0.6103 -0.7782 0.4769 0.6879 1.2535 1.0753 1.4268 -0.3201 1.4647 0.7357 0.7933 -1.1506 -1.2919 0.4225 -1.1198 -0.3679 -0.6731 -0.5785 -1.8687 -1.7245 -1.5159 0.3202 0.5200 0.2905 -1.5251 -3.9952 -0.8740 1.6276 0.4074 0.4056 -0.0741 0.1631 0.2674 0.4929 0.5117 1.6765 -1.1912 0.2046 -1.3376 -1.4010 0.1451 -0.1441 -0.3859 -0.9522 -0.5911 -1.0029 0.1582 0.1883 0.8443 -0.8281 -0.3667 0.7572 -0.4755 0.8608 0.8918 1.0126 0.4617 -0.4811 1.1169 0.7909 -0.2164 1.3201 -0.9391 1.1509 -0.3526 0.3447 -1.3994 0.0826 0.5925 -0.7319 1.2498 -0.1401 0.3172 0.4430 -0.3961 -0.1134 0.6534 0.8142 -2.7670 -0.1716 -0.5627 0.4440 -0.3157 0.6696 0.6492 0.0286 -1.7021 -0.4350 0.4395 0.3066 0.8786 0.9610 -0.0237 0.0554 0.7210 2.1531 1.1100 -0.6071 -0.5880 0.1086 0.2057 0.3588 0.4301 -0.8800 0.8510 1.5706 0.7531 -0.1442 1.2209 0.5720 -1.9458 0.4977 0.5283 -0.4584 0.9453 1.1390 1.1849 0.2129 0.4759 -0.2763 -1.0766 0.2714 1.6922 0.1029 0.0684 0.4108 -0.0067 0.3767 -0.2265 1.2977 0.5761 1.6177 0.1821 0.0735 0.7109 0.6250 -0.6358 0.5832 0.0658 -1.1172 0.3215 0.1524 0.6084 2.0290 -0.5091 -1.4701 1.7561 0.4840 0.7780 2.3810 0.1315 0.2286 1.3925 -0.4347 -0.7626 0.8814 0.2100 0.2707 -0.3708 0.4877 -0.0714 0.8587 0.4404 0.6768 0.9825 0.4323 -0.6322 1.1648 -0.2380 2.3444 1.1204 0.6495 -0.9828 0.0575 0.1847 0.7180 -0.5954 0.1543 1.3117 1.3858 -0.4969 0.7931 0.1582 0.8543 -4.2878 0.4294 0.1617 -0.7348 -1.2395 1.5108 1.5243 0.9642 0.4196 -0.8276 -0.8547 0.3309 0.6754 0.6922 -1.5590 0.2009 -1.2950 -0.2134 0.5700 0.7196 0.3427 0.7688 -0.1052 -0.1697 5-hydroxylysine -0.9315 2.4871 -0.8321 -1.3307 0.8392 0.3856 1.2350 -0.9182 0.7547 0.1477 0.2222 -0.0016 -0.0263 0.1717 -0.8302 -0.0306 -0.6447 -0.3148 -1.1132 -0.6389 -0.8653 -0.1807 0.2704 0.0291 -1.1620 0.0208 -0.8222 -0.3245 -0.6115 -1.2863 -2.4093 -1.9934 -1.2173 -1.4501 -1.2946 0.8664 0.8438 0.0408 -0.9072 -0.1639 0.2998 -0.9420 -0.9143 0.6535 -0.2589 0.1943 -0.7516 -1.1174 -0.5913 2.0771 -0.2088 -0.9022 -0.4949 -1.3114 -0.8126 -0.6977 -1.0409 -0.5656 -0.2456 -1.3216 -0.7742 2.9250 2.0803 -0.6065 0.3029 0.1302 -0.0454 -0.1648 0.4593 0.0451 0.2487 0.1554 0.0703 0.2661 0.7169 1.9839 -1.5635 0.4396 4.0105 -0.3209 -0.6083 -0.5959 1.7956 -0.0026 1.3150 -0.5710 -1.8852 0.4114 0.3410 -0.5287 0.3373 -0.3803 -0.1247 -0.9247 0.0586 -0.7976 -0.5448 -0.4185 -0.0939 -1.2325 0.9270 1.1334 -0.7937 0.4147 -0.5364 -0.4830 0.2684 -1.3396 -0.6732 0.8334 -1.1380 -0.2704 -1.1964 0.3603 -0.0345 -0.2232 -0.3482 0.2000 -0.1523 -1.0409 1.6182 1.4271 -1.9075 -0.7452 -0.5226 0.0854 0.1246 2.4326 -1.3569 3.8893 0.4650 -0.4749 -0.2478 0.5015 0.3997 0.8414 -0.0473 -0.2064 -0.5684 -0.2196 0.9146 -0.5400 -0.7634 -0.5874 0.4844 -0.8639 0.1668 0.8098 -0.6204 -0.1411 0.2819 0.1639 -0.5629 0.4651 -0.8378 -0.3894 0.0313 -0.2485 -0.6156 -1.4442 1.1367 -0.1589 1.2259 -0.2527 -0.3287 0.1678 -0.5423 0.3535 3.4231 -1.2035 -0.3944 -1.1490 2.3245 -0.1093 -0.1175 0.7417 1.3536 0.0728 -0.6100 -0.4317 0.2917 -0.3932 0.3788 -0.2835 1.0163 -0.0665 -0.3273 -0.4617 -1.4467 0.1855 -1.1159 -0.4477 -0.5047 -1.0821 1.4164 -0.4064 0.0200 -1.5293 0.3961 0.2472 -0.7436 -0.1248 0.0542 -0.9210 0.7760 0.1121 0.6213 -0.1375 0.3148 -1.0341 0.9909 0.1284 -1.4216 0.5201 0.0071 -0.0863 2.5379 0.4273 -2.4515 0.2973 -1.0300 0.2384 -1.8728 2.8632 -1.4262 3.1969 0.3255 0.2177 1.4107 0.4129 0.1277 0.2583 0.3697 1.1326 0.9430 -0.1052 1.8795 -0.4698 1.6007 0.8454 -3.4264 -1.1064 -0.6140 0.4975 1.7622 0.1747 -0.5828 0.1051 -0.1274 -0.4778 0.5031 -0.3045 0.2667 -0.1691 -0.3540 0.2179 -0.0118 0.0156 0.5513 -0.4396 0.0713 -0.4437 0.6711 0.8291 0.2944 1.1761 0.6526 0.3332 -0.2617 0.8464 0.3065 1.8473 0.2380 0.3856 0.4644 0.0162 -2.1634 1.2045 -0.8505 0.0605 -1.2099 -0.5135 -1.1093 0.6971 0.4580 -0.3735 -0.2803 -1.2049 2.7638 -0.5212 -0.7055 -1.0403 0.8094 1.8155 0.3820 -0.2165 -0.5076 0.8748 1.8686 0.5086 0.1176 -0.8964 -0.4192 -1.5292 -1.0153 -0.0232 0.0200 -0.1802 -0.7791 1.8536 0.7803 1.4088 2.6266 -1.2663 -1.1151 0.0359 -0.3447 1.1147 1.7710 0.2061 -0.0291 1.0004 -0.4131 0.9309 0.3075 0.1771 0.1691 0.3055 1.2287 0.5867 -0.8528 0.7646 1.2922 0.3345 0.6931 -0.3441 1.1367 -0.5787 -1.2165 -0.3512 -0.1671 -1.0955 1.7600 -0.3078 -0.6135 0.1695 -0.8992 1.5148 2.1400 0.7283 -0.3397 0.5964 0.0160 2.8016 0.9046 0.6942 -0.7632 -0.7037 -1.2699 2.8118 0.7503 0.1701 0.1077 -0.6634 0.0548 -0.6462 1.1049 -0.4145 -1.7955 -0.7845 -0.4402 0.6411 -0.2842 -0.2398 -0.8577 -0.2894 -0.6618 0.8527 -0.3908 -0.6635 0.4970 0.4938 -1.0907 -0.8698 -2.1513 0.2978 -0.3584 0.5343 -1.1624 -0.9522 -1.1876 -0.1962 0.1207 0.1175 -0.6877 0.0509 0.3111 1.0978 -0.0246 -0.7074 -0.8162 0.4437 -1.8784 -0.0491 -0.5778 0.4665 0.3477 -0.1313 -0.0485 0.1784 5-methylthioadenosine (MTA) -0.8302 0.5598 -0.1527 -0.6734 0.7596 -3.2309 0.8243 -3.2950 -0.2657 -1.7572 -2.9772 0.0072 1.0194 1.1871 0.3132 0.5517 -0.8735 0.6336 -0.2965 0.5291 0.4731 0.7903 -0.1805 0.4784 0.6069 -0.0851 -0.0561 0.3263 -1.0051 -1.3295 -0.1994 0.4315 0.9219 0.2855 0.0204 -1.4122 1.0195 0.7069 0.5676 0.7256 1.3769 0.5775 0.6512 0.3390 0.9281 0.7306 -0.2670 0.1108 0.1724 0.8314 0.5660 0.5322 0.6358 -2.4345 0.6249 -0.5810 0.7487 0.6771 0.9814 -0.1735 0.9852 0.7281 0.4497 -2.1470 0.3969 0.5444 -0.6667 0.3111 0.6082 0.6445 0.6094 -0.1425 -1.0976 -0.2770 0.5477 0.4485 0.7520 1.2988 0.5374 0.7059 0.6439 -1.6681 0.9052 0.7002 -3.0028 -0.0288 -0.3505 1.1825 0.0802 0.2490 0.6264 0.3754 0.6174 0.3792 -0.4445 0.1691 -1.6038 -1.2710 0.9235 -0.5133 -1.0114 -0.2708 0.1540 -0.0385 1.1964 -0.3835 -2.0377 0.4031 0.2789 1.0048 -0.7162 -1.3337 0.4833 -1.5184 -1.4721 -1.4635 0.5224 -0.4261 -1.8438 0.5201 -0.6433 -0.2726 0.0199 0.3892 0.6930 -1.4139 0.8729 -0.1102 0.3414 0.3040 0.2451 -2.0889 -0.6521 -0.0644 -1.8754 0.5789 0.3098 0.8432 0.4848 0.7002 -2.4629 0.5862 0.1456 0.4632 -0.4355 0.6421 0.3798 -0.2479 0.7676 0.6178 0.4222 0.9912 0.6965 0.6026 0.6384 0.4427 0.5252 -0.4394 0.6193 0.5124 0.0052 -0.3400 -0.1542 0.5136 -2.2521 0.7491 0.9062 -0.2211 -0.3636 0.3050 -0.1562 -1.0590 -0.0935 -1.8982 -0.9608 0.9484 0.6740 0.4496 0.6733 0.3929 0.7772 0.7975 0.5087 -0.5705 0.3892 0.2937 -1.0525 -0.2581 -0.2250 0.5614 -1.0253 -2.9215 -0.1050 -0.9070 0.5739 -1.1011 -0.1767 0.4043 0.1460 0.9333 -0.6551 0.6818 -1.6729 0.5038 -0.6619 -0.1760 0.3982 1.3050 0.3514 0.7526 -0.9241 0.7088 0.1626 0.7613 1.2819 -0.2701 -3.4551 -1.6075 -1.6659 -0.3016 -1.0872 -0.9875 0.7398 -0.7193 0.7828 0.6271 -1.7412 1.1982 0.8163 0.7542 -0.0850 0.4941 0.8131 0.9705 1.0194 -0.1718 -0.7899 0.8796 0.6658 0.3318 0.3317 0.8370 -1.2546 0.9158 0.8522 -1.7898 0.0261 0.3331 -2.2374 -2.2417 -0.1518 -0.2899 0.4403 0.3576 0.2957 0.9964 0.5836 -0.0556 0.7426 0.4061 1.0966 0.2746 -0.2732 -0.5918 0.5760 1.0145 0.0290 -0.1668 -3.0893 0.1612 0.2973 0.7766 -0.4460 1.1781 0.2097 -0.6168 0.6343 0.7640 0.8540 0.4040 1.0537 0.7249 0.2709 0.5771 1.0680 0.6172 -0.1416 0.4523 -1.6060 0.3438 -0.1728 0.2913 0.9803 0.7324 -0.8019 0.5580 -3.2787 1.2844 1.5959 -0.4731 -1.6378 -0.1394 -0.0421 0.2031 0.1958 1.1281 -1.4003 0.9727 -0.2119 -0.1384 0.3820 0.5887 0.6029 -0.1925 1.0806 -0.6872 0.6475 0.7090 0.8932 0.0648 0.3189 -1.7965 0.8285 0.3883 0.2983 -0.4200 0.4179 -0.2796 0.9292 0.6025 -0.5439 -0.3869 1.3544 -0.6040 1.0185 1.2279 -2.0025 0.4544 0.4953 -1.5417 0.8790 0.3190 -0.0327 1.0447 -0.2903 0.4868 0.9500 0.5246 1.0790 0.3531 0.7836 0.5911 -0.4795 -1.3361 -3.2969 -0.0427 0.5242 0.6661 -0.7923 0.0335 0.1936 0.7459 0.5728 1.2128 0.8715 -0.1162 0.6824 0.0421 -0.6572 -0.6586 -3.0157 0.7870 1.0068 -1.1710 0.3653 -3.0419 -0.7894 -0.2533 -2.7417 0.5490 0.4756 0.9426 0.2119 -1.3979 0.9370 0.9593 0.9175 0.5499 1.0270 1.2803 0.4252 -0.9270 -2.6750 1.4319 -0.7191 0.2163 0.2855 0.0042 0.4349 0.6142 -1.5984 -0.7577 -3.1062 0.6990 -0.1773 -1.7441 -0.0708 0.9283 -0.4579 -2.0142 5-methylthioribose 1.7544 -0.4728 -1.9935 -0.8451 1.2273 -1.5164 -0.6001 -2.3923 -1.2957 -1.7698 -1.0045 -0.4499 0.2310 -0.0882 -0.7457 1.0169 -1.3994 0.8967 0.4318 0.0890 0.1362 -0.0184 0.8585 1.4069 0.3685 -1.2388 -0.2367 -0.1103 0.0346 0.2033 1.1630 1.1864 0.7153 0.1605 -0.4178 -1.3015 -0.2141 1.2797 0.3256 -0.0870 0.7466 1.0768 0.1537 -0.1528 0.1521 0.0054 0.9916 0.8277 0.3162 -0.3795 0.7775 -0.7286 1.4213 0.6480 0.6669 0.0984 1.0947 0.3779 2.0421 -0.7818 0.8559 0.1840 -0.7012 -0.3554 -1.0061 0.1032 -0.3459 0.4196 0.1936 0.3782 0.4584 -0.4591 0.9412 -0.7291 1.6399 -0.9872 2.1510 0.1745 -0.1997 0.1164 0.9698 -0.0966 -0.7594 -0.3293 -1.5774 0.2653 1.2962 0.8979 0.3051 0.4930 -0.4087 -0.8385 0.6088 1.0754 -0.9762 0.1974 -0.2370 0.2101 0.3554 0.6776 0.7816 -0.2225 1.0522 0.9245 1.3530 -0.2692 -2.3502 0.3798 -0.4779 1.3449 -1.1173 -0.0912 -0.6624 -0.7567 -0.5913 0.8250 1.1331 0.6488 -0.7146 -0.9260 0.1140 -0.4829 1.1930 -0.0086 -0.4684 -0.9721 -0.5852 -0.1345 0.5513 -0.7238 -1.5951 -1.4887 -0.3691 0.4735 -0.6754 -0.2706 0.0917 1.0511 0.8152 1.4279 0.4752 0.9281 0.0591 -0.5650 0.3348 -0.0412 0.3604 -2.2122 0.6406 1.1071 0.4539 0.8034 -0.2897 0.2755 1.2898 -0.4362 -0.1216 -0.8346 -0.7494 0.9797 -1.0015 0.9090 0.9282 0.9805 0.3560 -0.0757 -1.6409 0.4494 -0.2200 0.5120 -0.5904 0.1891 -0.6644 0.6396 -0.1857 0.9489 1.3617 1.0685 1.4634 0.7962 0.1587 0.0135 0.9357 0.4407 1.1713 0.1604 0.7071 -0.0432 1.1272 0.9504 -0.0682 -1.2028 0.5394 -0.1152 1.8908 0.8187 0.7385 -0.0864 0.2297 0.4827 0.6003 0.7838 0.0740 1.1873 0.5727 0.1439 0.2016 1.2047 0.4111 1.0494 1.0780 0.5313 1.0996 -0.9437 -1.3108 0.7029 -1.1809 -0.9448 -1.0759 -0.5114 -0.9000 0.0083 -0.2675 0.2714 1.0239 -0.5473 -1.0179 -1.8996 0.7364 0.9847 0.2901 -0.2879 1.2163 0.6881 -1.0592 -0.6735 -0.4250 0.8898 -0.8585 0.6599 -2.4516 -2.4194 0.0247 0.7698 -0.1479 -0.9472 -0.7654 -0.4729 -0.6004 -0.8206 -0.4130 -0.0249 0.1671 -0.1791 -0.1307 -0.1716 0.2279 0.3827 0.9789 0.2568 0.8814 0.7898 -0.1543 0.1069 0.3449 0.9482 0.0598 -0.0418 -0.6841 0.2569 0.9862 -0.0660 0.3808 -1.0632 -0.6030 0.3833 -0.0618 0.5918 -0.6056 1.5700 -0.5819 -0.5426 -0.3025 0.6286 -0.2971 0.2264 1.5207 0.3786 -2.0908 0.2595 -0.3738 0.2209 0.7380 -0.2989 -1.2119 -0.2642 -1.7839 2.0555 0.2623 0.0317 -0.4296 -0.0412 0.6094 0.0354 0.5811 -0.3746 -0.8645 1.5811 -0.2813 -0.7053 -0.3155 0.6611 -3.1187 0.6288 -0.0968 0.3565 0.4536 0.8877 0.1731 -0.1316 1.1875 -1.5687 -0.1584 -0.2480 0.6425 -0.7271 -0.4697 -0.0952 0.2061 1.0588 0.4900 1.2169 -0.9310 1.2550 0.8849 -0.4461 -1.8034 0.9250 -0.6344 -0.6732 -0.9663 -0.2191 0.0721 -0.1195 -0.3302 1.5371 -1.2207 0.0075 1.2501 0.1290 1.3477 -6.6230 -0.2317 -0.9699 -0.9062 -1.1860 -0.8525 1.6338 -1.6774 0.0102 -0.3313 0.4365 0.9801 0.2871 0.5230 0.1581 0.4002 -0.4689 -1.2723 -0.1983 -0.1551 1.2757 1.6178 -1.8034 0.3865 -3.5595 -0.1621 -1.2926 -0.9678 -0.2578 0.5618 0.8859 0.1072 -0.8382 -0.2035 0.0011 -0.6054 0.0604 -0.1591 -0.6720 0.0524 1.0940 -7.2995 -0.1910 0.7307 -0.6879 -1.0241 0.3902 0.7236 1.2045 -0.6456 -0.1672 0.1373 -0.5789 -1.0140 0.1606 -0.1614 -0.4434 -0.2785 -0.8456 5-methyluridine (ribothymidine) 1.4592 -0.4888 -0.5652 0.9756 1.7814 -0.7265 0.0976 -4.2691 0.2857 -1.8067 -3.2183 0.5476 1.3080 0.5770 -0.4750 0.2503 -1.8179 0.6245 0.2037 0.0026 -0.3969 0.4352 1.0708 0.6094 1.5634 1.0886 0.5347 0.4389 0.0290 -0.0204 0.5402 0.6884 0.3280 0.5141 -0.0256 -3.1269 0.2214 1.4147 0.3748 -0.2061 1.0975 0.8251 0.1156 1.0146 0.1056 -0.3615 0.7464 1.3712 0.6589 1.8831 0.0800 -0.0026 0.0242 -0.2596 0.8807 0.6140 1.1519 0.4638 -0.4134 -0.0910 -0.5004 -1.7452 0.1394 -5.2631 -0.4662 0.0130 0.3126 0.7616 0.9788 0.6535 -0.0162 0.5768 0.0325 0.4144 0.8090 -0.2082 1.0766 0.0500 1.3102 0.0521 0.3329 0.6483 -0.8404 0.3985 -0.3313 0.9068 -0.2367 0.5111 0.1211 1.3492 1.1359 0.1579 0.0525 1.0076 0.0848 0.2654 -0.7299 0.2967 0.5260 1.1684 0.2178 0.6779 1.3671 -0.0251 0.9754 -0.3184 -1.8165 0.8262 0.1887 1.9511 -0.6171 0.6753 0.1218 -0.1171 -0.3057 0.0714 0.9035 0.6196 -1.1211 -0.3560 -0.0092 -2.4332 1.0996 -0.0975 -0.3759 -1.0200 0.6037 -0.1150 0.1735 -0.1445 -0.1651 0.0666 -0.1976 0.1691 -0.1174 0.8646 0.6090 0.9485 0.5175 1.3195 -2.2939 1.9182 0.4812 -0.0734 1.1100 0.2889 0.5056 0.1144 0.9353 0.4740 0.2532 1.7865 0.8193 0.2140 0.0625 0.9546 -0.2979 1.2244 0.4321 0.2057 -0.1321 -1.1256 1.9293 -0.1289 0.3623 0.8303 -0.3304 0.4806 -0.4638 0.9253 0.1521 -0.2254 -0.6471 -0.1767 -0.7375 0.5444 1.0433 0.0698 -0.1375 0.4962 0.3359 0.5751 0.4751 0.5681 0.4706 1.9294 0.3076 0.9028 -0.1539 0.8630 -0.7549 -4.1640 0.5846 0.7977 0.7939 -0.6069 -0.0950 -0.5958 0.1864 1.0025 0.1610 1.8000 1.1802 0.9909 0.0845 0.2156 0.6650 0.9081 -1.0303 0.4269 0.8105 -0.3742 0.7867 0.4655 -0.2588 0.0774 -1.5234 0.5486 -0.2098 -1.7348 -0.6193 -0.4836 -0.4063 0.2125 -0.0125 0.1292 -0.4133 -0.4564 0.5311 0.8275 -0.1676 0.1879 0.6602 0.9889 -0.8369 -0.2260 0.7576 -0.0524 0.2615 0.3773 -0.4438 0.7926 0.5574 1.9351 0.2782 -0.8826 -0.3814 0.0559 0.3437 -0.8104 -0.2366 -0.1237 -0.4232 0.0655 -0.7698 -0.0238 0.5952 0.5205 -0.7590 -0.1797 1.2821 0.7748 -0.9232 -0.3324 -0.0051 0.7327 0.3742 -0.4251 -0.2036 0.3534 -0.9147 0.7025 0.0050 -1.3645 0.3131 -0.3562 0.2117 0.9735 -1.3140 0.5625 -0.4479 0.9264 -0.7426 0.7749 0.2086 0.0245 0.4591 1.2398 -0.2262 -0.3925 -0.9454 0.4215 -1.0006 -0.7291 -2.3065 -0.1225 -0.6505 0.1409 0.3498 -0.4421 -0.2108 0.3256 0.7161 -0.8954 0.0656 -0.2286 -1.2569 1.6728 0.1836 -0.4979 -0.3146 -0.0785 -0.8361 -0.1233 -0.6603 -0.3976 -0.3168 0.3434 0.4899 -0.0637 -0.8100 -2.5569 1.0140 -2.6470 0.1689 0.0269 0.9756 -0.7902 -0.1235 -0.0707 0.3612 0.6668 0.7501 -0.7413 0.4923 -1.6593 -2.3606 0.0597 0.7734 -0.4389 -0.0918 0.0355 -0.5002 -0.0005 -0.1829 -5.4902 0.5091 0.2819 -0.1337 0.4864 0.9257 2.3029 -0.2203 -0.8986 -0.9860 -0.2035 -0.7275 -0.2628 -0.8181 -1.8079 -3.0119 0.0178 0.7229 -0.0594 -0.2387 0.3204 -0.0690 0.0518 -0.4111 0.2115 0.5262 -1.0852 0.2361 -0.3048 -0.1616 -5.3125 -2.0801 -0.9234 0.6464 -1.1797 -0.1934 -0.7862 0.0377 -0.3005 -0.4451 -0.7889 -0.7287 0.2338 -1.3429 -0.1953 1.4638 0.8568 1.6521 0.0514 -1.4526 -0.1653 -0.8866 -0.3382 0.3097 0.0230 -1.0180 -0.0433 -0.9718 -1.4978 -0.7007 -0.5564 0.1238 -0.6680 -1.5411 -1.0094 5-oxoproline 0.8057 -0.5549 1.5633 0.9092 -1.0359 2.6916 -1.0635 2.8917 2.1903 2.9191 3.1144 0.0875 -2.1701 0.0237 -0.1781 -0.4026 2.0059 0.0923 0.0471 0.0657 0.2332 -0.8325 0.8134 -0.0413 -0.4935 -0.2094 1.2174 0.9146 1.1853 1.2424 -0.5381 0.0727 -1.3090 -0.4485 -0.4133 4.1816 0.8938 0.9974 -1.2789 0.5341 0.8276 -1.5881 -0.6480 -0.1294 -1.3283 0.3496 -0.9017 0.4632 -0.7113 -0.6041 0.4316 0.0444 -1.2516 2.2823 -0.1772 0.4428 0.0057 -1.0797 -1.6880 0.4479 -0.1034 0.3109 -1.0288 2.3425 -0.7695 -0.5946 0.3706 -0.9403 0.0882 1.0117 0.6985 0.6377 0.3035 -0.2454 -0.9560 -0.2287 -0.5985 -0.8163 0.1134 -0.1648 -0.6981 1.5390 -0.3362 0.1074 1.3681 0.3461 -0.1264 -0.0910 -0.1646 0.1246 -0.0880 1.8441 -1.6159 0.4898 1.7802 0.2985 0.0090 0.1496 -0.5971 0.8006 -0.0678 0.9071 -0.8052 -0.2268 -0.7637 0.6361 3.0166 -1.9720 -0.9155 0.7869 1.6449 0.3910 -0.9496 -0.0044 0.5309 -0.4620 -0.7934 0.2168 1.1603 -0.9672 0.9821 0.4073 -0.0551 -1.0959 -0.8402 1.0310 -0.4649 -0.0660 0.1638 0.2153 0.6432 1.6536 0.7075 -0.4043 0.5334 -0.0422 -0.1602 -1.1852 -0.0770 -1.0950 0.3454 -0.8127 -0.8676 0.1706 0.3648 -0.7579 -0.5647 1.1968 -1.1682 -1.3110 -0.6046 -0.9498 -1.5900 -0.9796 -0.4176 0.0975 1.6438 -0.1525 1.3302 -0.5926 1.6905 -0.5631 0.1373 -1.1013 0.2998 0.0267 0.9443 0.1365 -0.2252 0.6196 0.4962 -0.0195 -0.1991 1.6394 -0.2309 -0.6523 -0.3841 -1.3417 -0.4333 -0.2023 0.9283 0.3399 0.7742 0.4130 -0.3512 2.0210 0.8372 -1.2702 -0.0965 -0.1347 0.3717 2.9079 0.1845 0.2793 -0.9480 -0.5797 -0.1008 -0.3206 -0.1755 -0.1817 0.1812 0.6313 1.4315 -0.9424 -0.1609 -0.3985 -1.0017 -0.1610 -0.6909 -0.1995 0.5576 -1.1655 -0.8765 -1.5149 -1.1496 -0.1493 1.8865 1.2917 -0.2347 0.1583 -0.4432 -0.0659 -0.2824 0.7635 -0.3345 -0.0177 1.1158 0.5590 0.2226 -0.6265 0.2379 -0.7182 -1.2139 0.3146 -0.1726 0.5022 0.7631 0.6502 -0.2330 -0.1597 1.0913 -0.4950 1.6204 -0.9499 -0.4835 0.5651 -0.7391 0.3269 0.7058 0.1238 -0.7326 0.6755 -0.9924 0.3437 0.0379 -0.4513 -0.9543 -0.4174 0.0064 -0.9939 0.5536 -0.2989 0.4846 0.5492 -0.1686 -1.6377 -0.3772 -0.0256 0.5548 -0.4783 -0.8139 0.5209 -0.7919 -1.4274 -0.3954 -0.4766 -0.3838 -1.6092 -1.1093 -0.3092 -0.6664 -0.1374 -0.2182 -0.9373 -1.9430 -1.2059 -0.6855 -0.9711 -0.0424 0.0734 -1.1736 0.0697 -0.9176 -1.5481 -0.6002 -0.0272 1.9154 -2.3112 0.0225 0.0609 -0.2752 0.0848 0.8561 0.2881 -0.3759 -1.5579 1.0991 -1.5815 -0.3403 -0.1454 0.4718 -0.9406 0.1650 -0.3764 -0.8217 0.1697 -0.5778 -0.2585 -0.4970 0.1538 -1.7273 2.1130 -1.5994 -1.5203 0.3914 0.5451 0.0581 0.5944 0.8066 -0.1196 0.2197 -0.2668 -0.1791 -0.4454 -1.1140 0.5652 3.4789 -0.9341 0.3065 -0.3410 0.7554 -0.2078 -0.0920 -0.2781 -0.4747 0.3382 -0.8161 -0.9363 -2.2952 -0.1583 -1.6190 -0.3754 2.0843 0.1335 1.9437 -0.1125 -0.0598 -0.5674 -0.0872 0.0047 -0.7681 -0.5993 -1.1879 0.1063 -0.0265 0.7018 -1.0728 0.0636 1.9441 -0.1882 1.8224 -1.5975 -0.3085 1.6546 0.3454 3.4250 0.8061 1.8362 2.4285 0.5986 -0.9321 -1.6104 -0.4501 0.6636 -1.1156 -0.6192 -0.5557 -0.3890 -1.5189 -0.3210 -0.4403 1.0212 1.1816 -1.1026 -0.7618 0.2459 0.3144 -0.3035 -0.9883 -1.9248 1.0899 2.3708 1.3353 0.7963 -0.2883 1.0049 0.2760 -1.0637 -0.4788 0.6577 6-bromotryptophan 1.9614 -0.2868 -1.4184 -0.7684 0.4058 0.0506 0.1043 -0.3265 0.3203 1.8886 -1.9293 -1.3109 0.2813 1.6376 -0.2751 1.6413 -0.0724 0.2223 -0.9336 1.4861 1.2565 0.3213 0.1745 1.1914 0.8313 0.3846 0.3705 1.3248 0.0480 0.2086 -0.9200 0.2813 1.2345 0.5232 -0.4772 -0.2318 -0.0078 0.2909 -0.3635 0.0447 1.6921 2.1163 4.8596 0.6568 -0.5668 -1.2734 0.4655 1.2224 0.2217 0.2560 0.6415 -0.1887 0.4157 0.0647 -0.5116 0.2736 1.0807 -1.5710 -0.0477 -1.6520 0.6819 -0.2904 -1.1565 0.3532 0.1837 0.1667 0.4557 0.3744 0.4776 1.0817 -1.3713 1.3060 -1.2022 -1.8811 -0.2971 -0.7841 0.0688 -0.4258 -0.2028 0.2368 0.2862 -0.3011 -1.3840 -0.9120 -0.2810 0.3832 1.6796 0.3749 0.9326 1.6614 0.1688 0.8252 0.3564 0.1308 0.1075 1.0025 -0.8780 0.5463 0.2274 1.3307 0.4573 -1.0308 -0.6385 0.7732 0.8327 -1.8663 -0.4238 0.4174 -0.4320 0.9135 1.3269 1.1250 0.7170 -2.0651 -1.0712 -0.0028 0.8006 0.4377 -0.3957 -2.2063 -0.1852 0.4057 1.0036 0.6219 0.1386 -0.8863 -0.3800 0.6553 1.3694 -0.2794 0.2491 0.2569 0.8670 0.4052 -1.0499 -0.0106 -1.0747 1.0663 0.9540 1.2675 -0.1601 0.1476 0.0214 -0.3135 0.4524 -0.2194 -0.1103 0.8717 0.4137 -0.2671 1.6962 0.9639 -0.0793 -0.3932 0.6078 2.0403 0.3693 0.0465 1.2891 1.6463 1.0399 -1.3917 0.5751 -1.3816 0.1979 0.6468 0.5431 0.8319 -1.0618 1.0540 0.3741 -0.6398 -0.5038 4.2499 -0.4470 0.2049 0.8386 -2.2949 -0.9871 0.3187 2.0505 -0.2552 0.4925 0.6030 0.1149 2.0328 -0.3474 1.1620 -1.4261 0.1151 -1.0916 0.3077 1.0326 1.3971 0.7273 -0.2207 -0.3316 -0.6798 -0.7557 -0.3761 1.6171 0.7980 1.0899 1.3546 0.3153 0.4560 -1.4758 1.6422 0.1677 0.4839 1.8385 0.5980 -1.3607 -0.1840 -0.5365 -0.1820 -1.3581 -0.0679 -0.4809 -0.4560 -1.2700 -0.6838 -0.3038 0.2366 -1.2544 0.3472 -1.6289 -0.2348 -0.8690 0.0286 -0.8248 0.9761 -0.8497 1.5898 -1.0028 0.4493 -0.7192 0.4444 0.2231 0.7848 0.2698 -0.9230 -0.0352 1.7532 0.4271 -1.3965 0.0139 -0.4736 0.1589 -0.1218 -0.1457 -0.4647 0.5915 1.4189 -0.4614 0.4121 0.6952 -0.0664 -2.2075 -1.1102 0.0060 0.6956 0.6161 -1.1629 0.1992 0.6629 -0.6901 -1.5116 -0.6682 0.5168 -0.4162 0.5998 -0.1573 0.0546 0.6633 0.8890 0.8622 -0.0457 -0.1105 0.9677 -0.7952 1.2223 -0.5567 0.2136 0.5537 -0.7370 0.9533 -0.4962 -0.8901 -0.1421 0.2437 0.1863 0.6731 -0.6486 0.1187 -0.8092 -0.8008 0.5746 -2.0865 -0.7562 -3.7448 0.5019 0.5472 0.4834 -0.9225 0.2761 -1.3104 0.6171 -0.6863 1.2752 -0.3509 -1.6145 -0.1010 -0.7584 -2.4065 -0.4089 0.3430 0.3602 0.5982 -0.5290 3.1459 -0.0162 -0.6529 -1.8894 1.5571 -1.0327 0.6994 0.4345 0.8554 -0.0902 0.2020 0.6168 -0.2847 -1.4857 0.2944 -1.6938 -1.3709 -1.5716 -0.3304 -1.9729 -0.3634 -0.1929 -0.9049 -0.3456 -1.2743 -0.3577 -0.2236 2.0057 0.8555 -0.2004 1.7513 0.8299 0.0829 -0.7255 0.2717 -0.1669 -1.7345 -0.1295 -1.5835 -0.0938 -0.3251 -0.2734 0.0957 -1.5190 -1.2474 -1.2238 -1.0244 -0.9252 -0.3909 -1.4812 0.8365 0.2864 -0.4324 -0.1751 -0.3076 -1.5565 -1.2540 -1.1210 -1.3974 -1.5219 -0.5450 -1.3204 -0.8121 1.9599 0.0161 0.2120 0.1260 0.6055 -1.6555 -0.9813 0.8414 1.0823 0.9542 0.2847 -0.1215 -1.0529 0.5808 -1.2125 0.6206 0.2968 -0.4257 -0.4696 -1.5695 -2.4816 -0.7610 -0.3357 -0.0487 0.2159 0.6150 -0.9246 6-hydroxyindole sulfate 0.4301 -0.1579 1.3627 0.9539 1.1536 0.1376 0.0276 -0.0347 0.6458 -1.5663 0.4920 -1.3059 0.5467 -0.2347 0.8936 -0.0919 0.5297 0.2962 1.2803 -0.9033 0.9283 0.8358 0.8209 -0.1655 0.2894 -0.2574 0.0730 1.0198 0.4329 1.4985 1.1248 -1.3779 0.1351 0.8119 -1.4450 0.7173 -0.9712 -0.0080 0.0888 0.4130 0.1489 -1.4721 -0.2225 0.7237 0.2895 0.8820 0.6551 1.2906 -1.3282 0.6798 0.8357 -0.3186 -0.1473 -0.5053 -0.2213 1.2798 0.2926 -1.2217 -1.9281 0.0345 1.5681 1.3548 0.0159 -0.0639 0.9255 1.3585 -0.2232 0.9995 0.8758 0.4570 0.5207 0.5441 0.3604 -1.1668 -0.0203 0.0305 1.2461 -1.9041 -1.2596 0.8348 -0.5743 0.8247 0.0642 -0.5171 0.4446 0.2536 -1.2694 -0.0702 -0.2829 0.1255 0.9242 -0.2504 -0.4127 1.3783 0.4944 -1.6713 -0.4415 0.9784 1.2114 -0.4545 0.6163 0.8008 1.6550 -1.1107 0.9258 1.8651 -0.5913 -1.9852 -0.3124 -0.6210 -0.4929 0.2426 0.0423 -2.3801 -2.6051 -1.6026 0.3223 0.7324 -2.5631 0.9169 -0.3811 -0.9679 0.7756 -0.8197 -0.8466 0.2288 0.2757 0.6071 -0.3228 -1.3338 -0.1399 -1.7019 -0.8836 0.4039 1.1179 0.1952 -1.4861 0.6175 0.2003 -0.9373 -1.6971 1.1543 1.2204 0.9931 0.2902 0.3356 -0.1231 0.7278 0.5622 -0.0261 0.4162 -0.8813 0.9008 -1.4471 1.2888 -1.6208 -1.6684 0.8581 -0.6331 -1.6771 0.3514 1.2210 -0.0974 0.3854 0.2517 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-1.4947 1.1246 -1.6739 -0.9419 -0.8209 0.5669 -1.6500 -0.1233 0.6888 -0.6288 -0.8222 1.1644 -0.2058 0.5701 1.3853 -0.1366 -0.0269 1.9122 0.1351 0.1190 -0.7515 -0.5014 -0.3436 1.3276 0.4336 0.3320 0.5377 -0.3269 0.7570 -2.3278 1.4455 -0.9122 -0.3113 -1.0329 1.1529 1.8353 -0.7009 0.2056 -3.4885 0.3841 -1.0206 -1.0773 -0.6610 -0.0832 -0.2422 0.7119 1.2942 -0.1729 0.1168 -0.2214 0.8944 0.1102 -1.4277 2.0496 0.2412 1.8157 -0.3985 -0.2554 -0.3835 -0.3305 -0.6212 0.7566 1.2126 -0.1883 0.7413 -1.6475 -1.1214 -1.1672 -0.5059 0.7428 -0.5438 1.3192 -0.1121 -1.2399 1.5127 0.4637 -0.6216 -0.0999 0.9856 1.3516 0.7942 0.6189 0.1411 -0.0311 0.1026 -0.8791 0.6116 0.1611 -0.4516 0.1579 -0.3400 0.2201 0.0565 -0.7951 -0.0556 0.4382 0.1300 -1.6740 0.5791 -0.7722 0.2315 -0.9523 -0.9919 0.3252 -2.4564 0.2663 0.1038 0.3408 0.8540 0.5699 0.9283 1.0467 1.9542 -1.3325 -0.3171 0.2338 0.5947 0.4681 -1.2333 -1.3485 0.5036 0.6242 0.3497 -0.8768 -0.1478 0.5067 0.5049 0.4811 -0.5349 -0.0053 1.5132 0.0525 -1.1762 -0.5429 -0.5159 -0.1996 0.4264 -0.6648 -1.1994 0.9850 -0.2114 0.7070 -1.7468 0.6656 -1.0728 -0.1923 -0.3561 -1.1970 -1.0012 1.6196 -1.0739 -0.6645 -0.2171 1.1860 -0.8737 -1.0557 0.9437 1.4583 -1.2561 0.4956 -0.2925 0.3851 1.1127 -0.2447 -1.5978 -0.9884 0.6485 0.9399 -0.0052 -0.0270 -0.1160 -0.1443 1.7810 -1.1727 0.1810 -0.4573 0.3605 1.0653 -0.8332 -0.7919 -0.2513 0.1826 -0.2217 -0.8828 1.9042 0.7947 -0.3920 -0.0781 1.3112 -0.6914 -0.6007 1.6484 0.6044 -0.6951 0.8524 0.5265 0.9472 0.3922 1.1252 1.0859 -0.1165 0.8202 0.1243 -0.9085 1.1422 0.7816 1.6748 -0.7842 -0.3890 -1.7425 -0.3196 0.5383 -0.3124 -1.5551 -2.9375 0.7984 1.1547 2.1157 1.4615 0.2461 0.4941 4.0168 1.1602 -1.6136 0.9985 -0.8768 1.6985 0.6372 -1.2733 0.7215 0.5493 -0.3011 0.4334 1.1202 0.1542 0.8866 0.2269 -0.2123 -0.0691 -1.1487 0.9316 1.6069 -0.2645 -0.9150 1.0204 0.2446 0.0408 0.8576 1.8013 -0.6609 0.4908 0.4470 2.1812 0.8744 0.5254 0.3512 -0.1459 0.2548 -1.7143 0.1599 0.9624 2.3345 2.6342 0.6162 -1.2131 -1.2966 -0.0627 -0.2956 0.1435 1.3061 0.9571 1.7573 -1.0286 -0.7306 -0.3473 1.2082 1.0927 0.3486 -0.2337 0.3447 7-methylurate -0.8234 0.5867 1.0674 -0.9748 -0.6942 0.8036 0.3184 0.3052 -1.0929 -0.2508 -0.9349 0.7029 1.2038 -0.1029 0.5981 1.4020 0.0924 -1.0313 1.2462 -0.8814 -0.9185 1.2969 0.6071 -1.0292 -0.3888 1.4300 -1.1856 -0.9615 0.3992 -1.0518 1.4485 0.1679 -0.7477 -1.2559 0.4846 0.4478 1.3390 -0.8558 -0.9607 -1.1977 0.7036 0.3480 0.2153 0.5624 -0.9267 -1.2150 0.6811 -1.0289 0.3021 1.5713 0.3826 1.3163 0.9128 0.6988 -0.8078 1.6368 0.4075 0.0863 -1.0865 0.8601 1.9693 -0.0822 1.6297 -0.9688 0.2587 0.7722 -1.0660 1.3626 0.1720 -0.9102 0.3640 -1.1465 -0.0610 -1.1980 -0.3966 0.0327 0.5738 -1.0369 -0.9170 -1.0855 0.6209 -0.9943 0.7522 0.5874 0.9822 -1.1421 -0.6520 -0.9929 0.1373 1.1195 1.4989 -0.9946 0.2299 -0.7888 0.6440 -0.6011 -1.0296 -1.0091 1.5475 -1.1387 -0.2286 1.3217 -0.9378 0.7838 2.0731 0.0589 -0.0786 -1.0834 -0.1062 -0.9629 -1.2019 -1.1788 0.0764 -1.0524 0.4477 -1.0401 1.8770 0.1967 0.5527 -0.0095 -0.9517 1.4130 0.9947 -0.0071 -0.0620 0.0971 1.6377 1.5140 -1.1234 1.4966 1.0105 -0.9477 -0.8268 -1.1580 -0.4059 -0.1874 -1.0208 0.5391 1.2936 -0.0850 -0.8868 1.9929 -1.0048 0.8359 -0.0726 1.0757 -1.0398 0.3655 1.2046 1.2250 -0.8834 -0.8976 -0.9693 -1.3989 0.7416 -0.9154 0.3977 0.3228 1.3241 1.1998 1.4311 -1.2378 0.5579 0.1952 -0.9958 1.4213 1.6410 0.9632 -0.2695 0.1231 -1.1981 1.2274 0.7639 0.0097 -0.5021 0.3514 -0.8879 1.4619 -1.0016 0.8057 1.1123 0.7870 1.0323 0.4267 0.7025 1.1415 1.3773 1.1214 -0.8970 0.7375 -1.2730 -0.9158 0.8696 -0.9348 0.0423 -1.1265 -0.9978 2.0276 -1.0696 0.4507 -0.5184 1.1964 -0.9429 0.1715 -0.1736 -0.8200 0.9430 -0.5263 1.3254 0.8989 -1.0190 -0.0946 2.2741 0.1874 0.8390 -1.1024 1.1320 -1.2352 -1.2784 0.2279 -1.1034 0.1092 -0.9117 -1.2626 0.7604 -1.2569 -1.1942 0.7359 1.9611 -1.0390 1.2204 -0.9475 -1.0210 0.0105 -1.2137 1.3174 -0.6183 0.1626 -0.2773 -0.9743 -0.2547 -1.2367 -1.0868 -1.3025 -1.1576 -0.2574 0.8351 1.2951 -0.4234 -0.7018 -1.1273 0.8086 1.1458 -1.0971 -1.1343 0.7313 0.6929 -1.1187 -1.0439 0.8243 1.0969 0.5025 -1.2104 -1.2830 0.2766 -0.8278 1.0596 0.0420 -0.7845 -1.1566 0.3367 -1.0049 -1.1965 -0.2778 -0.3286 1.4346 -1.1200 -0.3253 -1.2031 -0.8907 0.5361 -1.2050 -1.2315 0.4452 -0.0295 -1.0446 -0.5781 -0.5748 -1.1931 -1.2717 -1.2340 -1.2349 0.9332 -1.2269 0.5385 1.4208 0.8949 1.2068 1.9206 0.9369 2.2748 -1.1771 0.7210 1.3545 0.9401 1.0056 -1.1594 -0.8979 -0.4447 -1.2524 -1.0353 -1.1995 0.0790 1.2258 0.3936 0.6218 0.5841 0.8126 -0.2173 -1.1701 -1.0742 0.4611 -1.4233 -0.1101 -1.1329 1.6139 -0.7165 -1.0860 0.7592 1.1458 0.1273 1.1841 1.4538 -0.9374 0.1140 0.4173 0.8566 -1.1309 1.3500 -0.9439 0.2727 -1.3520 -1.2227 0.1080 -0.0736 1.3139 0.0044 -1.2020 -1.1581 1.0026 -0.0114 0.6752 -1.1511 -1.3143 1.3429 0.0078 -1.2596 -0.7476 -0.4547 1.3723 -0.4873 -1.1490 0.6587 -0.1549 -1.1409 0.7813 -0.7479 -0.5602 1.2157 0.6206 0.6362 0.0627 -1.0674 -1.0643 0.4212 1.0227 1.3433 1.8693 -1.2074 0.3864 -1.0947 1.8083 2.0980 0.4672 -1.4020 -1.3855 1.5207 1.0106 0.6269 1.9366 -0.9276 -0.6532 0.1757 -1.1622 1.2210 -1.2411 -1.3317 -1.1538 -1.3803 1.5631 1.0187 0.8301 -1.0390 1.4427 1.7089 -1.3801 -1.1262 0.6570 -1.1013 0.7425 7-methylxanthine -1.3115 0.6456 0.5125 -1.4584 -1.1879 0.7762 0.6909 0.3140 -0.3811 -0.2348 -1.4179 0.7012 0.7641 -0.0995 0.6839 1.0760 0.1490 -0.2250 1.3746 0.3232 -1.4040 1.1627 -0.0763 -0.0550 -0.0347 1.3111 0.1761 0.0769 -0.1246 -0.7367 1.5018 0.0108 -0.1282 -1.7288 0.5282 0.1624 1.0833 -1.3434 -1.4440 0.5103 0.8526 0.4621 -0.7516 0.0061 -0.2929 -1.6893 0.7754 -1.5109 0.1216 1.2188 -0.0396 1.1609 0.8527 0.4887 -0.3674 1.3842 0.3455 -0.4873 -0.4504 -0.1441 1.6426 -0.1488 1.3877 -1.4518 0.4450 0.9253 -1.5465 0.7720 0.4299 0.0561 0.2906 0.1435 -0.0989 -1.6725 -1.5301 -0.7034 0.6084 -0.5003 -1.4024 -1.5647 0.9149 -0.0022 1.2796 0.6066 0.7195 0.6262 -1.4128 -1.4752 0.6472 1.7765 1.0118 0.0538 0.4719 0.9703 1.0846 -1.4683 -1.5104 -1.4905 1.4293 1.6717 -0.5096 0.9020 -0.0521 0.4253 1.4068 -0.4974 -0.4434 0.2597 0.0121 0.2527 1.0424 -0.2090 0.6486 -0.4470 0.5976 0.0503 1.6172 -1.4805 -0.4006 -0.2285 -0.0252 0.9748 0.8397 -0.4611 -0.0980 0.0610 1.3584 1.4371 1.4391 1.3486 0.3484 -1.4309 -1.3149 -0.4445 -0.0981 0.1213 -0.7602 0.5501 1.3510 0.0141 -1.3722 2.0239 -0.0494 0.8540 -0.3351 1.0127 -0.5839 0.4780 1.1055 1.3367 -1.3697 -1.3833 -1.4531 0.5293 1.0259 -1.4007 0.2441 0.1334 0.7200 1.3551 1.6736 -1.7122 0.6570 -0.2683 -1.4773 1.6697 1.1760 0.9928 -0.1480 0.2714 -1.6736 0.9642 0.6135 -0.4041 -0.4791 0.9354 -1.3743 0.6587 0.0189 0.5104 0.9890 0.6571 0.9881 -0.1551 0.7795 0.7065 1.2432 0.9730 0.9535 0.9325 -0.0609 -1.4002 1.2232 -1.4188 0.3581 -1.6037 -1.4798 1.6960 -0.8216 0.5170 -0.1414 1.0021 -0.1193 0.5605 -0.0918 -0.4666 1.1607 -0.4858 0.9310 0.8084 -0.7918 0.6861 1.8232 -1.5843 0.8768 0.0120 0.8839 -0.9447 -1.7506 0.0462 -0.5692 -0.4357 0.2134 0.6369 0.3199 -0.0042 -0.4023 0.3863 1.5955 -1.5195 0.6001 -1.4312 1.7860 -0.1803 -0.8549 1.0374 -1.5822 -0.2563 0.3989 -1.4573 0.2080 -1.7096 -0.7002 -0.1884 -0.0992 -1.5463 0.7384 1.1015 -1.6851 -0.3140 0.0473 -0.0565 1.4252 -1.5756 -0.4718 0.5712 0.2549 -0.3466 -1.5242 0.9959 0.2255 0.5149 -1.6853 -0.2672 -1.6247 0.3337 1.1346 0.4980 -1.5101 -1.6330 0.2965 -1.4871 -1.6712 -1.6318 -1.3832 1.2909 -0.1225 -0.2875 -1.2341 -0.0639 0.4190 -1.6793 0.3433 0.3863 -0.9990 -1.5252 -0.9363 -0.5337 -1.6676 1.2607 -1.1335 -0.4618 0.7971 -1.7004 0.5157 1.0673 0.9672 1.0555 1.2244 0.5521 2.3650 0.5425 0.7740 1.4898 0.8281 0.1728 -1.6355 -1.3843 0.0283 -1.7256 -1.5162 -1.2697 0.3606 0.6123 -0.4525 0.0826 0.4146 0.3681 -1.5017 -1.6457 -1.5543 0.5588 -1.8896 -0.1912 -1.6109 0.8304 -0.1593 -1.5648 0.8988 1.3501 0.6740 1.0822 0.7628 -0.5743 -0.4746 0.3763 0.5573 -1.6077 1.0117 -1.4271 0.2121 0.9891 0.3082 -0.0845 -0.8836 1.0114 -1.4478 1.4556 -1.6346 0.5260 -0.6000 0.8373 -0.0402 -1.7847 0.3000 -0.6126 -0.1004 -1.6529 -1.1940 0.6909 -1.6512 0.4878 0.6789 0.5587 0.4048 -0.1367 -0.5997 -0.0946 0.7134 -0.1720 0.4331 -0.1187 -1.5470 -1.5436 0.4160 0.3130 1.0098 1.4117 0.0726 1.0105 -0.3024 1.6898 1.4759 0.0566 -1.8701 -1.8531 0.8326 0.8012 0.2043 1.5293 -1.4124 -1.5529 0.1257 -1.6393 1.0579 -1.7142 -0.6681 -0.1205 -0.2557 1.2463 0.5720 0.6347 0.2525 0.9912 1.1990 -0.1916 0.2877 0.1668 -1.5792 0.8978 8-hydroxyoctanoate 1.7984 0.8473 1.4993 0.9428 -3.9638 1.4476 -1.3743 1.2449 1.4300 1.6025 1.8637 1.0655 0.0295 1.5025 -1.4895 0.4604 1.3342 -0.0481 -0.3304 0.8609 -0.0834 -0.8943 -0.2898 -0.1841 -0.5311 -0.0741 0.3350 -4.5174 0.5423 1.4202 0.2959 -0.5269 -0.8960 -0.8265 0.1399 1.1266 -0.5204 0.6582 1.0121 -0.5757 0.3314 0.7474 -0.3821 -0.6450 -0.8295 -1.1422 0.2988 0.2433 0.1622 1.4790 0.4806 0.8253 1.0802 1.1347 1.2295 -0.1024 0.3164 -1.0850 0.9304 -0.1800 -0.0212 0.3090 1.2073 1.8530 -0.3901 -0.7047 0.1589 -1.2768 -1.2896 0.6102 -0.2407 -0.0013 0.7034 0.4813 -0.4640 -0.4625 -0.8580 -2.0884 0.5820 -0.5226 -0.4084 1.6596 1.5237 0.0201 0.2483 -0.5025 0.5757 -0.0009 -0.6815 -0.2878 -0.2966 0.7735 0.0823 -0.3324 0.8309 -0.3156 -0.5668 1.6109 -0.5362 0.4458 1.0935 0.1570 0.9480 -0.3318 -0.0617 0.1784 1.8064 0.1193 1.1774 1.1472 0.8657 0.7233 -0.4449 0.9590 0.0144 0.8197 -0.5626 -0.4989 1.0332 -0.6717 0.1829 0.0078 -0.5915 0.4959 0.9802 0.1989 -0.9400 -0.9923 -0.3675 0.1355 -0.2415 -0.0397 -0.8122 -0.4027 0.3816 -0.7107 -0.0482 1.0116 -0.1347 1.3312 1.7762 0.2925 -0.5532 0.8946 1.0785 0.6682 -0.3313 0.6090 -0.4842 -2.0869 -0.3823 -1.1300 -1.0539 -0.6419 0.7008 0.6946 0.3288 -0.5425 0.0957 -0.1054 1.1097 0.3295 0.3711 0.6144 1.3543 -0.7589 0.6569 0.0384 0.9779 0.6107 -0.3599 1.7536 -0.1873 2.2605 1.2970 -1.0879 -0.2806 1.8785 -0.1259 -0.2555 0.1218 0.0526 0.2707 -0.8917 -0.1557 0.6178 0.8702 0.1885 1.6525 0.4610 -0.0650 1.7929 0.0279 0.5526 -0.9773 0.6077 1.8346 -1.5557 -0.8639 -0.1342 -0.1997 0.5153 0.1580 -1.6023 -0.4007 -4.2234 -0.6360 0.2898 1.3195 0.1254 -0.8489 -0.7279 -0.2597 -0.6464 -0.6134 -0.8925 0.1174 0.0064 -0.7002 0.4693 0.2177 0.1646 -0.1888 1.7046 -0.4619 -0.5150 0.8538 0.0689 -0.1264 0.0207 0.0669 -0.4458 -0.8277 -0.1722 -0.2725 -0.3729 0.7662 0.2136 -0.3231 -1.2564 1.3985 -0.7680 0.1652 -0.4374 -1.0288 1.2685 0.4460 0.8361 0.2024 -0.5106 0.5182 -0.0800 0.1491 -0.3972 0.2097 -0.1689 0.8247 -0.2540 -0.0434 1.4063 -0.1840 0.8248 0.6220 0.6050 -0.7592 -0.8861 0.4021 0.5886 -0.3456 -1.1800 0.9477 -0.7359 -0.2055 -1.1280 -1.0666 1.2320 -1.6305 -0.5790 0.5718 -0.7603 -0.9460 0.7803 -1.2660 -0.2292 -0.7073 -0.2232 0.1232 -0.2241 -0.3407 -0.8165 0.1474 -0.9857 0.3035 1.2276 1.0973 0.0809 0.5217 -2.3274 -0.2567 -0.1848 1.8052 0.5983 -1.6346 0.4294 -0.0800 -0.9104 -0.1717 -0.6803 -0.3199 -0.2757 -0.4435 -0.9364 0.4143 -0.4816 -2.0071 1.3137 -0.9888 0.7705 -0.8870 0.4218 -0.9276 1.0151 -0.8457 -1.4005 0.6947 -0.0527 -1.5825 0.6040 0.1325 -1.1099 -0.0327 -1.3094 -1.1088 2.0950 -0.4589 0.1712 1.6754 -0.1312 -0.5761 1.5731 -0.7581 -0.9577 0.1424 -0.2519 0.4099 1.6716 1.2963 -0.3273 -0.8221 -0.2063 -0.4171 -3.8460 1.6340 -0.4592 0.5721 -0.8711 -0.2373 -0.8828 -0.1769 0.4608 1.0263 -0.1351 -1.0494 -0.6026 -4.9018 -0.1447 -1.3868 -0.4608 0.8381 1.4625 1.1609 0.4163 -0.0190 1.1756 -1.1288 1.7879 0.6325 0.5205 1.9024 -0.5121 1.1364 -0.3051 -0.6989 0.0007 -1.3035 -1.1214 -0.3816 -0.7875 0.7906 -1.4341 -1.0650 -1.0036 -4.1510 0.1704 0.4219 -0.6728 -0.7090 -0.9971 -0.1507 -0.8005 0.6593 0.6345 1.3092 -0.8033 -0.3404 -0.5967 -0.0839 -1.2930 1.0720 0.3783 8-methoxykynurenate -1.1961 0.7768 1.3655 0.5734 0.1942 0.8116 1.1839 0.4735 0.7559 0.4394 -0.4354 0.2034 0.8515 0.5040 0.9671 -0.7067 0.7140 -1.4582 -1.4358 -1.2696 -1.3148 -1.8804 -1.1360 -0.7608 -0.2051 0.5925 0.9821 0.6423 -1.3117 0.6052 -1.6703 -1.3251 0.7422 0.4878 1.5829 -0.5439 0.3207 -1.2353 -1.3705 0.0522 0.4398 0.0986 0.7248 0.8289 1.2384 0.5077 -1.4792 -0.0563 -0.1773 0.7620 -0.1083 -1.6910 -0.1360 0.1112 -1.1758 0.3496 0.5336 -0.2645 -1.5300 0.9280 -1.3252 1.0118 -1.6221 -1.3808 0.2709 -0.3614 -0.1694 -1.7600 -0.1642 -1.3049 1.1516 -1.6049 -1.5395 0.7336 0.1584 -0.6250 -1.3265 0.8074 -1.3132 0.0113 1.3957 -0.2790 1.2261 0.7342 0.6502 0.1055 -0.1149 -1.4109 0.0745 -1.1955 0.0825 -0.1755 -0.8262 -1.1488 0.4849 -0.6523 -1.4584 -1.4328 -0.4041 0.1432 0.4222 0.4845 -1.3383 -1.7091 -1.3771 0.6899 -0.0469 0.5407 0.3209 -1.3720 0.5301 0.5401 -1.3174 1.3718 0.8636 -0.5046 -0.0146 -1.4172 -1.5863 0.6672 1.1569 -1.4313 1.1799 -0.1319 0.5194 1.0013 -0.6335 -1.5352 0.3557 0.0233 0.4506 -0.3028 0.5971 -1.6204 1.4132 0.8799 -1.4460 -1.1611 0.5491 -1.0337 -1.2781 -1.5459 -1.4251 0.2180 -1.3588 0.9020 0.5352 0.2561 -1.3844 0.2265 0.1901 0.1232 -0.3020 0.1306 -0.0902 -0.3348 -0.4024 -0.7574 -0.4774 0.5989 -0.1510 -0.3178 0.3114 -1.4835 0.1465 0.1602 0.9594 -1.5808 0.5067 -0.3421 1.0713 -0.3589 -1.7826 0.7116 0.8947 0.4043 -0.2572 0.2689 -1.4210 -1.2594 0.2064 0.9637 -1.5401 0.3472 -1.3091 0.3682 -1.5155 0.4342 -1.2892 -1.3776 0.6756 -1.3149 -1.3900 1.1870 0.0121 0.9332 -1.4177 0.0436 -0.0108 -1.2077 -1.6226 -0.6577 -1.3466 -1.4452 -1.5362 0.4811 -0.2915 -0.8158 -1.4652 -0.0017 -0.1033 0.4270 0.2817 0.4179 1.7522 0.4720 0.8438 0.4156 0.4988 0.1797 1.4557 1.3142 -0.6526 0.3450 -1.8262 0.8559 -0.6965 1.3439 0.0085 -1.4703 -0.5587 -1.3539 1.2479 1.0420 -1.6913 0.5519 -1.5518 0.9042 0.9698 0.4331 0.7021 -1.7241 -0.0439 1.2019 -0.3322 0.8893 1.0967 0.2321 0.6217 0.0196 1.2585 -0.4707 -1.6677 1.8206 -1.5898 -1.4473 0.4942 0.6427 -1.4767 0.5903 0.2702 -1.3664 0.7500 0.9511 0.4535 -1.1998 -0.4602 -1.7151 0.2361 -1.2989 0.0036 -0.0150 -0.0883 1.0915 0.4218 0.9576 2.1943 1.2297 1.0096 -0.2181 1.8075 0.6762 -0.5451 0.4221 2.1788 -0.4457 0.1201 0.6575 -0.6907 0.6441 0.0886 0.8805 0.7759 1.8171 0.5880 0.9229 0.5320 0.6470 0.3986 0.4875 -0.5023 -1.6443 0.3956 -1.6602 0.3498 0.3178 -1.6243 -1.2879 1.2516 0.4270 0.8600 -0.0645 1.0144 0.7672 1.2418 1.0687 0.3448 1.1021 0.9676 0.2805 -0.0809 0.8062 0.0772 1.0105 -1.5875 0.6835 -1.5551 -1.5303 0.3150 -1.6883 -1.4215 -1.4294 1.5588 -0.1343 0.4143 0.0531 1.0046 1.0770 1.5025 -1.3514 -0.5559 1.5086 0.8139 1.0301 -0.0389 -1.4577 -1.3735 -0.2450 0.3812 -1.7219 -1.3199 1.0651 0.9300 0.3927 1.5236 0.5248 0.6197 0.6698 0.9841 0.0090 -1.6457 -0.2792 0.2725 1.4632 1.1469 -1.7085 1.1612 -0.6150 0.4484 -0.2752 0.3211 1.5521 -0.2667 1.1693 1.1980 1.7762 1.0631 0.0024 -1.6861 0.3758 0.7889 0.8305 -0.1098 1.2275 0.1782 1.0672 1.5324 1.1414 0.9815 2.4419 -1.3272 1.3714 1.4767 1.5973 0.5529 1.2947 0.9960 0.0508 -1.9066 -0.4974 0.0456 0.1259 -1.4708 0.6753 0.7539 1.0254 0.3591 -0.4102 0.6555 1.2688 9_10-DiHOME -0.6956 1.1026 0.1372 1.3257 -0.5282 1.0087 1.3503 1.3907 1.0027 -0.6387 1.3046 1.4655 0.7620 1.4762 1.5911 -1.0962 -1.2155 -0.9834 -0.9572 -0.7748 -0.8299 -1.4234 -0.6341 -0.9813 -0.9696 -0.9735 0.6718 -0.8879 -0.8261 -1.0031 -1.2075 -0.8375 -0.5994 2.2786 1.2514 -1.0173 -0.9462 -0.7443 -0.8825 -1.2090 -0.7326 -0.5205 1.0498 -1.2078 -0.8386 1.2028 -1.0071 -0.9826 -0.9763 0.9183 0.8854 -1.2128 -0.9209 -1.0986 -0.6754 -1.1660 -1.0137 0.5582 -1.0545 -0.0509 -0.8414 0.5686 -1.1495 0.8373 0.5559 1.1852 0.7851 -1.3040 -1.1891 -0.8170 -1.0093 0.4418 -1.0634 0.4965 1.1867 0.1497 -0.8419 1.5331 -0.8272 0.7792 0.5823 -0.9319 1.0740 -1.1893 1.0731 -1.1270 -0.8393 -0.9274 0.6418 -0.6974 0.5854 -0.9307 0.6965 -0.6561 0.1455 -0.9175 0.8529 -0.9465 -0.9296 0.6594 -1.1591 2.1411 -0.8588 1.3488 -0.8876 -0.9038 0.1018 1.0453 0.2588 -0.8886 1.4375 0.8338 0.5219 0.5291 1.3828 0.7451 0.1415 0.7848 0.5929 -1.2556 1.3529 -0.9450 -1.0479 -1.0667 1.6973 0.6541 0.5896 -1.0588 0.5797 0.7192 0.6061 0.9617 0.4934 -1.1528 1.2713 0.4968 0.1392 -0.6592 -1.0341 -0.5261 -0.7784 -1.0731 -0.9461 1.5799 -0.8658 -1.0743 0.1518 -1.0667 -0.8975 -0.8546 1.3796 -0.7980 -0.8996 -1.4733 0.3892 -0.8240 -0.9842 -0.8089 -1.1339 1.3719 -0.9673 -1.2637 -0.8406 -1.0011 1.3101 1.8928 1.0140 1.2739 0.3808 -1.0035 1.3407 -1.0263 1.2327 -0.7857 1.1648 -0.7162 1.3501 -0.7989 -0.9418 -0.7735 -0.9440 0.7614 -1.0648 -1.0503 -0.8241 -1.2594 -1.0363 0.6437 -0.7966 0.6063 0.8665 -0.8179 -0.9073 -0.8456 0.9486 0.2306 -0.9327 -0.0921 -1.0343 -0.7154 2.1462 -0.8106 -0.8613 1.4186 -1.0686 0.7372 -1.0700 -0.2976 0.3207 -0.9976 -0.9628 0.3072 0.8526 -1.0820 0.5716 0.2960 1.0407 0.7202 0.5893 1.2025 -1.0746 0.9167 0.5086 0.6725 1.2116 1.0223 2.1039 1.0118 0.9648 1.7825 0.6136 0.9667 1.4974 0.6417 0.7701 -1.2423 -1.0778 -0.9330 1.0538 -0.9019 -1.0781 0.9148 0.8200 0.7370 -1.1531 0.8657 -1.0742 -1.2417 0.6907 0.6381 -1.1096 -1.1738 0.7136 0.8972 1.2297 0.4972 -0.0493 -1.0982 -0.4756 1.5580 -1.1336 -0.0455 -1.2232 0.7526 0.7867 -0.7057 0.2726 1.0933 0.7906 -1.1479 0.4786 -0.9455 -1.2000 -1.1475 0.3470 -1.1033 0.7463 0.9207 0.2802 -0.7935 -1.2441 2.3572 0.8326 -0.2550 -0.4628 1.3587 -1.1587 1.5362 0.8862 1.4630 1.1409 -1.2581 0.4239 -1.2396 -1.0068 0.3215 1.2567 0.3996 0.7834 0.2945 -1.0123 0.1655 0.4995 0.8943 1.5968 0.7465 1.1675 -0.8034 1.4650 -1.2789 -0.9850 0.9328 0.8506 0.4111 0.9688 0.1882 -1.0034 2.2961 0.6340 -1.1641 -1.0419 0.8212 1.1094 1.1821 0.9381 -1.3744 -1.0866 1.0771 -1.1172 0.9006 -0.9415 1.0834 -1.0334 -0.8479 -1.0912 0.4380 0.6575 1.4009 0.5786 0.6070 0.4659 -1.4144 1.0963 1.6547 1.1181 0.3633 0.8835 -1.2123 0.0930 -1.2594 -0.8311 0.7576 0.7635 0.6046 -1.1499 0.7698 0.0931 -1.1804 0.9213 0.7737 0.8331 1.0274 -1.0720 0.6572 0.4047 -0.2035 0.4760 0.6081 1.1366 0.7832 0.6883 -1.1628 0.2001 1.1685 0.0211 1.3477 -1.4750 0.6379 -1.2131 0.8960 -1.0617 0.4232 -1.4271 0.0129 1.0000 -1.4527 -1.4514 -1.1370 0.0971 -1.3775 -0.8400 -1.0418 1.6866 -1.1616 0.7823 -1.2603 0.9040 1.1686 0.3498 -1.1891 0.6517 -1.1746 0.6033 -1.2323 1.5676 -1.4510 0.7301 0.6255 -1.0697 -1.3579 9-hydroxystearate 1.0224 0.5166 -1.7571 2.4611 1.9872 1.6019 0.9884 0.1132 1.5843 0.6783 0.9018 -0.0293 1.5297 -0.4053 0.4093 -1.7767 -0.0212 0.8940 -1.6335 1.3380 -1.4885 -0.0513 0.1937 -0.2943 -1.6545 -1.6615 0.9447 -0.4216 -1.4860 -1.7137 -1.9065 -0.7967 0.2796 1.2803 1.4363 -1.7098 0.6438 -1.3975 -1.5676 0.3423 -0.4598 -1.1622 0.8510 0.1817 1.0505 0.9406 0.2247 -0.7717 -0.0510 0.4434 -1.6552 0.2719 -1.6093 -1.8143 0.6755 -1.8673 -0.7523 2.3684 -0.2822 1.1508 -0.4059 1.0130 -0.2574 0.0981 -0.2981 0.5198 1.5318 0.4067 -0.2613 -1.4819 1.1349 -0.4455 -1.7634 0.1948 0.6735 0.1543 -0.4509 -0.0472 -0.2504 -0.7227 1.0047 1.1343 0.0559 1.7755 0.5059 -1.0585 -0.2175 0.7256 0.3402 -1.3602 1.4321 -1.6104 -1.6266 -0.0349 0.8129 -1.6012 0.7841 -1.6455 0.7137 0.1146 0.4566 0.3574 -0.5758 0.1042 -1.5796 0.5318 1.1929 0.5810 -0.5089 -1.5603 0.2855 0.6025 1.7874 0.0306 0.2110 0.7393 0.4470 -1.6159 -0.4111 0.7163 0.5942 0.0665 -0.3891 -1.8115 0.9616 0.9473 -0.0526 -1.7586 0.3080 0.6700 1.1087 0.7327 -1.3684 -1.8514 0.3510 0.5817 0.0038 0.6241 -0.1824 -1.1690 0.7060 -1.7649 0.9049 -1.7319 -1.5628 0.9044 0.2391 -0.1952 -1.5837 -0.1473 -1.4461 0.4088 0.2688 -0.0575 0.6804 0.3610 0.7812 0.6131 -0.0372 1.7538 -1.6453 -0.6026 -1.5057 0.3931 -1.6334 1.0901 -0.5700 -0.0837 0.9279 -1.6776 0.2995 -1.7224 0.8478 0.0089 -1.9186 1.0775 0.8166 -1.4881 -0.3506 -0.3002 -0.3646 0.4887 0.4680 -0.2911 -1.4813 -0.5192 -1.7388 0.6757 -0.7028 -0.3222 0.1921 -1.5142 -0.1594 -1.5358 1.0462 0.7486 0.3739 1.0667 1.1026 0.5022 -0.1830 -1.4611 -1.5311 -1.6222 -1.7413 0.3440 0.4816 0.1674 0.6769 -1.6552 -1.6500 0.3650 -0.6950 0.0390 1.0093 -0.2766 1.0438 1.0155 1.2272 1.3129 0.9827 1.0667 0.7043 0.2036 -2.0958 0.5025 1.7302 1.2505 -1.0330 0.2273 1.1182 -1.5498 0.0447 0.3826 -0.4528 0.3031 -0.1318 -1.6369 1.1573 -1.5845 0.9164 0.4758 -0.1109 1.3233 0.2077 -1.7320 -1.7764 -0.0840 0.5952 0.6429 1.0980 0.7911 -0.9652 0.7230 -1.1245 -0.6631 -0.3204 0.7627 -1.6942 -1.9352 -1.4140 0.3869 0.6164 0.7548 0.2220 1.4160 1.1684 0.3107 0.3671 0.4048 -1.8686 -0.1546 -0.3098 0.2602 0.0666 -1.7978 -1.7892 0.1079 0.2144 0.4750 0.4821 -1.9430 -0.3670 0.1682 0.4815 0.0048 0.1875 0.4613 0.7800 0.2738 0.0473 0.3060 0.1156 1.4982 -0.1822 1.2516 0.6323 0.1126 0.8824 0.9823 0.8296 -0.8738 0.5805 0.7427 -0.2876 -2.0134 0.6015 -1.4528 1.0922 -0.2501 0.5828 0.6856 1.7973 -1.2504 0.2980 1.1970 -0.6321 0.2304 -1.6479 0.6259 -0.5205 -0.3276 0.7783 -0.3511 0.1109 0.8018 0.0507 0.4832 0.8747 0.3188 0.0692 -1.6291 1.6602 0.5469 0.4084 -0.3121 0.4052 0.3810 0.2286 0.7545 0.8543 0.9020 1.1354 0.4650 0.4392 -0.0470 0.7296 -0.0229 0.2620 -1.9735 0.2501 0.7623 0.3487 0.6347 -0.1351 -0.2869 0.7501 0.7016 0.7485 0.9140 -1.8987 -0.3142 -0.4104 0.7602 -0.6401 -0.4433 0.2515 -0.2397 0.9615 0.0210 0.6288 -0.3976 0.4178 0.3900 0.3865 0.0990 0.5788 0.8282 -0.6377 -1.8897 0.8787 -0.1211 -0.6627 0.9297 -0.3032 0.6684 1.2544 1.2023 -0.1460 1.2706 0.3222 -1.7063 1.1513 0.3529 0.0180 0.5531 -2.1244 -0.4923 -1.4498 -1.8670 0.8732 -1.8765 0.3117 -1.9628 1.8095 -0.2418 0.8556 0.5021 0.6812 1.1018 acetoacetate -0.7879 0.5654 -0.5728 0.6887 0.9298 -1.1374 -1.2300 -1.1819 -0.3864 -0.7531 -0.9664 -1.2017 3.4149 -1.0842 0.4115 -1.0902 0.4969 -0.3523 -0.9842 0.2047 0.3068 -1.4196 0.4058 -0.9880 -1.0057 0.1857 0.5421 -0.9197 -0.5325 -1.0672 -0.6163 -0.8894 1.0357 1.4407 0.8866 -1.0511 -0.2594 -0.7975 1.1699 0.2961 0.0030 -0.6201 0.9543 -1.2130 1.5405 -1.2444 0.7371 -0.9784 0.2144 0.8383 -1.0027 0.3534 0.3997 -1.1433 0.9936 -1.1705 -0.2187 1.9321 -1.0820 1.0869 -0.8749 0.8311 0.8497 -0.9531 1.3597 0.6989 -1.0339 0.5360 -1.1733 -0.8669 1.7452 -1.1315 -1.0951 0.5583 1.5386 -0.4291 -0.8792 0.6053 -0.8693 -0.1496 0.9417 -0.9602 1.0045 0.3696 -0.9711 -0.2586 -0.9006 1.0252 0.1127 -0.7780 0.2317 -0.9701 0.3578 -0.7035 -1.0378 -0.5901 0.0509 -0.5737 -0.9513 -1.1246 -1.1843 -0.4880 -0.8739 0.1205 -0.9571 -0.9700 -1.1084 0.5486 1.6367 -0.9282 -1.2149 -0.0428 0.5716 1.6726 -1.0612 -0.5499 0.0979 -0.2320 -1.1559 0.8053 0.0716 1.2622 -1.0471 0.2191 1.2740 -1.1260 0.5580 -0.4474 -0.2920 0.3495 0.6319 -0.9507 -0.7872 -0.4439 -0.3342 0.2818 -1.0006 -0.7525 -1.0621 -0.6259 1.6277 0.3203 1.3165 1.8313 -0.9488 -1.1143 1.6686 -1.0843 -0.9559 -0.8804 -0.8424 1.4832 1.1175 -1.4750 -1.0669 -0.8737 0.3496 -0.8510 -0.1068 0.6169 -0.9939 0.2159 -0.8841 1.7320 -0.3427 0.3245 0.9755 -1.1212 0.2499 -1.0143 0.8070 -0.4513 0.1976 -0.8749 -0.1078 2.8248 1.8501 -0.8894 -0.9690 0.5747 -0.9612 0.6266 -1.0930 0.3672 1.0127 -1.2639 -1.0792 0.4088 -0.8665 0.4012 0.1707 -0.9134 0.3474 -0.9244 1.1545 0.6833 -0.9872 1.3714 0.7448 2.6285 -1.1479 -0.8412 -0.9058 1.1236 0.4658 2.1920 1.3697 1.5950 0.2395 -0.9858 -1.0042 0.6877 -1.2525 0.8726 1.1490 -1.0745 -1.3073 -1.2503 0.7351 -0.0990 1.3308 1.5803 -0.8864 -0.0670 0.7167 0.5963 -1.2366 0.4787 0.8425 1.3574 -0.6408 0.7104 1.1901 0.4231 1.2949 -1.2413 -1.1018 0.6518 0.8933 0.5644 0.0926 -1.2970 0.0361 1.1003 0.5256 0.5363 0.9425 0.8942 -1.2459 -1.1536 0.7863 -1.1992 0.5440 0.2748 -1.1245 0.5344 0.4662 -1.1194 2.7814 0.7320 -1.1266 0.5259 0.8899 0.0861 0.7848 1.7082 0.3890 0.5276 -1.0310 -0.0745 0.1554 0.6875 0.4627 1.1372 -0.1050 0.6991 1.6570 1.0130 0.3366 -0.8269 0.9995 0.2858 1.1518 0.8159 1.9208 -1.0348 0.6040 -0.1404 -0.4711 -0.1426 0.4947 -1.2413 1.5810 1.0144 0.2178 0.3646 -1.1703 1.5212 -0.0132 -0.1920 -1.0761 -1.1727 -1.0671 -0.1317 0.3184 0.2908 -1.1871 1.2318 0.6429 -1.2791 2.1197 0.1316 0.7546 -1.2043 2.0821 -0.2711 0.6866 0.2346 1.1672 -0.3738 -1.0431 -1.2133 1.6044 0.9933 -1.1139 0.5307 0.4090 -1.0939 -1.1214 0.9802 -0.0455 0.4012 0.3861 1.4604 1.1633 -0.0996 -1.1875 0.5564 -1.2454 0.0098 0.6212 -1.3925 -1.2570 -0.0579 -1.2700 -0.1250 1.3823 -1.2100 1.8946 -1.2563 2.3775 -0.5141 -1.1710 -0.4051 -1.1847 0.0085 1.5119 0.9593 -1.4312 0.1165 -0.2203 -0.0155 0.7796 -0.3801 1.4799 0.6748 -1.2909 0.1881 -1.3046 -1.3317 -0.9677 1.6286 0.9845 -1.0823 0.2525 -1.0296 -1.4902 -1.3002 -1.2543 0.5388 1.7928 0.4992 0.4154 0.1005 0.0186 0.4184 0.0569 0.5992 0.7714 1.1495 0.5201 -1.0278 -0.7212 1.0015 0.8552 0.6718 -1.3841 -1.1416 -0.1689 -1.1530 -1.3958 -1.1777 -1.0442 -1.2609 0.0684 -1.4337 2.0279 1.2769 0.6546 -1.4185 acetylcarnitine (C2) 1.3523 0.0913 2.6373 2.4267 -0.2790 2.5003 -0.2771 1.9054 1.4095 1.2497 1.2782 -0.6068 1.5607 1.3170 0.9758 -0.3404 2.6215 1.3949 -0.4506 -0.1867 0.0775 -1.6353 -1.2601 -1.2703 -1.5943 -0.2640 0.4690 -0.3176 -0.8314 0.5733 -0.5758 -0.9965 -0.9513 0.0994 1.7074 1.0972 -0.5390 -0.1494 -3.0503 2.0554 -0.9184 -1.7067 -0.2672 1.2455 0.4274 0.2261 0.3018 -0.0569 -3.4195 0.1329 -0.1428 -0.5837 0.1104 2.5517 -0.0750 0.1805 -1.2362 0.2184 0.3505 1.3308 -1.5891 0.3469 -2.3704 0.8058 -0.6432 -0.0375 0.3168 -0.2134 -0.7196 0.0080 1.9232 -0.9053 0.0502 -0.3800 1.4737 1.2457 -1.5491 -0.7713 -0.3359 0.5383 1.4152 0.9008 0.8776 -0.5888 -0.7237 -1.1069 -1.3169 1.8165 0.3519 -1.1885 0.0057 0.3956 -0.3646 -1.0275 0.4466 0.0487 -0.7451 -0.4919 -1.1269 -0.1302 -0.0468 -0.1407 0.2179 -0.0953 -2.0326 -0.5112 1.3322 0.4588 1.3319 0.9735 0.5638 0.9588 -0.4224 1.4246 0.2055 0.2009 -0.2358 -0.7727 1.9877 -0.1396 -0.3582 1.1129 -1.4797 -1.1604 0.4476 -0.5976 0.4602 0.6718 0.4970 -0.4461 -0.0470 -1.0276 -1.7625 -0.0654 -0.7511 -0.1094 -1.8783 -0.6331 -0.0789 -0.7556 2.0723 0.0376 0.1756 1.1120 -0.3336 -1.6847 -0.1366 -1.1532 -0.4620 -2.6224 -1.6245 0.1950 0.1486 0.0571 0.1370 -1.0238 3.1676 -0.6165 0.0922 0.6445 1.5696 -1.5662 -1.0137 0.4265 0.4756 -0.4812 -0.1316 -0.3002 -0.3638 -1.0994 0.2176 -0.3246 0.1333 -1.3204 -0.3715 1.2694 -0.6259 -0.4449 0.1017 -0.5234 1.0445 0.1719 -1.0394 -0.9693 -0.9745 0.5196 0.5834 -1.9206 -0.4280 -0.5759 0.1688 0.6567 -1.4159 0.7217 -0.5787 0.5776 -0.0673 -1.2855 -0.2125 1.0788 1.1697 -0.4140 0.9055 0.1627 -0.1357 -0.6282 -0.1444 -1.2140 0.5419 0.5577 -0.0379 -0.6148 -0.6875 -1.0720 0.2663 -0.4110 0.8963 -0.2769 0.1102 0.7066 1.5253 0.8708 -2.6331 0.7369 0.1340 0.4518 0.3055 0.4672 -0.5510 0.0129 0.1812 -1.8208 0.3347 0.7537 1.1629 0.7586 -0.7949 0.6592 0.1569 -0.1386 0.0608 -1.7878 1.5542 1.5056 0.0241 1.4586 0.4070 1.0129 0.0462 -0.5671 -0.0834 -1.0626 -0.1805 1.0875 0.7721 -0.5830 0.7782 0.3640 -0.0236 0.1041 0.8823 0.3077 0.6007 1.5017 -0.7011 0.2116 0.4453 -0.1156 0.5334 -0.3821 -0.1769 -0.5547 -0.9525 -0.0237 -0.7980 0.2064 1.8438 -0.9224 -0.3930 0.1691 -0.3382 -0.8550 0.1541 0.1922 2.1368 -1.3813 -0.2294 -0.7063 0.4431 -0.7103 0.9569 -0.4442 0.1195 -1.2067 0.4435 -0.3523 0.1102 -0.5249 0.6443 -0.8637 0.4272 0.3060 0.4631 0.0355 -0.4420 -0.5376 0.6156 0.0991 1.0540 0.6272 0.7885 -0.4769 -0.5894 -1.2140 0.7810 0.1458 -0.9846 -0.0919 -1.0928 -1.1289 -0.7306 1.9608 0.6267 -0.8179 0.0123 1.2515 -0.3291 0.3001 0.4124 0.3459 0.0829 -0.1083 -0.9562 0.7440 -1.4182 -0.2600 0.3659 0.2461 -2.7646 -0.2684 -0.1159 1.0534 -0.1453 -1.8382 -0.3615 0.6510 -2.7079 -1.2560 -0.9083 -0.1970 0.3358 0.5522 0.8054 1.2759 1.5462 -0.1482 1.4049 -1.0233 -0.9744 -0.0806 0.9019 -0.8817 -1.4041 0.2036 0.3927 0.5663 -1.5324 -0.5340 -0.3051 -0.4960 1.2521 1.2077 0.5721 1.6093 0.9556 0.1994 -0.2673 -0.5450 0.7103 0.1515 1.8539 -0.1937 -0.7506 1.1584 -1.0117 0.6753 -1.8686 -1.0819 0.6083 0.9720 -1.7381 0.7110 0.6771 1.0588 -0.6281 0.2544 -0.1735 -0.3287 -2.1363 -1.3110 0.4020 1.6231 0.5615 1.0167 0.1524 2.2034 1.5265 -0.3085 -2.4362 0.2987 aconitate [cis or trans] -0.6110 0.2333 -0.6370 -0.6425 -0.5159 -1.2339 0.7704 0.4096 0.7684 0.3822 1.2820 -0.8624 -0.0056 0.4318 0.4370 -1.1038 -0.3736 0.3564 -0.3669 -1.8848 -0.8241 -0.5967 -0.9792 -0.9175 -0.0904 -1.3172 -1.4691 -1.1546 -0.7204 -0.4854 -1.2736 -0.1015 2.0986 -0.7399 -1.5608 1.6642 -0.4777 0.7681 -0.8073 -1.2564 -1.0312 -0.7592 0.0540 -0.0302 -0.4494 0.1857 -0.4008 0.1081 -0.2648 -1.4335 -0.0541 -0.2602 -0.4774 0.2559 0.2731 -0.2502 -0.8304 -0.2778 0.2290 -0.4079 -0.0658 -1.3256 -1.3303 0.9225 -0.6952 0.0793 -0.4576 0.1768 -0.1932 -0.3170 -0.4300 -0.8277 0.5894 -0.1189 0.7731 0.4241 -0.7392 -1.6359 0.0646 0.2787 -1.0291 0.2637 -0.2456 -0.8029 0.2922 -1.1412 0.1293 0.6272 -1.1969 -1.3983 -0.8658 -0.7194 0.5741 -0.3528 -0.6527 -0.2176 -0.2443 -0.8063 -0.2586 0.7422 -0.5274 -0.8484 -1.5635 1.6182 -1.4118 -1.2579 0.5444 -0.4801 0.1746 -0.6453 -0.1072 0.4497 -0.1645 1.3713 2.0864 1.1082 0.0287 -0.3733 1.9803 -1.3210 -0.0400 -1.4172 0.3422 -0.1258 0.2814 0.6082 0.1146 0.3713 -1.0218 0.9263 -0.9477 0.7779 -1.4205 0.1615 -1.1886 -0.0357 -0.1206 0.0676 0.5391 -1.2969 0.2337 -0.4135 0.3055 -0.2444 0.3928 -2.1905 -0.0513 1.0861 -0.2070 -0.4437 0.2689 -0.5736 0.2032 0.1828 -0.5113 -0.2267 -0.2487 -0.5770 -0.5888 0.5910 0.8714 0.2817 0.2756 -0.6134 0.0320 0.7294 -2.4560 -0.2483 -1.4375 -0.8229 0.4379 -1.2823 0.7799 -0.3152 -0.7856 0.0083 0.1811 -1.1249 0.3598 -0.4370 1.8838 -0.4772 0.0366 -0.2529 0.0761 -0.9821 -0.7693 0.4644 -0.2690 0.1273 -0.7460 1.5049 0.1635 -0.3182 0.8834 -0.7259 -0.4652 -0.1169 0.9372 -0.2170 -0.1926 0.9852 -1.4292 -0.1045 1.0830 -0.2981 -0.1863 -0.5160 0.2864 0.2894 0.7343 1.6452 0.4305 0.6386 -1.1302 0.3120 0.9526 0.7861 0.0545 0.0966 0.3742 0.2823 0.0452 -0.8781 0.3857 -0.1976 0.5668 -1.7993 -0.1019 -1.5132 0.1386 -0.3516 0.7526 0.4267 0.8967 -0.3951 -0.2860 0.0684 -0.7801 1.0162 1.2585 0.0406 1.8182 1.6008 -0.3031 1.1207 -1.1109 -0.3508 0.3697 1.7176 0.9922 0.2280 0.4572 0.3020 0.6772 0.8028 -0.7587 0.4202 0.7312 -0.4674 -0.8725 0.3585 0.2829 0.2867 0.7777 -0.6773 -0.4493 0.9560 -0.0780 0.2057 -0.5010 0.4456 0.8910 1.2720 -1.3583 0.0230 -0.1225 -1.1021 -1.4351 -0.1800 -0.5883 -0.5815 -0.3188 0.9216 -1.1432 -0.2879 -0.7326 -0.2484 0.7593 0.2580 1.6854 -0.1029 -0.3393 0.8734 0.5196 -0.2111 0.7501 3.2187 0.0788 -0.9359 -0.9977 -0.1829 -0.2465 -1.0447 -0.0396 2.0171 1.4397 1.0304 -0.3263 -0.7573 0.1256 0.8308 -1.2650 -0.7547 0.3947 0.0076 0.7032 -0.5400 0.8612 0.8035 -0.8444 1.6259 -2.0818 1.7877 0.2563 -0.3443 1.5992 1.3791 0.2021 -0.0487 -0.4148 0.6893 -0.3332 0.4185 0.5056 -0.0793 2.4699 0.9528 -2.3154 -0.8546 1.2783 -0.9659 0.8800 -0.9100 0.5780 0.0476 0.8271 -1.3031 1.0407 -0.0415 -1.0886 7.1068 0.9139 -0.6417 -0.1766 0.0671 0.2488 -0.6616 0.2578 0.1846 0.8641 -0.4982 -0.4503 -0.3393 1.7571 1.7228 -0.4769 0.3842 -0.1765 -1.0771 0.6429 1.2377 0.5054 -0.2850 0.3897 1.1756 0.6227 -0.3885 0.0059 -0.3752 0.4584 0.0886 0.5217 0.5117 -0.1823 0.3315 -1.4684 -0.7326 0.4367 -0.9300 -0.6331 0.0676 8.3808 0.5555 0.7315 -0.9380 0.3873 0.5488 -1.3629 0.2034 -0.9464 0.7339 -0.9050 0.3298 0.2673 0.5100 0.7777 -0.1109 -0.9569 0.8426 adenine -1.0522 0.0914 -1.9740 -0.6633 1.6026 -2.0700 0.6583 -2.0808 -1.5577 -0.5866 -0.7304 0.3508 1.4929 0.1568 -1.0537 0.0341 -2.1987 0.5017 -0.0289 0.2996 0.4324 1.3854 0.5926 0.8056 0.8128 0.0049 0.0013 0.3420 -0.9364 -2.5362 0.6937 0.7429 1.1857 -0.2209 0.2946 -1.3035 0.2245 0.6606 0.6848 0.7560 1.2020 1.8455 0.9011 0.4454 1.2241 0.0111 0.1850 0.0508 0.3200 0.8132 0.7420 0.3135 0.6663 -3.1657 0.7974 -0.5595 0.7897 1.4907 1.8715 -0.6510 1.5892 0.3802 0.0705 -1.8710 0.6877 0.6160 -0.3569 0.5698 0.5616 0.2537 0.1798 0.7536 -1.4961 -0.7112 1.1137 -0.6833 1.7876 1.0065 0.5593 0.5124 0.9080 -1.1612 0.3554 0.4735 -1.8370 0.1128 0.3610 0.8056 0.2421 0.7176 0.3519 -0.2853 1.4660 0.1253 -1.5300 -0.0119 -0.9765 -0.4747 1.2067 -0.3809 -1.3273 -0.6577 0.4411 0.3629 1.6092 -1.0062 -1.1346 0.7498 0.3767 0.8302 -1.1619 -1.0978 0.7389 -1.5791 -1.4148 -0.8268 0.6500 -0.1860 -2.0787 0.3177 -0.7692 -0.6581 0.5737 0.0209 0.2927 -2.1229 0.8920 -0.1021 0.1093 -0.1045 -0.1537 -2.1851 -0.7546 0.3480 -1.7771 0.3412 0.8805 0.8939 0.0611 1.4727 -1.8900 0.5157 0.3134 -0.6061 -0.4991 0.7062 1.0164 -1.2002 1.0854 1.5903 1.2525 1.1127 1.1908 1.3628 0.6276 0.9013 -0.2013 -0.5027 0.0529 0.9874 -1.0469 0.0780 0.8589 0.7630 -1.3953 0.4357 0.4421 -0.3582 -0.5440 -0.1218 -0.8353 -0.2906 -0.8869 -2.9086 -0.9407 1.8278 0.7048 0.4978 0.7325 0.6947 0.6176 0.3728 1.0179 -0.9929 0.6412 -0.1928 -0.4496 0.4066 -0.4224 0.5860 -1.3714 -0.9203 0.7183 0.0822 0.8966 -0.7017 -0.2852 0.3894 0.0315 1.0077 -0.3346 0.8639 -1.5199 0.4102 -0.6898 1.0492 0.2845 1.7136 -0.1860 1.2048 -1.1711 0.6089 0.7790 1.1690 1.0415 -0.3873 -1.2209 -1.9659 -1.4669 -1.9024 -1.1456 -1.1781 0.8909 -1.4243 0.4474 0.3154 -2.2506 0.5700 0.8593 0.3825 -0.1098 1.1688 1.2678 0.8872 0.1307 -0.8771 -0.8967 0.7154 0.5812 -0.0866 -0.2087 -0.0002 -1.1025 0.5280 0.5608 -2.1513 0.1086 -0.4514 -1.9914 -1.1999 -0.2055 -0.5538 0.1650 0.1678 0.1686 0.6007 0.5185 -0.1315 0.6777 0.5543 0.6166 0.2968 -0.7770 -0.8286 0.4007 1.2922 -0.0988 -0.2663 -0.7645 0.4217 0.0530 0.7709 -0.2397 0.9054 -0.1681 -0.6898 1.2619 1.4247 0.6805 0.8698 0.6905 0.3315 0.1001 1.0624 0.7593 1.0092 0.5575 0.9633 -2.2761 0.6433 -0.0044 0.5710 0.3586 1.0349 -0.9278 0.1038 -2.3741 1.5869 0.4803 -0.5497 -1.5501 0.0243 0.6118 0.0673 0.3485 0.5665 -2.1834 1.1155 -0.3723 -0.3039 -0.2179 0.4759 -0.5407 -0.2046 0.7517 -1.0636 0.8454 0.9520 0.7007 -0.4506 0.8031 -2.0379 1.4423 0.5375 0.3845 -1.6431 0.3680 -1.0700 0.1028 0.1289 -0.4483 -0.6209 0.3083 -1.0669 1.5056 0.6628 -0.8274 0.2864 0.2371 -1.6912 0.5487 -0.2262 -0.8771 0.6164 -0.7112 0.0836 0.9958 2.1383 1.6800 0.3252 1.3390 0.7175 -1.5081 -0.8208 -0.9478 -0.6010 -0.0143 1.2542 -1.3945 -1.0464 -0.0090 0.7703 1.0923 0.5007 0.7853 -1.1708 1.0762 -0.0070 -1.2327 -0.8433 -1.9277 1.0258 1.1495 -1.4871 0.0991 -1.3889 0.2412 -0.8831 -2.5245 -0.0755 0.5038 0.9645 0.1797 -1.2597 1.1509 0.1159 0.6672 0.5531 0.2216 0.6735 1.3161 -0.6397 -0.6787 1.2322 -0.5701 0.4012 -0.3328 0.0527 0.1994 1.4086 -1.8419 -2.1013 -1.7551 -1.6909 -0.1425 -2.0827 -0.2231 0.8520 -0.4729 -3.1596 adipate 1.5033 0.3375 1.3686 0.4288 -1.4888 1.5155 -0.0849 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0.2244 0.3201 1.4543 1.7445 0.2198 0.9635 0.6595 0.4591 -0.9121 0.9204 1.2877 -0.3041 1.2104 1.4421 1.2193 0.0774 -0.0013 0.2738 1.6616 0.7695 0.6074 0.7149 -0.1219 1.1379 0.4327 0.3023 -0.8810 0.3901 0.7427 1.9929 1.1583 -0.1143 -0.6280 1.2800 -0.3074 -0.7463 -0.3366 -1.8155 0.7903 -0.5090 -1.5854 -0.1265 -1.4321 0.6321 -0.1231 -0.9255 2.4018 -0.2435 -0.1246 -0.1565 0.5983 -0.0647 1.2126 0.6655 0.0239 -0.0442 0.1917 0.2265 0.3872 -0.5681 alpha-hydroxyisocaproate 1.6722 -0.5360 1.7479 1.0933 -0.0288 2.0823 0.0591 1.9496 1.4241 2.3695 1.5609 -0.2659 -1.1375 0.9030 0.1178 -0.9003 1.9080 0.3851 0.0659 0.3309 -0.2726 -0.2746 -1.9399 -0.0155 -2.3541 0.2379 0.5573 0.4384 0.6453 1.0224 -0.9815 0.6461 -1.8691 -0.2354 -0.0582 1.6180 0.5018 0.7320 -0.7499 0.0753 -0.4845 -0.4012 0.0758 -0.3583 0.1744 1.0866 -0.3978 0.4406 -2.3661 -2.3632 0.8422 0.8825 -0.5641 2.3565 -0.1100 0.0967 0.0859 -1.9612 0.0827 0.3498 -0.5351 -0.3097 -0.5280 2.0674 -1.8555 -0.0764 0.8476 -1.3377 -0.7950 0.6215 1.2551 0.0955 0.5566 0.0192 -0.7559 0.4375 -2.1804 -1.5823 0.8965 0.3380 -0.1562 2.0228 0.0807 0.1914 0.4459 0.0558 -2.1972 0.0164 0.3887 0.2326 -0.1340 1.5843 -0.8393 0.1733 1.5667 0.5318 0.7341 0.0051 -0.0297 0.2487 0.0939 0.8700 0.0411 0.1163 -2.2703 1.1106 0.8290 -0.5131 -0.4811 0.9290 1.6303 0.2887 -2.1743 0.3247 0.3812 -0.5141 -1.6867 -0.6173 1.0162 -0.5369 1.7769 0.4876 -0.1584 -0.5232 -1.0152 1.8004 0.0894 0.7110 -0.1734 0.5983 1.6410 0.5606 1.1150 0.0537 0.1364 -2.5981 0.3214 -0.7192 0.1919 -1.8011 0.2958 -2.4796 -0.7125 0.8741 1.0141 -0.7237 -1.0489 1.9057 -0.7800 -1.2609 -0.1989 -0.6464 -0.5886 -0.8132 -0.7207 0.8348 1.5200 0.6574 1.2570 0.1239 1.8169 -0.7298 1.2467 -0.7316 0.4953 -0.2649 0.1152 0.1764 -0.5944 0.2896 0.4077 -2.4321 -0.3961 0.8368 -0.9502 0.3732 0.2560 -0.2193 -0.2768 -1.1082 0.8266 0.2649 0.5207 0.5849 0.1437 0.9943 0.8268 -0.0673 0.3671 0.1715 -0.5156 1.1016 -0.8308 0.7157 0.3239 0.3646 0.2640 -0.6318 0.3649 -0.0860 0.2162 -0.1135 1.9174 -0.4409 -0.4484 -0.8231 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0.9520 -0.4340 1.1300 -0.0312 0.1830 1.4200 -2.9300 0.5580 1.4600 0.3110 1.2500 0.7840 0.4840 1.3300 1.8000 -0.3510 -0.0377 -0.3800 1.1900 0.4150 -1.1300 1.1300 0.1680 1.1800 0.7490 0.7820 0.1140 -0.4870 0.7340 -1.0800 0.0468 -1.3300 -0.6570 -0.9500 0.5680 0.6340 0.6380 -0.4050 1.3800 0.8930 -0.3140 -0.9950 0.0182 -0.5060 0.6660 0.1180 0.1510 0.1090 -0.1580 -0.6740 -2.4700 0.6730 1.7200 -0.1400 -0.4310 -0.3370 -3.3300 0.7050 1.4400 0.2960 1.7300 -1.0200 0.2070 0.4540 -0.3000 -0.0590 0.9500 -1.6800 0.5610 0.3980 -1.4800 -0.0343 0.6480 0.9800 -0.1740 -0.4060 -1.6400 -1.2000 -0.4620 0.7410 -0.4430 0.8160 -0.0619 -0.2980 -1.4800 0.0290 0.3160 0.9640 -2.7800 -0.0000 0.6810 0.0115 1.1700 -0.6170 -1.1100 -0.1360 -1.1500 1.1300 0.9050 -0.2790 0.2230 -0.4950 -2.1200 0.0209 -0.2970 -1.7600 -0.1160 -1.1400 -0.5760 -0.8890 0.6610 -0.5000 0.4410 -0.4060 -0.8260 0.6410 0.6360 0.2880 -0.5910 -0.2950 -0.1930 -0.1480 -0.5150 0.3940 -0.0658 0.5100 -0.7570 0.8390 0.6620 0.1270 0.5480 -0.1070 0.7970 -1.1700 -0.4190 1.4800 0.1640 -0.9780 0.4650 0.4000 -0.4210 0.3790 -0.1530 0.3880 0.4630 -0.3050 1.3600 -0.3810 -0.0939 -0.6130 0.6820 0.5050 -0.8530 -1.3100 -1.7700 -0.2000 -1.9300 -0.1690 0.6240 0.0879 -0.1580 0.7090 -0.2280 0.2690 0.4150 -0.4900 0.2480 0.2350 -0.1820 0.1010 -0.3160 -1.2400 -0.4080 0.4790 -0.0819 -0.7360 -0.2560 -2.7300 -1.2100 -0.1910 0.1030 0.4120 0.2880 -0.3030 0.0279 -1.1000 -0.4720 0.2790 0.2020 1.2800 -0.2300 -0.6850 0.0637 1.0600 0.4540 -3.0700 -0.6570 -0.2350 -1.1500 -0.2590 -0.4460 -0.1780 0.1550 -0.8190 -0.7030 0.3910 1.1900 0.0397 0.5540 0.6530 6.9200 -1.0300 -0.4250 -1.5700 0.6040 0.4620 0.3780 -1.9200 -0.0698 -1.3900 -0.0840 1.5200 -1.5200 0.6980 -0.3410 -0.4030 0.8420 0.0420 -0.3690 0.8110 -1.0200 0.2720 0.1360 -0.0748 -2.5700 -0.4700 -0.5750 0.6160 -0.1350 -0.2980 -0.1570 0.2310 -0.8060 -0.7390 0.2650 -0.2790 1.5500 -1.2000 -0.1720 2.1500 0.2540 4.8700 0.7170 -1.2700 0.9270 -0.2870 -0.4080 -0.4260 0.6970 1.3000 0.7240 0.7360 -0.2410 -0.8060 -1.1300 0.1820 0.5330 -0.5520 -0.9740 androstenediol (3alpha_ 17alpha) monosulfate (2) 2.1155 1.3058 -0.0090 0.1093 1.2316 1.0627 -1.2131 0.5559 -1.0102 1.7255 -0.7186 -1.1260 -0.8546 -1.0070 0.6497 0.0496 1.0022 2.3363 -0.8785 -0.6446 -0.7182 -0.1285 -0.4674 1.8148 1.4385 -0.8974 -1.1749 1.8720 -0.7130 -0.9315 0.6816 1.7237 -0.4271 -1.2873 -1.3542 -0.9528 -0.8627 0.8699 0.6611 -0.0352 -0.5930 1.5233 1.0624 0.6987 0.9360 0.5386 0.8813 1.0846 -0.9009 -0.8807 2.3191 1.4723 -0.8298 0.1161 1.3672 -1.1421 0.4516 0.9008 0.7980 0.8846 0.5088 0.5268 -1.1186 0.6686 -0.3721 0.3458 0.6952 0.6157 0.3285 -0.7006 -0.9420 0.3063 -1.0107 -0.1560 0.9641 -1.1536 -0.7332 -0.0224 -0.7141 -0.9995 0.5585 2.0331 -0.9247 1.4122 -0.7909 0.7652 -0.7271 0.8315 2.5938 -0.5475 -0.0139 -0.8438 -0.8512 -0.4997 -0.8612 -0.8263 -0.8981 0.9330 -0.8446 -1.0960 1.2985 0.1537 0.5945 0.9466 -0.7866 -0.8071 -1.0061 0.1280 0.8435 0.5733 1.2819 0.4472 -0.7170 1.4425 -0.9371 0.3091 0.9421 -0.8498 0.6526 -0.1973 -0.1678 -0.8590 0.4220 -1.0074 -1.2422 -1.0331 0.0224 -1.0049 1.1349 -1.2474 -1.1152 1.6463 -0.5514 0.7544 -1.0026 -1.1388 -0.4789 -0.4983 1.7597 -0.3310 -0.6463 -1.0245 0.9802 -0.9728 -0.7578 0.5796 0.0406 -0.5062 0.1214 -0.7504 -0.6523 0.9152 -0.8070 1.0030 -1.0070 1.7108 2.5252 -0.6914 1.5574 -0.3958 -0.8912 -1.2681 -0.7307 -0.9304 -0.8336 1.2276 -1.1251 0.8361 -1.1332 -0.9383 0.9077 -0.9638 -1.3378 0.2005 -1.1598 -0.5754 -0.6635 -0.6732 -0.8592 0.6990 -0.8631 -1.3171 -1.0129 1.1442 0.9392 -0.5854 -0.1305 -0.8363 -0.6728 0.4450 0.7279 -0.6964 1.3310 -0.7330 -0.7148 1.8706 0.3030 -1.2820 0.0878 -0.5729 1.3671 -0.6947 0.4715 0.4128 0.5629 -0.5518 0.8372 -0.0437 0.4660 -0.9335 0.1303 -0.9598 0.3595 1.2724 -0.2482 0.5700 -1.2700 -1.2573 0.8480 -0.2443 -1.0233 0.4079 -0.6971 0.2829 -1.4000 -1.2993 -1.1750 -1.3294 0.5006 0.4647 0.2846 1.2711 -0.8916 -1.1020 0.2279 -0.2057 2.2119 -0.8428 -0.5856 -0.8065 -1.0289 0.3181 0.8312 1.0261 -1.1267 0.4303 1.7984 -1.2366 0.8080 1.6037 0.1974 0.3549 -1.1882 -1.0154 0.8198 -0.8926 1.9549 2.0911 -0.9225 -1.1947 1.4483 -0.7879 0.0510 -1.3403 1.1145 -0.5600 1.1822 0.0452 0.1057 1.4440 0.1929 -0.8633 0.0986 0.7378 0.3543 0.1074 -0.1308 0.7456 -1.1886 -0.6731 -1.2384 -1.1940 0.3659 1.2766 1.2067 0.3860 2.0821 -1.0047 -1.1704 -1.3225 0.9295 0.2451 -0.3397 -1.2302 -0.9395 -0.6010 -1.1019 -1.5203 -1.2957 -1.1521 -0.9431 -1.1609 0.4476 -1.1665 0.6897 0.3920 0.1126 1.2318 -1.1622 0.3346 1.0047 0.1965 -1.0648 1.2881 -0.4484 1.4527 0.8714 -1.0082 -0.8879 0.8259 1.8110 -0.6452 0.8221 0.5261 -1.0875 1.8054 1.4137 1.4282 1.5679 0.4648 0.9772 -0.8673 0.7853 -0.7351 0.7336 -1.3589 0.4134 1.0001 -1.2735 0.3338 1.5741 1.1432 -1.2284 0.9650 -1.1745 -0.8965 -0.7936 1.4147 1.6260 0.8559 -0.7173 -0.2513 0.6279 -0.5907 1.1491 0.5348 -0.2141 0.7564 -0.6639 -1.2755 -1.1445 -1.0972 -1.0238 -1.4616 -1.0884 -1.2492 -1.2676 0.9809 -1.2851 -1.3055 -0.8460 1.3549 1.1526 1.0041 -1.4777 -0.7392 -0.2082 0.1355 -0.6416 -1.1590 0.4484 0.2219 -1.4724 -0.3330 1.2944 2.3115 -1.5004 0.7164 0.4631 -0.4395 1.3108 -0.9889 2.1300 -0.2261 1.4351 -1.2577 0.8852 1.1685 0.6539 0.8487 0.6955 0.4274 -0.9123 -1.2222 -0.0804 -0.3550 0.8140 1.3362 -0.1527 -0.0346 androstenediol (3alpha_ 17alpha) monosulfate (3) 1.7422 -0.0659 2.1696 -0.4998 -0.0859 0.6275 -0.7605 0.0984 -0.5149 0.7803 -0.2914 -1.0443 -1.7807 0.0840 -0.8484 -0.7187 -1.0496 -0.9898 0.7904 0.2179 0.0199 0.0654 -0.3327 0.5499 0.6370 0.5611 0.1031 -0.4099 -1.2093 0.2786 0.8465 0.8493 0.7188 0.2064 0.6031 0.2814 -1.0005 1.2911 -0.5480 1.8075 0.1883 1.4394 -0.2200 -0.6113 -0.7623 0.5224 0.6993 -0.5245 0.5237 0.7372 0.9552 1.0465 0.3428 0.4689 -0.2738 0.8151 0.2505 1.5144 -0.8628 -0.7480 0.6189 -0.2171 -1.0959 1.9087 0.9175 1.3534 -1.4373 -0.9098 0.9226 0.5828 0.2018 0.7414 -0.1908 0.7003 0.0876 1.3800 1.1108 0.5144 -1.4432 -0.0938 0.5443 1.3262 -0.0023 -0.5696 1.0689 0.1389 1.4653 -1.1355 0.5747 -0.4367 -0.2128 0.3364 1.7681 -0.1642 -0.8835 -1.1529 -0.4913 1.4061 -0.3685 -1.1815 1.7297 -0.1076 -0.3590 0.4542 -3.8351 0.8544 -1.7741 0.1849 -1.1113 -2.4286 -0.5074 0.3506 0.5413 0.0106 -0.1187 0.4694 -0.9901 1.1013 -0.6367 0.8284 1.1924 1.1045 0.2158 -0.2321 -1.1506 0.1762 -0.3959 -0.1752 -2.8827 0.6615 0.2832 0.8905 0.0054 0.5582 0.1363 0.6398 0.5835 -0.3163 1.4576 0.5701 -1.1609 -1.6465 -0.2468 -2.0886 -0.2195 0.9611 1.3175 -0.1068 0.3544 0.6004 -0.8752 -0.5007 -0.1986 1.2933 -1.4264 1.5872 -1.2026 0.0897 -0.6825 -0.5750 -0.9875 0.8861 -1.1440 -0.7009 0.4143 0.1248 0.5449 1.6119 0.3561 -0.5762 0.8336 0.2461 -0.3762 0.3836 -0.5037 -2.7892 -0.1666 0.1741 -1.4141 0.5534 -0.8120 -0.3362 1.3983 0.7507 0.7907 0.0542 0.3373 0.4095 0.5365 0.8993 0.1258 0.6876 1.3629 -0.0165 -0.2373 -0.1366 1.1988 -0.2272 1.2800 -0.2477 0.8434 0.1940 0.9219 1.2218 -1.7955 0.7973 1.1760 -0.8939 2.0646 0.5535 -0.7209 0.3125 0.2354 -0.4988 0.8183 -0.4461 1.0245 -0.3581 0.5421 -0.4278 -0.5804 1.4332 -0.6174 -3.4140 0.2383 -0.0042 -2.0357 -2.7278 0.4353 -0.2960 -0.0883 0.8942 0.5629 -1.7599 0.9006 -0.3876 -1.8678 1.5227 0.9641 -2.3702 0.1970 1.1344 -1.6091 1.1709 0.6232 0.1469 0.2269 -1.1098 0.8394 0.4865 0.2574 1.1761 -1.1561 -0.7985 -1.0529 0.9617 1.3381 1.1879 0.0244 -0.6642 -0.6319 -0.1542 0.3218 -2.4587 1.1143 0.2864 0.4716 -1.1309 0.3889 0.3120 0.5145 0.2691 1.1053 -0.8267 -1.3502 0.4227 0.7674 0.2805 0.8614 0.1237 0.3961 -0.5715 0.3210 -0.7764 -0.0619 0.0054 2.6239 -0.7979 0.5742 -1.3834 0.7061 -0.6957 -0.4878 -1.4735 -0.2587 -0.6342 -0.1817 0.1218 -3.9449 0.2963 -0.0083 -0.2094 -1.5322 0.4459 -0.2926 -0.3738 0.5459 -1.1300 0.4300 0.2867 0.5302 -1.0760 0.1373 0.0419 -0.8527 0.7024 -0.9092 0.4794 0.2770 0.0609 1.0699 0.3760 0.5023 0.8858 -0.3142 -0.3979 0.0272 0.4385 -1.4161 -0.7065 1.4335 -3.9141 0.2513 -0.6542 0.3220 -4.4799 -0.7193 0.6029 -0.2382 0.4278 0.9593 -0.0175 -2.8068 -0.0663 0.4657 -0.5006 0.9246 0.3577 0.6967 1.0995 0.3115 -0.7178 -1.2023 -0.0356 -1.4793 2.0943 -0.6480 -0.8326 -0.0435 -0.4431 -0.5765 0.5721 0.1180 -0.7115 0.7949 -1.1028 0.6634 1.3079 1.0031 -0.0786 0.1895 0.0565 0.4008 -0.9740 -0.3696 -0.0086 -0.5885 -0.7630 -1.1461 -0.2297 -0.5964 -0.8991 -0.7781 -0.6744 0.2124 0.7049 -0.8190 1.2377 0.5636 -0.6397 1.0935 -0.4107 2.0963 0.0604 0.7963 -0.8682 -0.6869 1.5066 1.3590 -0.0502 -1.5193 0.3637 -0.5810 -0.3265 0.1025 -0.0021 -0.1234 1.2629 0.5301 0.2480 androstenediol (3beta_17beta) disulfate (1) 2.3912 -0.0068 2.4090 -0.1599 0.1676 1.6016 -1.3429 -0.4214 0.4215 1.1583 -1.0662 -1.8219 -1.5065 1.8206 -0.2948 0.4860 -0.9750 1.0052 -0.3008 -0.3723 -0.0332 -0.6937 -2.4810 -0.2248 -0.3199 -0.2656 -0.9013 0.2279 -0.8586 -0.3560 0.2988 0.0964 0.2075 0.9131 0.8589 -1.5838 -3.4486 0.1271 0.0975 1.7638 -0.9978 0.0601 -0.7905 0.7216 -1.9152 0.4841 0.2512 -0.6365 -0.8238 1.8627 0.0018 0.5340 0.0902 0.0041 -0.2576 -0.9118 0.2149 -0.7495 -0.4341 -0.0416 -0.4189 -0.6107 0.2875 0.4268 0.5915 0.3274 -0.1335 -0.6708 0.4274 0.6446 0.1563 0.7985 -0.2635 0.8430 0.3410 1.9259 1.1516 1.5588 0.0729 -0.1352 -0.0646 0.0183 -0.5837 0.2000 0.5070 0.0809 0.5322 1.4046 1.1395 -0.4433 -0.8875 -0.0135 0.9706 0.0722 -0.6488 -2.7909 -0.7036 -0.6928 -1.3185 -0.6269 0.1182 -0.9028 -1.2629 0.6699 -4.4782 -1.2666 -1.7975 -1.6603 0.2125 -1.6214 -0.5648 0.7515 0.3694 -1.5635 -0.2570 -1.9437 -0.2364 0.3236 1.4223 0.7374 1.0991 0.6394 -0.0659 -0.9252 -0.5630 -0.5483 -0.2391 -0.1321 -1.3745 0.8013 -1.0748 -0.6184 0.0185 1.8078 -1.3603 -0.6830 -0.6595 -0.6743 -0.0282 0.0887 -0.5711 -0.7246 0.1339 -0.6732 -1.2546 -1.4267 0.3765 -0.6021 0.4123 -0.2279 -1.4595 -0.4441 0.5737 1.3793 -0.6661 1.0420 -0.0617 0.6648 1.2054 0.2513 0.4642 -0.1624 -1.5313 -0.7472 -0.5521 -0.4443 -0.8468 1.3914 0.6585 -1.3944 2.5830 0.6012 -0.6129 -1.4826 -0.7224 -1.3737 -1.3064 -1.1408 -2.9567 0.8505 0.6733 -0.5259 0.1411 1.3259 -0.0354 -1.0806 1.2372 0.2043 0.3063 -0.0432 0.1743 0.5745 -0.2739 -0.3258 -1.1006 0.5013 0.1600 -0.1126 -0.1793 -0.6401 1.2737 -0.8456 1.9223 1.2464 -2.4891 1.1611 -0.0372 -0.8799 1.2963 0.9928 -0.0788 0.1013 -0.1634 -0.2887 0.5480 -0.7538 1.5601 -0.2958 0.3324 0.0548 -0.3759 1.3959 -1.8480 -0.3297 0.2594 -0.0261 -1.3970 -2.4221 -0.2780 -1.1958 0.7046 -0.3360 -0.2036 -1.2471 0.7613 -0.2599 -1.4644 1.0172 -0.5329 -1.3299 -0.3080 0.4230 0.5242 2.9086 1.2157 0.6199 1.6321 -0.5090 0.4731 0.9353 -0.4670 0.5379 -1.0987 -1.1485 -0.7158 -0.8646 1.2245 0.1855 -0.5831 -0.8046 0.5921 -0.4737 0.2009 -0.0632 0.6084 -0.0129 0.1408 -0.4976 -0.0903 0.3982 1.0212 -1.0459 -0.9805 -0.6612 -0.7716 0.1125 0.2320 -0.9942 -0.0477 2.2968 -0.0526 -0.1572 0.5731 -1.3970 0.2637 1.3312 0.6635 0.1408 0.9126 -0.8977 1.1022 0.2679 -0.7434 -0.1660 0.6675 -0.2617 -1.8797 1.3610 -3.7703 -1.2597 -0.2433 0.5574 0.4945 0.5678 -0.3911 -0.0524 0.5841 0.4374 0.2792 0.7376 1.3698 1.4079 1.5470 0.3227 -1.5623 -0.6206 -0.0031 -1.4009 0.8548 -1.0797 1.1055 0.6110 1.4424 0.7697 -0.2111 0.5819 -0.8296 -0.3344 -0.1660 0.2647 0.5872 -0.1309 0.3747 -1.1656 -0.5171 -0.3549 -0.7390 1.4887 0.1210 0.3360 1.3683 0.7319 -1.7341 0.0665 0.7131 0.4597 -1.4901 1.1371 1.5503 1.5362 -1.2034 -0.2360 0.0077 1.0885 0.0258 0.8825 0.9576 1.1119 -0.7863 -1.8944 0.9051 0.2809 -0.1074 -0.9107 0.9963 0.6329 1.7875 0.5670 0.0593 0.7620 0.3100 1.3454 0.5099 0.3062 0.6274 0.0232 0.0113 -0.6298 -0.2870 -0.0423 -0.4903 -0.4183 -1.5611 0.7216 0.9832 1.7867 0.2889 0.6661 0.9575 0.2123 -0.3965 -0.3678 0.9651 1.3081 1.1376 0.7374 1.0186 0.7715 0.9005 0.1903 0.1666 0.5414 -0.7205 -0.1109 0.6886 0.1377 1.7387 2.7008 0.6016 0.4763 androstenediol (3beta_17beta) disulfate (2) 1.0932 0.9211 0.9669 -0.7266 -0.3540 0.8326 -2.3629 -0.0664 -0.4098 1.3810 -1.6044 -2.3559 -1.5341 0.1926 -1.0395 0.3077 -0.0737 0.4018 -0.5648 -1.3534 -1.3012 -0.5829 -2.2559 0.8985 0.2808 -0.4439 -1.2748 -0.2867 -0.8903 -1.2050 0.5421 0.4253 -0.0850 0.0391 -0.5039 -1.7709 -1.2247 -0.6511 0.3044 0.8159 -1.2646 0.3959 -0.1880 0.3365 -0.7579 0.2089 0.0402 -0.3346 -0.7191 -0.5407 0.3878 -0.0900 -0.0589 -0.2277 -0.1567 -0.8528 0.2222 -1.0344 -0.8060 0.5287 -1.8910 -0.5649 -0.5381 0.3389 0.2405 0.2500 -0.3544 -0.1505 -0.1370 0.1578 -0.3084 0.7406 -0.6651 0.5130 0.3540 -0.0238 0.2645 1.1399 -1.5905 -1.3280 -0.0134 0.2084 -0.7883 0.8964 -0.6841 0.2657 0.2212 0.0277 1.1345 -1.2201 -0.9530 -0.7600 0.0446 -0.2979 -1.6926 -2.1669 -0.7120 -0.7083 -1.0737 -0.7124 0.8047 -0.4491 -1.0313 0.6672 -3.2825 -2.2697 -0.7587 -1.1376 0.2347 -0.5063 0.1007 1.1431 -0.3902 -0.3489 -0.7745 -1.8148 -0.1674 0.0782 1.1129 0.2876 0.1982 -0.6299 0.1121 -1.2394 -0.4943 -0.7653 -0.2703 -0.6379 -0.5562 0.1730 -1.2852 0.2533 0.8165 0.8641 -1.9294 -0.6996 -1.0225 -0.9240 0.9639 -0.7660 -0.4188 -0.7104 0.5236 -1.4776 -0.5154 -0.9488 0.1282 -0.4971 0.1153 0.1871 -1.9971 0.0796 0.4149 1.3991 -0.9328 0.9336 0.9513 -0.5209 1.6967 -0.8664 0.1969 -0.8759 -2.9003 -1.5967 -1.1702 0.4047 -1.1121 1.3821 0.1645 -1.4155 1.4166 -0.6855 -1.7205 -1.0018 0.0096 -0.5438 -0.9432 -1.3877 -2.6909 0.4331 -0.7271 -0.9734 -0.1547 1.2022 0.1371 -0.8965 0.8487 1.0540 0.0018 0.0583 0.4361 0.3531 0.0646 -0.5803 -1.2590 0.8722 0.6059 -0.8140 0.2279 -0.5626 0.8926 -1.2587 0.4947 0.7207 -1.2166 1.1302 -0.0346 -1.5602 0.2435 -0.5332 -0.1274 -0.0757 0.0040 0.7818 0.5882 -1.2815 0.6749 -1.5045 0.7184 0.2033 -1.0676 1.2106 -2.5698 -0.2248 0.2790 -0.3186 -1.6779 -2.2824 -0.2312 -0.8529 0.0414 0.2309 -0.6961 -0.5769 0.8831 -0.2806 0.3205 1.0184 -0.9236 -1.0162 -0.6266 0.1188 0.5038 0.7738 -0.0237 0.6883 0.9283 -0.8388 0.3786 0.8611 0.0750 0.5896 -1.2852 -0.7418 0.0637 -1.2091 2.0245 1.1647 -1.3658 -0.9619 0.0383 -1.4275 0.8040 -0.5161 1.3983 -0.5015 0.6470 0.0735 0.5465 1.0308 0.5014 -1.7342 -0.8745 0.2965 -0.8952 1.0397 0.3616 -0.3925 0.0760 0.2086 0.0354 -0.3466 0.6634 0.5471 1.2081 1.3063 1.6041 -0.5009 0.7208 -0.6171 1.2555 0.2008 -0.0785 1.0278 1.1273 -0.9033 -1.9948 0.5233 -3.5692 -1.3145 -0.3772 -0.2494 0.3459 0.3788 0.2463 0.1379 0.9195 1.1569 0.0852 0.4541 1.5565 1.5551 0.7342 0.8604 0.4248 0.8593 0.6987 -1.0059 -0.1016 0.1391 1.4521 0.9623 1.3506 1.1849 -0.2887 1.6974 1.1325 0.7944 1.0344 0.8797 1.0134 0.4321 0.2392 -0.8080 0.1067 -1.5958 -0.4055 1.0990 -0.3845 0.5216 1.5444 1.4412 -1.0617 1.1787 0.3219 0.1000 1.0627 1.3160 1.6925 1.3877 -1.2918 0.3423 0.0582 1.2703 1.0655 0.9890 1.4876 1.7735 0.3076 -1.3401 0.5232 0.1792 0.2364 -0.8541 0.8919 1.1761 1.5573 1.2775 0.5566 0.8273 -0.1138 2.6242 1.5662 0.6587 0.1569 0.0034 0.7468 0.3311 0.4107 -0.9661 0.5653 0.3680 -1.0531 1.0767 1.2637 2.4670 1.1666 1.5741 2.0227 0.8377 0.4148 0.5618 1.4110 1.3917 1.6069 0.2299 2.0077 0.9851 0.9701 1.5914 1.2929 0.9395 -0.7712 0.5537 0.8105 0.2550 1.1509 2.8574 0.0749 -0.2069 androstenediol (3beta_17beta) monosulfate (1) 2.7179 0.6210 2.7523 1.4153 1.2593 2.2502 0.5102 0.6652 0.4856 1.7656 -0.2366 -1.8740 -2.0081 1.3168 -0.0117 0.1738 0.4048 1.1965 0.2312 0.5294 0.3716 0.2635 -1.6511 1.3334 0.9075 -0.1956 0.0819 0.9760 -1.8701 0.3549 0.2116 1.7056 0.1454 0.9055 0.6639 -0.2413 -1.3398 1.2199 1.0840 1.4150 -0.1331 1.2562 0.7317 0.8608 -0.1437 0.4789 1.3664 0.5131 -0.9332 2.1931 1.5438 1.0601 0.0256 0.3323 0.9458 0.1069 0.5133 0.4383 0.5864 0.1455 1.2860 0.2924 0.1249 0.8156 1.0271 0.1715 0.5063 0.1309 0.2856 0.4152 0.1032 1.1072 0.6899 0.4550 0.3215 0.3864 1.4098 1.3586 0.4306 -0.5507 0.9102 1.7584 0.5683 0.5742 0.6720 0.4143 0.5373 0.5894 1.6993 -0.0473 -0.6751 0.4475 0.6097 0.4423 0.4462 -0.6797 0.1017 -0.3038 -0.8543 -0.5304 0.7996 -0.2882 0.2025 1.2012 -1.9467 -0.8679 -2.1480 -0.5599 -0.5524 -1.1715 0.4654 0.6184 0.6084 0.7035 0.6529 0.1159 0.5380 0.8194 1.0282 0.6102 0.9445 0.5671 0.3212 -0.5448 -0.5445 -0.2190 0.2549 -0.4913 0.1386 0.2775 0.4372 0.6887 0.2658 1.4114 -0.3027 -0.1795 -0.4108 -0.2289 0.7806 0.4901 -0.4858 -2.1578 0.8967 0.0682 -1.1306 -0.6437 0.5358 -0.0660 0.4119 -0.2387 -0.1071 0.5714 0.6249 1.3323 -0.0108 1.9265 1.7918 0.8707 1.1472 0.1562 0.7132 -0.1202 -1.8877 0.0866 -0.3331 0.3749 -0.1132 0.5574 0.4753 -0.8156 1.6675 1.0535 -0.8810 -0.2396 -2.2928 -1.7411 -0.4112 0.0686 -2.0046 1.2023 0.8925 -0.7474 0.9012 0.9437 0.8281 -1.5131 1.3078 0.0473 0.0802 0.5866 0.2674 1.1201 0.5061 -1.8986 -1.8715 1.3072 0.4541 0.2099 -0.1212 -0.8434 1.7022 -0.5315 0.7771 1.4047 -1.4946 1.2242 -0.0158 -0.5826 1.4855 0.7238 -0.8656 -0.2105 -0.4155 0.3868 0.3248 0.1633 1.1536 -0.6515 0.5401 0.1693 -0.4593 0.8924 -0.8476 -0.9362 -0.2068 -1.0228 -0.8356 -2.4368 0.5258 0.0262 0.1204 -0.0480 -0.1663 -1.8150 0.1706 0.4788 -0.2420 -1.0286 -0.5808 -1.0149 -2.1659 0.5366 0.3340 2.6519 0.5405 0.5609 0.9658 -1.6063 0.5118 0.5949 -2.2014 1.0097 -1.6608 -1.0593 -0.1188 -1.1944 0.8234 1.0322 0.1354 -0.7321 0.2540 -0.4808 0.3727 -0.7306 0.4761 -0.7012 1.0544 -0.2862 -0.1313 0.1025 -0.6533 -2.0096 -0.6980 -0.4107 0.3121 -0.7278 0.3654 -0.4514 -0.1927 -0.3814 0.4837 -0.6853 0.3849 -0.5405 0.7582 0.8613 -0.0176 0.6859 -0.6286 -1.4926 0.1679 0.3523 -0.3862 -1.4935 -0.3804 -0.6566 -2.2348 0.2636 -2.4221 -0.5332 -1.3949 -0.2694 0.7308 0.0933 -0.1160 0.5384 -0.2251 0.0589 -0.9654 0.2386 0.7853 -0.2213 0.3688 0.6088 -2.4515 -0.1883 -0.0498 -0.4288 0.1854 -1.1596 0.9692 0.2837 1.3781 -0.4272 -0.6224 0.5669 -0.9877 0.2297 -0.0722 -0.4309 1.0523 -0.8491 -0.5383 -1.1829 -0.2502 -2.4674 -0.7134 1.3071 -0.7575 0.0956 1.3074 0.2899 -2.3507 -0.0949 0.1052 0.2806 -1.9456 1.2598 0.6320 1.0745 -0.8593 -0.2130 -0.0401 -0.5403 -0.8030 0.0613 -1.4239 0.5586 -1.3845 -2.3995 -0.4806 -0.5952 0.7241 -2.5568 -0.6137 0.2820 -0.2550 -0.4755 -2.4045 -1.1039 -1.2682 0.1602 0.3651 0.6433 -0.7171 0.2711 -0.7779 -2.3752 -2.3260 -2.2833 -1.0404 -0.0096 -1.6465 -1.2824 -0.1320 0.7445 -2.5996 -2.2341 -0.3168 -0.8393 0.8538 -0.2975 1.1548 -0.2872 0.8673 -2.3792 -0.5030 0.3874 0.8063 -0.2186 -0.6904 0.2524 0.6059 -2.3468 0.3673 -0.0577 1.3455 0.9979 -0.6178 -1.3579 andro steroid monosulfate C19H28O6S (1)* 0.2662 1.2246 -0.5168 -1.1887 0.4774 0.2182 -2.8684 -0.6436 -0.2506 0.9814 -0.9479 -0.6027 0.2975 0.5570 -0.5397 0.5236 0.1099 1.0309 -0.8599 -2.7094 -0.5350 -0.5319 -2.5162 0.4145 -0.1929 -0.3724 -0.9573 0.4391 -0.9892 -0.3473 0.1958 -0.1249 -0.2004 0.3965 0.4462 -3.0434 -0.3673 -0.7534 -0.7528 0.0740 -2.6521 -2.3600 -0.1662 1.0005 -1.1091 -0.8059 -0.8944 0.1755 -0.8220 -2.9665 -0.9564 0.0926 -1.4138 -0.8146 -0.3367 -0.7953 -0.7231 -2.5645 -2.3455 0.6663 -0.7042 0.4050 -0.8365 -0.2653 0.1222 -1.0010 0.4436 -0.2671 -1.1989 0.1370 -0.2562 1.1658 -3.1068 -0.2363 -0.0860 -0.6457 -0.4600 0.2611 -0.5927 -0.7364 -0.8456 -0.8091 -0.6551 0.4925 -0.5668 0.1173 0.8286 0.2502 0.8839 -0.0612 -0.3803 -0.6509 -0.5461 -0.0374 -1.0897 -0.8631 -0.2180 -2.9452 -1.0533 0.1069 -1.0390 0.6320 -0.2847 -0.2315 -2.8642 -2.8865 -0.5658 -0.5138 0.5933 0.4270 1.1958 0.2582 -0.7440 0.0121 -0.8978 -1.7905 0.9704 0.6351 1.6761 0.4539 0.4732 -2.9431 -0.0532 -0.8583 -0.5791 0.2049 0.0167 -0.6863 0.9312 0.2887 -0.5279 -0.3192 0.7877 1.2020 -1.8817 -0.7764 -1.1099 -1.0978 -0.4642 -2.3677 -0.0758 -0.4125 -0.0105 -1.4397 -0.1303 -1.3699 0.7597 0.6796 -0.2440 -0.2479 -1.2167 -0.0813 1.4915 0.0435 0.5180 0.7325 1.4282 -0.9252 1.8285 -0.6072 0.5072 -1.7209 -1.5038 -1.5209 0.3735 0.0975 -1.1116 -0.1296 -0.3614 -1.3028 0.4590 -0.1448 -1.0654 -0.3068 0.4624 0.0920 -2.7278 -0.8602 -1.0515 -0.4177 -0.3635 -1.4157 -0.0112 0.9499 -0.4028 -2.4520 0.3745 0.3634 -0.8194 -0.5891 0.0673 -0.1780 0.0533 0.1774 -1.2439 1.0246 0.7335 0.3876 0.2110 -0.2750 0.0424 -0.2403 0.2227 0.3547 -0.2428 0.5838 -3.1165 -2.0541 -1.4277 -0.4840 0.7611 -0.4089 -1.3730 0.4391 0.7261 -0.4719 -0.2368 -0.2136 0.2731 -1.1280 -0.6691 0.2739 -0.5481 0.6714 -0.0864 0.3604 0.3642 -1.3408 -0.5966 -0.9634 -0.1570 -0.2903 -0.6626 -0.5813 0.0399 -0.3029 0.7299 -0.0467 -0.2129 0.2903 -0.0320 -0.1166 0.8457 0.4292 -0.0277 0.5628 1.1898 -0.5472 -0.0713 0.2394 -0.2338 -0.3578 -0.6692 0.3705 0.4284 -0.7973 1.6851 0.5037 -0.0833 -0.6017 0.7811 -1.3814 -0.5382 0.2021 0.9385 -0.3432 1.0342 0.1993 -0.0594 1.4603 0.2428 -0.9272 -1.6210 0.0161 0.2214 0.9540 0.4949 0.0339 -0.2750 -1.3809 -0.2409 0.3001 0.3343 0.4059 0.8672 1.6396 0.6901 -1.0127 0.0839 -0.3305 0.7193 0.3888 0.5296 0.7803 1.0497 -0.0658 0.1907 0.2933 -0.3305 -0.2638 -0.2718 0.4620 1.4639 0.1672 0.3526 0.7850 0.5011 1.3841 1.0379 0.6225 1.3151 1.3027 0.8997 1.6792 -1.0967 0.5936 1.3520 -1.3339 -1.0387 -0.0715 0.8190 0.6858 0.9989 0.3796 0.3746 0.9919 0.6123 0.8767 1.8645 0.8172 -0.4660 1.3954 -0.1247 0.4655 0.2494 0.4665 0.5823 0.3022 0.1077 0.6797 1.4092 1.4069 -0.1784 0.3749 0.9505 1.1553 0.7138 0.9960 1.7825 0.5226 -0.5669 -0.1182 0.3907 0.9568 0.9882 0.0838 1.4950 1.3561 0.3935 -1.6349 1.2459 0.8077 0.6704 0.9171 0.2706 0.9202 1.7287 1.4583 1.2197 0.7467 0.5356 2.9434 1.1861 0.8740 0.1231 1.1459 1.0783 0.2714 0.7555 -0.8478 1.6159 1.6749 -0.0048 0.9362 1.4693 1.7194 1.2159 1.8438 1.4677 0.9281 0.6011 -0.2076 1.3414 1.0230 1.3226 0.9553 1.6534 0.3309 1.1141 1.2289 1.5043 1.2626 0.0025 1.3319 0.7902 0.2858 0.5195 1.6239 0.4605 0.6982 androsterone glucuronide 1.8400 0.9618 0.8778 1.1907 0.4942 1.4298 -0.4665 0.8451 -0.3747 0.6927 0.2465 -1.0642 -2.4570 1.2359 -0.2221 0.1303 0.3158 0.4709 -0.2217 -0.8737 -0.6587 -0.5846 -1.1835 1.5392 1.4156 1.1945 0.0120 0.9541 -0.6934 -0.1090 0.8724 1.5967 0.2741 -0.3978 -0.5704 -0.9464 1.1069 1.5603 0.6861 -0.7158 -0.7088 1.6861 0.6230 -0.0334 1.0953 -0.1783 1.8626 0.1404 0.5513 -0.2757 1.5415 0.5692 0.0116 -0.0258 0.7094 -0.2896 0.8724 0.4562 0.5389 -0.3801 0.0720 0.4955 -0.8803 0.7341 0.6610 0.9833 0.0625 0.3424 0.0390 -0.6027 -0.4597 -0.0296 0.1263 -0.1566 0.3641 -0.5280 0.0596 0.3098 -1.9357 -0.9823 0.2772 1.2284 0.0088 0.6727 0.2921 0.4046 0.1140 -0.4673 1.1196 -0.7175 0.3178 -0.5402 0.2554 1.0158 -0.5014 0.3365 0.2311 0.8123 -0.5073 -0.6168 0.8926 1.5158 0.7651 1.0497 -0.7729 -0.4066 -2.6001 -0.2891 0.5473 1.0631 0.4041 0.1283 -0.5746 1.1525 -0.6204 0.1327 0.9373 0.0478 -0.5062 0.2153 0.2182 -2.4615 -0.0865 0.0547 -0.4314 -0.2305 0.5912 -0.5202 0.2695 -0.9517 0.2121 1.2111 0.9657 1.0235 -2.5960 0.6108 -0.7680 -0.4827 1.4521 -0.1416 -2.2620 -0.4923 -0.2329 -1.2049 -2.3666 1.2131 0.0040 0.5271 0.2119 -0.3830 0.6959 1.7451 -0.3433 0.9108 0.3810 1.0857 1.5484 0.1940 1.5435 -0.2804 0.9886 -1.3701 -0.8547 -0.2493 0.1223 0.9248 0.8239 -0.0948 -0.3856 0.0053 0.5268 0.5822 -0.2674 0.8951 -0.1164 -2.1911 0.5040 -0.4624 -1.3327 0.2670 -0.0328 -2.8911 -0.2428 1.2755 -0.0366 0.8204 0.4307 0.3572 0.3553 1.6256 -0.4419 0.5982 0.2892 -1.2066 -0.5948 0.9157 -0.3477 -0.8166 0.0183 0.6176 1.0469 -2.3036 -0.9930 0.4126 0.6172 -2.1689 1.7745 -1.6911 0.6636 0.5815 -0.4131 0.2948 0.6307 0.6438 0.5865 0.6071 0.2646 -0.3367 0.2456 -1.0604 -0.4797 0.1905 -1.0845 -0.9091 -0.6591 -0.7846 -0.9517 -2.9029 -0.4834 0.6615 -0.5575 1.3408 -0.9763 -2.6878 0.5974 0.1483 1.9544 0.3423 -0.8671 -1.0161 -0.8911 -0.1409 0.4169 0.7272 -0.4113 0.3216 0.3668 -0.5587 -0.2020 0.7116 -0.2633 0.0571 -2.7700 -2.6081 -0.5419 0.4720 1.2245 1.9724 -0.7051 -0.6795 0.4376 -1.0166 0.4394 -1.0225 0.6493 -2.1777 1.8177 0.9171 -0.2401 2.2049 -1.1884 -0.7523 -0.1579 0.2903 0.8123 0.8685 -0.0678 -0.3084 -0.5076 -0.5701 -0.9653 -0.0212 -0.4941 1.3662 0.5447 0.4464 2.4210 0.3624 -0.8969 -1.2057 0.7604 0.0804 0.0920 -0.6958 -2.5362 -0.6595 -1.9072 0.6608 -2.8752 -1.2368 -0.5691 -1.1568 0.2782 -2.7513 0.2358 0.1382 -0.9638 1.0851 -0.8540 -0.0050 0.5871 0.0717 -0.7079 1.4250 0.1540 1.6885 -0.2843 0.2275 -0.0339 1.2397 0.6184 -0.3542 0.2743 -0.1858 1.1816 1.0973 0.0066 1.1016 -0.1384 0.4103 0.4328 -0.1412 0.2232 -2.3453 1.0676 0.2231 0.9645 0.4820 -1.4799 -0.9293 1.5378 1.6530 -2.8093 0.7802 -0.1101 1.3370 0.6966 0.7733 0.8873 0.3307 -0.0054 -1.8845 0.1871 -0.6104 -0.3665 0.6754 -2.8636 0.7311 -1.1301 -1.3834 -1.0259 -0.2477 0.1674 -1.0974 -1.2574 0.0628 -0.5974 0.3856 -0.3123 0.6022 -0.3376 1.2909 0.4686 0.1979 -0.9663 -0.5531 -0.2448 -0.3381 -0.4587 -2.7430 -0.1230 0.8741 0.3739 -0.3922 0.8031 0.8498 -0.9563 0.4807 -1.0869 -0.9624 0.9194 0.2740 1.5829 -0.3037 1.5157 -1.5919 -0.1262 0.8727 0.4292 1.4061 -0.9474 0.4849 0.0780 -2.8039 0.3072 -0.5269 0.8244 0.2307 -0.6700 -0.1004 androsterone sulfate 1.3580 0.4772 1.9630 0.3488 0.0660 1.2768 -0.3219 0.0709 -0.1943 -0.3795 -0.1193 -0.8962 -1.9905 -0.1420 -0.0728 0.0703 -1.1237 -1.1957 0.8168 0.0482 0.4202 0.1883 -0.1708 1.3160 0.7398 1.3132 0.7460 0.0302 -1.6885 0.5871 0.0338 1.1539 -0.0237 -0.2854 0.7389 0.6033 0.4759 1.6268 -0.7099 1.2351 -0.0149 1.6926 0.5912 -0.6644 -0.5396 -0.2644 0.8305 -0.8741 0.9745 1.5141 1.0696 0.9900 0.5333 0.6965 -0.3608 0.1907 0.1709 2.0289 -0.6179 -0.8851 0.7852 -0.1235 -1.6786 1.6459 0.7905 1.3898 -1.1057 -0.8457 0.6259 -0.0057 0.2957 0.4367 0.0657 0.6623 0.2607 0.6878 1.0590 -0.1038 -1.9875 -0.3692 0.4187 1.4976 0.3387 -1.0882 0.2585 0.4177 0.8658 -0.8969 0.3462 0.3422 -0.1428 -0.2050 1.8306 0.7408 -0.1341 -0.5449 -0.2433 0.8364 -0.1721 -1.2593 1.5272 0.7177 0.3868 1.0290 -2.1267 0.5687 -2.4931 0.2446 -0.3522 -2.0231 -0.2962 -0.3999 0.4402 0.7463 -0.0513 0.3103 -0.7075 0.2591 -1.4780 0.7283 1.2969 1.2180 -0.2698 0.0508 -1.0835 0.3842 0.2687 -0.8571 -2.1926 0.3633 0.9066 1.5258 0.4861 0.9425 -0.1896 0.9140 0.0853 -1.0984 1.1241 0.1609 -2.0308 -2.3163 -0.4787 -1.0713 -0.4865 1.4977 1.1579 -0.1791 0.7386 0.9422 -0.5828 -0.0395 -0.7774 0.9744 -1.1645 1.1580 -0.3880 -0.3738 -0.6154 -0.2333 -0.7463 0.2163 -0.8520 -0.2557 -0.1096 0.6274 0.0372 1.3181 1.1766 0.0462 0.9825 0.8868 0.8004 1.4041 -0.4636 -1.7015 0.1900 0.1951 -0.4532 0.0501 -0.4980 -0.2020 1.0684 1.3176 -0.1607 1.0174 -0.1206 0.1297 0.4257 1.0953 0.2182 0.1500 1.4199 -0.2941 0.2531 -0.3032 0.4987 -0.4646 1.2883 0.2960 2.0705 -0.0571 0.2147 1.1992 -0.7918 0.2400 0.8100 -1.2324 1.6891 0.7017 -0.7220 0.5661 0.8009 -0.7258 0.9345 0.3056 1.2769 0.3541 0.9495 -0.0521 -0.7163 0.5141 -0.7326 -2.5745 0.0513 0.1425 -2.5215 -2.4739 -0.1557 -1.0003 0.1025 0.7380 0.4601 -1.7172 0.9146 -0.1277 -0.7128 0.8970 0.7738 -2.7295 0.3873 1.2309 -2.0029 2.2889 0.8657 -0.5911 0.1585 -1.0110 1.1256 0.5144 0.2608 0.6918 -1.8984 -1.1442 -1.5646 1.8628 1.2460 1.4294 -0.0678 -0.1078 -1.0151 -0.8196 0.2965 -2.1946 1.0453 0.4724 0.8007 -0.9123 0.0022 0.6302 0.5567 0.2843 -0.0040 -0.0309 -0.8406 0.7411 1.6921 0.1721 0.6474 0.3140 0.2035 -0.0622 0.0442 -0.1290 -0.0543 -0.4749 3.0887 0.0226 -0.0448 -1.6259 0.7908 -0.9480 0.0284 -1.8504 -0.5007 -0.5567 -0.4707 0.5408 -3.4769 -0.0514 -0.1394 -0.9779 -0.9773 0.1369 -0.0062 -0.3466 -0.2064 -1.2753 0.1262 0.1490 -0.2824 -1.5376 -0.4091 0.4276 -1.4415 1.0046 -0.8824 0.9693 0.4303 0.4377 0.9707 -0.3816 0.0892 0.4089 -0.1141 -0.7709 0.6675 0.5425 -1.8545 -0.8113 1.3290 -3.3959 0.2749 -1.5414 0.8965 -1.9465 -0.1355 -0.0344 -0.4845 -0.2165 1.6789 1.0418 -3.4915 0.6980 0.6513 -0.2194 1.0873 0.7555 0.4441 0.9931 0.0555 -0.5510 -0.4955 -0.4927 -1.9658 1.5652 -2.0070 -0.3240 -0.9955 -0.4160 -0.9584 0.1362 -0.3003 -0.8358 -0.7514 -0.9714 0.6137 0.8159 0.1615 0.2979 0.2095 0.0662 -0.4592 -1.3190 -0.1933 -0.1517 -1.1834 -1.2720 -1.7096 -0.5366 -1.3067 -0.7488 -0.4054 -1.0601 0.2273 0.3099 -0.9215 1.3820 -0.1500 -1.5709 1.0561 -0.6918 1.7676 -0.4055 0.9067 -0.8388 -1.3930 1.4937 1.0260 0.3007 -2.5342 0.1346 -0.5552 -1.8635 0.1174 -0.2390 0.3642 1.0135 -0.2413 0.3878 anthranilate 0.3470 -0.1690 0.3820 0.6820 1.2700 -0.0793 0.4960 -0.0927 0.7290 0.0329 0.2380 0.9210 -0.1430 -0.1230 -0.1500 0.2990 -0.3080 0.5050 -0.0799 0.0313 1.5500 0.7290 1.5400 0.8090 0.6710 0.3170 0.7760 0.4470 0.8480 1.1700 0.2330 -0.7440 -0.4450 0.8900 -0.1050 0.2180 0.3650 -0.1720 1.0600 1.2100 0.5530 -2.5000 0.2490 0.3820 0.9670 0.9610 0.2930 0.7670 0.5210 -0.3430 0.4020 -0.1020 -0.8540 1.0900 0.2660 1.0900 0.7530 -2.7100 -0.5510 0.6340 1.2700 1.2400 0.3020 0.4710 0.8040 1.2000 0.2510 0.0331 0.2890 1.1500 0.9110 0.4330 -0.0157 -0.6220 0.4310 0.0001 1.6300 1.1600 -0.1860 -0.0055 -0.2220 -0.9200 0.4700 -0.5150 0.4620 0.3870 -0.0320 -0.0349 -0.0437 1.2400 0.6650 0.1130 0.4170 0.9050 -0.1570 0.7880 0.6710 1.1000 0.1110 -0.2770 -0.0574 -0.4330 0.2030 -3.5700 1.5800 1.9800 -3.3200 -0.5080 -0.2880 0.4280 -0.3330 -0.3110 0.1380 -0.8530 -0.8720 -0.3160 0.5840 0.9930 -3.3900 -0.3030 0.1320 -0.1950 0.3390 -3.3600 -0.3430 -0.3740 -0.1400 -0.0101 0.5910 -0.6050 -1.5400 -0.8290 -2.7800 -0.2970 0.4000 0.5330 -0.4160 -2.7200 0.0516 -0.6660 -0.4470 0.2820 0.6680 0.7070 -0.5940 0.2790 0.0016 0.1770 0.3270 1.0000 1.0100 0.6170 1.6700 -0.3010 0.6180 0.5390 0.2330 1.5300 0.1450 -0.3710 1.4500 0.7110 -1.0600 -0.0378 0.1400 -0.3530 0.0339 0.4590 0.2020 -0.5550 0.0246 -0.1170 -1.0700 0.0946 0.1960 -0.2430 0.5340 -0.0541 0.6540 0.7120 -0.2740 -0.8510 0.7200 0.4190 0.5500 0.9990 -3.2700 -0.2330 0.2580 3.2600 0.6560 -0.1980 0.2940 0.9570 -0.6030 -0.0411 -3.1200 -3.6200 0.1850 1.2700 0.2530 2.1000 -1.0000 0.6380 -0.2620 -0.4060 -1.1400 0.3710 -3.1900 0.6500 0.5410 -0.9390 0.2970 0.6610 0.7770 0.5760 -1.5400 0.0209 0.4240 -0.4510 -0.7770 -0.3470 -0.0795 -0.2980 -0.3550 -0.7110 -0.3670 0.1070 0.6630 -0.8480 0.0438 1.3300 -0.9990 0.5950 0.5020 -0.2190 -0.3200 0.3390 0.5890 0.1210 -0.0352 -0.1840 -0.5380 0.4320 0.4560 -0.0879 -0.1080 -0.3340 -0.6250 -0.2780 -3.3700 -0.3320 0.4000 -0.8160 -1.0400 -0.3070 0.0330 1.3600 0.7190 -0.3290 -0.3950 -0.3030 -0.1050 -0.3970 0.0746 0.8010 0.5110 -0.3470 -0.9230 -0.1410 -0.1990 -0.4350 -3.5200 -3.4300 0.4660 0.2110 0.5590 0.2150 -0.2080 -0.4840 0.6210 0.4160 -0.0526 -0.4230 1.0900 -0.1310 0.6110 2.1900 0.1000 0.0076 -0.4100 -0.1670 0.3050 -0.5840 -3.2200 0.1140 -0.6550 0.0135 -0.4210 -0.7870 0.2030 -0.9870 0.8190 1.0000 0.5450 -0.1530 0.0763 -2.9000 0.5550 -0.1260 -0.3850 -1.7800 -3.3900 -0.0960 -0.8100 -0.0133 0.0666 0.0777 -0.1690 0.4530 -0.0158 0.1770 0.7520 0.6260 -0.5620 0.4190 0.4370 -3.3000 0.0038 0.0700 0.6870 -0.3700 -0.0331 0.4290 1.1600 0.1790 -1.2100 0.6700 1.2400 0.5500 -0.8130 0.2890 0.5050 0.8400 -1.1200 0.2670 -2.5300 0.3510 0.3720 0.7930 0.3670 0.1730 0.2540 -0.3800 0.8380 0.9790 0.6170 0.6620 -0.1360 -0.2390 -3.4800 -0.2090 1.3900 0.6210 0.0593 1.1700 -0.8700 -0.2900 -0.5780 -0.7690 0.7820 -0.3090 -0.5170 0.2590 0.3300 -0.3090 -0.2370 -3.6200 -0.0688 0.4480 0.8420 -1.5100 0.0719 0.2110 0.6880 0.0318 -0.0093 0.1300 -0.4520 0.7380 0.7520 1.5800 -1.1300 0.8660 -1.1500 0.3160 -0.0063 0.2080 0.6110 0.6250 -0.2080 2.0400 0.9590 0.8460 -0.4370 0.0731 -0.0621 0.2510 -0.2660 -0.5400 arabinose -1.4084 -1.9263 -0.3125 0.6958 1.1145 -1.6955 0.4482 0.6650 0.4508 -1.3727 -1.5310 -1.7457 0.4566 1.1415 0.5701 0.7144 0.1445 -1.6009 0.4491 0.6162 0.6833 -0.6889 0.5074 -1.5973 0.6187 0.6754 0.4159 -0.6832 -1.4899 0.3770 0.0331 -0.6467 0.9399 0.7403 -1.8661 0.6904 0.3916 -1.4319 0.8568 -1.7629 0.5507 1.1659 -0.4937 0.5968 0.3909 0.6040 0.6546 0.6219 0.3833 0.7942 0.4407 0.5379 -1.5681 0.0070 -0.3236 -1.7383 0.6850 -0.4707 0.8721 -1.7132 0.6264 0.4365 -0.8204 0.2862 0.5845 0.7303 0.4955 -1.8326 0.6848 0.6411 -1.6309 0.6577 0.5436 0.5596 0.3170 -1.7475 0.6712 0.3323 0.9938 -0.1253 0.7042 0.0078 -1.6207 0.0818 0.3716 -1.7201 -1.5077 0.1345 -1.7679 -1.4056 0.3355 -1.5701 1.1575 0.9979 0.1566 -1.5634 -1.6090 0.9071 -1.5629 0.7627 0.5270 0.3565 0.4982 -0.3439 0.6654 0.7472 0.2867 0.6933 0.4386 -0.1455 -1.7728 0.6280 0.7759 0.2406 -1.2871 0.4935 1.0111 0.3777 -1.7095 0.1978 -1.5321 0.3572 -1.6457 0.3936 0.9436 -1.6881 0.7403 0.6095 0.6420 -1.7983 0.9757 -1.5346 0.5800 0.7110 0.7384 -1.7387 0.9639 0.1952 0.8684 0.6615 0.3865 0.8075 0.8508 0.2436 0.7647 0.2802 0.4543 -1.6667 0.5976 -1.5068 1.0224 0.5493 0.5437 1.0314 -1.6570 0.5679 0.4970 0.4907 0.9552 -1.2961 0.2719 0.7054 0.6194 0.6700 0.5142 0.4699 0.6196 0.7911 0.6569 0.6442 -1.7658 0.2688 0.4991 -1.4765 0.8003 0.5238 0.9668 0.8381 0.6898 1.0641 1.0551 0.8853 -1.6691 0.1876 0.8537 -1.8100 -1.6524 0.8701 -0.1116 1.1281 -1.8341 0.5406 0.5430 0.7354 0.5837 -1.3349 0.5305 0.5468 0.4862 -0.4595 0.3060 0.6874 -1.5186 -1.5830 -0.5346 0.4013 0.5777 0.9791 0.4989 0.8929 -1.5954 0.7750 0.6392 1.1962 -1.1710 0.6276 0.5087 0.5470 0.6259 0.2599 0.0642 0.8044 -1.4931 0.5396 0.3388 -1.8214 -1.7741 -1.8448 0.6838 0.7884 -1.6761 0.5551 -1.5938 0.5673 0.6782 0.7348 0.7125 -1.5843 0.2590 0.6902 -0.6369 1.0913 0.1207 0.4592 0.5473 -1.6472 0.9213 -1.7970 0.4043 0.4314 -0.2766 -1.7518 0.5615 -1.6735 0.7661 0.5153 0.4586 -1.6922 0.6063 0.4435 0.6941 1.1288 0.6315 0.5688 -1.7193 0.5498 0.3641 -0.3793 0.5507 0.6427 -0.0131 0.8748 0.8732 0.8272 -1.7187 0.3826 -1.6884 0.8054 -0.0640 0.4048 -1.8021 0.5020 0.9209 0.6419 -1.8677 1.5122 1.0896 -1.6525 0.7801 0.7156 0.9905 0.4406 0.5398 0.8968 -1.6273 -1.9106 0.3602 0.7260 0.6419 -1.7526 -1.6415 0.8840 0.2908 0.7819 -1.6493 0.9603 0.4311 0.8941 -1.7716 -1.8235 0.0352 0.7543 0.6690 -0.1355 0.2700 -1.6814 0.8291 0.2921 0.9402 0.9445 0.6757 -1.7591 0.7249 0.7573 0.7564 -1.8921 0.7577 0.6779 0.5344 0.6775 0.6220 0.7703 -1.6550 0.6777 0.4719 0.7435 -0.0750 0.3313 0.3948 0.5885 -1.6471 -0.0858 -1.7982 -1.7749 0.5630 0.6706 0.8738 0.7235 0.4804 -1.8073 0.7424 0.4945 0.4043 0.3248 0.0497 0.6086 0.0153 0.8676 -1.9314 0.4646 0.9283 -1.7303 0.7227 -0.8895 -1.7181 0.5002 0.5689 0.7540 0.6166 0.0814 -1.5698 0.7096 -1.6457 0.4098 -1.9333 0.4842 0.7836 -1.8210 -1.5332 0.6368 0.5156 -1.9172 -1.9268 0.4093 0.4444 0.3197 0.4402 -1.7234 0.5022 -1.8978 0.5848 -1.6363 0.7290 0.3708 0.4298 0.7416 -1.9042 0.8823 0.7263 -1.7415 0.5471 0.2197 0.3976 0.6979 0.6677 -0.3178 0.2055 0.8130 0.8303 0.6703 arabitol/xylitol 1.5600 -1.2741 -0.2458 -0.0701 0.6118 -0.0969 0.1189 0.8494 -0.8893 0.0566 -0.3121 0.2789 -1.3118 1.7785 -0.2312 -0.4545 0.2854 -0.7992 -0.7117 0.3297 0.7881 -0.8355 -1.0098 0.0135 -1.0071 -0.9584 -0.7105 -0.4972 0.2176 0.0313 -0.0119 0.5471 1.0617 0.7258 -0.0245 0.9367 0.3815 -0.1570 -0.8148 -2.3345 0.8260 0.2721 -0.9295 -0.8682 -0.1993 -0.9240 0.4912 -0.3601 0.3469 0.6086 -0.5021 -0.0257 -0.5517 -2.0964 -0.7023 -1.3869 0.4551 -1.4479 -0.6293 -0.3840 -0.0389 0.9097 3.9282 2.1398 0.2359 -1.1200 -0.0089 -0.0276 -1.8577 0.3477 -1.1885 0.0894 -2.3818 0.7592 -0.6146 -1.3030 -0.0508 0.1284 0.3770 0.0664 0.6625 0.7327 -0.1740 -0.7225 1.1246 -0.6189 0.6374 -0.5464 -2.0427 -0.3924 -1.3300 0.9935 -0.3636 0.0512 0.1517 -0.8068 -0.9208 -0.1428 -0.1896 -0.5225 -0.7459 0.2553 -0.4861 0.6902 -0.9777 2.7767 0.9039 -0.7771 -1.4360 1.0226 2.4406 0.3941 -1.8791 -0.5163 0.4571 -0.1766 1.4475 -1.4144 -0.2041 -2.5666 -0.4958 0.1740 -0.8766 -0.2147 2.2093 0.7624 -0.9543 -0.1100 -1.3434 -0.8282 1.1478 -0.1376 0.4393 0.1527 1.0692 -0.0725 -0.0740 -0.6262 -0.3730 -0.3192 0.0085 0.1612 -0.6402 -0.1886 -1.5698 0.2976 -0.8500 0.3155 -0.4864 -1.8791 0.4631 -1.3562 -1.2581 0.6473 -1.4471 -0.3699 1.0438 -0.7125 0.4335 -0.7820 1.8801 -2.5919 -0.1079 -1.3690 -0.5516 0.0808 1.5765 1.4924 0.4302 -1.2162 -0.2971 -1.0509 0.1876 1.5509 1.3335 -0.9682 -0.0935 1.0487 -1.0270 -1.3876 0.7611 -0.5972 -0.2858 1.5761 0.9126 0.8128 0.6841 0.0191 0.0277 0.7285 -0.4202 -0.9316 -0.8994 -0.3069 -0.7224 -1.5436 0.5046 0.1285 -0.1289 -0.5670 -1.3447 -0.1313 2.3469 -0.1058 -0.5432 -0.4459 0.3112 1.0224 0.3203 0.8184 1.2458 -1.0140 -1.1860 0.0321 -0.2748 0.4807 0.2592 0.3517 -0.2378 0.9709 -1.9092 -0.2045 -0.2629 0.1458 0.1102 -0.3364 0.6036 0.0948 0.9494 0.2722 -0.0796 0.1493 0.2735 -0.6981 -1.6440 0.4471 0.5688 1.3559 -0.3504 0.3528 1.2877 0.2717 0.1925 -0.0580 -1.1461 -1.2385 -1.1752 0.8204 0.5667 0.5079 -0.8836 -1.2272 0.0641 -1.0884 -1.3894 0.3024 0.0866 1.2426 -1.2027 -0.4684 -0.8995 1.1981 1.2497 -1.6842 -1.4744 -0.2407 0.6756 -0.8098 -0.0634 -0.0445 -0.6393 0.8651 -0.2300 -0.0006 -0.0148 -0.1753 -1.4902 -0.9152 0.3303 1.1151 -1.6777 0.8084 -0.3698 1.0454 -0.9940 0.5002 0.1435 0.2008 0.3770 1.7138 -1.7775 -0.4768 -0.3916 0.1320 -0.2621 1.0940 0.6675 0.7997 2.6003 -0.0532 0.6022 0.1772 -0.7622 -0.3027 0.1986 -0.6497 0.6236 1.0061 -0.6547 -2.0216 -0.9516 0.1113 -0.1230 -1.0219 -1.2924 3.5113 0.0440 -0.2693 0.0715 1.6343 -0.9278 1.1883 0.7648 0.6517 -0.1735 -0.8268 -1.6197 0.3552 -0.0996 -0.5980 0.4460 1.3924 1.4294 -0.0266 -0.8152 0.3887 1.2550 0.6918 1.4520 1.7089 0.5683 -0.2288 -0.7364 0.2224 -0.0620 1.9345 1.8701 -0.2956 -0.0028 -0.5934 -1.1111 2.4516 2.7158 -0.3315 2.3559 -1.2530 -0.1296 0.3726 -0.6298 0.6222 0.8336 -0.0706 -0.8813 1.6561 0.3536 -0.8729 0.4388 -0.8359 1.9391 -0.4171 1.6567 0.8530 -1.7767 -0.0835 -0.2597 1.8043 -0.6598 2.1404 0.5415 1.1763 0.2196 2.5222 0.7952 -0.3004 0.3507 1.6113 1.1856 0.1015 -0.9056 -1.1842 -1.4666 0.6852 1.0792 0.0424 0.3952 -0.1054 0.0692 -0.3857 -0.0821 -0.2321 -0.6212 0.9052 -0.0779 1.4059 0.3712 -1.5655 -1.3774 2.2089 0.2487 0.2347 arabonate/xylonate 0.3098 -0.1488 -0.3985 -2.0187 0.3271 -2.2492 -1.0403 0.1627 -1.6736 -0.0835 -0.5596 0.3691 0.4921 1.1656 0.4385 1.0477 -1.3127 -0.1807 -0.3434 0.0013 1.5667 1.7677 -0.3891 -0.0544 0.1358 0.3217 -0.7244 0.1531 -1.8198 0.0010 -0.3175 -1.0642 1.4479 0.0026 0.3284 1.0286 -0.1316 -0.2174 1.6719 -1.3979 -0.3854 3.1426 -1.2255 0.1113 -0.9109 -0.1929 0.6947 -1.8372 0.7504 1.1946 -0.5980 -0.1412 0.1075 -2.4470 -0.0264 -0.3218 0.1310 -0.1080 1.0167 -1.7342 -0.7576 -0.3198 1.4924 -1.2097 0.3189 0.5184 -0.0209 -1.3640 1.2587 -0.3459 -0.9213 -0.3911 0.8557 0.6324 2.3184 2.0278 -0.4499 0.3584 -0.2373 0.4076 1.1461 0.1604 -1.3975 -0.5357 0.1769 -1.4612 -0.3274 0.3287 -0.7970 -1.1245 -0.3319 -0.1958 2.8665 0.9497 -0.9893 0.2149 -0.5520 0.2156 0.7373 0.3900 0.4935 0.0054 0.0566 0.8728 0.6805 0.2261 -1.0880 0.9370 -0.3531 0.4430 0.3212 -0.5189 0.6570 -1.2662 -1.6173 -0.5793 1.6112 -0.8133 -0.4845 -0.3251 0.3394 -0.6200 -2.2841 -0.1131 1.2991 0.2586 0.2934 0.6330 -0.2725 -0.4971 -0.2510 -0.6035 -0.2621 0.5213 0.7228 0.1793 1.1856 1.1270 2.5802 0.5717 -1.3706 0.8790 0.0668 -1.0031 0.8177 0.3771 -0.1272 0.1179 1.9326 -0.0655 1.0326 -0.1646 0.0051 3.5983 1.6292 -0.0371 -1.7097 -0.8841 2.5572 -1.7303 -0.8984 0.4055 0.6985 0.2673 0.1123 -0.3240 -0.6164 0.9540 -0.1030 0.6327 -0.1391 0.2100 0.9167 -0.5903 -1.0940 -0.7925 0.0543 2.2835 0.6056 1.7867 1.1069 -0.7089 0.9404 0.5942 0.7273 -0.1442 0.2236 1.4599 -0.5045 1.1209 -0.0427 -1.6107 0.4247 -0.4567 -1.6607 -1.2536 -1.3682 -0.6235 0.5285 0.0414 -0.4226 -0.6463 -1.7646 0.9943 -0.8569 -0.9280 0.2082 0.0064 -0.8073 1.2102 0.3005 0.8331 -0.5852 2.0869 0.4988 0.1314 -1.7485 -0.8430 -0.5941 -0.1557 -1.4672 -0.2354 0.6258 -0.4322 -0.9948 0.3768 -0.2404 0.0075 0.8238 0.5311 -0.9261 -1.0742 0.5498 -0.1800 0.7824 -1.1944 -0.1612 0.1445 0.2119 1.5932 -0.8474 1.7645 -0.6121 -0.2867 0.1140 -0.9938 0.2305 -0.4306 -1.0797 -1.6501 -0.2341 -1.1889 0.8226 -0.6655 -0.8572 0.3751 0.6079 -0.0132 -1.2625 -0.3994 0.2285 0.3304 0.8774 0.4736 1.1349 0.3484 -0.2213 0.3681 -0.5835 -0.5818 -0.7311 0.9675 1.4481 1.6715 0.0927 -0.9275 -0.5221 0.8665 -0.3974 -0.9597 -0.4929 -0.6219 1.0761 -0.4491 0.4104 -0.2713 -1.0103 -0.3733 0.7465 0.3464 0.3208 0.9517 0.0790 4.0017 1.3928 1.0524 -0.1667 0.8276 -0.0984 0.3422 0.4424 0.0041 0.2311 -0.2928 -1.9770 1.6367 0.5301 1.4966 -1.5030 -0.8549 -0.8697 0.0284 -1.1043 -0.4780 -0.6352 0.3618 -0.5688 -0.4994 0.7967 -1.2355 1.2103 -2.2720 0.3792 1.5895 -0.4145 -1.6563 0.6627 0.8074 1.8939 0.7381 0.9118 0.6222 -0.3789 -0.2846 -0.3345 0.4729 1.2261 0.6154 0.3452 -0.5998 -1.2263 -1.5486 -0.1857 -1.1324 0.5362 0.1077 1.4419 1.7307 0.3774 -1.0025 -0.3934 -0.1015 -1.2571 -0.6676 0.2454 0.7401 -0.6837 0.2633 -0.0898 2.1539 2.1454 -0.3815 0.5035 0.2489 0.2617 -0.5510 0.2351 -0.1586 -0.0710 -0.7664 -1.9544 -0.2056 -1.6291 -2.2983 0.7685 -1.7363 -0.3160 -0.7267 -1.3418 0.3302 -0.8380 1.8879 1.8232 -0.5876 -0.0842 -0.9868 -0.1209 -0.9016 0.4856 -0.9886 0.3951 0.8288 -1.4624 -0.9407 0.2961 -1.3685 -0.0752 -0.2324 1.2370 0.4452 -0.2263 -2.2257 -1.1030 0.6538 -0.7313 -0.7958 -1.9692 0.8923 0.9251 1.4309 arachidate (20:0) -0.3045 -1.0722 -0.1543 1.0174 -0.4025 0.5652 1.6364 -0.2669 -0.1594 0.3644 -0.1104 -1.6520 1.7709 -0.9222 -0.8387 -0.6045 -1.2188 -0.6858 -0.5007 0.3440 -0.0747 -0.8090 0.4508 -0.2472 -0.5148 -0.7468 -1.1394 1.5419 -0.1242 -0.5755 -0.6226 -0.2057 0.1973 5.9363 1.1631 -0.1895 -1.1043 -0.2978 -0.5913 -0.5436 -0.3722 -0.3445 -0.1152 -1.3664 0.2465 0.2862 0.8582 0.2854 -0.3333 0.8814 -1.2191 -0.3437 -0.8619 -2.4739 -0.2570 -0.0651 -0.2301 1.6593 0.4149 0.4291 -0.4619 0.4639 -0.7481 -0.5706 0.0665 1.4560 -0.0558 0.9970 -0.4744 -1.0711 1.4086 -0.4730 -1.1291 -0.4785 -0.0029 -0.6724 -1.2475 -1.3107 1.7808 -0.1414 -0.2120 0.6403 0.6834 0.3707 -0.4530 -0.4594 -0.1410 -0.1020 0.0916 0.4485 0.0169 -0.4252 -0.2679 -1.6739 -0.7917 -1.1707 1.1437 0.5423 0.2746 1.2345 -1.5390 1.0561 0.0192 0.3103 0.2539 -1.2857 0.2143 0.8549 -0.1752 0.1183 0.6427 -0.5179 0.5032 1.1815 1.5576 0.8680 0.3391 -0.3730 0.4731 1.1059 -0.2777 0.5602 -0.1108 1.7120 1.3277 0.4878 2.2537 -2.1401 0.2675 -0.4490 0.1416 0.0172 -0.1530 -1.2878 0.2921 0.3607 2.5063 0.0115 1.6187 -0.4095 0.6560 0.8072 0.7157 -0.6009 -0.4063 -1.4340 0.0257 0.0234 0.8017 0.6784 0.7791 0.3561 1.3640 -1.4405 0.3052 0.1674 0.7102 1.0743 -0.6100 0.4470 -0.7102 0.2164 -0.7206 0.3947 0.8893 1.0405 -0.8385 -0.8218 -0.1065 -0.4421 1.7702 -0.8146 0.5525 -1.9241 0.8852 0.3505 0.4000 -1.2385 0.2041 -0.3543 0.0613 -0.0813 -0.0171 0.1325 -0.7638 -0.7392 -0.8279 0.2201 -2.6645 -0.3261 0.6667 0.3874 2.1580 -0.6552 0.4789 0.1295 1.7007 1.5648 0.6771 -0.0003 -0.9551 -1.1915 -0.9636 0.0433 -0.3064 1.5432 0.3230 1.3932 0.0889 -0.9521 -0.0388 -0.2171 1.7435 -0.9852 0.5680 0.0842 0.9740 1.3101 1.9437 1.8104 1.0199 1.8554 -0.7664 -0.9608 -0.8545 0.9582 -0.3157 1.0597 -1.3819 -0.0744 1.0060 -1.2694 2.7864 0.1476 0.8168 -0.2940 -2.4178 0.2633 0.9404 -0.1338 0.4201 -0.7521 0.4067 -2.0961 1.5639 -1.1561 -0.4363 -0.4117 0.5124 0.6826 -0.9182 -1.1221 -0.7644 0.7366 1.1415 -0.6695 -1.5067 -0.0845 0.5188 -0.1625 0.4305 0.3477 -2.2788 -0.6481 0.9918 1.9439 -0.7943 1.0539 0.2458 0.1781 -0.3174 0.3582 -0.4825 -0.6953 0.2162 0.1119 -0.0337 0.2882 0.1584 0.8672 -2.4696 -0.3125 1.2232 -0.0610 -0.6670 -0.4129 -0.8942 0.3326 0.0878 -0.4815 0.0974 0.5534 -1.0475 -0.1334 0.4294 0.6145 0.3913 0.5438 0.9371 -0.5308 0.1188 0.3714 0.4731 0.6768 -0.3864 -0.4745 -0.0537 -1.3269 1.1219 -0.5818 -2.1050 0.9558 0.5559 -2.3887 0.0421 -0.1252 0.0359 -0.4915 -2.3154 -0.3324 -0.4763 -0.4220 0.6975 1.1721 0.5490 0.4563 0.3130 -0.3547 -0.6800 -0.1287 0.0748 0.9751 -0.9968 -0.5854 -1.1707 0.2290 -0.0327 -1.0836 -0.9462 0.3543 1.2826 -0.6191 -1.0430 -1.0173 1.2589 -0.6220 -0.2112 -0.1592 0.6521 -0.9738 0.6421 1.3107 0.0827 0.6499 -0.6754 -1.0371 0.6029 0.4161 -0.8614 -0.1953 -0.3431 -3.0032 0.5730 0.0440 0.3299 -0.5100 0.0157 2.5182 1.0203 -1.1132 -0.2130 -3.1853 -1.7182 0.5640 -1.2828 1.0801 0.2834 -1.4154 -1.3477 0.1227 1.5500 -0.1252 -0.4166 0.2879 2.9786 -0.6225 -1.1961 0.0875 -0.9340 0.1232 1.2744 -0.5500 2.1380 -0.1887 -1.5262 0.4890 -1.2420 -0.0047 -0.6533 -0.9413 1.1796 0.0459 -0.3075 -1.9284 2.5967 0.2116 -0.2976 0.3222 0.0322 -0.7053 arachidonate (20:4n6) -0.6562 0.8757 0.7346 1.3825 0.5678 2.5529 -1.4841 1.1697 0.8418 1.2129 1.5067 0.0764 2.4201 -1.5654 -2.0028 -0.5365 -0.4026 1.4026 0.7595 0.4272 -0.7772 1.4086 1.0152 0.2984 -0.3560 -1.7341 0.1355 0.4248 0.0695 -0.7832 -0.9437 0.3672 -2.7027 0.6784 1.1289 2.0371 -0.2673 -0.1189 0.2603 0.6241 -0.0127 0.2624 -0.6446 0.1623 1.7990 -0.0843 1.0356 -0.3792 0.0861 -0.3411 -0.1007 1.2745 -0.6506 1.6305 -0.3618 0.9487 0.1682 2.2880 0.8054 1.5707 0.4309 0.2448 -0.6880 -0.3682 -0.1022 0.7021 0.1035 1.6037 0.8912 -0.4749 0.9656 1.0741 -0.2370 -0.5945 0.0785 -0.2760 0.0879 -2.0373 -0.3330 -0.9134 -0.7621 -0.8756 -0.6800 1.2147 -0.4676 0.1367 -0.3782 0.2381 0.4190 -0.1481 0.8887 0.9292 0.3587 -0.4229 -0.5262 -0.2546 1.7474 1.9330 -0.6678 0.7792 -0.2659 0.4165 0.4102 0.2809 -0.4163 -1.3768 1.9570 0.0151 2.3588 -1.0676 -0.8898 -1.3987 -0.0943 1.1423 0.5319 0.2444 -0.0251 -0.3960 -0.8008 1.4700 -0.5969 0.9779 -0.7216 1.1426 -0.6485 -0.4551 1.0804 -3.4720 0.0577 -0.7486 -0.2122 0.8277 -0.5526 -0.1919 -0.3488 -0.5107 -0.1671 -1.0643 0.7017 -0.4976 -0.0395 -1.0816 -0.2786 -0.5407 0.3808 -0.6890 1.6616 -0.5873 -0.9087 1.1574 0.3156 0.3405 0.7991 0.6343 0.4402 0.9703 0.6513 0.7202 -0.1444 -0.0407 -1.4691 0.7360 -0.0352 0.8674 1.3623 -0.0459 -0.6403 -0.3115 -0.2000 -0.4079 0.9479 0.4012 -1.0738 -0.8079 -0.2878 2.0183 0.8457 -1.8179 -1.3243 0.7758 0.1017 -1.0770 1.2237 -0.0572 -0.7810 1.0176 -0.6871 1.1119 -0.5564 -1.2872 0.3689 1.2462 1.4262 0.3488 -0.3675 0.8305 -0.4050 -0.3480 0.4292 0.4772 -0.3589 0.7621 -1.4657 -1.7316 -1.2740 0.3538 0.2099 -0.5538 -0.4284 -0.4640 0.1517 -2.8625 0.4825 -0.3187 -0.4663 0.4980 -1.0140 0.1760 0.8135 0.9583 1.0865 0.5500 -0.0085 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0.2752 -0.1481 0.5599 0.9482 2.2073 -0.8725 0.2897 -0.0995 0.9775 -0.5778 0.5758 -0.6186 0.7645 -0.6340 0.4679 -0.6615 -1.1970 -1.6832 0.0401 -0.3613 -0.6739 4.4230 0.0972 -0.2578 -0.8662 -0.4196 0.3938 -1.3867 -0.4640 0.4971 2.0537 0.1723 0.2359 0.3297 -1.6238 1.4646 1.5800 -0.0945 1.8902 0.1868 -0.9789 -0.4233 -1.6646 -0.8478 0.4886 0.6239 0.8834 0.3291 -0.5945 -1.2101 -0.0032 0.3414 1.1375 -0.7508 0.9717 0.3657 arachidonoylcarnitine (C20:4) 1.1273 -2.7249 1.3999 1.3797 -0.0520 2.1334 -0.3058 2.1155 1.5497 2.7633 2.2804 -0.1501 -0.3353 -0.4174 0.1360 -0.4112 1.4307 0.3758 1.1811 0.4184 -0.2299 -1.2094 1.3257 -0.3747 -0.2092 -0.2884 0.2069 0.9500 0.4634 0.5425 -0.7445 0.3312 -0.1999 -0.0461 0.1874 2.4667 0.7865 0.9357 -2.1525 0.6218 0.3951 -0.0974 -0.0094 0.4937 0.3535 0.3529 0.4605 0.8680 -0.1937 0.8602 0.5163 0.3417 -0.2357 1.9461 -0.4789 0.8114 -0.0238 0.5606 0.3460 0.7350 0.1472 0.5778 -2.4400 2.2403 0.2122 -0.3769 0.0475 -1.0711 0.1022 0.7881 0.7649 0.7500 0.8500 0.1839 -0.3352 -0.0122 -0.2384 -0.9578 0.5078 -0.5711 -2.3105 0.5910 0.1479 0.2728 1.0906 0.8152 0.0325 0.1299 0.2121 0.2301 -0.0080 0.9265 -0.4639 0.0758 1.4690 0.4620 0.4366 0.2410 -0.4610 -0.0525 0.6465 0.9270 0.6078 0.2073 -0.4553 0.5191 2.5817 -0.6550 -0.2302 -0.1695 1.4699 -0.7517 -0.6847 0.6045 1.3248 0.4256 0.1723 0.4154 2.2381 -0.0200 1.2444 0.8015 0.0983 -0.3280 -2.5371 1.8698 -0.4845 -0.3115 0.3680 -0.5346 0.3639 1.1164 0.7446 -0.3959 -0.2218 -0.4928 -0.5198 -1.9149 -0.5915 -1.0017 1.1717 -0.2353 -0.0422 -0.2993 1.0478 -2.3600 -0.4537 0.6907 -0.5618 -0.6533 0.2497 -0.7532 -0.3673 -0.4804 -0.5719 0.0069 1.3443 0.7317 0.0487 0.0678 0.5894 -0.8030 -0.5093 -2.2831 0.1660 -0.9636 0.5161 0.6910 -0.9613 -0.2289 0.2568 -0.2764 0.1393 1.2254 -0.5765 0.7259 -0.5384 -2.0720 -0.4237 0.3160 0.2693 0.2875 0.1440 0.4033 0.4228 0.9749 0.5871 -0.9331 -2.0594 -0.7619 0.0213 3.2946 0.1205 0.5789 -0.4749 -0.0046 -0.4076 -0.0202 -0.3644 -1.9600 0.7714 0.1614 1.4001 -0.6450 -0.3164 0.4538 -0.5382 0.8440 -0.5634 0.2715 -2.2341 -1.9039 -2.5542 -0.7064 -0.4620 0.3621 1.5400 1.5387 0.7717 -2.4726 0.4404 0.1359 -0.6377 0.0373 -0.3422 -0.7250 1.3199 -0.1178 -0.5981 -0.6964 -0.1174 -0.3871 -0.4508 -0.4414 0.0166 -0.1895 0.5251 0.6457 -0.1458 0.6072 0.3861 -2.5637 1.1866 -0.6234 -2.4293 0.8601 -0.5318 0.1493 1.6091 1.1735 -0.7601 -0.4175 -0.5038 1.0860 -0.2240 0.2051 0.3374 -0.4244 -0.4120 -0.5096 0.5438 0.0004 -0.5649 0.3859 -0.8823 0.2694 -0.3358 -0.5018 1.1795 0.2560 -0.1784 0.3226 0.0811 -1.0008 -0.1122 -1.4309 -0.0550 -1.0799 -0.7539 0.3984 -0.5557 -0.1442 0.6912 -0.9901 0.2359 -2.2714 -0.9587 -1.0336 0.9059 -2.5946 -2.5475 0.3421 -1.3727 -1.0191 0.1927 -0.3118 0.6301 -2.7553 -0.9433 0.7200 0.6368 -0.0622 1.0008 -0.4575 -0.2422 -1.1159 2.0979 -0.0778 0.9639 1.8535 0.1050 -0.7361 0.0600 -0.2946 -0.2430 0.1536 0.3672 -0.7729 0.4636 -0.0399 -2.3043 1.4449 -0.5956 -0.9281 0.2544 0.2040 -0.0237 0.2792 0.2741 -0.7800 0.5039 0.4428 -0.3167 0.1914 -0.8363 -0.2733 2.1862 -0.4336 0.3731 0.6474 -1.2505 0.0558 -2.5345 -1.0628 0.3440 0.4638 -1.0808 -0.2018 -2.4368 -0.9308 -0.8957 -0.1302 1.4327 0.0490 1.2352 0.0862 0.1552 -0.9071 0.2904 -0.4310 -0.3219 -0.8739 0.2898 -1.2159 0.0359 -0.1058 -0.6994 -1.5492 0.5765 0.3251 1.7881 -0.5354 -2.3082 1.2582 -0.3551 2.7255 0.1262 1.8715 1.7676 0.4721 -0.4484 -0.8755 -0.6336 0.4018 -0.1977 -0.0035 -0.7742 -0.5367 -1.7557 0.1145 -0.1607 0.6418 0.0737 -0.0416 -2.5515 -2.5635 -0.3852 -0.0167 0.1411 -0.4572 1.3015 2.3568 0.5352 0.8180 -0.1275 0.8949 0.1561 -1.0667 -0.7405 1.0550 arachidonoylcholine -0.5964 0.0897 0.3399 0.6614 0.2817 -1.3615 -0.4270 -0.6820 0.8247 -1.3943 -2.3865 1.0094 1.1413 -0.0813 -2.4717 0.0017 -1.2358 0.2593 1.6473 1.0306 -0.8991 0.3585 2.0891 0.8874 -0.5426 0.2129 0.7893 -0.2462 1.7374 -0.5621 0.5228 1.3488 -0.7057 0.0682 0.3491 -2.0325 1.7358 0.9863 0.2186 2.0099 1.2718 0.6883 0.2548 0.1454 1.2546 0.0128 -0.0287 -0.3967 1.5382 -0.1864 1.0389 1.0366 -0.2905 -2.4606 0.4775 0.0006 0.7222 1.0629 0.1686 1.1414 1.3527 0.2266 -0.5934 -0.9519 1.1144 0.7219 0.5681 -0.4451 0.7195 0.7829 1.1340 1.2877 1.1334 0.3348 -1.5437 -0.6033 0.8484 0.8419 0.4336 -1.0084 -0.3033 -0.3119 -0.2578 0.3349 0.1628 0.6222 0.2867 -2.0309 0.6762 0.4116 0.5853 0.3023 0.8976 0.7720 0.3564 0.4617 1.6106 0.9468 -0.0526 0.1698 0.1620 0.2887 0.8772 -0.1536 0.4825 1.5531 -1.5659 -0.0281 0.4447 -0.3161 -0.3967 -0.9865 0.3318 0.4530 -1.6720 0.6506 0.0560 0.5932 -1.9131 0.9224 1.5254 -0.7350 0.8262 -0.2269 -0.7031 -0.7627 0.3632 -0.4391 0.6916 -0.4241 0.7193 0.2027 0.2177 0.4550 0.0249 -0.0407 -0.0061 -0.8867 -1.1657 0.3340 -0.8786 -0.5533 -0.2141 -0.0288 0.7725 -0.1800 -0.1005 -1.4241 -0.5261 1.4893 0.9271 0.7385 0.5217 -2.0310 -0.3516 1.8714 -0.6064 0.9204 0.5945 1.1753 0.5481 -0.0241 0.0568 0.7546 1.1867 -0.8105 0.9198 -0.3119 0.1361 -0.4561 0.1473 0.7920 -0.4262 0.8142 0.3286 1.1803 -0.2886 0.2949 -1.0007 1.0086 0.6622 -1.3965 1.1999 0.1047 0.5919 0.2601 0.8478 0.9857 0.6292 0.5398 1.1540 -3.2278 1.9077 1.1196 0.5469 0.2538 -0.3105 -0.2751 0.0715 0.3490 0.1179 1.2428 -0.2489 -0.5437 -1.0658 -0.3971 -0.7466 0.7480 0.4644 -0.0034 0.2761 -2.7858 -0.2329 -0.2893 -0.7850 0.9235 -2.0399 0.1432 0.8781 0.1921 1.0028 -0.1322 0.3966 -0.1997 -0.2455 -1.7986 0.5197 -0.0099 0.4520 -0.7033 1.1879 1.2032 0.2435 0.2434 -2.3770 -0.7978 -0.1988 -1.2109 0.9294 0.4432 -0.1265 -1.8780 0.0407 -1.0568 -0.9982 0.0021 -0.5776 -0.7713 -0.7737 -0.2644 -0.8023 0.7854 -0.7703 1.2604 -0.0275 0.1722 0.5523 -1.1741 -0.3370 0.5999 -0.8183 0.3693 -1.9125 0.0051 0.2515 1.1586 0.2380 -0.2204 0.9344 1.3888 -0.0341 -0.3370 0.6624 -0.8103 -0.8696 -1.2997 1.4742 0.1000 0.2636 1.0161 0.6590 0.8291 0.3995 -1.0801 0.0039 1.7349 -0.3706 0.8443 -1.1659 -0.1221 0.3400 2.5894 -1.0112 -1.0439 -1.1400 -0.1398 -1.1795 -1.8975 -1.7639 0.5365 0.3477 -1.0024 1.5568 -0.1018 0.9695 0.3852 -1.1830 -0.0899 0.9664 -1.1665 -0.1344 -0.9335 -1.3647 1.8211 1.8336 1.2666 0.3965 0.7788 -0.4331 -0.5508 -1.3002 -0.8791 0.3237 -0.2254 0.5424 -0.1741 -2.1108 -1.3466 -1.4174 -1.0171 0.5673 -0.0755 0.0528 -0.1910 0.4149 0.8011 -3.3740 -0.5519 0.5254 -0.3924 -0.3900 1.2412 -0.8042 -0.2105 -0.1684 -1.2879 0.2161 0.7101 0.2543 0.3091 -0.1212 -4.0555 -2.6063 -0.5505 -1.3495 1.0233 0.3770 0.9106 1.9824 -0.9378 -0.0551 0.2973 0.3683 -1.0424 -0.3725 -1.6372 0.8584 -0.9362 0.7293 1.0955 -0.7968 -1.0537 -0.2257 -0.2729 -0.8236 0.2651 0.3868 0.5616 -0.8816 -0.6993 0.9670 -0.3581 -0.0069 -0.6834 1.2995 -0.0113 -0.3396 0.9828 -0.6667 0.0818 1.2854 0.0480 -5.0531 0.5973 -1.8310 0.1338 -1.9254 -1.1236 0.3097 0.9525 0.3638 -0.7546 -0.4605 -1.3950 0.5538 -1.6898 -0.3291 -0.0763 1.3817 -0.4831 argininate* 1.0523 1.3207 0.5360 0.0949 0.8582 0.8641 0.9515 -0.0465 0.5138 0.3329 0.7357 0.6069 -0.2493 1.5761 -0.8564 -0.5188 0.1339 0.2460 1.7075 0.2041 -1.4909 0.2250 0.0654 0.6928 -0.0379 0.1570 -3.3288 -0.9999 0.4655 -3.1849 -1.6285 -0.5324 0.8804 -0.3664 1.3146 -0.7987 0.0310 2.4199 0.6420 -0.3521 0.1447 2.2597 1.1031 0.2241 0.5748 -0.1399 0.6650 0.3419 -0.6619 0.9892 0.8446 0.6711 0.1210 -0.1649 -0.1723 -0.7131 0.0322 -0.9747 0.1960 -0.7873 0.2825 0.7760 -0.5656 1.2230 1.3425 0.6933 -0.0322 -0.0294 -0.5315 -2.9059 0.8778 -1.1356 0.2678 0.4290 0.2648 0.1954 0.7106 0.8098 -0.1487 1.3568 0.6201 1.5679 1.3977 -0.1986 1.6324 1.5369 0.9387 -0.4211 0.7527 0.7617 -0.8071 -0.2315 1.0128 0.9218 0.6919 0.4448 0.9636 0.1559 0.7812 0.2453 0.7510 0.7861 0.2395 -0.5262 1.0684 1.4015 -0.8089 0.5761 0.4240 0.9207 -0.4151 0.1768 -0.1851 -0.3969 1.2061 -0.2635 -0.6996 0.3246 -0.9181 0.7149 -0.9700 0.2421 -1.4654 0.1986 0.7186 0.7154 -1.2014 -1.6869 0.4142 -0.1802 1.0666 0.4867 0.6191 0.5280 0.6669 0.7018 -0.5453 -0.4113 0.6728 1.4680 -0.8839 0.8745 0.4099 -0.0591 -0.8556 1.1760 -3.0980 0.9475 -0.2779 -0.7819 0.3846 -2.9056 0.6739 -0.7735 -0.5864 -1.2181 0.6601 0.1625 -0.5379 -1.1813 0.4515 -1.6490 0.5509 -0.8534 -0.6464 -3.3459 -0.5352 0.1950 -1.4331 -1.2430 1.1569 0.4045 0.8854 0.8416 -1.8096 0.1005 -1.6154 0.2556 1.3289 -1.0131 0.2050 -0.3908 0.1939 0.6603 0.3393 -0.7183 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-1.1061 1.3179 -0.8447 -1.2244 -1.1995 -1.2275 -1.1969 0.1628 2.5439 0.4249 -1.0623 -0.2588 -1.2726 1.6589 -1.2312 -1.1279 2.3612 2.2102 0.6378 0.6761 -1.3995 -1.2722 -1.1677 2.2102 0.8582 -1.0874 0.5237 0.0437 0.8112 0.2532 0.2255 0.3271 -1.2516 0.7332 -0.3354 -1.1133 0.2065 -1.2914 1.4956 -1.0269 0.6017 -0.9907 0.2791 -1.0505 1.6280 -1.4449 1.7442 1.0663 0.3755 -1.0880 1.7187 0.9681 -0.8197 -0.9700 -0.9769 0.0997 1.4281 -1.0951 -1.3016 1.2924 -0.3318 -1.2391 1.6239 -1.0520 -0.8635 -1.2189 0.1099 1.1122 0.7246 0.9943 0.6562 -1.1459 1.0817 -0.4714 -0.5635 1.2809 0.9073 1.7319 -1.2950 -1.2611 -1.1652 0.6952 0.2927 1.4371 -1.1367 -0.4240 -1.3645 -1.1270 -1.2230 0.7727 0.0159 -1.2578 1.7139 0.6879 -0.1579 -1.0445 2.1821 -1.3782 2.3499 0.3777 1.4161 0.9467 -1.1698 1.5737 -0.0083 -1.3728 0.0325 -1.4193 -1.4027 -1.3968 -1.1350 1.0593 -1.3347 -0.8868 -0.4871 -0.7159 0.7047 0.3677 -1.2397 0.4818 -0.1694 -1.3965 -1.1696 1.1729 0.6871 0.9111 0.7154 -1.2951 0.4052 -1.1095 0.7719 1.6176 0.7001 azelate (nonanedioate; C9) 0.8508 0.6012 0.8313 0.6362 -6.9761 1.2557 -0.7148 1.0390 0.8554 1.2768 1.3338 0.7218 -0.6048 0.7121 -0.1669 0.4252 0.9229 -0.1971 0.2205 0.3124 -0.0963 -0.9255 -0.1483 -0.2144 -0.5300 -0.2668 0.1651 -6.1071 0.5557 1.0408 0.4009 -0.1136 -1.0662 -0.6177 -0.1514 1.3990 0.1995 0.5216 0.2885 -0.4753 0.1884 0.0013 -0.2790 -0.5107 -0.6944 -0.5648 0.1585 0.3547 0.0525 0.8474 0.3573 0.4464 0.4875 0.9922 0.4935 -0.0382 0.0016 -0.7659 0.6160 -0.0008 -0.2316 0.3615 0.5083 1.4876 -0.4189 -0.8009 0.2756 -0.5396 -0.4965 0.9106 -0.0003 0.2491 0.5510 0.1799 -0.2041 0.0099 -0.9622 -1.5488 0.3510 -0.0561 -0.6646 1.3668 0.9818 -0.0488 0.1492 0.0800 0.3955 -0.1560 -0.2415 0.1420 -0.2862 0.6631 -0.1708 -0.1306 0.8527 0.0461 -0.3523 0.7889 -0.4076 0.3501 0.7324 0.3719 0.5436 -0.2968 -0.4934 0.2358 1.3618 -0.1996 0.8245 0.8133 1.0510 0.4456 -0.4169 1.0142 0.3845 0.7972 -0.4092 -0.2924 1.1232 -0.5751 0.7251 -0.0392 -0.2014 -0.0165 0.2967 0.4525 -0.6982 -0.3713 -0.1684 -0.0665 0.1865 0.1019 -0.1483 0.1169 0.1723 -0.6684 -0.1148 0.2215 -0.2463 0.5048 1.1142 0.1161 -0.6970 0.3212 0.5100 0.3082 -0.5863 0.5585 -0.5839 -1.4594 -0.3081 -1.2664 -0.6956 -0.7249 0.2961 0.1172 0.3586 -0.2239 0.2029 -0.4896 1.0028 0.5763 0.0789 0.4827 1.1600 -0.2933 0.5043 0.2245 0.4559 0.6022 -0.2050 1.3832 -0.0425 1.5090 0.9634 -0.7759 -0.3815 0.9757 -0.0174 -0.1952 0.0052 0.1033 0.0928 0.0207 -0.2226 0.5676 0.6600 0.0113 1.0976 0.0665 0.6493 1.3802 0.1604 -0.1639 -0.5640 0.4702 1.2592 -0.5768 -0.2342 -0.5069 -0.0417 0.4387 0.5171 -1.1033 -0.1898 -7.5275 -0.6953 0.0677 0.7850 0.1037 -0.1502 -0.9515 0.3556 -0.8085 -0.8424 -0.1942 0.6534 0.5274 -0.0512 0.6530 0.3168 0.2460 -0.3128 1.5982 -0.1582 -0.4213 0.8973 0.2793 -0.0488 -0.4256 0.3226 -0.4653 -0.8032 -0.2057 -0.3208 0.2270 0.4053 -0.0434 -0.3733 -0.4555 1.0580 -0.5067 0.8072 -0.5087 -0.4835 1.0695 0.1136 0.9054 0.5375 -0.0692 0.6365 0.1911 0.4852 -0.1335 0.1729 -0.2919 0.5310 -0.1751 -0.2744 0.7959 -0.0618 0.3574 0.4582 0.6799 -0.2882 -1.0931 -0.0016 0.4431 0.0347 -0.6083 0.7851 -0.5558 -0.1542 -0.6399 -0.1245 1.0061 -0.9834 -0.7362 0.7533 -0.6491 -0.8253 0.4610 -0.7534 -0.5951 -0.9430 -0.6312 -0.4225 -0.5040 0.1249 -0.2469 0.2033 -0.0799 0.4411 0.9747 1.2040 0.0730 0.6462 -2.0969 -0.4892 0.0653 1.2088 0.4002 -0.5285 0.1280 -0.2395 -0.7905 0.4600 -0.3156 -0.2547 0.0682 0.2497 -0.1311 0.1492 -0.1971 -1.0924 0.9011 -0.4478 0.4666 -0.7386 0.3628 -0.4516 0.8858 -1.0508 -1.1795 0.6518 0.1164 -0.7398 0.3657 0.1706 -0.5224 -0.1056 -0.6530 -0.7920 1.3186 -0.7643 0.1623 1.6101 -0.4367 -0.1421 1.4329 -0.0359 -0.3783 0.2036 -0.2270 0.1265 1.1864 0.7500 -0.7805 -0.8193 -0.2207 -0.7157 -5.9665 1.4702 -0.2036 0.6551 -0.2560 0.1416 -0.5009 0.2015 0.4139 1.0724 -0.1726 -0.7429 0.1804 -6.0291 0.1662 -0.6504 -0.1690 0.6380 1.1127 0.8948 0.2952 -0.2382 0.8041 -0.1695 1.5485 0.4482 0.3485 1.4992 -0.1548 1.3326 -0.1041 -0.4921 0.5481 -0.6568 -0.7832 -0.5236 -0.4553 0.4275 -0.7405 -0.8837 0.0540 -5.5637 -0.3377 0.4765 -0.1984 0.3364 -0.1087 -0.4316 -0.8029 0.3319 0.6204 1.2205 0.2767 0.1276 0.1823 0.0201 -1.0511 1.1040 0.3938 behenoylcarnitine (C22)* 0.2266 0.0984 0.7426 0.4076 -0.0044 0.3904 2.3954 -1.0169 -0.8687 1.4221 0.9407 0.1638 1.0344 -0.8602 -1.1319 -0.8984 0.0552 -0.7244 0.7789 0.6218 -0.4872 0.4584 1.3123 -0.7168 0.4378 0.8048 1.4300 -0.5798 -0.4831 -0.7950 0.3463 0.6854 -0.1221 1.3362 0.1488 -0.7964 0.4320 1.9121 -0.5923 0.2600 -0.3479 1.0941 1.5327 -1.0922 0.7851 1.3324 -0.7569 -0.7109 -0.7324 4.5277 -0.7216 1.3428 -0.6516 0.2390 0.6911 1.0741 1.8767 -0.2348 0.0025 -0.9660 0.3514 -1.0499 0.7556 -0.6096 0.7520 -1.0951 -0.7964 0.3988 0.7920 -0.4753 -0.7882 1.2200 0.9550 0.4339 -0.7661 -1.0419 0.3508 -0.7512 -0.4865 0.5935 -0.8222 0.5313 0.4704 0.8467 -0.6214 0.6208 -0.5207 -0.6561 -1.0872 2.3828 0.0468 2.1946 -0.6766 -0.2060 -0.7233 -0.6417 -0.7403 0.5018 1.4207 0.2497 0.8950 -0.4231 -0.5192 0.4129 0.9836 -0.6315 0.8368 1.8317 -0.0422 -0.5867 0.2844 0.2560 -0.4965 2.2708 -0.7939 -0.7510 -0.4616 -0.6643 1.4521 0.4126 1.2751 -0.6977 0.7628 0.5431 0.2631 1.3439 1.2073 1.7899 -0.9077 0.4913 -1.0099 -0.5777 -0.3091 1.3902 -0.8634 -1.0228 3.0558 0.6965 -0.8201 1.6472 -0.4494 -0.8769 -0.6732 -0.8263 1.5770 -0.8958 -0.7460 -0.8667 1.9621 0.8500 0.8488 -0.4554 0.8954 0.3240 -0.8461 0.6309 -0.7346 1.1166 -0.9674 -0.0635 -0.7081 0.0877 0.6488 1.3326 1.1063 1.5006 -1.0077 -0.0049 -1.0517 -0.7566 -1.0822 -0.8134 0.7862 -0.4520 3.4689 -0.3021 -0.4263 0.7133 1.1652 -0.3902 -0.6624 1.3930 0.3300 -0.8386 -0.4773 -1.1775 1.0928 1.2999 0.5343 -0.5971 0.1392 -0.5101 1.5623 0.7464 -0.4844 -0.3940 0.7174 0.4466 -0.8089 -0.3101 -0.1356 -0.4505 -0.5449 -0.6873 0.8135 0.9160 1.5856 0.3409 -0.7502 -0.7303 0.6238 0.2690 3.1654 0.4494 -1.0760 0.4583 -1.2203 0.5169 0.7560 -1.0605 1.2611 -0.9839 -0.4887 -1.2217 0.1507 0.7624 0.1033 0.9644 -0.9612 -0.7592 -0.8866 -0.5661 3.3228 -0.9594 0.0811 0.5338 -0.8899 -0.6859 -1.0683 -0.6178 0.7602 0.2896 1.4365 0.9588 -0.9965 -0.8230 -0.8896 -1.1492 0.2616 0.3328 -0.9407 0.4182 1.1761 0.6752 -0.9471 2.1251 -0.9324 -0.9217 -0.7709 1.4745 0.3588 -0.5729 -0.1982 0.7619 -0.9808 0.9807 -1.0290 0.2175 -0.7418 -0.1161 0.0849 -0.6754 0.4591 -0.9990 -0.9797 0.5448 -0.9143 -0.9263 0.6079 -0.4241 -1.1599 0.0555 0.3713 -1.0810 0.3884 -0.7660 -1.0094 -0.8365 -1.1002 -1.2383 0.8529 0.0888 0.1503 -1.1693 -0.7806 0.5433 -0.9947 -0.0541 0.3165 -1.0523 -0.8101 0.1439 0.7016 1.3910 1.0326 1.5107 -1.0196 1.6022 0.2176 0.8411 -0.7454 1.3623 -0.9545 0.2737 0.8845 -0.8974 -0.7916 -0.8633 0.9424 -1.0434 1.1298 -1.0660 -1.5897 0.8848 -0.9391 -1.3558 0.9800 -0.8598 -0.9408 -1.1090 0.2589 0.9576 -0.8397 -0.5530 -0.9082 -1.3027 -1.0054 -0.9655 -1.1724 0.3808 -0.8241 -1.4158 -1.1512 -0.1785 1.1611 -0.7398 -0.5889 0.8022 0.4433 2.1572 -0.5037 0.1168 -0.9982 0.3570 -1.0177 -1.3015 0.9365 -1.0299 -1.4394 0.1104 0.1306 0.6866 -0.8713 -1.4136 -0.9773 -0.3775 0.4823 2.7975 -1.2284 0.1615 -0.6560 -1.0218 0.7641 1.3860 -1.4454 -0.6336 -1.5437 0.3973 -1.1274 1.0946 0.5886 1.4797 -1.4315 -1.4044 1.0465 -1.5116 -1.4874 -0.9891 0.1165 -1.3678 -0.5138 -0.8021 1.3132 1.0893 -1.1761 -0.2837 0.3767 1.0107 1.1043 0.1100 -1.3821 -1.0355 -0.7633 -1.1500 0.9441 -1.4801 -0.9326 -0.9713 -0.9017 -0.2140 behenoyl dihydrosphingomyelin (d18:0/22:0)* -1.2695 0.5078 0.4930 -0.8226 1.6280 -0.6879 -1.3110 -1.9425 -0.7489 0.1522 0.6425 -0.2210 -0.4624 -0.8340 -1.4965 -1.0193 1.2215 0.2597 2.0623 1.6256 0.2853 1.3527 1.7192 -0.9925 1.4275 0.8783 1.1816 0.2948 -0.4289 -0.5926 0.9810 -0.8556 -0.1364 1.3655 -1.5112 0.0237 -0.3655 0.9739 1.4957 0.2948 -1.8464 0.5299 1.3123 -0.0789 -0.0564 0.3882 0.8962 0.8518 0.1697 -1.5026 -0.7777 1.2993 0.8889 -2.4208 1.2455 0.4221 1.5771 0.8327 -0.6348 -0.7247 -0.3699 0.1088 -0.4257 0.0498 -0.6108 -0.1371 1.2356 -0.4874 -1.4483 0.3402 1.0616 0.4023 0.4514 -0.1854 0.1611 -0.6390 1.1441 -0.3421 -0.2968 -0.3767 0.9400 -1.4364 -0.5364 1.3578 -0.9351 -0.3633 -1.0490 0.9045 -1.7982 1.0548 0.3541 -0.9443 1.0428 0.3366 -0.3581 0.4195 1.0355 1.3344 0.4607 0.9881 -0.5723 1.2111 -0.3061 -1.1392 0.3030 0.5479 -0.4261 -0.7992 1.0136 0.3350 -0.7661 -0.6615 1.8740 -0.1660 -0.1335 -1.0499 -0.3812 -0.6330 -1.3622 -0.2987 -0.7362 1.5883 -1.1781 -2.0814 -0.1889 -0.3659 -0.5029 -0.0546 0.4410 -1.5827 -1.4444 0.1988 -1.3346 -0.1904 -0.6529 -2.1358 -1.0349 -0.1313 0.3959 0.4035 -0.6297 -1.1955 1.3123 -0.8880 -0.7390 -0.2277 1.6021 0.1288 -0.5667 -0.1093 1.5303 0.9769 1.2002 1.1621 0.6028 0.8176 -0.2912 2.4084 -0.7616 -0.0776 0.9383 -0.5350 0.0063 0.3321 0.0990 -0.5870 1.1652 -0.8898 -1.9232 -0.3362 -0.1382 0.2446 -1.2304 1.1781 -0.7473 0.7221 -1.4861 0.6605 0.4800 0.8834 -0.3857 -0.2071 0.2954 -2.1090 -0.0620 -1.4671 -1.6950 1.7700 -0.2901 1.4957 -0.7688 -0.0575 -0.0530 -0.6876 -1.3403 -0.5375 -0.3305 -0.0260 -0.5965 1.6405 0.6642 1.1416 0.1915 -0.0279 0.2183 -0.8849 1.7687 -0.0419 -0.3357 -1.0089 0.8574 -0.6819 0.9997 0.9324 -0.2455 -0.2239 0.1029 -0.0902 -1.5177 -1.7642 -0.5990 -1.6566 -0.6903 -0.0656 -0.4502 -0.8287 0.6385 0.6294 0.9460 -0.8437 2.0326 1.5722 1.0201 0.9190 -0.1182 -1.7807 0.8058 0.9311 1.6324 -1.9028 -0.2850 1.2504 0.5202 -1.5193 -1.3242 -1.3125 -1.5678 -0.8666 -0.3798 0.4546 0.4949 1.1304 -0.8746 0.4061 -1.0436 1.3322 0.0210 -0.6188 2.6199 -0.8593 1.1547 0.1742 -0.2013 1.6075 0.5914 0.8326 1.1302 1.4614 0.4280 0.5924 0.7683 0.2974 -0.4538 1.3676 -1.5329 -0.2278 1.0726 0.3215 -0.0628 -0.1301 -0.1905 -1.7958 -1.6150 0.2838 1.6831 2.1523 -1.3841 0.0098 -0.1736 -0.2245 1.3832 0.4750 -2.1319 0.0524 0.2844 -0.3788 1.0525 -1.7468 -1.2257 -0.0150 -1.5231 0.2391 0.4762 -0.2441 0.1552 -1.5543 -0.9601 0.5500 -2.2708 0.6243 0.2068 -1.2627 -0.3307 -0.4166 1.2384 -0.9208 0.7201 0.2131 0.5816 0.5669 0.3176 2.3433 1.6074 -0.8708 -0.1790 -0.2007 -0.5721 -0.1549 -0.5886 -1.4220 0.8628 -1.1554 0.2178 1.4018 -0.2419 0.4297 -0.0592 0.1313 -0.9840 -1.6514 -0.8269 1.0749 -2.1139 -0.6617 -0.3716 -0.7412 -0.1078 0.8576 1.1877 0.4591 0.3113 1.0786 0.2764 -0.2277 0.9298 0.4457 -0.4641 0.1126 -1.8698 -1.0290 -1.9333 2.5337 -0.6097 0.3794 1.7080 -0.1269 1.4666 0.4135 0.1019 -0.5157 -1.6646 0.3335 0.6685 0.3765 0.2016 -0.8027 -0.4830 1.6720 -1.3511 0.1839 -2.3750 -1.2167 -0.1583 -1.0285 1.6466 0.0648 -0.3735 1.5360 0.7035 0.1006 0.2740 -0.4551 1.1006 1.2316 0.5857 -0.5388 -0.9517 -0.0945 0.9403 0.9116 1.9787 -0.2987 1.0197 -0.0621 0.5036 -0.8140 -0.0935 0.1305 -1.6944 0.0603 behenoyl sphingomyelin (d18:1/22:0)* -1.8385 -0.6326 0.0452 -0.3315 1.2800 -0.6042 -0.0904 -0.9024 0.3059 -0.8144 -2.5102 -0.5661 -0.2482 -1.9549 -0.5251 0.3692 -0.0085 -0.4199 1.0560 0.5107 1.3563 1.7035 0.5503 0.5981 0.2739 -0.4425 2.6190 0.8490 0.6985 -0.3322 1.3609 0.1867 -0.6312 1.9463 0.0868 0.7301 2.0177 0.2168 1.7280 0.3566 0.3683 0.9825 0.8690 -0.2640 0.5291 -0.2442 1.7745 1.1290 -0.2195 -1.6523 0.9888 1.2835 0.0556 -2.9235 1.2226 1.8483 1.9023 0.9898 -0.0109 0.3805 -0.1473 0.9270 0.6890 -0.3908 0.5783 0.1875 1.1136 -0.1085 1.8004 0.9167 -0.3623 1.1522 0.3472 -0.5287 0.3064 -0.0813 1.1372 0.0536 -0.9288 0.3229 2.1818 -1.2241 -0.5998 2.0749 -0.4397 -0.5430 -1.0110 0.1684 -1.0658 1.3870 0.4092 0.1957 -0.6325 0.7371 -0.2604 -0.9291 0.2387 0.5137 1.8078 1.5950 0.9263 -0.8654 0.5051 0.2000 0.7075 0.1798 -0.5149 -0.7957 -0.9442 0.8136 -1.0938 -1.3245 0.4900 -0.4884 -1.1905 0.3551 0.7116 -0.9932 -2.1345 0.3701 -0.5428 0.9146 0.1610 -2.5183 0.8830 -0.1594 1.4237 0.1749 0.7590 -0.7194 -0.8035 -0.5352 -0.2294 0.2421 0.3265 -1.4648 0.3609 -0.9321 -0.0152 0.2353 -1.0554 0.0996 0.1165 -0.3443 -0.9515 0.0913 1.3614 -0.3301 -0.0847 2.1705 0.3840 1.0002 1.6378 0.9331 1.0725 0.6756 0.1995 1.1071 -0.0878 0.1426 0.8933 -0.4334 -0.0662 1.0330 -1.9032 1.3459 1.0058 -0.0764 -2.0723 0.1012 1.3234 -0.3265 -1.5180 -0.2401 0.1437 -0.2775 -0.1392 0.8136 0.3159 1.4522 -1.9524 -0.2691 -0.2017 -0.0700 1.2547 -0.5233 -0.0328 1.6911 0.0856 0.9513 -1.7747 -2.5809 0.2011 -0.4939 -0.7744 -1.0969 -0.3077 1.1433 0.1909 0.7254 1.7182 1.4837 -0.0710 1.0386 0.0357 0.4836 1.0653 -0.3091 -1.4017 0.0021 1.4814 -0.1920 1.6559 1.0182 0.3456 0.2321 -0.9993 0.0707 -1.6383 -1.6792 -1.0183 -1.2645 -0.7619 0.1196 0.3500 -1.4459 -0.7578 1.2900 1.0549 -1.1419 1.2640 0.3838 1.1910 0.0691 -0.9079 -0.3387 -0.5476 -1.5652 0.9981 -0.5437 -0.9949 0.2337 0.6259 -0.3338 0.6435 -1.2251 -1.5278 -0.1233 -0.9619 -1.1694 -0.9682 0.5331 0.8092 -0.5012 0.2136 0.7972 -0.5923 -2.1362 0.2040 0.0917 0.6621 0.3857 -0.1715 -0.8856 0.1717 -0.2573 1.5949 0.7155 -0.0640 1.6623 -1.0777 0.2387 -1.0318 0.4221 -0.7064 0.9599 0.7540 0.4172 -0.1175 -0.5010 -0.5695 -0.9314 -0.1255 -0.2174 0.9671 2.0277 -1.1248 0.3340 -1.4218 -0.4353 -0.5687 0.0472 -0.4949 -1.4065 -0.0918 -0.1487 0.7101 -1.1946 -1.0756 1.2956 0.2374 0.2916 0.3134 1.1165 0.4256 -0.6979 -1.0562 -0.6764 -1.7897 0.1383 0.1598 1.0649 -0.5278 -0.4117 1.2230 -0.9626 0.2138 -0.4399 -0.0817 -0.6957 0.9086 1.0263 1.2425 -0.4416 0.2535 1.0486 -2.7050 -1.1978 0.2378 0.4788 1.3702 -0.2104 0.0549 -0.8434 0.2494 1.2027 0.3290 -1.8014 -0.7711 -1.4504 -2.0772 0.2396 -0.8217 -0.6596 -1.9906 -2.2577 -0.5134 1.4175 0.7823 1.2526 -0.0970 0.6390 -0.4595 -1.1009 -0.4592 0.5295 -0.3600 -1.1315 -2.2796 -0.5199 -2.5398 1.0471 0.4438 0.1560 -0.8477 0.2037 -0.6914 1.0289 1.1234 -0.2301 -0.2184 -1.2478 0.6354 -0.3293 0.3292 -2.3994 -0.7057 1.1899 0.4897 0.8323 -1.6469 0.0258 0.3185 -1.0232 1.2573 -0.0827 0.4502 0.9945 -1.1096 0.2568 0.5384 0.3876 -0.5444 1.5469 -0.2348 -0.2618 -1.2227 0.4296 0.0592 1.5886 1.2155 0.7187 0.5260 -0.7193 -0.6702 -1.3451 -1.2210 -1.1595 -2.3036 -1.8727 benzoate 0.4952 -0.8620 -0.4247 0.3283 0.3096 -0.4290 -0.0522 0.7188 0.7162 0.8367 -0.6084 -0.5728 -0.6362 0.2154 1.4945 0.8497 -0.1854 0.3229 1.1905 0.0217 0.2569 0.5318 1.1517 0.5113 0.6769 0.7480 -0.4605 0.5905 0.1812 1.5362 0.5201 1.1888 0.5926 -0.7003 -0.7002 -0.1127 1.2440 1.1540 1.9798 0.1931 0.9223 0.9577 0.0797 -0.3221 -0.5393 -0.2286 1.3022 0.6681 -0.0398 -0.4795 0.5984 1.6081 0.5384 1.2560 1.5051 -0.1560 0.6650 0.3718 0.6781 -0.9454 0.8649 0.1688 0.5344 0.9695 0.5369 -0.3939 -0.1874 -0.5045 0.0388 -0.1985 -0.0402 -0.0836 0.5017 -4.0079 0.8620 0.1081 0.9365 -2.2874 0.4438 -0.7278 -0.0178 0.5490 2.6704 -0.0266 -0.2342 0.2317 1.0266 0.1840 -0.2202 0.6354 -0.3539 0.3909 -2.6381 0.8288 0.4235 0.9842 0.2671 0.3983 -1.5457 0.3127 0.8364 -0.3803 0.5188 -0.3277 0.3759 -0.0685 -0.1384 -0.1401 -1.2008 1.3858 -0.7167 -0.1364 -0.0597 0.0488 0.4576 -0.1051 0.1018 0.1090 -0.6544 -0.2158 -0.0989 2.1819 1.3661 -0.7726 -0.2781 -0.4168 2.0934 -1.0693 -0.2038 -0.7390 -0.9856 -0.1162 0.5951 0.2424 -0.4670 0.1637 0.0403 0.5402 0.6038 0.6226 0.5492 0.7665 1.4443 -0.2189 2.7132 -0.8688 0.0216 0.4778 2.6657 1.7983 0.7485 -0.4118 0.3089 -0.1770 0.6855 1.1352 0.4591 0.8384 -1.9800 2.9009 0.5566 0.2372 0.6222 -0.0343 -0.1535 -0.6297 -0.4477 -0.4376 -0.7067 0.5856 -0.4774 -0.5405 -0.7246 0.1926 0.0971 0.7112 0.5771 0.4432 0.7960 0.6727 0.5466 -1.1351 0.0387 -0.3638 0.5822 1.1413 0.9893 0.7700 0.8203 0.0479 -0.3543 0.8104 0.8384 0.1801 -0.2728 -0.8892 0.5098 0.0432 -0.2882 1.0886 -0.2080 0.6613 0.3288 0.3268 -0.5251 1.9767 -0.2722 1.1867 0.1130 1.1535 0.3913 -0.1100 0.7578 0.3720 -0.0123 0.0507 -0.4991 -0.2418 -0.3192 -0.5102 -0.8289 -0.3313 0.8944 -0.8104 -0.7522 -0.1993 -0.6282 -0.8799 2.6086 -0.1141 1.6245 -0.4484 0.0518 -0.4316 -0.3473 -0.3667 -0.1333 -0.1131 -0.3769 0.0424 -3.6884 -0.2905 -0.9993 -1.2123 0.3923 0.0181 0.0600 -0.4719 -0.1666 -0.2457 0.2237 -0.1629 -1.0049 -0.0828 0.1033 0.1007 -0.3754 -0.0613 -0.0585 -0.2766 -3.6629 0.2331 0.4553 -0.8249 -0.3348 1.3248 -0.4588 -1.3507 -0.5068 -0.5796 -0.3722 0.3839 -0.1353 -0.1853 0.5000 -0.4281 0.5145 -0.7225 -0.2978 -3.0206 -0.1661 0.0380 0.0885 2.0917 -0.7819 0.1209 -0.4364 -0.2555 -0.8398 -2.3746 -0.6839 -0.1808 -0.0283 1.6100 0.3616 -1.1494 -0.0451 -0.7908 -0.2667 -0.7414 -0.1141 0.3154 0.3516 -0.4175 -0.0716 -0.3648 -0.1857 2.6558 -0.8967 -0.3384 0.3596 -1.0966 -0.4001 -0.1985 -0.8988 -0.0696 -0.0362 -0.2017 0.2012 -3.9089 0.5070 -0.7313 -0.9703 -0.6929 -0.0295 -0.6366 0.0728 -0.4278 -0.0028 0.2332 0.2426 0.0693 -0.5451 3.0964 -0.2541 1.0078 -0.0930 -0.0959 -0.5166 -0.2921 -0.3556 -0.4662 -1.1683 -0.2771 -0.8248 0.1052 0.0615 3.0574 -3.8073 1.7508 2.5791 1.2722 0.3525 -1.7218 -0.0899 -0.5138 -0.6243 0.1514 -0.6704 -0.6593 -0.1499 -0.4856 0.6207 -0.4516 -0.4477 -0.3835 -0.6950 -0.0444 -0.5025 -0.5059 0.0857 -0.3935 -3.6129 -1.2544 -0.8732 2.5923 -0.1883 -0.4880 0.0485 -0.6894 -0.4085 -1.3752 1.1460 -1.0898 -0.8803 -1.0439 -0.3886 -0.0545 -0.1656 -4.2491 1.2451 2.1456 1.0755 -0.4424 -0.5581 -0.8132 -0.4257 -0.4655 -0.5705 -0.5754 0.0443 0.0014 0.8910 -0.1829 -0.7317 -0.7529 -0.6642 -0.0111 -3.7677 -0.8179 beta-alanine 0.4403 -0.6021 0.9110 -0.6969 0.0795 -0.9784 2.0977 0.1520 1.0688 0.9130 0.4679 -0.8538 -0.7838 2.2871 -0.7569 0.7497 0.7932 0.7085 -0.3558 -0.2390 0.3811 -0.8668 -0.3766 0.1004 -1.0750 0.1267 -0.0627 0.7132 -0.7260 0.4538 -0.3799 -1.0974 -0.3326 -0.4662 0.4021 2.0014 0.0080 0.7342 -0.4126 -0.2968 1.5951 -0.2455 -1.0669 -0.3737 0.0739 -0.2682 -0.3793 1.3346 -0.8487 0.0958 0.4334 -0.9498 0.5584 -0.3052 -0.4316 -0.0808 0.9464 -0.3385 -0.0425 0.1569 0.1206 1.7790 0.3521 -0.5630 0.5052 -0.2282 -0.1503 0.2661 -0.6610 0.1600 0.0158 -0.1388 0.2028 0.4734 0.4092 1.1279 0.1874 -1.6565 2.2089 0.1359 -0.9155 0.6402 0.5663 0.5068 1.5494 0.3277 -0.8252 -0.1162 1.0135 -0.2193 -0.7303 -0.4393 -0.5429 -0.6129 0.8713 -0.3581 0.2779 0.5520 0.8039 0.6289 0.1583 2.4617 -0.4210 1.5662 1.5774 -0.3165 0.4337 -1.0106 -0.2726 -0.4537 -0.0941 0.0747 -0.5449 -0.5860 0.6292 -0.3143 -0.8041 1.2807 -0.0431 -0.6671 0.6403 -0.1816 0.4149 -0.8238 -0.8514 0.9934 0.0379 0.4471 -0.8079 -0.1052 3.8957 0.2271 1.4484 2.7863 -0.4371 3.6358 0.3184 -0.1164 -0.6462 0.2356 -0.0293 0.3993 -0.8382 0.3840 0.7991 -0.9547 0.6299 -0.0199 -1.0017 0.3022 -0.4391 -0.2773 -0.2466 -0.5031 0.4267 0.4793 0.6521 0.2525 0.6840 -1.8749 -0.5670 0.4515 0.4006 -0.3790 -1.7242 0.7996 0.0390 -0.4929 0.9286 0.5506 -0.4228 -0.5065 -2.4420 -0.7838 -2.0547 -0.2181 0.0991 -0.3908 0.4464 -0.0919 0.4676 -0.7854 -0.4990 -0.5981 -0.1715 -0.4046 0.2503 -1.3315 -0.4755 -1.0958 1.0210 0.4052 0.0828 -0.6029 1.1442 -0.8436 -0.4668 -2.1076 0.4214 -1.1527 0.3364 0.3273 -0.2101 -0.4175 0.6879 -2.0379 0.1354 0.8151 -0.2922 0.5809 -1.8981 0.0545 0.0946 1.9660 1.4049 0.1358 1.4969 1.1620 -0.1820 1.7311 -1.7899 -0.2483 0.1154 0.6481 0.6700 2.8465 -0.9497 3.0378 -0.7488 -0.1180 1.6797 -1.3689 -0.0887 0.4638 1.1075 0.0559 -0.1425 -0.4414 1.5370 0.2423 0.2297 -0.5562 -0.8657 -0.4875 4.8352 0.4378 -0.0880 -0.4827 -0.8967 -0.8444 -0.1202 -0.7384 -1.2430 -1.4355 0.9483 -0.6251 1.0608 -0.2530 -1.3596 -0.7689 0.5106 0.1179 1.2684 2.5385 1.3026 -0.3095 0.5139 -0.5807 -1.1148 0.6900 0.2754 2.2079 0.8142 -0.4754 -0.5995 -0.0796 -0.5776 -0.6198 -1.0405 -0.3941 -1.2541 -1.2384 -1.1422 -0.9943 -1.2497 -0.4066 -0.3981 -1.0037 -0.7683 0.1866 0.5342 0.9196 1.3401 -0.5241 0.4714 0.5438 -0.7420 -0.7014 -0.2122 -0.8443 0.3962 0.8640 0.6389 -1.3568 0.2396 -0.2605 0.0956 0.6722 -0.3638 -0.0839 -0.9186 0.0542 -0.5596 -0.4838 -0.9316 0.2344 -1.8347 -0.4983 -0.2368 -0.9312 -0.3572 0.8595 -2.8761 -1.8703 -0.3825 -1.0189 0.9082 0.2325 0.5943 -0.2300 -0.4101 2.4393 -0.5286 0.8419 -0.1663 -0.8291 2.0258 -1.3963 -0.1227 -1.2664 1.2105 0.4840 0.9404 -1.6103 -1.1462 -0.1501 -1.1600 -0.9044 -0.6108 -0.5126 -3.9675 0.9271 0.5422 0.9548 0.9755 0.8916 -1.1351 0.6280 0.2984 -0.2402 3.9725 -1.1491 -0.0927 -0.7522 -0.0589 0.9584 -0.1751 -1.1078 0.1865 -0.3130 1.5229 0.4259 0.4834 0.1525 0.4007 0.8350 -0.7662 -0.0427 0.5154 0.2112 -0.9840 -1.1862 0.0008 -0.2382 -0.2958 -0.9066 -0.3772 0.4750 -0.9203 -0.1427 0.3519 1.6548 1.1296 0.1864 0.2634 -0.8603 -1.3423 -0.0164 -2.6184 -1.4084 -0.3076 0.5731 -0.2755 -1.3547 0.1994 0.4318 -0.0453 -0.3021 -1.3096 -0.3966 beta-citrylglutamate 1.0821 -0.7150 1.2700 -0.1926 -2.5848 1.8432 -0.5906 1.6697 0.7505 2.3008 2.5383 0.2788 -3.1711 0.5626 -0.4004 -0.3866 0.1464 -0.1945 -0.2574 0.6428 -0.0527 -1.6235 1.0171 -0.1337 -0.1288 0.4425 0.2201 1.2116 0.9776 0.2570 -0.1216 0.8887 -2.6859 -0.6776 0.0470 2.1659 0.7148 1.3306 -0.4422 0.4791 0.7389 -2.5685 0.0164 -0.1455 -0.2571 0.2222 0.6197 0.9165 -0.7440 0.0784 0.3204 0.4806 -0.2899 0.5006 -0.5417 0.3940 -0.2117 -2.0004 0.3970 0.5777 -0.7783 0.2452 -3.4710 0.9044 -0.7369 -1.0537 0.7326 0.6439 0.4893 0.4184 0.2536 -0.0771 0.1286 0.1793 -1.4584 0.0733 -0.1449 -1.3333 0.5972 0.3005 -2.1159 0.8358 0.1166 0.1156 1.3009 0.5548 0.1971 0.3805 -0.2519 0.3734 0.1921 0.3725 -0.5665 0.2831 1.4552 0.5441 0.8630 1.2930 0.3094 -0.1963 0.7145 0.6782 -0.3103 0.3761 -0.9685 0.2680 1.7925 -3.3316 0.0221 0.7806 0.7571 -0.1510 -1.3262 1.0472 1.7171 0.5083 -0.4492 0.4066 2.0505 -0.2726 1.4625 1.0411 -0.6727 0.7235 -1.5144 0.2253 -0.2436 0.1717 -0.3522 -0.5423 0.5630 2.2071 1.1358 -0.2236 0.4390 -0.0931 -0.1601 -0.2664 -0.0574 -1.2847 1.4691 -0.1993 0.2710 0.0097 0.6544 -0.5665 -3.2518 0.1420 -1.0513 -2.1756 -1.5031 -1.5630 -3.1175 -1.4029 -0.8091 0.0523 0.8308 0.5591 0.3830 -0.1895 1.1810 -0.5259 0.0469 -0.4253 0.4132 -0.1284 -0.2971 0.1871 0.3323 -0.2757 0.4958 0.0338 0.5017 1.4089 -0.5367 -1.5557 0.2272 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-0.1600 -0.0577 -1.8900 0.8940 1.3600 -2.0000 0.2290 -1.8700 0.2140 0.1840 -2.2100 0.1130 -2.0400 -0.9600 -0.0844 -0.5220 0.5480 0.5000 0.6660 0.3440 -0.2460 0.8890 0.2110 0.9810 -1.2400 0.3350 0.0165 0.0001 0.6150 -0.1450 1.0600 1.0900 0.3320 -2.1500 -0.1270 -2.2200 -0.1830 -2.4400 -2.0800 0.0658 -2.0600 -2.3700 biliverdin 1.7454 -0.5758 0.2032 1.6089 1.8428 3.4635 -0.4927 2.4127 0.0506 3.2264 1.3281 -0.0624 -0.4540 -0.1336 -1.2800 2.1862 2.1538 0.1266 0.8316 0.2706 0.5044 -0.1508 -0.7831 1.1222 -0.4281 3.5667 0.0556 1.4421 0.7488 -0.4329 -0.5642 0.1220 -0.0196 0.4709 1.0270 0.6764 -0.5449 0.6432 1.0519 0.2630 0.3780 -0.1548 0.8428 -0.5822 0.8286 -0.6577 -0.6842 -0.0270 -0.9508 -0.7137 -0.2609 -0.5040 -1.0493 2.6413 -0.7313 -0.4242 -0.9595 0.1985 -0.8678 -0.2678 -0.8176 -1.0777 -0.9839 2.1359 -1.2310 -1.8366 2.3101 -1.6359 0.9227 -0.0235 -0.4807 1.1217 -0.1487 0.7813 0.0569 -0.7784 0.1148 -0.0356 0.3527 0.2681 -0.7592 1.8446 -0.7013 0.6092 -1.3239 1.1903 2.0361 0.5826 0.7836 -0.7352 -0.8107 -0.1256 -0.7878 -0.5259 1.4211 0.0633 -0.8585 1.0171 -0.2720 2.9577 -0.5110 -0.8259 0.1271 -1.1505 0.0367 -1.7554 -0.4412 -0.3593 0.3011 0.0675 1.3613 0.2937 -1.2865 -0.3109 1.0843 0.6183 -1.4689 0.6572 -0.5198 -0.2340 0.3234 1.4190 0.5681 -0.3966 -0.6286 0.6143 0.2634 -0.0722 -1.3297 -0.0757 0.5641 -0.4378 -0.2422 -0.9426 0.1893 -1.5063 -0.4357 0.2969 -0.3922 0.7660 0.9052 0.0558 1.0152 -0.6429 -0.5620 0.1123 0.3617 -0.5520 -0.4880 -0.1225 1.4526 0.8194 0.2897 0.0282 -0.2304 1.1440 0.5055 -1.1766 0.3657 0.5598 0.2193 -0.5096 0.1436 0.4146 -0.5210 -0.0978 -0.3417 -0.2509 -0.7222 -0.1223 -0.0257 1.3869 -1.4722 -0.2942 -0.3432 -0.4347 0.2796 -0.5817 0.1503 -0.3049 1.4675 0.8792 -0.8419 -0.8865 -0.9565 2.4069 0.9957 0.6993 -0.2642 -0.3898 -2.6651 -0.7103 -0.3133 1.1640 -0.4096 0.5143 -0.1370 -0.6065 -0.8468 -0.3611 -0.6053 0.2840 0.9997 0.0322 -0.3682 0.4116 -0.4073 0.6171 0.4156 -0.6087 -0.5143 0.0779 0.4146 -0.5252 -1.7340 -1.3805 -1.5497 -1.1774 0.6129 -0.8768 0.2052 -1.6948 0.3445 -0.5790 -0.5410 -0.6434 -0.7061 -1.0360 -0.5716 -1.1908 0.3723 -1.6145 -0.4438 1.0799 -0.2734 -1.2705 0.2089 0.5171 -0.3886 0.4072 1.4450 -0.5060 0.8049 1.3631 0.0640 1.1446 0.4426 0.0003 -0.4569 -0.2831 -0.5847 -0.7859 0.7297 -0.1179 1.4214 -0.6097 -0.8483 0.3119 -0.0921 -0.2639 -0.3396 -0.4007 0.4284 0.7161 -0.4282 0.6306 -0.7610 -1.4503 -0.9047 -1.5378 -0.4613 -0.5467 0.7584 -0.8181 -1.2077 -0.6482 0.4046 -0.6820 -0.2347 0.2222 -0.7072 1.0611 -0.8687 0.3188 0.8671 1.4523 0.9944 -0.6178 -0.4328 0.0189 0.9730 -0.4612 -1.3630 -1.2870 1.5162 -0.8437 1.5582 -0.2149 -0.7122 -0.5236 -1.2338 1.0959 0.5781 0.3399 1.2184 -2.7178 -0.8851 -0.1953 0.3227 1.0569 0.4060 -0.7190 -0.7951 -1.4786 0.1810 -0.5653 -0.8345 -0.8625 -0.6691 -0.8965 0.4455 3.2281 -0.6552 0.8692 -0.6714 0.4476 0.9680 0.0747 -0.3335 -0.2305 1.0515 0.9719 0.1908 -1.0096 0.5970 -1.8163 -1.4160 0.2481 -0.8984 -0.6398 -1.3062 -1.4188 0.9143 0.7289 -1.5432 0.7793 -0.9349 0.2092 -0.1968 -0.4654 0.7243 1.3139 1.7645 1.6033 1.1563 -0.6952 0.0525 -0.5170 -0.6419 -0.0301 -1.3975 -0.2854 -0.2747 -0.3555 -0.2121 0.1225 -0.1373 -1.2064 0.1742 -0.4129 2.3426 -0.0107 1.8987 2.4682 0.5970 -2.7251 0.3016 0.0367 3.4193 -0.1978 0.0874 -2.0796 -1.3697 0.1263 -0.9392 -0.2859 0.1218 0.0876 -0.6018 0.0807 -1.0003 0.9498 0.8302 -0.9029 -0.2396 0.6481 -0.0851 -0.8140 -0.5230 0.5950 2.5041 2.7078 0.8158 -1.3862 -1.5659 0.4163 -0.8208 -0.2751 -0.6963 -1.0184 branched chain 14:0 dicarboxylic acid -1.5548 0.0778 -0.0164 1.2390 -0.1843 -1.9017 0.4987 1.1054 -1.3463 -0.8477 -0.5403 1.0077 0.0407 -0.4183 -0.5811 0.7540 0.3103 -1.7847 1.6647 1.1812 0.1003 1.4883 0.1332 1.2059 0.3660 0.9613 0.7698 -1.7049 1.0038 1.6572 0.5108 0.2529 0.1723 -2.0620 -0.7458 0.4842 0.4168 -0.2349 0.7191 -0.0417 0.3619 0.7374 -0.7959 -0.1989 -0.2777 1.3128 -0.7484 0.3655 1.5244 0.8324 1.0221 -1.3045 -0.5127 -0.2781 -1.0014 0.5122 1.1945 0.5711 0.4261 0.0273 1.6910 -0.0705 0.0790 1.4995 -0.4766 -0.0494 -0.1926 -0.4860 -0.5773 0.6483 1.2197 -0.2675 0.7985 0.6262 -1.0118 -0.1204 0.4477 0.8459 0.0925 -0.5863 0.9381 1.4325 -0.7248 -0.4987 0.1892 1.0845 0.3489 -0.0510 -0.8404 0.5273 0.0163 0.6947 -0.0024 -0.8796 0.5617 1.2255 0.2469 0.7414 0.0192 1.3444 0.6117 0.5478 0.9362 -2.0184 1.2102 0.5916 -1.3946 -0.1203 0.0121 -1.7094 -1.9934 1.3287 1.9888 -0.9888 1.5974 0.6674 -1.1777 -0.6621 0.1244 -0.0809 0.0698 -1.1646 -0.3690 1.5357 0.8178 2.1975 -1.9387 -0.5595 -0.5265 -0.0924 0.0332 -1.7083 1.0919 -0.2545 0.7503 -1.6369 1.0790 -0.6761 0.6171 0.0379 -0.4464 0.9430 -1.7571 -1.8440 -1.7094 -0.2824 0.7811 1.4426 -1.7269 0.5141 -1.6189 -0.3344 0.2172 -2.2374 0.6918 -1.6540 -1.1149 0.3626 -1.1035 -1.4154 -1.7766 2.3623 0.8042 -0.4348 1.4318 0.4456 0.8697 1.1304 1.4172 0.6542 -1.0668 0.6957 1.9999 1.3185 1.8239 -1.5496 0.5054 1.0733 1.3371 -0.4055 -0.6230 -0.3676 0.1012 0.2920 0.7733 -0.7159 0.8385 -0.2605 0.7393 -0.7923 -0.3832 0.7282 0.6119 -1.2012 -1.6518 1.1350 0.3023 0.9822 -0.4595 -1.5551 0.8786 -0.1555 0.8370 0.2020 -1.2700 0.4915 -0.0539 0.7118 -1.8020 -0.0429 -0.1817 0.9127 -0.9376 -0.4891 0.0375 -0.0670 -0.3919 0.1838 0.4636 0.1963 -0.0983 -1.3317 0.6564 -0.6998 0.8502 0.6677 1.2537 0.6439 0.8531 0.9655 -1.8772 0.9226 0.8989 0.2446 -0.3520 0.7722 -1.1768 -1.7679 2.4218 -0.8868 0.4627 1.6172 0.3192 1.6824 0.8948 -0.4289 0.6381 0.3774 0.5791 0.2974 1.2499 -0.3397 1.4030 -0.1923 -1.0670 -0.9673 -0.4956 1.1720 0.8429 1.3794 -0.2625 0.7909 1.1426 -1.0286 -0.2968 0.4835 0.1625 1.4919 -0.5200 -1.4596 -1.9514 -0.2779 -0.3997 0.3470 1.9849 0.3123 -0.9822 1.5427 -0.8731 -1.6175 0.1649 1.2968 -0.5179 -0.1570 -0.3283 0.1407 1.2128 1.8582 0.0684 0.4985 -1.4300 -0.3346 0.2577 -0.5442 0.1401 0.6276 -0.9516 1.5102 0.3391 -0.2189 -1.8369 0.2661 -0.0644 -1.9861 -0.4854 -0.3602 0.0292 -1.6255 -0.3808 0.7533 0.1148 0.3571 -1.2315 0.6498 -2.1044 0.8539 -1.8261 0.3589 -1.7783 -1.9661 -0.8237 -1.9785 -0.4897 -0.1001 1.2293 0.4914 -0.2285 -1.8632 1.4010 -1.9987 0.1982 0.6938 0.4119 0.1390 0.6930 -1.4745 -0.5200 0.7049 1.0789 -0.2388 -1.1275 -0.5634 0.8086 0.9548 -0.4387 -1.7966 -0.0356 -1.9914 -0.0684 -2.0351 -0.5948 -1.3151 -1.9401 -0.1163 -1.9513 -0.6810 0.9259 0.4887 0.1331 -0.7158 -0.7470 0.7195 -1.1009 0.1918 -0.0040 -0.5506 -0.4756 0.0855 0.4481 -0.0931 -1.7481 -1.1202 -0.1582 -0.8575 0.7780 -1.7460 0.0565 -0.8002 0.6724 -0.6662 1.4319 0.3799 1.3983 0.6507 -1.2647 0.0650 1.0070 0.4784 -0.8204 -0.4453 -0.7379 0.6350 -0.7010 -1.9368 1.1473 0.2654 1.1601 0.2762 0.7784 -0.4306 0.9892 0.2876 0.0018 0.3607 -0.4723 -0.6454 0.7792 -1.9238 -0.1624 1.4096 bromine 0.8603 0.7764 -1.4179 0.5963 1.4605 -1.2442 -0.7884 -0.3288 0.0035 0.0922 -0.7282 -0.1630 -0.9005 0.0656 -0.1539 1.4995 -0.0859 0.0774 1.9718 1.2377 1.1923 -0.1917 1.3733 1.2599 1.0645 1.0777 0.4253 1.3286 2.4754 1.1973 1.4394 0.5781 1.1789 -1.4772 -0.2390 0.5270 0.3227 1.1711 1.6411 0.0803 1.2339 2.2286 -0.1872 -0.1505 1.3312 -1.2086 0.7577 0.0288 0.7532 0.4329 -0.2335 -0.6327 0.6750 -1.5317 1.6582 1.4146 1.1672 1.2061 0.6687 -0.5868 2.2893 0.3063 0.3783 -0.0477 1.0236 0.7839 -0.9049 0.0296 0.6605 0.2667 -0.5802 0.3193 -0.0019 -0.8105 0.3695 0.2486 1.1718 1.5984 0.1035 0.6452 2.2091 0.5768 -0.1742 0.5620 -0.3563 1.4167 0.6779 -0.0426 -0.8750 2.4662 -1.2534 0.0812 -0.0106 1.4648 -0.2302 0.7866 1.7578 0.0002 0.1328 0.9442 -0.5445 -0.0744 1.7096 -0.6205 1.2908 0.7831 -0.6054 -0.0796 -1.9335 0.3299 1.0808 -1.2307 1.5594 -0.0169 -0.0335 0.7481 -0.1612 -0.5997 -0.7906 -0.0050 0.4018 0.0424 0.1712 -1.4381 0.0912 -0.1669 -0.2769 -0.3432 0.0727 -1.6093 0.0626 -0.1934 0.5593 -0.3248 -0.4377 -0.3121 -0.4530 0.8782 1.6970 1.5543 -1.0895 0.7291 -1.3548 -0.4078 -0.4780 0.7706 -0.8550 -0.3277 -0.5321 0.5313 2.0316 0.0088 0.6066 -0.3385 0.8808 -0.8964 -0.1726 0.3944 0.7805 0.3057 0.9800 -0.6941 0.3158 0.1795 -1.3294 -0.5741 0.7844 -0.6922 -1.0411 -0.6433 0.0884 2.2474 -0.7469 0.7449 -0.3731 0.2523 0.5101 0.0298 1.6625 1.4394 0.3736 -0.2459 -1.9041 0.2465 1.1106 -1.3601 -0.2647 -0.3329 0.5182 -0.1244 0.7766 -1.1087 0.6335 0.5711 0.1498 -0.0194 0.4715 -0.0308 0.1042 1.5666 0.5717 0.8595 2.1642 0.6777 1.1618 1.1703 1.3549 3.7756 -0.1036 1.0588 -0.7612 -0.7743 -0.6765 0.2104 -0.9338 1.3952 -1.2083 -0.3594 -0.7651 -1.0175 -1.1819 -0.9114 3.3420 0.0588 0.0971 -0.5590 0.4095 -0.3370 0.3634 0.7007 -0.9508 0.0783 2.8630 0.5313 1.0070 0.1465 -0.4447 -1.9832 0.3427 0.4833 -0.7601 -1.2538 0.7996 0.2606 -0.1865 -0.4634 -0.4942 0.7480 0.3170 -0.4376 1.1276 0.1786 -0.6633 -0.3709 0.0877 0.2667 -0.6957 0.6773 -0.5041 -0.4449 0.5988 0.3884 1.1051 -0.9332 -0.0968 0.5055 1.4337 -1.7132 0.7987 -1.0748 0.6151 -0.2659 -1.9088 0.0086 -0.2960 0.9768 0.4569 0.5509 -0.2365 2.5965 -0.7080 0.4785 0.4405 0.3795 -1.7147 -0.0489 -1.3071 -0.4496 -0.5125 -0.7724 -1.0108 0.3637 0.4896 -1.0583 -0.1771 -0.3512 -0.4707 -1.8507 -2.1017 0.4446 0.9339 -0.0045 -1.0561 -0.3016 -0.2458 0.0931 -0.0317 0.0798 -0.3254 -0.7361 -0.2471 0.3406 0.6093 -0.1391 -1.6535 1.0930 0.2436 0.6097 0.6982 -1.7441 1.6083 -2.3304 -0.8092 -0.4080 0.1647 -0.9146 -0.1552 0.6811 0.4111 1.6091 -0.2508 -1.1904 -0.4628 -0.9153 -0.6474 -0.0917 -0.2383 -1.6831 1.7434 -0.4938 -0.9495 -1.7229 -0.7190 -0.1041 -0.4889 1.0241 -0.8628 1.4161 -0.6768 0.1577 -0.3619 -0.4074 -0.5453 -2.5885 -0.3332 -2.6719 0.0222 -1.1043 -1.4563 -0.2119 -0.2346 -0.1502 0.3098 -1.2535 -0.6955 -1.1183 -0.8532 -0.6036 -0.9704 -0.9460 0.7114 -0.6397 -0.1727 -1.3366 0.3045 -1.8194 -2.5804 -2.1022 -2.0243 -0.6700 -1.4354 -1.1984 -0.2003 -0.6295 -0.8843 -2.3536 -0.4206 0.2493 -1.6453 -1.0848 0.3293 -0.0073 0.3120 -1.2743 0.1237 0.3413 0.1931 0.1941 -1.4930 -0.1697 -1.9905 -0.3295 -0.3207 -1.1934 -1.1297 -1.5332 -0.4557 0.3196 -0.0938 -2.1548 butyrylcarnitine (C4) 1.5600 -0.0319 1.5042 -0.0195 0.2766 2.5564 -0.0808 0.8994 -0.5204 -0.4452 -0.3171 -1.0105 1.1190 1.2492 0.6518 -0.9499 0.7537 1.6066 -0.3505 1.2047 0.6934 -1.7468 -0.4253 0.9947 -1.6969 0.3105 -1.1105 0.9892 -0.6905 -0.4360 -0.3404 0.6551 -0.8356 -0.8388 0.9181 -0.5625 -1.3556 0.1553 -0.9438 0.8102 -1.0269 -0.6357 0.4607 0.5367 -0.5795 -1.3718 1.0841 -0.1077 -0.6841 0.6065 -0.5155 0.4177 1.6394 0.5432 1.1252 0.4342 -1.0529 0.0162 -0.0741 0.2692 -0.5723 1.2631 0.8052 -0.7743 1.4138 0.1873 0.0270 0.8036 -0.2796 -0.1943 2.2857 0.1085 -1.0055 1.3094 1.1503 0.9235 0.1993 0.0834 0.9994 0.6173 -0.1779 0.6129 0.4060 -0.2808 1.0970 -1.3870 -0.3590 0.8321 0.5425 -0.0586 -0.7302 -0.8429 -0.0049 0.8757 0.6852 1.1084 -0.6191 -0.7803 -0.3756 0.4488 -0.8004 -0.4114 0.0833 -0.0107 -3.7079 1.3933 0.5131 -0.1362 -0.4902 -0.7107 -0.8569 0.6030 -0.2368 -1.0752 2.7529 -0.9656 0.8040 -0.5183 -0.2089 -0.6679 0.6944 1.6711 -2.7153 0.9886 -1.6379 -1.5518 -0.6677 0.5487 0.2264 -0.6614 -0.1312 -0.6985 -1.2615 0.9323 0.2341 0.2976 -0.8542 0.1986 0.3002 -0.8432 -1.0654 1.1042 0.7401 -1.9053 1.7717 1.0215 -0.4157 -0.0276 -0.1733 -1.2671 -1.1707 0.3787 -0.0729 0.1775 -0.0226 -0.3807 1.2784 0.1533 0.7001 -0.5171 0.3424 -1.6975 -0.1412 -0.7109 -0.6470 -0.8268 -0.1807 -0.0035 -0.6420 -0.6413 -0.2744 0.6956 -0.3542 0.5805 -0.9425 -0.2658 -0.8495 0.2123 -0.5916 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0.5291 0.1561 0.4260 -0.1899 -1.6017 0.8256 1.1366 1.2827 -0.7393 -0.0482 0.2363 -0.6405 -0.4497 -1.0596 -2.3238 0.2121 -0.4318 -0.8315 -0.6010 0.2994 -1.1588 -0.9099 0.9145 0.5655 0.0734 0.6638 -0.4665 1.0730 -0.2825 -0.5578 -0.6237 0.5750 -0.7283 -1.9150 0.3954 0.9565 -0.1372 -3.3860 -1.9873 -0.9362 -0.9080 0.6836 1.2101 0.6324 -0.3315 -0.4605 -0.7026 0.0165 0.5970 -1.7636 0.7416 0.1527 -2.8140 0.2702 0.5300 -1.6297 -0.5486 -0.1072 0.2356 0.5574 0.1670 0.2324 -0.9431 -1.3399 -0.8574 -0.3953 -0.8143 1.2055 -0.0249 1.0621 1.2835 -0.1743 0.3239 -0.1356 -3.5212 0.7152 0.9210 -0.5549 -0.6626 0.5427 -1.7291 0.2968 1.7312 -0.2600 -0.2000 0.5524 -1.2793 0.3178 -0.1546 0.4045 -0.1341 -1.2453 0.0900 1.0436 0.1279 -0.6695 -0.7497 1.4942 2.5992 -0.4426 1.1945 0.2511 -1.2304 -3.8606 0.7985 -0.4757 -1.1234 -0.4718 -0.2898 -0.1316 1.2513 0.9454 1.2214 -0.9046 -0.6317 0.1519 -0.4400 -0.6560 0.1728 1.1025 0.2907 -0.2078 0.9454 -0.1311 -0.5572 -1.8928 -0.2692 -0.9493 -0.7261 -0.7021 caprate (10:0) 1.0047 1.3688 0.1580 2.1471 -0.8120 1.1164 1.8171 1.5184 1.2751 -0.0528 0.6613 0.4721 0.8022 0.8791 0.6352 -0.2398 0.2000 -0.6408 -1.4055 0.2223 -1.2825 -1.8661 -1.2555 -1.2561 0.0110 -0.1549 0.6237 -2.1605 -1.3105 0.0554 -0.7002 -1.0951 0.3742 -0.0518 2.1413 0.6872 -0.3180 -0.9663 -0.8086 -0.4081 -1.1595 -1.1798 2.2237 -0.8150 -0.3150 2.5409 -0.6511 -1.0770 -1.0544 0.0814 -0.7997 -0.4282 -0.9465 -0.2307 -0.3544 -0.6481 -1.3934 0.3154 -0.7832 -0.1854 -1.0416 -0.0629 0.7084 1.6528 0.6410 0.3768 -0.5226 -0.8006 -0.0839 -1.1130 -0.3284 -1.3041 -0.7417 -0.6347 -1.3334 -1.0084 -1.8488 -1.7319 -0.8439 -1.3890 -0.7297 1.3444 1.5167 0.1816 0.4001 -1.1901 -1.5252 -0.1561 -1.5535 -1.7764 -0.2022 -0.5636 -1.5018 -0.3995 -0.5301 -1.7337 -0.7738 0.0349 -0.7263 1.4361 -0.7645 0.7244 -0.4471 -0.4144 -0.6670 1.0551 0.5297 1.4675 0.3871 -1.0580 0.4611 -0.1975 -0.2390 0.1544 0.4890 0.3158 -0.5683 -1.3368 -0.0918 0.0655 0.9262 -0.4360 -1.4626 -0.7196 0.5169 0.9781 -1.1937 1.2262 -0.1027 1.7580 1.6266 0.2331 -0.8939 -0.8653 -0.7677 1.4961 -0.6016 -0.4403 -0.9968 -0.8110 -0.0595 0.0643 0.0542 -0.7646 -0.5052 -0.6098 -0.4567 -0.6242 -1.0089 -0.3800 0.4861 -1.1526 -0.2262 -1.8256 0.6704 -0.1976 0.3005 0.3166 -0.1738 0.6419 1.5278 -0.0409 -0.6057 0.2818 -0.3001 0.1798 0.6386 0.7519 -0.9524 0.0391 -1.0645 -0.1554 3.0927 -0.1287 -0.1583 0.0424 -0.4829 -0.5906 -0.2637 -2.3614 -0.7668 -0.3013 1.0552 -1.2184 -0.8581 0.2793 -0.2704 0.2563 0.6232 1.1076 1.1953 1.0011 -0.9015 -0.7681 1.8746 -0.4811 1.1290 2.1285 -0.1006 -0.9165 0.0291 -0.7303 0.2662 0.5807 -0.0820 -0.0603 -0.0844 -0.5360 0.9341 -1.3981 -1.7256 -0.1977 -1.0830 0.0504 0.6569 -0.5958 -0.5225 1.7382 0.7929 1.0168 -0.1708 -0.3131 1.3328 1.2477 0.5751 0.1855 0.7002 0.8264 -0.2794 0.8172 0.0382 -1.1755 -1.6051 -0.6114 -0.9160 -1.1741 -0.0815 -0.4427 0.6427 -0.3873 0.3089 0.3628 0.1443 2.5687 -0.7088 -0.1747 0.5573 1.3526 -0.2354 0.0729 -0.2946 0.2077 1.1622 1.1124 -0.6989 1.4183 -0.6624 1.5254 -0.2741 -0.3375 -1.5218 -1.1440 0.7378 1.1432 0.8925 0.5088 0.0368 0.8395 -0.0846 -0.0237 0.0501 -0.6674 0.6226 1.4397 -0.9471 0.2998 1.5838 0.6630 0.0143 -1.0530 1.0423 0.5055 -0.4606 1.3675 -0.3634 -1.2459 -0.7284 -0.4421 0.5935 0.3222 -1.0904 1.0384 0.7492 2.7556 1.4663 2.3583 0.8858 3.1009 0.7664 -0.2527 -0.4053 0.3144 -1.1453 1.3493 -1.2702 -1.0000 -0.7214 -1.0824 0.9779 -1.3944 -0.2686 -1.3507 2.2201 -0.8193 -0.4442 2.7732 1.8465 1.0769 -0.3270 1.4089 -0.9606 -0.1813 -0.6154 -0.8799 1.4843 -0.0552 -0.5532 1.2406 -0.0331 1.4028 -0.6543 -0.2243 0.2933 0.9679 0.0429 0.6282 2.1852 1.2749 -1.5936 -0.2059 0.3079 -0.3381 2.1247 0.3829 1.2019 0.3068 -0.1122 -0.0844 -0.7526 -1.5926 -0.1750 -0.5522 1.3638 0.1630 -0.1797 -1.0254 -0.4450 -0.3481 0.1345 1.2707 -0.4701 -1.4243 -1.3599 -0.4862 0.5284 -1.0275 -1.4785 0.1813 2.3663 -0.1327 0.5680 -0.7065 0.0241 0.8697 -0.8067 1.2288 0.3858 0.2206 -0.0269 -0.0094 0.4027 -1.1268 0.5405 0.2133 -2.1400 -0.9646 2.4551 -0.0431 1.0835 0.9100 -0.8155 -1.2193 1.5442 0.0439 -0.4592 0.7951 -0.5617 -0.8469 -1.8622 -0.9957 0.6019 0.3230 0.8826 -0.2540 2.1180 -0.3078 -1.0414 0.4782 -0.1695 1.5258 caproate (6:0) 3.5404 -0.1159 1.1119 2.9751 -0.3252 2.6984 0.0470 1.6919 0.2297 1.6425 1.3457 0.3025 1.2744 3.3829 -0.5914 0.0343 0.6565 -0.7379 0.3289 1.0111 -0.7521 -1.3240 0.2196 -0.1312 0.2931 0.8790 1.4146 -2.5136 0.5351 0.5586 0.4630 -0.8685 0.1296 0.5212 -0.4878 1.5835 -0.0934 0.4148 0.5859 -1.3017 -0.8507 0.1764 -0.3059 -0.7774 -1.1547 0.0593 -0.8050 -0.3587 -0.3610 0.3192 0.0852 -0.0015 -0.4804 0.4431 -0.0981 0.0141 -1.5522 0.0075 -0.9485 -0.8152 -0.3263 -0.6008 0.4010 4.6105 0.9775 0.5553 0.4005 -0.3531 -0.7747 0.6940 -0.4211 0.1212 -0.0660 -0.4963 -1.4480 0.6453 -0.2444 -1.1627 -0.5106 -1.4540 -0.5762 0.6505 1.5025 -0.5420 1.6037 -1.4235 0.1415 0.0422 -0.7959 -0.1755 0.6146 0.6488 0.2861 -0.1470 0.2265 0.3813 -0.1916 0.6979 -0.3194 -0.6519 0.3574 -0.0003 0.2579 -0.0234 -0.8926 0.9184 1.5029 0.3096 1.9339 0.4916 -0.8062 -0.0127 -0.3906 0.3709 -0.2320 1.0789 -0.6600 -1.0913 1.0757 -0.9970 0.2317 -0.2142 -0.4209 0.0086 -0.1261 0.1057 -1.4203 -0.0321 1.8452 -0.2585 -0.2942 0.0645 -0.8817 -1.3670 0.2670 0.1724 -0.2167 0.6994 -0.2987 0.2807 1.1246 -0.2482 -0.6206 0.2253 0.4382 0.7276 -0.3600 0.5130 -0.6918 -1.4399 -1.0838 -0.2247 -0.9581 -1.2840 1.5673 1.3062 -0.1438 -0.3920 1.7558 1.2632 2.7526 -1.4290 0.9488 0.7156 0.8297 -0.8282 0.1053 -0.9041 -0.5225 0.1127 -1.1189 1.2225 1.3885 1.4020 0.5051 -0.4449 -0.4519 1.6978 -0.4474 -0.2305 -0.2614 -1.0888 0.6947 -0.1807 0.8436 1.6625 2.2063 3.0408 3.1159 1.5733 0.9050 0.4551 -0.5181 0.4167 0.3645 -0.4593 2.0348 0.2389 -0.5393 -0.6139 -0.1447 0.4549 -0.2976 -0.3818 0.1740 -1.0743 -1.0980 0.5021 1.8947 0.7540 -0.9241 -0.4945 -0.3139 -0.6208 -0.0784 -0.9229 0.1567 -0.3093 -0.4797 0.3205 -0.5569 -0.0737 0.4668 1.3470 -0.9510 -1.2239 0.0748 -0.0987 -1.1983 0.1015 0.0425 0.1166 -1.6496 -1.4285 -0.7014 0.0538 1.4139 0.1015 0.5476 -0.8505 1.5608 -0.2783 0.4868 1.1748 -1.3115 1.1042 -0.4548 0.5035 -0.1958 -0.4452 -0.1353 -0.7538 0.1607 -0.3761 0.2874 0.0166 0.2167 -0.2036 -0.6892 0.0878 -0.3001 0.7835 -0.4446 -0.0739 -0.4725 0.5886 1.2256 0.9110 -0.7692 -1.2047 0.1379 -1.3210 -0.4953 -0.0126 -0.8189 -0.0264 -1.1609 0.0685 0.0457 0.8887 -0.8631 -0.4790 -1.5092 1.0502 0.5336 -0.5638 -0.3458 -1.1854 -0.5071 -1.1109 -0.4778 -1.9796 -0.0624 0.4663 1.1409 -0.8018 0.4246 -2.0856 -0.2886 -0.1616 0.9889 -0.5970 -1.6211 -1.0812 -1.1815 -1.2441 0.1428 -0.5889 -1.7502 0.0977 0.1347 -2.0633 -0.1210 -0.7596 -1.0818 1.2135 -0.0317 0.0723 -1.5935 -0.5810 0.6528 0.5800 -0.4564 0.6560 0.2431 -0.7808 -1.7238 -0.3463 0.1758 -0.5580 1.4154 -0.7868 -0.6594 1.0770 -0.0728 -0.6559 1.3472 -0.8644 -0.3671 0.7607 -0.3775 1.0837 -0.6764 0.2847 -0.4285 0.9110 0.2583 -1.4571 1.5014 0.1360 2.1782 0.0786 4.5724 -1.2755 -0.3919 -1.5361 -0.5386 -0.2069 -0.1528 0.3153 0.2615 -0.7301 -1.7951 -0.9041 -1.5410 -0.1551 -0.6068 -1.2903 1.1080 0.1808 1.7738 0.6397 0.4922 2.2257 -1.1890 1.9286 -1.0693 0.1274 0.5808 -0.4856 0.3291 -1.2466 -0.4435 0.7817 -1.4016 -1.5539 -0.8041 -0.5422 0.7077 -1.1858 -1.5129 -0.9727 -0.3931 -0.5012 0.0600 -1.3875 -0.4643 -0.8789 -0.2961 0.6631 0.2405 -0.8839 0.9763 -0.6614 -0.2192 -0.4773 0.1097 -0.9299 0.9808 0.1891 caprylate (8:0) 2.6128 0.7931 -0.1416 1.0560 -0.9861 1.5928 1.4504 1.6175 0.8100 0.5708 0.6333 -0.1203 0.8585 1.9033 0.4713 -0.3120 0.1334 -0.5243 -0.8048 -0.1957 -1.5961 -1.9570 -0.7461 -1.5787 -0.2530 0.0467 0.4643 -2.1499 0.7167 1.3347 -0.4633 0.1748 1.2625 0.6092 0.9726 0.5298 -1.0079 -0.2407 -0.2954 -0.3773 -1.3128 -1.0575 2.3345 -1.5345 -0.9814 1.6436 -0.7070 -0.9523 -1.3869 0.0698 -0.7421 -0.6039 -0.9943 -0.2503 -0.3840 0.0532 -1.0819 -0.8712 -0.7090 0.4456 -1.1577 -0.5928 1.1992 2.7228 0.3631 0.9345 0.2140 -1.1812 -0.9586 -0.7083 -0.3481 -1.6517 -0.2877 -0.4203 0.7030 -0.6134 -1.2992 -2.0445 -0.8936 -1.1520 -1.0511 2.0125 2.1618 -0.4994 0.5660 -1.5745 -0.8941 -0.7879 0.4975 0.8136 -0.3523 -0.5818 -1.0484 0.6223 -0.3784 -1.1711 -1.6732 -0.0631 -1.4981 0.1658 0.7069 0.9642 -0.6045 -0.2714 -1.1217 0.5045 0.5708 1.9296 0.9070 -0.3513 1.5067 -0.3521 0.6179 0.1806 0.4779 0.4091 -1.7125 0.6559 -0.2250 -1.2568 0.9497 -0.7525 0.3874 -0.8833 0.2032 0.0652 -1.2700 0.6655 1.1203 1.0562 1.8659 0.6710 -1.5401 -0.7342 -0.3166 0.4741 -1.0423 0.6395 -1.3889 -0.6286 0.0192 -0.3272 -1.2460 0.7775 -0.2910 -0.4004 -0.5190 0.5865 -1.1440 -1.0711 1.6788 -1.0349 -0.1456 -0.9995 0.4930 1.8257 0.1818 -0.4704 0.0973 0.8651 3.0265 -0.8676 -0.1985 -0.2073 0.0998 -0.6552 0.4376 1.9081 -0.9110 -0.3397 -1.3263 0.5985 3.6650 -0.3222 -0.6132 -1.0278 -0.2711 -0.1310 -0.9875 -1.9171 -0.6326 -0.8425 1.3789 -0.7923 0.0723 0.5271 0.6841 0.2606 1.5748 1.3070 1.7458 0.9808 -0.7996 -0.8509 1.3791 -0.7132 0.6388 1.4791 -1.2264 -1.0071 2.2932 -0.4292 -0.2907 -0.5169 0.9395 -0.8257 -0.8976 -0.8554 1.0106 -0.2822 -1.5306 -0.3143 -1.0174 0.3893 -0.7170 -0.1841 -0.3392 1.4351 -0.5284 0.6302 -0.5265 -0.6470 1.0565 0.7831 -0.0150 -0.0747 -0.0005 0.3220 -0.4139 1.0441 0.5708 -0.4953 -1.5140 -0.0658 -1.4872 -1.1636 0.3838 -0.1076 0.5917 -0.9437 0.1442 0.0040 -0.4921 2.6909 0.0244 0.0596 0.0437 0.9406 0.3248 -0.4144 -0.7209 -0.4149 1.1793 0.3860 -0.6890 2.5837 -0.7142 0.1055 -0.2596 -0.2998 -0.0655 -0.7544 0.3486 0.1444 -0.1269 -0.1418 0.6013 1.3431 -0.6048 0.5461 -0.3934 -1.2637 0.3836 1.3908 -0.1882 0.1825 -0.5920 -0.1097 -0.6858 -1.5292 -0.2638 1.4534 -0.3495 1.5050 -0.2592 -0.9941 -1.0302 -0.3686 -0.3817 0.0769 -0.8834 0.8250 0.2473 1.3649 0.5320 1.1750 1.1200 3.6258 0.4826 -1.0477 -0.2901 -0.8788 0.5894 0.1801 0.1359 0.1335 -0.4594 -1.0022 -1.2111 -1.4634 -0.9625 -1.4471 1.0534 -0.6383 -1.4042 2.0434 2.9345 1.9388 -0.4820 0.1487 -1.0488 0.2517 -0.7410 0.2431 0.9057 -0.8100 -0.2730 0.1439 -0.1846 1.0539 0.1461 0.1835 0.8212 0.6602 1.0127 0.2164 1.2919 1.0194 -1.1993 -0.2029 -0.0179 -1.4086 1.6540 0.1900 0.5334 -0.0461 0.3840 -0.6383 -0.1135 -0.6941 0.5247 -0.4749 2.5222 -0.2969 -0.2087 -1.3177 -0.4637 -0.2744 -0.5281 0.5964 -0.3414 -1.1349 -2.1150 -0.9968 0.3301 0.1080 -1.2631 0.5161 1.2280 0.5605 0.8208 -0.1967 0.3909 1.2652 -1.3864 1.4461 -0.4286 0.0447 0.3130 1.0269 -0.2692 -0.7047 0.8281 -0.3932 -1.4471 -1.4370 1.5358 -0.4030 0.5181 -0.2354 -0.5962 -1.2700 0.9589 0.1273 -0.5739 -0.0932 -0.3966 -1.1065 0.4571 -0.5940 0.6636 -0.1835 0.6557 -1.2607 0.9137 0.3792 1.0089 -0.5835 1.1936 1.7140 carboxyethyl-GABA 0.8193 -1.3603 0.3613 0.5997 0.0673 1.1893 -1.8377 -0.5099 0.2320 2.6437 2.0370 1.0134 0.1335 -0.4608 -0.6218 0.8337 0.9938 0.1281 -0.2430 0.5770 1.1877 -0.7553 -0.4479 0.5429 0.4475 -0.2799 -4.4494 -0.3325 0.5000 1.0454 0.0391 -0.4057 1.7270 -0.5913 0.7483 3.2363 0.8473 -0.7052 0.2479 -4.4454 1.0490 0.5397 -0.9760 -0.8240 -0.0380 -0.6946 -0.0359 0.0865 0.7798 -0.2065 -0.2310 -0.8680 -0.0486 -0.3853 1.4772 -0.3416 0.4589 0.6528 0.3833 0.1336 0.3931 0.5159 -0.7440 1.9546 -1.1961 0.5141 -0.1012 0.7553 -0.1781 0.9664 -0.1732 -0.9282 0.3160 -0.2772 -0.8251 0.4744 0.0961 1.9041 -0.8095 -0.6729 0.8840 0.4820 0.0928 -1.8762 -0.1507 0.3553 1.0713 0.1281 -0.8250 1.3950 -0.6743 0.8257 0.2375 0.3238 1.7727 0.0620 0.7417 -0.3608 0.1795 0.1242 0.1559 0.5384 0.6516 -0.6359 0.0638 -0.2864 0.8915 0.1402 -1.3022 0.7912 -4.5925 0.3788 0.3594 0.3316 -1.6721 0.4994 0.8883 -0.8179 1.1131 -1.2454 0.3863 -0.0127 0.0685 -0.9553 0.2633 -0.9985 -1.2579 -0.2243 -0.0512 -0.0959 -0.6296 0.5895 0.6830 -0.3516 0.2861 -0.2933 -1.4318 1.0726 0.3733 1.4291 1.2961 -0.3765 0.1318 -0.6699 0.5337 0.5006 -0.5305 -0.5443 -1.0887 0.4970 0.3703 0.3456 1.3648 -1.6525 0.0545 1.3127 0.1256 0.0179 -0.2148 0.8913 0.8333 -0.5484 0.1093 -0.7569 1.8720 0.3348 0.8362 0.7879 -0.6991 -3.8211 -0.4043 0.6108 -2.0060 1.3478 0.7269 1.0082 -0.2850 0.4724 0.9005 1.2916 0.7743 -0.8258 -0.0112 0.1972 0.1108 -0.1187 1.0469 -0.0748 0.7828 -0.5045 -1.3296 1.0758 -0.2439 0.9825 -0.7561 -0.3751 0.7807 -0.8912 0.4318 0.2316 -0.0607 1.2774 1.2055 0.7862 -1.2650 -0.3320 -0.3425 1.6672 0.9851 0.7369 1.1149 0.4296 -0.6441 0.0327 -0.4248 -0.4826 -0.8362 -0.1419 -1.6158 1.1477 0.3907 -0.7958 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1.0673 0.1943 1.0063 1.7068 -0.2653 0.5834 -0.3362 -2.3393 0.0074 -0.1782 1.0619 0.4463 0.4200 -0.3003 0.3851 1.2773 0.8092 -0.8580 0.6213 0.3988 -0.5261 0.4500 0.0433 -0.3588 -0.1639 1.3767 0.6336 -0.2709 -1.3842 -1.6514 1.6204 -0.3723 1.1631 -0.7679 1.0925 1.4321 -0.8917 -1.6768 0.3928 0.9996 0.4161 -0.9476 0.5073 -1.0494 0.1753 0.1336 -0.0824 0.2465 -1.7554 0.5422 0.5382 1.3229 -0.0525 -0.5038 -2.5257 -1.1361 0.7948 -1.2610 -0.1845 -0.6087 0.2548 0.1936 1.0116 0.0862 0.9933 1.2195 -1.0641 -0.5477 0.1337 -0.3030 -0.4153 0.9183 0.6498 0.8758 0.8827 1.3178 1.0175 0.6175 -0.1875 1.0597 0.7914 0.2534 0.9756 0.0485 -1.0095 -0.2445 -0.0173 -1.2730 -0.0188 0.2201 -0.5397 -0.7086 -0.1269 0.2156 -0.2905 0.4430 -1.4034 -1.3382 1.5413 -1.1591 -0.1288 0.2511 1.2639 0.4573 0.4108 0.4514 -1.8245 0.6539 -0.2067 0.7787 -0.5333 -0.7237 0.3372 -0.5568 -1.9170 -0.2028 1.0923 0.8817 -0.5280 -0.6335 0.6725 -0.1273 1.1759 1.5044 0.5567 -0.2682 2.1924 0.7851 0.8444 0.2447 1.3496 -0.2855 1.5768 0.4502 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-0.3047 0.0876 -0.2427 0.0828 -0.1187 0.4330 -1.7145 -0.5236 1.2968 1.1110 0.3299 0.1707 0.1591 -0.0863 -0.0678 0.2277 -0.5112 0.2099 -1.2452 0.0647 2.3641 -2.3950 0.6468 0.9609 -0.2092 0.3718 -0.5093 -0.3540 -0.4468 -0.2980 -0.6248 -0.8104 -1.2297 0.5357 -3.0803 -1.6914 1.1343 0.3703 1.4504 -0.4103 -1.2388 0.9573 0.5899 -1.0110 -0.8847 -1.1462 -0.6131 0.8501 -0.8911 0.5570 -0.2168 -0.3461 0.4134 -0.1940 1.2674 -0.0350 -1.6688 0.5866 -0.5196 3.5968 1.4628 0.8752 1.0696 0.5630 -0.3774 -2.0098 -0.0794 0.8287 0.0100 -0.6246 -1.2047 -0.5893 -1.1819 -0.7637 -0.7936 1.4242 -0.8519 0.5353 -0.2213 -1.4171 0.4375 0.7171 -0.2916 -1.1129 -0.3476 1.4225 0.7809 0.8794 -0.7518 1.6636 0.1482 -1.5493 -0.1240 1.1997 cinnamoylglycine -1.1681 0.0249 0.4701 1.6555 -1.0337 0.9251 0.1759 -0.1428 -0.6023 -1.1214 0.7512 -1.5429 0.4637 -1.4651 0.6902 0.4882 1.4548 0.5820 -0.2684 1.0105 -1.2787 1.3450 1.2444 0.4456 0.2574 0.3174 1.0995 -1.0600 1.0373 -1.4179 1.3208 -1.2843 0.8682 -0.1011 -0.1423 -0.1786 -0.1542 -1.2089 0.5264 0.0903 0.7961 -1.0262 -1.4229 0.4381 1.4879 1.0765 -1.4232 0.3334 1.5328 -1.3848 0.2259 -1.5874 0.3868 0.8222 -1.1519 1.3576 0.2262 1.3883 -1.4607 -0.4404 0.9516 0.7726 0.5546 -0.9334 -1.3912 0.4045 0.0859 1.0919 -0.6941 0.3360 1.3579 0.0712 0.4410 0.0879 0.9038 1.0740 -1.2884 0.2146 -1.2763 0.5761 0.3908 0.9538 -1.4125 -1.5702 -1.3275 -1.5190 -1.2855 -0.0954 0.2988 -1.1700 0.6549 0.3603 -1.3653 0.2082 -0.1529 0.3784 -1.3957 -1.3721 0.8320 -1.5215 1.0993 0.0036 1.4582 -1.6198 0.0758 -1.3374 0.2217 -0.4052 1.6681 -1.3260 0.6290 -0.4660 -0.1810 0.8941 0.0601 -0.2051 -1.2677 -0.2596 -1.5038 0.7105 -1.3105 -1.3709 -0.1953 0.7725 -0.0497 1.0048 -1.5430 0.4574 -0.2524 0.9061 -1.5353 -1.3021 -0.7593 0.5110 -1.4627 -0.2192 1.4478 0.0994 -1.4442 0.2716 1.3806 1.2244 0.2072 0.2318 0.4461 -1.4763 0.8540 0.7774 -1.3326 -1.2991 -1.2371 -1.2519 -0.7481 -0.1129 0.7246 -1.2735 0.3285 -0.5451 -0.3706 -1.0703 -1.3902 -0.6371 -1.2871 -0.8823 0.3183 -0.0443 -0.3174 0.0711 0.3421 -1.4201 1.1422 1.2846 0.6857 0.7489 0.3142 1.4253 -1.2438 -1.2518 -1.3696 -1.2332 -1.3717 0.4577 -0.7297 0.4636 0.5594 -0.0666 -1.4455 0.5151 0.6564 -1.3302 0.6062 0.5850 -1.3412 -1.2900 -1.2766 1.4594 -1.3613 0.9816 1.0264 0.1536 0.6983 0.1018 1.5575 -1.4005 -0.0929 1.9998 -1.4737 -0.0768 -1.4023 -0.5812 -1.3860 0.3601 0.9820 -1.4834 0.2734 0.2938 0.1370 0.3953 -0.6478 -1.5643 1.3851 1.1357 1.0148 -1.6565 1.5871 0.3072 1.2856 0.1161 0.5186 0.9821 -1.4762 0.5263 1.7500 0.6097 0.4692 -1.6136 -1.4797 0.3420 -0.2459 0.9759 0.5210 1.5465 1.5676 0.5048 -0.9452 -1.4358 0.8535 -0.3238 0.5058 0.7607 2.5296 1.4706 1.1138 -1.4710 0.7922 -1.3912 0.9990 0.8713 -1.4115 0.9639 -0.1562 -0.9103 0.9359 -0.9383 0.9618 0.6990 1.3549 0.5205 -1.3949 -1.5363 -0.5628 -0.1004 1.2539 0.1995 1.3688 0.7811 1.0711 0.6919 -1.5834 -1.2494 -0.2963 -0.0409 0.0697 -0.0188 0.4415 -0.1104 1.3529 1.3868 -0.3372 0.3904 -0.9950 -0.3997 -1.5230 -0.5125 0.1055 0.9043 -1.5269 0.2768 0.1930 0.1862 0.7327 0.0734 -1.4910 0.1084 0.6918 -1.6588 0.2903 -1.2574 1.4845 0.1649 1.2882 0.5608 0.8453 0.0358 -0.7539 0.7020 -0.3351 0.2486 -1.3884 -1.5490 0.1031 0.3690 -1.1928 0.6692 0.5041 1.0581 1.0830 -0.7934 -0.3379 0.3758 0.3551 0.5394 -1.4426 1.3461 0.3583 -0.2950 0.2893 2.2633 0.7685 1.1112 -1.4494 0.1012 0.5907 0.5749 0.6239 -0.5040 -1.3276 -1.5894 -1.5389 -1.6275 0.6147 -0.9774 -1.5297 0.3689 -0.6421 0.4647 1.4485 0.2582 -0.0565 0.0822 0.2919 -0.2022 0.3430 1.2431 1.4336 0.4507 0.3039 0.0883 0.6345 0.9884 1.1950 -1.5489 0.6273 -0.1328 0.4283 -1.2977 -0.4811 0.2830 -1.5886 -1.5630 1.9984 -0.1568 1.7176 1.5200 -1.8089 0.3727 -0.0500 -1.5275 1.0092 0.9870 -1.2864 -1.4518 -0.4197 -0.5957 0.7127 2.0014 0.7355 0.2058 -0.0607 0.0208 -0.4448 0.2422 0.6699 1.3212 0.7832 2.0776 0.4431 -1.5228 1.0899 1.1940 cis-4-decenoate (10:1n6)* 0.6559 0.7103 1.2605 1.6242 0.7916 1.6822 -0.7755 0.5010 0.9866 0.4126 1.3946 1.3122 1.5601 -0.2856 -0.1123 -1.5800 0.4722 1.7830 0.0494 0.3629 -1.3876 -0.1098 -1.0301 -1.4008 -0.3956 -0.1254 0.7475 -0.2892 -2.1627 -0.5730 -1.3679 -2.5380 -0.7182 0.7671 1.0821 -0.0779 -2.0428 -0.2008 -0.1572 0.9304 -1.7379 -2.6070 -1.7131 1.8177 1.1897 0.0829 -0.5697 -0.4793 -0.8886 -0.4347 -0.4219 0.8407 -0.8022 1.8029 -2.0383 1.3029 -1.4438 1.1280 0.3662 1.7569 -1.1389 0.1154 -0.6416 -0.3074 -0.6770 -0.3710 2.1077 0.8577 -0.0188 -1.7926 1.1920 -0.4405 -0.9249 -0.0790 0.7151 -0.1035 -1.1822 -2.0650 0.2075 -0.8653 0.0038 0.3840 -1.1811 0.6575 0.1477 -0.8473 -0.3155 1.7411 0.2384 0.1099 0.4711 -1.3717 -0.7569 -1.0334 -1.2316 -0.5850 0.1169 -0.1908 -1.0721 0.0061 -1.7524 -0.8263 -1.4190 0.8770 -1.2634 -0.7355 1.0682 0.6378 1.0229 -0.8438 -0.1504 -0.0968 1.4086 1.8495 1.5667 -0.9187 -2.9372 0.6157 0.5119 0.0943 -0.2317 0.4099 -0.6596 0.3189 -0.8173 -0.9387 -0.0401 -1.5432 0.2258 0.0577 -0.3119 0.1841 -0.1017 0.5192 -0.8466 0.4401 -0.7547 -0.2331 -1.3706 -0.2855 1.0562 -3.2690 0.0785 0.6321 0.8580 0.4207 1.2428 0.6310 0.9751 -0.6394 1.0979 1.1934 0.6673 0.6179 0.6554 0.5149 1.6061 -0.4822 -1.1508 0.6567 -2.2269 0.5879 0.7050 1.1908 1.2373 0.4815 -0.3509 -0.4839 -0.8686 0.2261 0.7479 0.8004 -0.6275 -2.1208 0.4076 1.5335 1.8546 -1.8713 0.2193 -0.1316 -0.0239 -0.2325 -1.0816 -2.3234 -0.9550 -0.2373 -1.7334 -0.0737 -0.7078 -1.2147 0.3766 1.2728 -0.2003 -0.0933 0.0922 0.9912 0.0636 -1.6617 -0.2119 0.8344 -1.2097 -1.3878 -0.0933 -0.9365 0.6774 1.8203 0.5402 -1.6439 0.0295 -0.2806 0.0715 0.2796 -0.1537 0.1205 0.2376 -0.5050 0.6694 0.1569 1.2393 -0.1662 0.9237 0.5971 0.3893 -0.4553 -1.1653 0.4401 -0.3598 -0.0319 -1.4029 -1.6919 -0.4192 0.0407 0.7232 -0.2900 0.7441 -0.0329 -0.7748 1.5244 -0.8245 -0.8076 1.5806 0.8198 0.6446 -0.4723 0.1374 1.3790 0.0609 -2.6826 0.9348 0.3061 0.1153 0.8493 -2.1011 1.7400 1.1037 -1.1711 0.1870 0.1423 0.7377 0.3277 0.6259 -0.0306 -0.5215 0.5906 1.0069 1.2780 -0.4791 -0.6939 0.0418 -0.4952 0.1845 -1.4810 -0.2998 0.2953 0.7126 -1.8684 1.4053 -1.4462 -0.8265 1.5865 -0.4862 0.3087 0.8626 -0.0833 1.6702 -0.9501 0.6325 0.3193 -0.2301 0.2608 0.9598 -0.0074 -1.0163 -0.1403 -0.1781 -1.4418 -0.0315 -0.4396 -0.3528 0.5947 -1.9881 -1.1627 0.1055 0.0412 -0.2586 -0.3059 0.5442 0.6748 0.4233 0.1942 0.3917 -0.4337 0.2627 -0.6280 0.9447 -1.5083 -0.7818 -1.5174 -0.5534 -0.5004 0.4559 1.4724 1.0495 1.0628 -0.5103 0.4723 1.0869 0.6181 -0.0938 -0.0295 -1.2938 -0.7081 1.0011 1.0296 0.2398 -1.5757 -0.8193 2.2590 -0.7254 0.0752 0.5894 0.6046 0.0400 0.6579 0.4583 0.0236 1.0566 -0.7347 2.0379 -1.0486 1.1009 1.9507 -0.1755 1.1485 0.5720 -0.9823 1.9678 1.1266 0.6483 -0.1450 -0.1109 0.1228 -0.3305 0.3939 1.1431 0.2681 0.4143 -0.1416 0.0996 -0.9926 0.5284 0.4320 1.2241 1.9740 -0.5385 0.7664 -0.4738 0.1030 -1.4352 0.2186 0.3536 -2.3126 -1.0290 1.0250 -0.0832 0.5463 -1.6127 0.9932 0.6327 2.4060 1.1524 -0.2923 1.4589 0.1619 -0.2606 1.6450 -0.7674 0.3082 -0.2789 -0.7807 0.0902 0.7105 -1.1890 -0.3801 -0.4189 0.8832 1.5699 -1.6838 -0.1512 -0.4071 cis-4-decenoylcarnitine (C10:1) 0.9814 0.4729 2.2237 1.2402 0.5965 0.4168 1.0607 -0.9342 1.0621 0.6263 1.2920 0.5327 1.8312 0.1238 -0.4337 -1.1342 0.6079 1.1588 0.1850 0.0403 -0.2000 0.0757 -0.5172 -2.2489 0.2913 0.2484 1.2902 0.5367 -1.5640 -0.4077 -1.1391 -1.3801 -0.3305 0.8336 0.5192 -1.0776 -0.8160 -0.0423 0.0959 2.1962 -1.8493 -0.1222 -0.9780 1.8812 0.1586 1.1924 -0.7703 -0.2175 -1.4970 0.4908 -0.9379 0.6723 0.2849 0.7320 -1.9756 2.1043 0.0011 0.8193 0.1907 1.8248 -1.6417 -0.1509 -0.3952 -2.2073 -1.1979 -0.6454 1.1008 0.6749 -0.2905 -0.7114 0.5463 0.4172 0.0205 -0.3344 0.4649 0.0326 -0.8181 -0.5947 -1.2331 -0.9108 -0.2046 -0.3778 -0.9899 0.6050 -1.1765 -1.4709 -0.3404 2.2580 0.3151 0.3920 1.0004 -0.2922 0.1218 -2.1465 -0.9155 -0.9286 0.1365 -0.8596 -0.3872 -0.9474 -0.1263 -1.4763 -1.9324 0.5661 -0.7441 -1.1839 1.9181 1.4746 1.7009 -0.4466 -1.4151 0.4083 -0.2094 1.3050 0.8804 -1.5827 -2.0876 0.8224 0.7857 0.4373 -0.8314 0.9137 0.2407 -0.0375 0.0632 -1.6768 0.5102 -1.8104 0.9841 -0.9149 -0.5148 -0.2584 -1.2001 -0.4488 -0.8769 -0.6488 -0.3108 0.0711 -1.6536 0.3912 1.0014 -1.9822 -0.3623 -0.2089 1.7144 1.1137 0.0695 -0.2783 1.3965 -0.3443 0.6549 2.2619 1.6344 1.7182 1.1782 -0.3224 1.6314 -0.0401 -0.9070 1.7410 -1.2873 0.5496 0.0654 1.5049 0.5684 -1.0357 -1.2666 -1.4310 -0.4012 -0.1844 0.1644 0.5117 -0.9852 -1.6872 1.3084 1.5559 0.4545 -0.4839 0.3820 0.5580 -1.1104 0.2632 -0.9365 -2.5594 -0.0866 -0.0028 -0.6323 0.6400 -0.5247 -2.3914 1.4719 0.0864 -0.7113 0.2495 -0.6285 0.3980 0.4531 -1.4115 -0.3413 0.5487 -0.8390 -0.3083 -0.0663 -1.4687 0.2554 0.5122 0.9202 -1.1165 -0.8612 -0.7511 -0.1273 -0.3127 -0.6804 -0.2486 0.3241 -0.8249 0.3280 -0.7377 -0.4127 -0.6226 -0.5179 -1.0031 -0.1372 -0.8633 -1.1598 0.3870 -1.1630 -0.1293 -1.1114 -1.2878 -0.8500 -1.0348 -0.2043 0.2285 0.6939 0.2881 -1.2299 1.8403 -0.7067 -0.2784 1.0376 -0.6928 0.7315 0.9570 -0.2604 0.5993 -0.1307 -0.8136 -0.6965 -0.6172 0.3848 -0.8496 -0.5284 1.8101 1.5949 -0.5357 0.2158 0.1024 0.4663 0.5124 1.0812 -0.6774 -0.8947 0.4837 0.3624 1.3148 0.4145 -0.3971 0.3864 0.5235 0.6913 -1.4706 0.2330 1.0873 -0.4208 0.3108 1.0229 -0.6213 0.5353 0.9815 0.3019 -0.8411 0.2257 0.3780 2.3926 -0.7317 0.6599 -0.4301 -0.5847 -0.5515 2.1093 -0.2212 -1.2497 0.0428 -0.5496 -1.2611 -0.9633 0.7730 -0.3902 -1.0017 0.3362 -1.5572 0.3733 -0.4155 -0.0926 -0.4452 -0.2796 1.5525 0.9279 1.1627 0.0199 -0.4376 -0.9167 -0.7644 1.3001 -1.4739 -1.0849 -0.1832 -0.3174 -0.9617 0.7859 0.7872 0.0032 0.7518 -0.3030 0.4046 0.5333 -0.1009 -0.3471 -0.3047 -1.3621 1.0982 2.0223 0.5694 1.0884 -0.6989 -2.4776 1.8598 -0.0099 -1.3170 0.6290 -0.4780 -0.8238 0.5979 -0.2322 -0.7419 0.3084 0.0492 1.5168 -0.8382 1.9815 2.2590 -0.1612 1.2246 0.3221 -0.4973 2.2484 1.6824 0.8640 -1.0793 -0.1445 0.0939 -0.7811 0.3404 0.5351 0.7685 -0.5342 -0.7296 -0.8986 -0.4983 0.0808 2.1146 1.5831 2.1426 -0.1648 -0.3493 0.1322 0.1073 -2.5563 0.4828 1.1775 -1.4227 -0.8268 0.2407 -0.4344 1.0392 -1.3362 0.6128 1.0247 2.8797 0.7697 0.9753 1.6449 1.0435 0.7502 1.2495 -0.5156 0.8117 -0.5024 1.3537 0.4979 -0.1140 -1.3479 -0.1830 0.2604 0.5926 0.0046 -1.4732 0.0036 -0.7479 citraconate/glutaconate 2.0431 -1.0295 0.2195 -0.6447 -0.4041 2.0365 -0.1271 1.4355 -0.5917 0.5837 1.3709 -1.0261 1.5319 1.3542 3.5069 -0.3787 1.5445 -0.3245 -0.3194 -0.6887 -0.2811 -0.8213 0.1865 -0.5483 -0.0081 1.5386 -0.1268 -1.0947 -0.8127 -0.6625 -0.3604 -0.8354 1.6865 1.2221 -0.5669 -0.6678 0.1072 0.4930 -0.1925 0.2306 -0.6381 0.2664 0.9098 0.7308 -0.7747 -0.9501 -0.5687 -0.5254 -0.6769 0.5807 -0.3851 -0.9557 -0.3483 0.3905 -0.3185 -0.9143 -0.7240 1.8593 -0.4834 -0.8921 -0.4071 -0.8431 0.1646 2.6148 1.7672 1.1521 -0.6134 -0.6734 -0.1906 -0.7960 -0.9415 -0.7362 -0.2572 -0.4677 0.1659 -0.0812 -0.7978 -0.7339 -0.5915 1.2715 -0.2458 -0.1333 -0.3482 -0.9374 1.8041 0.9906 -0.1208 0.4937 -0.9852 -0.7131 0.4565 -0.5349 0.2948 0.0995 0.3141 -0.3104 -0.4981 -0.5031 0.0709 -0.7463 -0.4929 -0.2160 -0.2868 0.7446 -0.1900 2.2687 1.3180 1.6516 0.3596 -0.2895 -1.0731 -0.8006 -0.4764 -1.0168 0.9177 -0.5308 -0.0550 1.3445 1.4772 -0.8375 -0.4840 -1.0678 -0.3840 -0.7312 -0.9188 -0.7523 -0.4125 -0.5763 -0.6067 -0.7453 -0.0178 1.3029 -0.4795 -1.0022 -0.2635 -0.2043 1.4971 -0.2898 0.0044 -0.1847 -0.3291 -0.2984 -0.2381 -0.6368 -0.4552 -0.3742 -0.6241 0.0651 0.1819 -0.2663 -0.0442 -0.2578 -0.4283 1.3146 1.2385 1.3899 -1.1188 -0.7936 2.6645 1.5169 1.1838 1.1900 -0.4157 -0.6401 -0.2589 -0.9008 2.2084 -0.5330 -0.5938 -0.5151 -0.4543 -0.6851 0.4278 -0.5618 -0.7865 -0.4200 -0.2370 0.0105 -0.7077 0.4226 -0.0890 -0.6606 0.8632 -0.6092 1.3118 0.9786 1.2712 1.2944 1.3977 1.7048 -0.7314 0.1075 -0.4615 -0.8379 -0.6241 -0.9500 1.3160 0.6071 -0.3793 -0.3098 1.3215 -0.2005 -0.3852 -0.0218 -0.3614 -0.9604 -0.2329 -0.2294 1.1252 1.5948 -0.2783 0.1383 -0.7397 2.4853 0.7441 -0.6320 1.2747 0.5909 -1.1167 -0.1749 -0.1299 1.0533 -0.4738 0.0252 -1.5425 -0.8547 -0.7822 0.0493 -1.2550 -0.7940 1.0395 -0.6253 -0.8946 -1.0898 -0.6379 -0.5907 1.2420 1.2802 1.4676 -0.3177 -0.1800 -0.6063 -0.3402 -1.1735 -0.6160 -0.2939 0.7120 2.2423 -0.7035 0.1401 0.6470 -1.1887 1.3674 -0.6731 -0.6016 -0.5790 -1.0673 -1.0778 -1.1407 1.3964 -0.5597 -0.4321 -0.8640 -0.1725 -0.7560 1.8788 1.4275 1.5777 -0.4230 -0.8285 0.1798 0.5309 0.1801 0.9199 -1.0911 -1.0949 -1.1064 0.3278 -1.2431 -0.9640 0.1199 -1.0213 2.4504 4.9426 1.3722 -0.6077 -1.2422 -0.6131 -0.9462 -0.9201 0.2150 1.6909 -0.4766 0.8212 0.0190 3.1832 -0.3188 -0.7715 1.1772 -0.4340 -0.2423 -0.5342 -0.4516 0.2698 -0.8227 2.1202 1.2666 0.0448 -1.5314 -1.3121 -0.8692 0.1226 -1.1816 -0.9618 2.0788 -1.0874 -0.8377 -0.7355 -0.2058 -1.1721 1.4988 -0.4503 1.3378 2.4834 -0.7445 -1.1940 -0.6069 -0.4119 -0.3533 -0.8784 0.9344 -0.5124 -0.9478 -0.4791 -0.6563 0.0326 1.6270 -0.8935 -0.9945 -0.6234 1.2005 -0.0809 -0.7236 -0.3985 -1.0911 -0.5097 0.0664 0.3170 1.4867 1.2622 1.5607 -0.0951 1.1091 -1.6924 -0.9295 -1.2772 -1.3280 1.6271 -0.1391 2.0558 -0.4661 -0.7597 -0.3811 -0.7333 -1.2281 0.1499 0.1773 0.3892 0.6192 0.7168 0.8066 1.3890 1.1172 1.1713 0.8958 0.4437 0.2219 -0.4450 2.7932 -0.9099 -1.2542 0.8225 1.4869 -0.4885 -0.4467 -0.2992 0.8943 -1.0814 1.1633 -0.5497 0.1731 -0.9706 -0.7446 -0.9296 -0.6826 1.0479 -1.2458 -0.7033 -1.1028 1.6932 -1.2797 -1.4354 -1.2014 -1.4341 0.4031 -0.0435 -0.8555 -0.6086 1.4943 0.6109 citrate -0.7657 0.2674 -1.0910 -1.1718 -0.6343 -2.5292 0.2947 -1.3589 0.1110 -1.8660 -0.9119 -0.8788 -1.0491 0.7913 -0.1318 -0.2011 -0.5137 0.3519 0.3930 -2.1868 -0.7607 0.1900 0.1285 0.3173 1.1705 -0.6127 -0.5767 -0.8843 -0.2310 -0.4026 -0.8091 0.7577 2.0252 -0.0125 -1.1760 -0.0681 0.0057 0.5946 -0.0025 -0.7499 -0.7428 0.4926 -0.2880 0.0204 0.2683 0.3362 -0.1181 0.6083 0.2513 -1.8927 0.1375 -0.1457 -0.2157 -0.5242 0.6221 0.1911 0.5792 -1.2633 0.3163 -0.2974 0.7558 -1.1235 -0.2747 -0.3268 -1.5068 0.4925 -0.2497 -0.4468 1.1466 0.1357 0.1166 -0.0173 1.0303 0.0990 1.0638 -0.3590 0.5358 -2.3882 0.1408 0.0724 -0.9134 -0.6707 -0.0011 -0.3077 -1.3057 -0.3220 0.7046 0.4509 -0.6458 -0.7442 -0.3206 -1.1172 1.4691 0.2880 -1.4674 0.3177 -0.3622 -0.1745 0.0189 1.0809 -0.0953 0.7192 -0.2970 1.7859 -0.6393 -1.2170 -1.3246 0.2666 0.3158 0.0555 0.0058 0.2709 0.1862 0.3069 0.1552 1.0864 -0.6239 -0.4240 0.2178 -0.5745 -0.0292 -1.5549 0.9075 -0.6540 0.2069 0.4651 0.6421 0.4256 -1.3509 0.7744 -0.8521 -1.4372 -1.8812 0.3226 -0.8334 -0.3792 0.4020 0.2310 1.1711 -0.3290 -0.3186 0.2477 -0.3568 0.1987 0.8026 -1.9575 0.2945 1.2966 -0.2890 0.2886 0.3478 -0.8121 -0.5365 -0.1001 0.3537 0.1062 -0.9124 -0.6934 -0.1800 0.9052 -0.2845 0.9549 -0.5436 -0.6251 0.1463 1.1564 -2.6975 0.0102 -1.7713 0.5771 0.8180 -0.8617 0.8327 -0.2158 -0.7141 -0.1807 -0.3345 -0.5991 0.9074 0.2617 1.8044 -0.3944 0.7848 -0.5558 0.0182 -0.6840 -1.2962 -0.1140 0.1152 0.3610 -0.1512 -0.9096 0.5848 -0.3887 1.6211 -1.2387 0.0207 -0.0033 0.9839 -0.0095 0.0513 1.3974 -1.8108 -0.1293 0.7115 -0.9097 -0.5441 -0.1059 0.3637 0.2958 0.7132 1.5122 1.7448 0.6762 -1.8839 0.7551 -0.4923 -0.2240 -0.3681 0.0155 0.0750 0.3411 0.2355 -1.0361 1.0283 0.9238 -1.6842 -1.3065 -0.3205 -1.3364 0.1514 0.3253 0.8627 0.7288 0.5363 -0.3793 -0.2745 -0.1939 -0.5328 1.1504 0.7683 0.7041 -0.8109 0.4566 -0.0541 0.4671 -1.6448 -0.2737 0.0342 0.9613 0.2302 0.7597 0.8549 -0.4029 1.1143 1.2469 -0.4099 0.6157 0.3045 0.0806 -0.8913 0.7467 0.1273 -0.0769 1.1795 -0.7372 -0.9599 -0.0864 -0.5648 0.4628 -0.2317 -0.5047 1.0456 1.1420 -1.1246 0.7205 0.4906 -0.5852 -0.7379 -0.1105 -0.4063 -0.3401 0.3794 1.0739 -1.5392 -0.5099 0.2861 0.4150 0.4692 0.0455 0.8922 0.9360 -0.0175 0.9663 -0.0931 0.1368 0.4895 2.5194 -0.5274 -0.9418 -1.1239 -0.3014 0.3197 -0.4278 0.4619 0.9856 0.2676 1.1951 -0.1495 -0.6138 -0.3931 0.9940 -1.4503 -1.0586 0.0488 0.0192 0.2678 -0.3452 0.3235 0.2780 -0.4824 0.3313 -1.8334 1.0500 0.4691 -0.1412 2.1010 0.8215 -0.1055 -0.6774 0.3575 0.7669 -0.0938 -0.2850 1.1738 0.6321 -0.0553 1.4136 -0.7164 -0.7338 1.1519 -1.1202 0.9595 -0.6449 0.9171 -0.5321 0.4982 -0.4237 0.4473 0.2803 -2.0464 8.6509 -0.3565 -0.8310 -0.4277 0.0252 0.4598 0.5772 -0.2159 0.3538 0.7134 -0.1417 -0.3117 0.3401 2.0782 2.1237 -0.2098 0.8617 -0.0043 -0.4289 -0.1412 0.9737 0.1871 -0.9674 0.7151 -1.9969 -0.4145 -1.0482 -0.6300 -1.1965 -0.1969 -0.4647 0.9571 0.9224 -0.3440 -1.1543 -0.2975 -0.7817 0.6220 -0.3202 0.3234 1.0941 7.5493 1.4483 0.4286 -0.8698 0.7884 0.6084 -0.2041 0.2305 -0.3688 -0.2029 0.1506 0.0412 0.6089 -0.7603 0.3853 -0.0692 -1.3620 -1.4059 citrulline -0.6341 0.5450 0.0702 1.1392 2.1954 1.8610 0.0138 2.0450 -0.6721 0.2103 1.3683 0.3806 0.1716 -0.0200 1.3543 -1.5247 -0.2282 0.3042 -2.5209 -0.4467 -1.6146 -0.6721 -0.8664 -0.5668 -1.9163 0.2991 0.0194 -0.7669 -1.4143 -0.5526 -0.4331 -1.4876 1.7534 -1.1776 1.3115 -0.6033 -1.4030 -0.6775 -0.3281 -0.4703 -0.9171 -1.8379 -0.7952 -0.0541 -0.3003 -0.7547 -2.0790 -1.3587 -1.2813 2.4577 -1.9892 -1.3187 -1.0665 -2.0591 -2.1628 0.7646 -1.1263 0.8904 -1.4380 -0.9422 -1.6410 0.4845 0.3543 1.7640 -0.1195 1.0987 1.8607 0.5017 -0.8574 -1.3025 -0.3648 -1.2686 -1.3673 -0.2398 -0.4491 -0.8094 -1.6840 1.0827 -0.1887 0.7601 0.9667 0.4472 -0.2275 -0.4559 0.4349 -1.7033 -0.4655 -1.0350 -0.1434 -0.0819 0.0649 -0.2739 0.5749 -1.4468 0.0057 -2.8072 0.2958 -2.0435 0.6359 -1.3011 -0.6615 0.9241 -1.0330 -0.6752 -0.0137 0.4184 0.6939 -0.2793 -0.8310 -0.3955 1.3123 0.8608 0.2925 0.4390 -1.0862 0.6278 -0.4924 0.7511 0.0160 -0.4233 -0.4812 -0.6625 -0.4278 -0.3510 -0.9064 -0.1686 -1.4061 1.5844 0.0995 0.4306 1.5273 0.2339 0.2556 0.7760 4.0578 0.9677 0.4530 -1.4701 -1.2728 -0.7315 0.3181 -0.2753 -2.0474 0.9880 -0.2319 0.6626 0.0263 0.3784 -1.7571 -1.3456 0.3190 0.6767 0.2452 -0.5756 -1.5231 -0.3628 0.0581 -1.9289 -0.3294 0.2913 1.5060 -1.7224 2.1758 -0.4023 0.4748 0.8224 0.9823 0.9060 -1.1682 -1.6311 0.7683 0.4809 -0.5629 -1.3984 -0.0140 -0.2266 0.6141 -1.5288 -1.6795 -1.5938 0.5211 0.8351 -1.4442 -1.1528 0.3745 -0.3247 0.9025 -0.4610 -1.1992 0.8786 -0.3475 0.2968 -0.3275 0.7541 -0.3190 -0.2085 0.4502 0.5311 -0.3322 -0.0860 -1.8479 -1.0907 0.7308 -0.5199 -0.4598 1.0493 -0.0749 -1.1328 -1.0380 -1.0784 -0.2413 1.3246 -1.2691 -0.8274 3.2108 0.6192 0.4451 1.0992 0.5239 0.4574 0.4137 0.2022 -1.5060 0.8422 -0.7367 0.5506 0.6775 0.0761 0.8084 -0.2888 0.6437 0.3988 0.0931 0.0806 -0.1758 -0.6005 1.7694 -0.7141 0.0446 1.0044 1.3327 -0.4530 1.0983 2.2564 -0.6366 -0.2257 0.3479 0.6867 -0.1018 -0.4156 -0.1046 -0.5412 0.2783 1.3939 -0.3757 1.6184 0.4081 -0.5344 -1.8062 0.0678 -1.0206 -0.1927 0.6106 0.3035 -0.6358 -0.9882 0.5311 -1.0374 2.1996 -0.3107 -0.0623 0.0984 0.5921 0.2942 1.3868 1.1484 0.6232 0.2874 -0.5326 -0.0428 -0.0786 1.0705 0.9083 -0.1765 -1.0448 -0.4618 0.5022 1.2192 0.4536 -0.2410 -1.5585 -1.8867 1.4415 0.3346 0.7834 -0.3183 1.2588 -0.6390 0.3612 0.5320 1.4313 1.6067 0.7589 0.0956 1.9223 1.0534 -0.4185 -1.0051 0.7753 1.2000 -0.0305 1.7676 0.9107 -0.0632 0.2167 -0.6512 0.1398 1.4803 0.3534 -0.3829 -1.3482 -0.0401 0.1004 -0.1480 0.5218 0.8560 0.4774 0.6724 1.1935 -0.6401 -1.2211 -0.0569 0.9372 0.4069 0.1987 0.7204 1.1576 -0.7630 2.5805 1.1094 0.2668 -0.2626 0.6550 -0.1318 0.1423 0.1264 0.5069 -0.4335 -0.5513 0.3174 0.8184 0.3406 1.4768 1.0822 -0.0331 -1.2173 -0.7333 0.6850 -1.0946 -0.9781 -0.7335 0.9437 0.8629 0.6391 -0.3950 -0.7737 0.0894 -0.5372 0.0846 -0.9865 -0.0875 0.6243 -0.5516 3.0219 -0.1028 1.8380 0.4032 0.6551 1.1038 1.6627 0.7265 0.5842 0.1341 1.0695 -0.4404 -0.7711 -0.1762 -0.4931 -1.7761 0.2351 -0.7766 -0.2192 0.1423 -0.3606 -0.5187 1.0537 0.1469 -0.4812 0.0886 0.3735 -0.8930 2.2463 -0.7283 0.7204 0.5905 -0.1269 0.3406 0.6182 0.9840 -0.7981 corticosterone -0.1908 -2.3959 -0.6282 -1.6770 -1.1413 -0.0009 -2.1238 -1.0734 -1.8970 0.3920 0.9813 -0.9534 -1.7241 -1.8929 0.4838 0.4904 0.2949 1.0340 2.3311 1.3352 -0.3861 -0.3100 1.2928 1.3053 1.4449 -0.0440 1.4857 0.8845 -1.5625 0.1850 -0.0466 1.6501 0.3944 -0.5893 -1.3235 -0.3241 1.3503 -1.4467 0.1839 0.0578 0.9086 1.3454 0.5036 0.3022 0.6893 0.8100 0.4446 0.4427 0.5424 -1.7537 0.4897 0.8797 -0.1306 0.5900 1.1761 1.0189 1.0929 0.2443 -0.5822 0.7926 -1.5843 -2.0564 -0.1495 -0.3334 -1.7636 -0.3330 -0.6871 0.2725 0.8672 0.6625 0.4116 0.1387 0.4971 -0.6297 0.8887 2.0134 0.1416 -1.7891 -1.5640 -0.1032 0.1803 0.9174 -0.5549 1.2721 0.0340 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-0.8502 2.1247 -2.1760 0.1231 3.5907 -0.3797 2.9042 -0.0745 2.8021 5.8582 -0.4274 0.1129 -0.2224 0.3139 0.7949 2.2379 -2.0222 -0.5046 0.0182 0.8326 -0.0629 -0.0637 0.0262 -0.5263 -1.4816 0.1915 0.9123 0.3419 -1.9529 0.3520 0.4746 0.1524 0.1188 -1.1264 4.8409 0.8367 -0.2740 -0.0530 -0.7679 -0.0566 0.4108 -0.0651 -0.0948 -0.3766 -0.4484 0.7391 -0.5371 0.4670 0.1119 -0.3530 -0.4968 0.4618 1.9427 0.6306 -0.2545 0.1602 0.1247 0.2287 -0.3930 1.0053 -0.0745 -0.3769 2.7011 -0.3751 -0.1164 -1.5339 0.7574 -0.2425 -0.1827 -0.2258 0.0179 -0.1139 -0.0172 0.8912 0.3508 -0.0319 -0.1317 -0.5874 -0.4053 0.0784 -0.8909 -0.1412 -0.5936 1.8880 -0.4475 -0.2367 1.0074 -0.3217 -0.4611 0.0714 0.8999 -0.0957 0.2900 1.9390 1.0505 -0.6792 -0.6553 -0.0035 -0.7317 0.4673 -0.2738 0.5423 0.1613 1.1381 0.1711 4.4305 -0.1088 -0.5615 0.2900 0.0533 -0.9846 0.2071 0.4821 -0.3842 0.9093 0.5715 0.3560 2.0374 -0.6471 -1.1259 -0.7337 -0.0736 -0.5254 -0.3827 0.2953 -0.1689 -0.3346 -0.7302 -0.8614 -0.7914 1.8204 -0.6317 -0.1251 0.1690 0.0793 0.3951 -0.1397 0.0229 0.1073 0.3989 0.8529 -0.2562 -0.6672 -0.1305 -0.6195 0.3783 1.0219 -0.9289 0.6366 0.3595 1.0373 0.6544 -0.9069 -0.2375 0.1630 0.4457 0.3521 -0.0158 -0.1568 0.8737 -0.4244 -1.7290 -0.1731 0.3289 -0.2832 -0.0614 0.0464 -0.7658 0.0897 -0.5420 0.1012 -0.5381 0.1016 -0.5831 -0.4517 -0.2304 -0.2894 0.9979 -0.0332 -0.3511 -0.3968 -0.2170 0.1677 -0.1737 0.7056 -0.1448 -0.2906 0.0762 0.3883 0.0435 3.1958 0.6258 0.4965 -0.7098 0.1476 0.0001 -0.0428 -0.4312 -0.0803 0.7899 -0.8781 0.9372 1.6618 0.4237 -0.0658 -0.3511 0.4295 0.1362 0.8188 0.3212 -0.2501 1.0216 1.3062 -1.3735 0.4408 2.3072 1.0013 0.7400 0.1046 -0.1327 -0.9863 -0.1229 -1.1850 -0.6452 -0.0113 1.4806 0.2209 0.0545 -0.2612 -0.7238 -0.7835 -0.2037 0.7467 0.6852 1.1475 -1.1366 0.3630 -0.7759 0.0809 0.3583 0.5060 0.5354 1.0869 -0.0485 0.4627 -0.4099 0.0194 -0.4355 -2.0057 0.4660 -0.4399 0.2724 0.9836 0.2681 -0.2848 0.0222 -0.0266 -1.2386 0.0435 0.0016 0.4785 0.1941 -0.6097 -0.3597 0.0521 0.1047 -0.6987 0.6984 -0.3578 -0.1816 0.0388 -0.0928 -0.0284 -0.7191 0.4123 -0.2225 -0.4007 -0.7628 0.5018 -1.0100 -0.8098 -0.1751 0.0858 -1.4892 -1.5351 -0.0983 -1.2739 -0.4099 -1.8497 1.2122 -0.2235 1.1525 -0.6621 0.3020 -1.0361 0.4625 -0.0055 0.2736 -0.0341 -0.5992 0.1709 0.2933 -0.6845 -0.6804 -0.3829 -0.6462 0.0949 -1.4283 0.5035 -1.1336 -0.2930 -0.1974 -1.1122 -1.6749 0.6996 -0.4200 -1.0091 -0.4597 -1.5987 0.5887 1.3799 -0.2486 -1.5422 -0.1998 -0.6339 -0.1946 -1.3137 -0.8096 -0.1375 0.0053 0.1895 1.0610 -0.5706 -0.0895 -0.1504 4.2523 -0.6812 -0.7426 -0.1998 -1.0827 0.0656 -0.7176 -0.2769 -0.2147 -0.0586 0.5027 0.5541 -0.2844 -0.5641 -0.4373 0.2596 0.2404 -1.7253 -1.7692 -1.1776 -0.9487 0.2091 -0.2641 -0.8188 -0.3071 -0.0015 -0.4635 -0.6566 -0.5511 -0.8761 0.1973 -0.4295 0.6974 -0.1428 -0.3493 -0.0329 -0.1762 -1.2672 -0.9987 6.5688 -0.6446 0.7078 0.6272 -1.1808 -0.8551 -0.1415 0.6498 1.2223 -0.6432 -0.1064 1.0195 -0.4893 -0.9958 -0.5966 0.1851 0.2454 -1.7559 -0.5038 -0.3683 -1.3269 -0.7337 0.0528 -1.0442 0.2346 -0.8302 -1.5183 -0.2111 -2.4579 -0.0967 2.2506 -0.8146 -0.6483 -0.2821 0.7206 cysteine-glutathione disulfide -1.1835 0.1301 -1.4303 -0.3455 0.6179 1.3387 0.8622 -1.5011 -1.4355 -1.1480 -1.2990 0.6649 0.9674 -0.2370 1.3750 -1.4499 -1.5433 -0.0282 1.2559 0.7895 0.5337 1.0756 1.1228 0.9411 0.7101 1.1547 0.2345 -1.3075 0.5025 0.5782 0.8273 0.9555 0.2040 -1.5910 -1.6271 2.6822 0.5541 0.2914 -1.3120 0.9284 -1.2036 -1.0567 1.0512 -1.5353 1.5157 -1.5528 0.3634 0.4678 0.8713 -0.1800 -1.3704 -0.5989 0.6578 -1.4663 0.9317 -1.5043 0.7820 1.2158 0.2758 -1.4779 1.2045 0.6767 0.9734 -1.3197 -0.7306 -1.5381 1.1787 0.6698 0.9274 0.3930 0.9218 1.3000 1.0529 -0.1577 -1.3905 -1.5129 0.2289 1.1554 -0.0031 0.2551 1.2253 -0.3087 -0.0874 1.0842 -1.3242 0.3417 1.0037 -1.3408 -0.6689 0.8816 -1.6484 -1.3412 -1.3497 0.5827 0.3961 -1.3343 0.9575 0.1095 0.4042 1.3670 1.0657 0.2536 0.5339 0.9608 0.9120 -1.3291 -1.4395 0.4032 -1.6721 -1.3103 -1.5374 -1.5112 0.9770 0.3804 1.6802 0.8829 1.0116 1.3387 -0.1125 1.1683 0.8838 0.7208 1.6498 0.3934 -1.5629 -0.4230 0.8487 0.9942 0.6080 -1.5624 0.3261 1.1179 0.6360 0.6261 -1.4329 0.2201 0.4002 0.8937 -1.4140 0.7354 -0.3205 0.4302 0.6018 1.4562 0.6929 0.8173 -1.3816 0.3627 0.1127 1.4841 0.5972 0.3900 1.3317 -0.8885 -1.4262 0.2216 0.0699 0.1842 -1.4801 0.5426 -1.3645 -1.3121 -1.2761 0.6513 0.2801 1.7525 -1.4976 -1.4653 0.3250 -0.6247 -0.0741 0.2976 0.5529 -1.2489 -0.2710 1.2483 0.8947 0.5834 0.5768 0.5706 0.1159 -0.3262 -1.4367 0.2936 -0.0162 -1.5731 -0.1243 0.0502 0.3794 -0.3636 -0.0032 -1.2744 1.4384 0.6839 1.2360 -0.4209 0.4153 0.9262 0.4829 0.9901 1.8006 -1.2503 -0.3061 -1.3572 0.0053 0.9971 0.7729 0.3326 0.4691 -1.3757 0.2839 0.5264 1.2009 0.1374 0.4192 -0.0411 -1.5909 0.2916 -0.0675 -1.5207 0.3619 -1.4867 1.2817 -1.5933 0.3927 1.1203 1.2844 0.3620 0.6337 -1.3863 0.2008 -0.5811 0.8201 0.6321 0.7534 0.0648 -1.4450 -1.3530 0.3102 -1.3236 0.4038 -1.5791 1.2337 1.4460 -0.2782 0.2626 0.4101 -1.5605 -1.5502 -0.8018 0.7160 -1.5161 0.8812 1.8287 0.9286 0.8634 0.3523 1.2722 0.9543 0.9950 -1.4771 0.5998 0.2078 1.5924 0.2657 0.9814 0.9482 -0.1959 -0.0886 -0.0985 -0.3345 -1.3498 -1.5372 0.1171 0.3805 0.0686 0.5609 0.9637 0.5878 -0.5392 0.3550 0.4820 -1.5630 0.5050 -1.3815 -0.0314 -0.2847 0.8764 -1.5372 -1.6009 0.2350 0.3526 1.0562 -1.5682 0.3211 0.5374 -1.4911 0.3789 0.5597 1.1743 0.0466 0.2818 -0.6026 -1.5288 1.5464 0.2369 -1.5020 0.5086 0.6590 -0.7339 1.2192 -1.5312 -0.0346 -0.7907 -1.6233 -1.4476 0.2422 0.6542 0.4229 -0.4632 -0.2040 -1.5227 -1.7553 -0.0434 -1.4679 -0.2106 1.1076 -1.4311 0.3364 0.6360 1.0496 1.2162 0.7379 -0.7441 1.0618 0.1015 -1.4952 0.0976 1.8362 -0.6913 0.0367 0.3871 1.5190 0.5159 0.0229 -1.3775 0.0254 0.5991 1.1071 0.1606 0.8667 1.2508 -1.4928 -0.1939 -1.5012 -1.6273 0.4098 0.5514 0.2211 -1.5951 -0.9093 0.1149 1.5296 0.2463 0.7855 0.2503 0.3290 0.2283 -1.5949 0.1162 -1.3411 0.3049 -1.4134 -0.3414 0.7376 -1.3264 -1.7348 -1.5813 -1.5496 0.4091 -0.2690 0.4607 0.4768 0.4531 -0.1819 -1.7203 0.4892 0.6324 0.1773 1.3148 0.7870 -1.4075 -1.1355 -1.4948 0.8465 -1.5795 -0.0490 -0.3869 -0.4629 0.7171 -1.6631 1.1171 -1.3878 -1.5600 0.6848 0.7776 0.9257 -1.4814 -0.2172 0.2824 cysteine s-sulfate 0.6506 -1.6718 -0.8675 1.1809 0.9665 -1.6472 -0.7090 -1.0566 0.0516 0.3762 -1.5144 0.2137 -0.9079 -0.8693 0.8621 -0.0896 -0.0166 1.9188 0.8798 -0.0769 0.0684 -0.3941 2.0850 0.9427 0.7335 0.7829 0.9501 0.5469 1.0407 0.9741 0.0793 -0.0500 -0.5653 -0.3363 -0.8910 -0.1123 -0.5625 1.1927 0.5442 0.9001 1.4531 1.1317 0.0426 -0.8568 0.0942 0.5205 0.8815 0.9705 -0.3171 1.4124 0.1218 -0.2391 -0.3454 0.1840 -1.1550 0.2354 -0.4827 -0.0915 0.1826 0.4711 1.4555 0.3662 -0.1547 0.4070 -0.8359 -0.6616 1.6096 0.5249 0.6601 1.1480 1.2727 0.0374 -0.5811 -0.3750 0.1777 0.5838 1.5033 0.9146 -0.0803 -0.2533 0.1114 0.7466 -0.2802 -1.0382 -0.2263 -0.2067 0.3329 0.0109 0.0755 0.8889 -0.3794 -0.4151 -0.6020 1.5562 -0.3152 0.7616 -0.5576 0.2710 0.0559 0.1769 0.8826 0.8860 0.8631 -0.6505 0.3239 1.4520 -2.9034 0.4083 -1.9365 0.2850 -0.8763 0.0832 -0.6623 -0.3325 0.2752 0.1848 -0.6148 1.4133 -2.8790 0.2205 2.2318 1.0559 -0.3083 -0.6615 -1.2228 0.6869 -1.2042 -0.6642 0.4703 -0.6598 -0.6925 -0.7519 -0.5219 -0.1010 1.1987 0.9152 -1.3208 -0.0885 -1.0307 0.0519 0.4930 -0.3998 0.7074 0.8098 -0.4320 -0.0462 0.5075 0.3228 0.6163 -0.4193 -1.0631 -0.1959 0.0011 -0.8695 -0.3845 0.6875 -1.3800 1.5896 -1.3820 2.1248 -0.3912 -0.2867 0.7674 -0.7752 0.7256 -0.2381 -0.8705 0.0822 -0.4383 0.8679 1.7917 -0.1270 3.7054 0.6721 0.0271 0.7408 0.3248 -0.0798 0.4730 1.9789 1.5708 -0.6896 0.5122 -0.2486 -0.5149 0.6431 0.2657 -0.5748 0.7678 -0.9618 0.4080 0.1411 0.4432 0.7138 0.3573 -0.6920 -0.9080 -0.5524 0.7831 0.2363 0.0117 1.4394 -0.1247 0.0574 1.2792 1.0684 -0.1256 0.4941 0.1433 -0.5384 0.6296 0.0972 -0.2379 -0.6223 0.8373 1.1319 -0.6514 -0.4268 -1.0886 -0.2694 -0.3807 0.7106 1.3719 0.4098 -0.3348 -0.8026 -0.6608 0.7651 0.3483 0.9337 0.4158 0.8181 -0.0689 0.2432 -0.9180 -0.0022 -0.2803 -0.9119 0.3308 -0.0793 0.0080 -0.8700 0.6134 -1.0627 -0.2491 -0.5955 -1.2080 -0.1683 -0.4323 1.2180 -0.1309 0.5877 -1.3010 0.0348 -0.0054 0.2906 0.3985 -0.0434 0.3763 -1.0918 0.4143 -0.4097 -0.3584 -0.0470 0.3677 -0.3255 -0.3116 -0.7887 0.2722 -0.2618 -0.0289 0.5877 -0.3758 -0.3214 0.9166 0.4499 -0.1205 0.1697 -1.6635 0.8780 0.1180 -0.4404 0.1390 0.0577 -0.9156 -1.5597 0.6046 1.0251 -0.5764 -0.3685 -1.7065 0.4942 -1.0237 -0.9537 -2.7377 -0.5130 1.3472 -0.6590 0.0825 -0.0189 1.6523 0.5179 0.8360 -2.2556 0.1628 -0.5867 -0.0486 -1.0548 -0.2411 -0.4533 -0.4393 -0.5874 -0.0646 -0.3563 -1.1882 -1.7735 -0.5889 -0.1768 -0.1094 -0.5312 -1.1360 -0.0735 -1.2108 -1.7507 0.6846 0.7874 0.4947 0.2880 0.5045 0.3662 0.8561 -0.2274 -0.4235 1.6880 -0.6419 0.2716 -4.2484 0.1832 0.9693 0.1280 -0.3440 -0.0072 -0.2491 -0.4553 0.6082 0.6364 0.2336 -1.1074 -0.4132 -0.0747 0.1591 7.6586 -0.5543 -1.2180 0.6975 0.0857 -0.3879 -0.0820 -0.6249 -1.0306 -0.4646 -0.0284 1.1190 -0.2160 0.3080 -0.3669 -0.7739 -0.1223 -0.5445 -0.9445 0.3927 -0.9250 -0.5463 -0.0651 -1.0429 -4.6197 -0.7981 -0.0578 -1.4037 0.3688 0.3089 -0.6095 -0.0407 -0.2621 -1.4225 -0.3123 -0.7145 0.1970 -0.5938 -0.6343 0.2465 0.3498 4.7869 1.2736 -0.3961 -0.4376 -0.3642 0.0881 -1.7404 0.6946 -0.4122 0.4007 2.0511 1.3681 -0.2679 -0.7743 1.2383 -1.0809 -0.7884 -2.2392 cysteine sulfinic acid 0.9796 -0.4748 -1.9229 2.9940 0.1665 1.1550 -1.5742 1.7808 2.0797 1.3819 1.8983 -0.3547 0.7347 -0.1986 -0.0651 0.9344 0.4047 3.2395 -0.3844 0.0883 0.4623 0.1920 0.0188 -0.3872 -0.5040 0.0954 -0.4562 0.5420 0.4149 2.0333 -0.2503 0.4294 0.4008 -1.1917 -1.5676 0.8702 0.1876 0.2799 0.2842 -0.6325 -0.4718 1.1016 0.2277 -0.8363 0.0316 -0.7380 0.8478 -0.5230 -0.0840 -0.3831 -0.0442 1.1888 -0.0499 -2.4737 0.2936 0.2564 0.0795 -0.2633 -0.1306 -1.3179 -0.3993 -0.3117 -0.2216 2.2322 -0.1503 -0.8242 2.5769 0.5132 0.0994 0.2750 -1.1853 -0.4869 0.5081 -0.1755 -1.1032 -0.3604 0.0089 -0.9165 -0.9660 -0.5237 0.9042 2.6776 -0.3298 -0.9228 -0.4901 -1.3676 -0.9974 0.6598 0.2072 -0.7809 -0.1989 -0.2858 -0.0177 0.4115 -0.1867 0.2516 -0.3274 0.0698 0.3496 -0.3412 1.1098 -0.9059 1.3087 -0.2914 -0.9979 0.2785 2.7900 0.2662 -1.0168 0.6990 -0.9502 -0.6819 0.8329 0.3659 2.6034 0.4116 0.6493 0.1553 -3.6034 -1.2719 2.5724 2.4331 -0.5952 -1.2095 -0.0884 -0.6430 -0.6568 -1.3421 -0.1155 -0.6545 0.8103 -1.7705 0.0751 0.1935 0.1901 1.4551 -0.3336 -0.1506 0.7033 0.1349 1.0381 0.2675 0.7608 0.2530 0.0382 0.1148 -0.1911 0.3456 -0.1532 0.6511 1.0789 0.6325 0.5996 1.2093 0.3759 -0.1334 0.0770 0.2063 -0.5580 0.8577 0.5161 -0.2302 1.2012 -0.3483 0.7132 -0.2533 -1.0247 0.5274 -0.3393 0.6140 0.1084 -0.2088 -1.2223 1.0463 -0.8540 0.5252 0.4382 1.0145 -0.3442 -0.0142 0.5776 -0.7837 -0.3463 0.5064 -0.0143 -0.2488 -0.9043 1.3608 0.6638 -0.1751 -0.1502 1.3012 1.2572 0.5108 -0.0390 0.4486 0.1917 -0.0364 -0.0817 0.3511 0.0816 -0.5271 -0.0554 0.4784 0.5155 0.4632 0.3591 0.9981 0.2714 0.0103 -0.8169 -0.1617 -0.2641 0.3602 -1.1662 0.5345 2.2882 -0.4525 -1.7406 0.5991 0.0910 0.5617 0.1185 1.8159 -1.5216 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-1.1218 -0.9974 -0.7871 -0.5961 0.2918 -0.2365 0.0249 -1.1838 0.0136 -0.5264 -0.6795 0.1076 -0.0046 -0.1459 0.7859 0.0671 -0.8862 1.0852 -0.7111 -1.6250 -2.0963 2.3365 2.7359 1.9083 1.4350 -0.3755 -0.4339 -1.2130 -1.4105 -0.0739 -0.6283 0.3208 -1.1003 -0.7713 0.4130 -0.1836 -4.2730 -0.0309 1.0492 -1.4694 -0.9091 0.0086 -0.9124 0.0822 0.3209 0.9116 1.1718 1.8266 -1.1853 -1.9568 2.5159 -0.5336 -0.0929 -1.4112 cysteinylglycine -0.2695 0.1791 2.2242 -2.6032 -0.0973 3.2069 -0.1764 1.3030 -0.1437 1.9150 3.9637 0.2873 -0.1232 -0.5808 0.3205 1.1199 1.2007 -1.2273 -0.2369 -1.3207 0.2847 0.5124 0.2276 0.4336 -0.5223 -0.8043 0.0169 0.5987 -0.8355 -1.4382 0.6089 -0.1105 -0.3425 -1.7809 -1.0107 3.5987 0.8433 0.0988 0.3289 -0.2460 -0.8353 0.0625 -0.7866 0.2195 0.3676 -1.1943 0.4188 -0.5911 1.0650 -0.5189 -0.5434 -0.5980 0.9811 1.7953 1.1445 0.3910 0.4981 -0.0607 0.3816 -0.7205 1.0240 -0.5369 0.2186 1.0321 -0.5641 -0.7762 -1.7182 1.0903 0.1543 -0.2524 0.5005 0.6976 1.2202 -0.3820 1.9457 1.3013 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1.8152 -0.6388 0.8977 0.1464 -2.3564 0.8360 0.7570 -2.0798 0.1197 0.0504 0.4685 0.0385 -0.5837 -0.0867 0.2255 0.5137 0.5329 -0.3550 1.1238 2.5125 -1.6052 -0.3853 -1.2569 -1.0053 0.0064 0.4324 -0.2589 -0.8174 -1.0063 -0.2113 0.5521 0.2928 0.1928 0.2599 0.0259 0.2106 -1.5528 -1.2099 -1.8154 0.4091 0.2727 -0.4641 0.6248 -7.7169 -3.4834 -1.8152 -2.7706 0.0094 -1.6451 0.0054 0.3873 -1.3673 1.1977 0.6191 0.0357 1.1647 -0.6439 0.7986 0.7015 0.6883 -1.2057 1.0159 -0.0909 -0.4329 -0.5780 0.2020 0.0878 0.9455 -0.5322 1.6249 -1.3765 -0.8469 -0.3067 0.2260 0.3109 0.7104 -1.3911 -1.3491 cystine 1.7911 -0.3519 -0.7262 0.1724 0.8967 1.4202 0.4264 1.4162 -0.7660 2.8003 2.5274 -0.4792 0.2006 0.2035 -0.2872 -0.8818 -0.6309 0.7602 0.5391 0.4964 0.4823 1.2359 1.1489 -0.0824 0.5899 1.4783 -0.3526 1.1206 1.9038 -0.5355 -0.5946 0.1977 -0.6056 -1.0774 -0.7035 5.8449 0.0554 0.6533 -0.0415 -0.8505 0.3411 1.2612 0.4561 -0.3572 1.0833 -0.7490 0.8246 0.5044 -0.9119 0.9023 -0.0508 -0.3121 -0.0123 0.6581 -0.6455 0.3787 -0.3546 0.4204 2.0325 0.0923 -0.0180 -0.3233 -1.1832 1.0378 -0.6079 -1.2309 0.3603 0.1427 -0.2338 -0.2400 1.0921 1.1469 -0.2883 -1.2052 0.2156 -0.6394 0.7285 0.6941 1.0647 0.6612 0.5388 -0.7126 -0.2832 0.6743 0.8245 -0.1775 0.0814 0.4979 -0.8994 0.1459 -0.2820 0.6383 -0.7180 -0.2197 0.5606 -0.2946 0.4867 -0.8676 0.1225 0.2153 0.3668 0.8987 0.4837 0.0705 1.0730 -0.2369 2.3031 0.1629 0.5541 -0.2655 -0.0824 0.2697 -1.1950 0.4457 0.1363 0.6112 -0.2913 0.9067 0.6915 -0.6492 0.0243 1.5981 0.3313 0.0543 -0.6960 -0.4842 -1.5860 -0.6151 -0.5742 -0.8488 -0.5429 0.2410 0.2959 0.4049 0.2689 -0.0851 0.9370 0.1589 0.2017 0.5773 -0.6958 1.2103 1.0747 0.1022 0.1558 -0.1318 -0.0575 0.5894 0.0497 0.3980 -2.1923 0.9550 -0.7822 0.2327 -0.1716 0.5931 -1.2812 0.8785 -0.8233 0.8613 0.6248 -3.6787 -1.8607 -0.5084 -0.9061 0.6420 -1.3792 0.3726 -0.4254 -1.3558 1.2041 -1.3035 -1.1548 -1.8939 -1.0574 0.7306 0.2922 -0.0639 1.3597 0.3178 0.8331 -1.4088 -0.8923 -0.0336 -1.2416 0.4359 -0.2392 0.9785 -1.4646 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0.8323 -0.6534 0.3326 -0.0321 0.4372 0.4861 -0.2022 -0.0018 0.3249 -0.7740 -0.6001 0.5609 -0.6202 0.2355 0.6618 -0.2997 -0.8752 -0.0606 -0.6626 -0.1940 -0.9927 0.2580 1.6186 0.4217 -0.9556 -0.0779 2.3095 -0.1979 0.2722 2.0449 -0.6529 1.4787 -0.3487 0.0941 -0.2327 -0.2479 -1.8242 0.4787 0.7884 1.3746 0.8223 0.0431 -0.6028 -0.4482 0.7926 0.4071 -0.7302 -1.9699 -0.6151 -1.7376 -0.0049 -0.8240 1.2398 -0.5919 -0.5093 0.6826 0.0636 -1.3068 0.2277 0.0836 0.3026 -0.1164 0.9772 -0.3383 -0.4317 1.1810 0.8580 -1.6935 -0.3642 -0.1382 -0.5393 0.4731 -0.5032 -1.1478 -1.3896 -1.3136 0.1931 -0.1024 -1.0080 -0.5941 0.1063 -1.3337 -0.2049 -1.5094 0.0531 0.6818 0.9060 -1.3545 -1.3209 -0.0587 -0.7566 1.1361 -0.5325 -0.6378 0.2531 -0.2077 0.6025 0.0784 -0.0668 1.3621 -1.0961 0.2458 0.7068 0.4766 0.0497 -0.3321 0.4072 -0.0140 0.4073 0.0808 0.7270 -0.8461 1.5022 0.5001 0.9989 0.1091 1.8007 -0.8687 -0.1343 0.8647 -0.7002 -0.1824 -0.6190 0.4200 0.4619 0.3328 1.3989 1.1012 0.6986 -0.0419 0.6497 -0.6092 0.4544 -0.1888 0.3174 -1.4629 -1.1597 0.0255 -2.2479 0.9377 -0.1688 -2.2830 0.3644 1.0054 0.7700 0.2015 -3.9731 1.4100 -0.5365 1.2445 0.7816 -3.6724 0.3294 1.3168 0.8164 -0.1023 0.4218 1.0793 0.9502 -4.0040 -0.2443 -0.9590 0.7485 0.1713 0.4339 -0.1081 1.3936 -0.5026 -0.3459 -0.8704 -0.4577 -0.7319 1.2119 0.5727 0.1802 -0.3083 1.2101 0.3719 0.6704 -0.1175 1.4774 1.6726 0.7902 0.8556 -0.0189 -0.9372 1.0353 0.4869 -0.5090 -1.1047 0.7725 -1.3562 -1.1866 0.2674 -0.2669 -1.6047 2.1883 -1.2500 1.3172 -1.3591 -0.1430 -0.0268 1.0947 0.0414 0.6642 -0.0711 1.6902 0.1977 0.8428 0.3711 -1.7545 -0.9008 -0.4723 0.9565 1.5473 -0.2669 1.0756 1.5066 1.3664 0.5594 0.8500 1.3807 -0.3535 -0.7044 0.8478 0.2163 0.0125 0.3507 0.4063 -0.2501 -1.0626 0.4153 -0.3485 0.2222 0.1710 1.7090 0.3495 0.5843 0.6052 -1.1403 -0.1523 -0.5757 -0.2896 0.3959 1.3023 0.7792 0.2319 1.5041 1.1493 -1.8540 -0.3634 0.7571 2.0697 0.4122 0.4682 -1.1201 0.6871 -0.1899 -0.4591 2.1858 -0.0633 0.1366 0.5107 -0.1715 -0.5441 -0.4086 2.2470 -0.4308 0.6599 1.5216 -1.7711 -0.0133 0.6926 -0.6463 1.5558 -2.1229 -0.3766 0.0678 -0.0960 -0.1703 0.1454 -0.0419 -0.7323 1.6743 0.5874 -0.7567 -0.9289 -1.0786 0.4837 -0.0424 -0.0320 -0.5094 0.7154 1.2303 -0.8450 0.3670 0.5989 0.0005 0.5417 -1.2943 1.5858 -1.4621 -0.5739 0.7574 0.7278 0.2408 -0.2189 -3.9199 -0.4214 -0.3978 -0.0296 0.4465 -0.5223 0.9377 -0.5410 0.8071 0.9912 0.4457 diglycerol 0.0657 -1.2416 -1.3340 -0.4582 -0.3332 -0.2305 1.6049 0.0537 0.9154 -0.7607 -1.3618 -0.6172 0.6575 -0.4460 1.3527 0.5839 -1.0281 -0.6360 -0.7855 0.0798 -1.3248 -0.9365 0.5137 0.1494 -0.9916 -1.6750 -1.1536 -1.1645 -0.8742 -1.4557 -0.3609 0.0065 0.6250 0.1298 1.6643 0.9290 -0.7869 0.1583 -1.7397 -1.3269 -0.8518 -0.8204 1.3142 0.2083 -0.3071 0.1276 -0.0684 -0.0281 -0.2505 1.7087 -0.0113 -0.6413 -1.0238 0.0231 -1.2606 -0.2269 -0.9874 -0.3780 -0.6203 -1.4840 1.6727 0.1574 0.0614 0.8039 1.0285 1.0324 -0.1087 -0.3116 1.5653 -0.6475 -1.3076 -1.1810 -0.9954 3.1748 0.5082 -1.2000 0.0360 -0.1767 -0.2674 1.1356 -0.4236 0.5329 -0.8951 -0.0984 -0.3479 -0.3673 -0.1826 -1.0471 -0.6303 -0.6818 2.3194 0.2142 -0.1443 -0.3891 0.2925 0.1360 0.8202 -0.8152 0.0571 -0.1277 -0.8759 0.2276 -0.3633 2.4704 -0.8414 0.0961 -0.7562 -0.0254 -0.6525 -0.5056 0.7678 -0.4543 0.4122 -1.3961 -0.4718 0.2970 1.4419 0.8035 -1.2974 -1.2664 -0.3685 -1.3328 -0.6418 0.3905 0.5033 -0.5013 1.2440 0.4780 1.2096 -0.7698 -0.0699 0.2838 0.3673 -0.0648 2.0238 0.2601 0.2547 -0.1918 1.4416 -0.7425 -0.8427 -0.4224 -1.3266 -0.2897 -0.4591 -0.2954 -0.0237 -1.4947 -0.6993 0.2980 0.0921 0.0499 0.2234 -0.4684 -0.5163 -0.6680 -1.3675 0.1751 1.0038 0.3642 0.5922 -0.8500 -0.2709 -1.0448 -1.1851 1.7034 0.1718 -0.1812 1.0579 -0.2549 -0.9880 -0.8146 0.8526 -0.9000 -0.1127 0.0265 1.2361 -0.4569 0.0376 -1.1546 2.9774 0.7328 1.8827 1.7895 0.1155 -0.1294 -0.3070 -0.5819 -0.1902 0.2368 0.6639 -0.4591 -1.0904 -1.2580 1.1112 -0.8863 -0.5027 -0.0627 -0.6061 -0.4755 -0.7035 -1.1178 -0.2582 2.9953 1.1171 -1.3022 0.2413 -0.6608 1.0471 1.6940 -0.1389 1.2756 0.3720 2.0196 0.7823 -0.0906 -0.0403 -0.4947 0.4642 1.3860 -1.3247 0.6937 -0.6679 0.1646 -1.1089 0.1840 0.4148 -0.5774 0.2513 -0.2807 -0.6229 1.7887 -0.7288 0.4712 -1.0345 2.6315 -1.2355 2.8569 1.3080 -0.5367 -0.0662 -0.7629 -0.4850 -0.1473 -0.8760 1.9086 -0.2619 -0.2063 -0.2566 -1.1327 -1.1333 -0.2737 1.6289 -1.0185 -0.9661 0.9791 0.3282 2.1621 -1.5301 -0.1899 -0.0902 2.5279 0.4499 0.3489 -0.4841 -0.7795 -1.0551 1.9039 -0.4137 -0.4848 0.6515 0.6564 -0.8303 -0.9074 0.9551 0.2978 -0.9639 1.8405 0.7800 -0.6328 -0.0223 -0.2728 0.1543 0.0010 -0.5867 2.5126 0.4402 2.1174 -1.9957 0.4311 -0.3220 0.5524 0.8208 -0.6649 1.3984 0.7612 0.5025 1.8027 0.2200 0.2585 -0.0755 0.6012 -0.6591 -1.0993 -0.4213 -0.6515 1.3793 1.7240 -1.3344 -0.8807 -1.3872 1.5518 -1.8154 0.1778 0.0199 -0.3937 -0.4951 -0.3786 -0.8917 2.1823 -1.2292 0.2224 -0.3990 0.4524 2.3123 -1.1606 -0.3848 0.9910 -0.1223 0.4222 -1.1346 1.7516 -1.0722 1.5310 -0.7167 -0.3773 0.7765 0.1251 1.5321 -0.4098 -0.0747 1.0480 -0.3126 -0.6988 -0.2180 0.0924 2.1500 -0.4409 -0.5031 -0.5552 -0.1668 -1.6023 1.0697 -0.8122 0.2606 0.5377 -0.6144 -0.8723 -1.9551 0.8692 2.0323 -0.1611 2.0026 2.2207 0.7790 0.3806 -1.0184 1.3671 1.5255 -1.1474 -0.6700 -0.4679 0.3769 0.0772 1.4136 0.0198 -0.7194 -0.4851 0.6469 0.6227 -0.2754 1.2811 1.1772 -1.4858 -1.0148 -1.1523 -0.3342 -0.3461 -0.6678 -1.2937 0.4572 1.3756 -1.9016 0.6527 -1.1740 0.5438 -1.5304 -0.2455 -0.2011 0.6395 0.3312 0.4221 -0.4006 -1.1704 0.0992 -0.5473 -1.3223 2.9946 -1.0917 -0.1243 dihomolinoleate (20:2n6) -0.1246 -0.0114 1.5666 1.5356 1.0770 1.8653 -1.1499 0.5797 0.6920 1.2697 1.2284 -0.1555 1.5764 -1.3998 -1.5490 -2.0519 0.7834 1.0585 -0.8776 -0.3329 -0.9797 0.8433 -0.6084 -0.6949 0.6051 -0.3240 0.0672 0.7377 -1.3399 -0.4021 -1.4156 -0.8099 -0.1935 1.0358 1.3910 -0.0124 -0.5368 -0.9249 -0.1694 0.0772 -1.4509 -0.9760 -1.6809 1.1758 1.6537 0.0861 -0.4390 -0.7989 -1.3089 -0.8468 0.2852 0.7307 -1.3916 2.4220 -0.7823 -0.0623 -1.3018 1.8199 -0.5226 2.0206 -0.4072 0.3630 -1.3303 0.1177 -0.5674 -0.7023 0.0208 0.3105 -0.1807 -0.6699 1.3328 -0.9887 -0.1737 -0.6580 1.4662 1.1680 -1.8012 -1.1516 -0.1629 -0.8083 0.2154 0.3673 -0.1474 1.5154 0.3145 -0.9273 0.1006 1.5224 -0.0091 -0.7441 0.2423 -0.2554 -0.1614 -0.2652 -0.4823 -0.2427 0.1654 0.1348 -1.0475 -0.2088 -0.9874 -0.8679 -0.6593 -0.6872 -0.9251 -1.6146 0.3929 -0.3843 2.0123 -0.3357 0.0269 -0.9904 -1.1431 2.5044 0.6356 -0.8982 -0.3707 -0.0053 0.9451 0.8512 0.0282 1.3432 -1.2638 3.4102 -0.5414 -0.2811 0.7650 -2.3493 -0.2952 0.9378 0.2285 1.1990 -0.1223 -0.5816 -0.9322 -0.4509 0.1748 -0.5821 0.0100 -1.2690 0.6812 -0.8563 0.4374 -0.5687 1.2711 -1.2389 1.8713 0.7531 0.4729 -1.0057 -0.2763 0.6007 0.1906 0.0927 0.4905 0.3136 1.4659 -0.2664 -0.3941 0.3179 -0.7699 0.7085 -0.6406 1.0255 1.2908 -0.1263 -1.3813 -1.6740 -0.6039 -0.0661 0.7031 -0.1074 -0.6471 -1.0293 -0.2382 1.0948 1.9434 -1.5979 -0.0315 -1.4036 -0.9072 -0.7594 -0.8566 -0.2018 -1.0315 -0.3798 -1.7191 0.7865 -0.3918 -1.8788 0.5408 1.1108 0.0192 -0.4686 -0.6283 1.9129 -0.0617 -1.0733 1.7475 1.3918 -0.7905 -0.1552 -0.4349 -1.3441 0.6602 1.9914 0.4551 -1.0773 0.1915 -0.8993 -0.5100 0.2820 -0.5634 -1.1430 0.6915 -0.8994 0.0556 -0.9355 1.0715 0.1686 2.2936 1.1917 -0.7292 -0.2865 -1.2747 0.1621 -0.0673 -0.2348 -1.0736 -0.5411 -1.0053 -0.6044 0.7990 0.1707 0.8071 -0.6449 -0.5973 1.8872 -0.9685 0.1534 1.6381 0.0898 -0.0360 -2.1518 0.0906 -0.0140 0.2149 -1.8471 0.1532 0.1725 1.0730 0.9123 -1.5074 0.6338 1.1188 -1.7681 -0.3339 0.0355 1.4870 -0.7097 0.7154 -0.6770 0.3005 0.6460 2.0675 0.3907 -0.0864 -0.0611 -0.5076 0.3135 -0.1616 -1.3283 0.3074 0.5621 0.5239 -0.7299 2.7207 -1.2415 -0.1779 1.4923 -1.0643 -0.7375 0.0027 -0.6300 1.3662 -1.4495 -0.2582 -0.3903 0.2760 -0.8866 0.4446 -0.4244 -1.2725 -0.5791 0.1169 -1.0785 -0.2647 -0.7581 0.3183 0.6219 -0.6777 -0.9116 0.1163 -0.4740 -1.5129 -1.5716 0.3753 -0.2508 1.8126 0.8481 1.7198 0.1896 0.9734 -0.2048 1.3417 -0.5549 -0.2113 -1.4269 -0.8656 -0.1941 -0.2896 1.4825 0.8913 0.9509 -0.4292 1.2353 0.9962 0.8770 -0.2239 -0.0553 -0.0724 -0.1305 0.5889 0.2995 -0.5832 -0.6550 -0.5318 1.1864 -1.4816 -0.0702 0.7157 0.4297 -1.4692 -0.6565 2.3311 -0.7444 0.4950 -1.1670 2.1258 -0.8883 0.6636 0.6310 0.5288 0.3189 0.9635 -1.4729 2.0111 -0.2999 1.2248 -0.4089 0.0217 -0.5050 0.2595 0.3673 1.9777 -0.4157 -0.3211 -1.1980 0.6439 -1.2774 0.3147 -0.2243 1.1753 0.7177 -0.0093 2.0096 0.6466 -0.9478 -0.9075 -0.4338 1.9393 -2.5758 -1.1498 1.0342 0.2028 0.9390 -0.0949 0.7761 0.0391 1.2798 0.7214 -0.6727 1.0582 -1.0412 -0.1101 1.5883 -0.6004 -0.3257 -1.5249 -2.0027 -0.2881 0.6039 -0.1722 1.2726 -0.1685 1.8127 2.8255 -0.8772 1.0670 0.0858 dihomolinolenate (20:3n3 or 3n6) 0.8737 0.6706 0.3564 0.8830 1.2046 1.2482 -1.8223 0.1654 0.5865 0.5206 1.0774 0.4195 1.6838 -1.6963 -2.1277 -1.0176 0.4708 0.5893 0.4597 0.5827 -0.7168 1.0292 0.8917 0.1225 0.8472 -0.8747 0.0834 -0.1658 -1.5046 -0.4321 -0.2469 1.0216 -1.2175 -0.6673 1.7444 0.6422 -0.2034 -0.3498 -0.8559 0.5672 -0.4013 0.3155 -0.6421 1.3891 2.5225 -1.1026 0.7817 -1.4440 -0.0558 -0.3354 0.1163 1.1598 -1.2764 2.3585 -0.2375 0.4545 -0.7092 1.7679 0.3654 2.6370 1.1948 -0.4901 -0.9064 -0.3809 1.0827 -0.4355 -0.7134 0.6605 1.0081 -0.8484 1.6527 0.5432 0.5210 0.4824 1.6912 -0.1224 -0.0739 -0.3473 -0.3883 -1.3180 0.6893 -0.5696 -0.7815 1.3322 0.3468 -0.7815 -0.0050 -0.0182 0.1679 -0.6612 0.8392 1.7023 -0.4690 0.1660 0.4969 0.4124 0.2193 0.6934 -0.8676 0.8798 -1.0252 0.0107 0.4899 -0.4560 0.7462 0.1293 0.2039 -0.3107 1.1954 -0.4249 -0.9381 -1.8203 -0.5256 1.7315 0.5074 0.1604 -0.5336 -0.2387 -0.1615 0.4384 -0.0804 1.2875 -0.7663 3.9561 -1.3580 -0.7412 1.9805 -2.1545 -0.9564 0.5189 0.5292 0.7326 -1.0449 0.7838 -0.6326 0.4775 0.1382 -0.9684 0.1138 -1.2247 -0.4147 -0.9637 -0.0660 -0.9040 1.0370 0.2508 1.2770 0.0925 -0.8576 0.3281 -0.2861 -0.2040 -0.5561 -0.1292 0.7171 2.2576 0.3973 -0.5847 0.0958 -0.1337 -0.1239 -0.2231 0.5691 1.1467 0.6254 -0.5324 -1.5216 -0.8709 -0.9364 -1.1554 -0.4766 1.0035 -1.4165 0.0826 -0.2327 0.9860 0.6140 -0.5338 -0.2296 -1.1892 -1.2365 -0.8535 -0.0625 1.0080 -0.7800 -0.3913 -0.6359 0.7014 -0.4958 -1.3233 -0.8058 1.0258 1.6198 -0.1410 -0.7874 1.5735 0.5839 -1.0181 2.2110 0.5536 0.1933 0.0930 -0.6219 -1.2284 0.1423 1.3117 0.2699 -0.2492 0.6997 0.1017 -1.1524 -1.1973 -0.8333 -0.6484 0.8907 -0.1195 -1.3369 -0.5020 1.6003 -0.2271 1.9420 -0.0039 0.9903 0.1906 -0.2932 -0.9964 0.4084 -0.5411 0.1107 -0.8343 -0.4743 0.9765 0.6907 -0.9906 -1.2819 -0.2207 -0.6975 0.7223 0.1438 0.4532 0.7173 0.1616 -0.9033 -3.2287 -0.9636 -1.5967 0.4778 -2.2971 -0.1968 -0.0924 0.5137 1.4513 -1.3315 0.1748 0.5129 -1.8202 0.0552 -0.3516 0.8339 -0.3675 -0.2643 -0.3953 -2.1966 -0.3499 2.0136 0.7964 0.9601 -0.8829 0.2720 -0.3031 0.5523 -1.3539 0.2196 0.0506 -0.4414 -0.1936 2.7129 -0.9888 -0.0132 0.6447 -0.5915 0.2553 -0.0478 -1.3034 1.1560 -0.3877 -1.6157 0.1339 0.3724 -0.1818 -0.0802 0.9330 -1.6243 -0.6951 0.3170 -0.0650 -0.0391 -1.3378 -0.1029 1.0437 0.7403 -1.0843 0.8612 -0.5544 -1.0369 -0.4349 -0.2631 -0.4684 1.7182 0.1847 1.3178 -0.7506 -0.7332 0.6937 0.8707 -0.9021 0.7053 -0.9507 -0.8273 -1.3048 -0.9647 0.1216 1.5369 0.8097 -0.1224 0.7051 -0.7198 0.4514 -0.9757 -0.1741 0.0523 -1.5707 0.0894 -0.3101 -1.1236 -0.2236 -0.2564 0.1563 0.0251 -0.1628 0.5012 0.4339 -1.1120 -1.2504 1.5674 -1.4912 0.6075 -0.0502 1.9384 -0.5539 -0.3083 -1.6312 -0.0632 -0.8423 0.1878 -0.2070 1.1793 -0.2219 2.5215 -1.3003 0.0783 -0.1197 0.7800 -0.0957 0.7867 -2.5007 0.7526 -1.6130 0.8172 -0.9157 0.2706 -1.4464 0.5326 0.2998 -0.2929 4.5339 0.4242 -0.5556 -1.0564 -1.8599 1.4693 -1.3474 -0.6256 0.6732 1.1223 1.1588 -0.7196 1.3274 -0.7092 1.6802 1.4076 -1.5825 1.6790 -1.2490 -0.8215 1.2773 -0.4977 -0.4993 -1.1981 -1.3036 -0.7588 -0.9954 -0.3546 0.0885 -0.0877 0.4498 1.2120 1.0814 1.5529 -0.0522 dihomo-linolenoylcarnitine (C20:3n3 or 6)* 1.8500 -0.8210 1.0600 1.3500 0.3360 1.6300 -0.5850 1.6800 1.5700 2.6400 2.5700 0.1030 -0.7890 -0.4960 0.4640 -0.5570 1.8000 0.2700 1.1100 0.6730 -0.0535 -1.5200 0.8260 -0.4640 0.0808 -0.1040 0.3560 0.6750 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-0.7270 0.9790 -0.6110 0.4700 -2.0800 -0.6840 1.0400 0.8430 0.0000 0.4350 -1.2200 -0.8020 -0.8810 2.8200 0.1290 1.1200 2.3600 1.2200 -0.5580 0.7400 -0.7980 -0.4050 -0.0270 0.5290 -0.5510 0.1430 -0.5000 -1.4600 0.8830 -0.7510 -0.9660 -0.2730 0.3470 0.7370 0.4060 0.0196 -0.4000 0.6210 -0.7670 -0.6780 0.0251 -1.0500 -0.5890 1.7100 -0.8910 0.2020 0.7120 -0.4020 -0.5690 -0.8780 -1.2500 0.7310 -0.0487 -0.6100 -0.7020 -1.5300 -1.3100 -0.5310 0.1770 1.0300 -0.4620 1.4800 -0.0148 0.5030 -2.5800 -3.0000 -0.7240 0.0106 -1.4600 0.3720 -1.8200 -0.0477 -1.2100 -0.9020 -1.9100 0.2820 0.2550 2.3500 -0.8220 -1.0900 1.2100 -0.3430 3.2000 0.3350 1.5300 1.3800 0.2310 0.6970 -1.6700 -1.0900 0.4980 -0.3520 -0.0422 -1.1500 -0.2610 -1.1000 0.2830 -0.9490 0.2980 0.3780 -0.2130 -0.7040 -1.6400 -0.4670 -0.1450 -0.8120 -1.7900 0.7900 1.7400 0.1600 1.2400 -0.9580 1.2100 0.5390 -0.6500 -0.7930 0.7670 dihomo-linolenoyl-choline 0.2932 0.1446 -0.5393 0.2274 0.6095 -2.2003 -0.6381 -0.9045 0.6054 -1.8660 -2.7952 1.0074 0.7175 -0.4318 -1.8614 -0.0821 -0.7586 -0.0799 1.5252 1.5510 -0.7067 0.4036 1.8499 0.8396 -0.1603 0.1186 0.6655 -0.5755 0.7607 -0.3704 1.1718 1.7032 -0.3893 -1.1646 0.7594 -2.3609 1.5020 0.7358 -0.4348 1.6008 0.8675 0.6562 0.4985 0.7797 1.2398 -0.6000 0.4859 -0.6321 1.5263 -0.3478 0.5979 0.9648 -0.5675 -2.2728 0.7462 -0.4614 0.4328 0.5433 0.0726 1.4695 1.5737 -0.0870 -0.8469 -1.0028 1.3550 0.5625 -0.2331 -0.1666 1.1472 0.2801 0.9642 1.0308 1.1372 1.2163 -0.4847 -0.4097 0.9641 1.3553 0.2262 -0.6816 0.3880 -0.3788 -0.5322 0.4811 0.6596 0.2767 0.6832 -1.9704 0.9107 -0.0664 0.7564 0.5070 0.2651 0.6875 0.8046 0.6569 1.1037 0.7917 0.0024 0.0795 0.0799 0.0064 1.2552 0.0853 0.9078 1.9256 -1.8924 -0.3306 -0.5776 -0.2892 -0.4398 -1.0684 0.4905 0.8936 -1.0097 0.8313 -0.2855 0.8595 -1.3643 0.5145 1.5696 -0.7563 0.7858 0.3975 -1.1108 -0.4168 1.3064 0.0379 0.1823 0.1657 0.9911 0.3628 -0.3491 0.8375 0.2397 0.7047 -0.1155 -0.7454 -1.1968 0.0831 -0.9701 -0.4768 -0.2237 -0.1919 0.7634 0.7400 -0.3405 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1.2554 0.4855 -1.4859 -0.2270 1.3991 -1.1466 0.5721 -0.7470 0.3796 0.1574 1.7438 -0.0816 -0.4731 -0.1204 0.2572 -0.9865 -1.9400 -1.2330 0.9318 1.0917 -1.0168 0.9820 -0.4525 1.0291 0.6935 -0.1466 -0.3199 1.5290 -0.6202 0.3654 -0.4805 -0.8179 2.1860 1.1078 1.1839 1.1398 1.1663 -0.0323 -0.5549 -1.3696 -1.6659 0.1760 0.1608 0.3853 -0.3703 -1.9707 -0.9801 -1.3829 -0.5689 0.6436 -0.6714 0.0097 -0.2899 -0.3421 0.8759 -3.2016 -0.4971 0.5428 0.4336 0.0699 1.3581 -0.7185 -0.3473 0.6773 -1.3336 0.2100 -0.0104 0.4280 0.4085 -0.8122 -4.9835 -2.7464 -0.8181 -1.4164 1.2091 0.5526 0.3905 1.5463 -0.8194 0.1306 0.1780 0.5532 -0.9551 -0.6803 -2.4394 1.3671 -1.2526 1.0744 1.3776 -0.0055 -1.4461 -0.1871 0.0144 -0.4421 0.3235 0.8723 0.6697 -1.0802 -1.0552 1.4539 -0.2388 0.2348 -0.5548 0.6764 0.4642 -0.5145 1.2892 -0.3428 0.0933 1.2995 -0.8913 -4.6452 -0.1026 -1.5922 0.6772 -1.0858 -0.8512 -0.4028 -0.0044 -0.8741 -1.4746 -0.3763 -0.9174 0.2284 -1.4516 -0.3724 0.6000 1.2702 -0.6713 dihomo-linoleoylcarnitine (C20:2)* 0.9941 -1.1924 0.9354 1.4338 0.4981 1.1320 -0.1973 1.3496 1.1886 1.8618 2.0288 -0.1087 0.3525 -1.0222 0.5735 -2.4430 1.5227 0.5391 1.0359 -0.7386 -0.4366 -0.9740 1.0398 -0.6640 0.5745 0.1243 0.4672 1.3422 -0.8900 0.2041 -1.0665 -0.3427 0.2510 0.6789 0.4229 1.9191 0.6474 -0.4905 -0.0494 0.7371 -1.8709 -0.1485 -0.3132 0.7546 0.4973 0.5441 0.2847 1.0671 -0.7440 1.1649 0.5039 0.1931 -0.9342 1.4554 -1.7878 0.9692 0.3145 1.2532 -0.0968 1.2932 -0.5770 0.9703 -1.5390 0.8651 -0.8417 -0.2804 -0.4683 -0.8656 -0.1276 1.1060 0.9575 0.2203 1.3887 0.2166 0.8456 0.3108 -2.0369 -0.7192 0.8033 -0.8856 -0.4300 0.0968 -0.2162 0.4608 0.8358 0.4222 0.3872 0.8574 0.6932 0.1959 -0.2622 0.3578 -2.2120 0.1389 0.6158 1.0119 0.5498 -0.2239 -2.1764 -0.3757 0.3083 -0.4047 -0.0643 0.3733 -0.3057 -2.1650 2.1129 -0.2450 0.4971 -0.1788 0.9857 -0.8745 0.3033 1.5322 1.6454 -0.4072 -0.4481 1.3360 3.1464 0.0750 1.6087 0.8867 0.3535 -0.0055 -0.7510 0.8813 0.0798 0.0106 0.3981 -0.1601 -0.0898 1.5898 0.5826 -0.1747 -2.4060 -0.4497 -0.3333 -0.5785 -0.5173 -1.5387 1.5116 -0.2611 0.3329 0.4347 1.5385 -0.5020 -0.1411 0.4815 1.0607 -1.1296 0.5124 0.3601 0.3437 -0.3065 -0.6626 -0.2100 1.2023 0.9018 -2.5144 0.3152 0.3413 -0.4119 -0.4450 -0.0184 1.1022 -0.2741 -2.5561 -0.7004 -0.6108 -0.9098 0.2946 -0.7117 0.1371 0.3569 -2.6348 1.3704 0.4771 -2.0022 -0.2264 0.2901 0.2150 0.0195 -0.6617 0.1235 0.3265 0.9117 0.5569 -0.2552 -0.0214 -1.5613 -0.2980 3.1413 0.1650 0.6353 -0.2931 0.8641 -0.5747 -0.3283 0.5390 0.6310 -0.0162 -0.0642 1.2238 -0.9086 0.2062 2.1635 -0.1555 -1.1557 -0.4011 -2.2688 0.7978 -0.1710 -0.2937 -0.4215 0.0958 0.0645 1.7893 0.3479 0.9708 -0.8632 1.5120 0.5896 -1.1155 -0.3413 -1.1235 -0.0955 0.6668 0.2586 -0.9788 -2.2977 -0.2962 -2.0972 -0.4487 0.1186 0.1984 -1.7413 -0.8451 0.6414 -0.6425 0.4408 0.7708 -1.0478 1.5480 -0.4812 -0.5973 1.6967 -0.1253 -0.9850 1.7249 1.1058 0.2787 -1.1828 -0.3249 1.1094 0.1338 0.1245 0.1319 -0.5571 0.8755 -1.2925 0.7725 -0.0154 -2.6664 1.0588 -0.2000 0.1169 -0.2238 0.0478 1.0374 -0.0292 0.2099 -0.0139 0.2024 -0.4211 0.4490 -2.4690 0.4074 -2.4717 -0.3555 0.6025 -0.6360 -0.2743 1.4005 -1.5679 0.9814 -2.3050 -0.9487 -0.8142 1.1593 -2.7958 0.0139 -0.9870 -1.1207 -1.5658 0.1994 -0.7762 0.0820 -0.8736 -0.9337 0.9449 0.1802 0.1516 0.2491 -0.6801 -0.3823 -0.9538 2.2652 -0.1207 1.4540 2.6169 1.2924 -0.3747 1.1332 -0.6007 0.5988 -0.0439 0.2617 -0.7667 0.0609 -0.7492 -0.1134 1.1603 -0.2812 -0.0276 -0.3940 0.5238 1.5631 0.2318 -2.4869 -0.8630 0.7085 0.5441 -0.4672 0.1324 -0.5672 -0.7865 0.7508 0.1586 0.1729 0.5536 -0.3274 -0.8620 -1.7533 -0.8417 1.0089 0.2725 -0.8237 -0.3832 -0.4721 -1.6328 0.4911 -1.3891 0.1582 0.1486 0.5669 -0.1771 1.0805 -1.3059 -0.8451 -1.0851 -0.6293 -1.0939 0.2266 -2.1534 0.7874 -0.3065 -0.9411 -1.4557 0.0458 -0.5253 1.4079 0.0043 -0.2542 1.1346 -0.0460 1.9001 0.8033 0.6855 0.7813 0.7915 0.6158 -2.0091 -1.1515 0.5435 0.1324 -0.0115 -0.4952 0.1407 -1.3518 -0.1804 -0.5246 1.2058 0.9967 -0.5510 -0.3912 -0.8591 -0.7861 -0.0486 0.0045 -0.6415 0.3471 0.9846 -0.1892 1.2367 -0.5544 1.3448 1.0688 -1.8222 -2.4454 0.2368 dihydroorotate -0.6876 1.1856 -0.9667 -0.8580 1.7243 -1.0007 0.8793 -1.0495 -0.9800 -0.6416 -0.7977 -1.0529 1.8638 -0.9780 -1.1190 0.2953 -1.1009 -0.9187 0.8571 0.3000 -0.7967 1.5182 -0.6396 0.9470 0.8338 -0.9093 -1.0831 0.1303 -0.7934 -0.9309 0.1675 0.6179 0.9855 -1.1538 -1.1958 -0.9440 0.9641 -0.7284 0.6644 0.8522 1.0251 -0.5497 -0.0238 1.0973 1.4641 -1.1094 -0.9379 -0.9192 0.0805 0.9370 -0.0020 -1.0954 1.2076 -1.0071 -0.6720 -1.0626 0.8902 1.2229 1.2064 -1.0180 0.8660 -1.0691 1.5117 -0.8451 1.6043 -1.1140 -0.9566 1.3837 0.1796 0.1745 -0.9372 1.1157 0.9151 -0.0678 1.0147 0.6543 -0.8061 1.7971 0.8887 0.8008 1.3914 -0.8773 -0.9264 1.2701 0.9453 -1.0299 -0.1529 0.5544 -1.1014 -0.6899 -0.1233 -0.8756 0.7442 0.7969 -0.6203 0.9477 -0.9098 -0.8866 1.1268 0.8522 -1.0559 -1.1790 -0.8207 0.8832 0.4905 -0.8528 1.2084 1.0832 0.1923 0.1293 -1.0983 -1.0778 1.1539 0.2945 1.3706 1.1054 1.0225 1.2141 1.8425 0.9134 -0.8268 -0.8853 -0.9702 -0.9788 -1.1255 -0.9945 1.1009 -0.9767 1.0763 0.6111 -1.0459 0.9351 -0.2101 -1.0523 -0.9753 0.6828 0.9707 1.2104 1.1174 1.1689 -0.7521 0.9397 -0.1431 -0.9566 -0.8219 0.3906 0.6031 -0.9838 1.0230 1.2597 1.4866 1.3853 1.4485 1.0852 0.6452 0.9810 -0.9186 0.7990 0.2035 0.7795 -0.9052 -0.8737 -0.8046 1.2006 -0.8695 1.3727 -1.0521 -1.0187 -1.0574 -0.9347 -1.0965 -0.9509 0.5912 -0.7586 -1.0741 2.5174 -0.7624 -0.7689 1.0794 0.1816 -0.8875 0.1823 -0.9817 -0.9710 -0.7921 -1.1360 -0.9583 -0.8711 -0.7684 -0.0654 -0.0052 -0.7835 -0.8572 -0.8063 1.1220 1.0185 -0.8763 0.7641 0.5066 1.0757 0.2794 -0.7819 -0.8208 1.4957 -0.9871 -0.6922 1.0003 1.5784 -0.9163 0.8695 -0.9007 -0.9482 0.0167 1.2461 0.4105 0.4507 0.6183 0.9664 0.6383 -1.0743 0.9140 -1.0371 1.5311 -1.1650 -1.2244 0.7439 0.8908 0.9571 1.1117 0.6554 -0.9886 -0.8216 1.4392 -1.0374 1.0053 -0.3566 -0.9921 -0.8752 1.1994 0.8585 0.7252 0.3179 2.1041 1.9815 0.0454 0.1803 0.5787 -1.1220 -0.5079 -1.0232 1.4525 0.2240 0.8923 1.0152 0.3998 1.1787 1.0962 0.4332 0.0325 1.0869 -1.0379 -0.8404 -1.1078 1.0837 -1.0403 1.6565 -1.0687 -1.1338 -0.9089 -1.0470 0.8369 -0.8878 -1.0876 1.7721 0.9979 -1.0129 0.7615 1.3713 0.8878 1.4617 0.9098 0.7943 -1.1324 -1.1103 1.3281 0.3408 -1.0569 -0.9763 0.6898 1.0344 0.1761 -1.1363 1.4115 -1.1182 1.3017 -0.2363 -0.2238 1.5046 0.6120 0.9318 -0.9382 -1.0743 -1.0045 -1.0782 0.1471 1.2673 0.6732 2.0203 0.7606 0.9096 0.6855 0.7958 -1.0144 -1.0927 0.8686 -0.9872 0.7819 -0.9787 0.6431 -1.0590 0.4769 -1.0713 1.3899 1.4347 -1.0282 -1.2274 1.4509 -0.9705 0.1557 0.7171 -0.8846 -0.8903 0.8339 -0.8077 -1.0030 -1.1987 0.7463 0.9055 -1.1449 0.3437 -0.9629 0.4058 -1.1170 0.5102 -1.0836 -0.9088 1.5375 1.5292 1.3323 -1.1364 1.6994 1.8917 -0.3942 -1.2128 -1.0481 -1.1867 -1.1524 0.5479 -1.2526 -1.1467 1.0409 -1.0348 0.9161 0.4210 0.5877 -1.1297 1.1375 -0.1188 -1.1526 -1.1655 -0.8769 -1.0597 0.6610 -0.9443 -1.2732 -0.8110 -1.3046 -1.1294 -1.0973 -1.0733 -0.9777 1.3415 -0.0558 -0.3622 1.6279 -1.2866 -1.2875 -1.0385 0.7917 0.7400 -0.8038 -0.9663 -0.6373 -1.0605 -1.1277 -1.1354 -1.2343 0.1878 0.8313 1.3173 -1.2262 -1.0695 -0.9188 -1.1131 -1.1871 -1.2879 0.3362 1.5085 -0.0200 0.2968 dimethylarginine (ADMA + SDMA) 0.3225 0.1709 -0.3404 0.3704 -0.6933 1.1246 -0.5834 1.4620 -0.6502 1.1793 0.6114 -1.3977 -0.5579 0.9195 -0.7962 0.8390 0.9829 0.5604 0.1858 -0.0733 -1.1048 -0.3572 -0.0362 0.6936 -0.3625 0.0816 -0.0420 -0.0360 0.3597 -0.6145 -1.1307 -0.2877 -0.4171 -0.3594 -1.4611 0.6231 0.6776 1.0547 -1.7961 -2.0995 0.2538 0.5984 0.0028 -0.1097 1.4924 -0.3051 -1.1222 1.4217 -1.4340 1.3103 -0.1795 -0.3939 -0.0894 1.1304 -2.1683 0.1762 1.1286 -0.6693 0.4287 -0.0381 0.1294 0.6962 -2.0851 2.3519 -1.2339 -1.2804 1.5752 1.2929 0.6137 0.2579 -0.0457 1.0869 0.9178 -0.0500 0.9837 -1.0631 -0.7474 -1.6321 1.1797 0.6168 -0.8985 0.5867 -0.1973 0.4732 -0.3898 -1.1132 1.8197 -0.4229 1.2244 0.4387 -0.5721 -0.8427 -1.5114 -1.0676 -0.1993 -0.4905 -0.2390 -0.5276 0.7984 -1.1336 2.1218 0.2100 1.2054 1.7634 0.1789 -0.6879 1.8031 -2.3501 -0.0096 -0.0711 0.3312 1.2284 -1.0109 0.2557 -0.3487 -0.5642 -1.5760 -0.2980 0.4070 -0.9379 0.5286 -0.1269 1.0584 -1.6767 -1.6348 -0.4456 0.0241 -1.2287 -1.9393 -1.7196 0.1041 -1.2684 -0.2197 -0.2449 0.0346 0.1294 -1.4751 -0.0614 0.0580 -0.6885 -0.2551 0.6689 0.4652 -0.4856 -0.0166 -1.5361 -1.1426 1.8726 -1.0550 -1.0414 -0.5327 -1.0440 -2.1608 1.3178 -2.2135 -1.5984 0.6301 0.8880 -0.0202 -1.4871 1.7852 0.9780 1.1337 -0.7785 -0.2811 0.1002 -1.0083 1.0421 -0.1768 -0.9316 0.5153 -0.6570 -0.4902 -0.8635 -0.7509 0.3816 3.2368 -0.5181 -0.5888 -0.0727 2.3561 -0.2361 -0.2489 0.1495 0.4139 0.6069 0.5370 -0.9957 -0.2157 0.4679 1.1042 -0.3244 0.1730 0.2127 1.1359 0.2093 0.6843 -0.5615 0.2377 0.1238 0.6061 1.0253 0.6843 0.3700 0.8035 1.7216 -0.7110 0.7440 0.0011 -0.4172 2.4410 -0.3027 0.0418 -0.7476 -0.9825 0.3464 -1.1079 -0.0593 -0.9783 -0.0259 -2.1680 -0.1106 -1.0236 0.1177 0.1803 2.3410 -1.1137 -1.4081 0.0933 0.6519 0.0059 -0.5779 -0.4347 0.9969 -0.4789 1.6163 0.8497 -0.0566 -1.3876 0.7583 0.1678 -1.0770 0.4842 -0.4668 0.9655 -0.0904 0.0123 -0.9338 0.3832 1.9104 0.2277 0.6318 0.1801 0.2295 1.0990 -0.4335 -1.2011 1.1240 0.5707 -0.2662 -0.0565 1.0857 -1.0723 0.3816 -0.6414 -0.4327 -0.9222 -0.6317 -1.3373 0.1011 0.3461 -0.3765 1.1418 -0.6755 1.1951 0.5723 -1.7128 -1.1964 -1.0393 1.1719 -0.7269 0.0014 -0.9335 -0.2198 -0.8058 0.0017 0.7623 -0.3961 -1.4286 -0.6240 1.1791 -0.4455 1.0264 -0.7155 -1.0230 0.5859 -0.8505 1.2142 -0.6707 -1.0453 0.5083 0.7590 2.2575 -0.5004 0.2388 -0.4070 -0.4652 -0.2257 -0.6259 1.2301 0.4273 0.6328 -0.1346 -0.1617 -0.8825 -0.2693 -0.3418 0.3200 0.3708 0.3111 0.0537 0.9492 1.8280 1.4582 1.1609 -0.2064 0.9086 0.2364 -0.5977 0.7692 0.3811 1.0684 0.0088 -0.2536 -1.6066 -0.0443 0.9165 -0.5249 0.9170 -0.8373 0.3836 -0.3114 -0.7737 0.4712 -0.9001 0.6828 -0.7761 0.7600 0.2795 -0.2451 0.7504 0.2067 -0.8081 0.2238 1.8609 -1.8516 0.0421 1.7313 -0.8194 -0.7427 -1.2172 -1.3052 -0.0826 0.5557 -0.9778 1.6513 -0.3463 -0.1742 -1.3807 0.3384 1.5758 0.5051 0.6173 1.7837 -0.6203 1.7513 -1.4673 0.6743 1.1445 1.3830 1.5645 0.9945 -1.6367 2.4520 1.6184 -0.4443 -0.8184 -1.2256 0.9258 -0.5802 -1.9622 3.6354 1.2994 0.8766 -0.6429 -1.4109 -0.8193 1.0889 0.9732 -2.0334 -0.2505 2.8429 -1.1034 0.2787 -1.6708 0.6080 -0.3015 -1.3387 -0.3763 -1.1034 dimethylglycine -0.7103 0.2665 -1.2405 0.1141 0.7925 0.2430 1.3304 0.3832 -0.7070 0.8164 -0.4625 -0.1963 0.5854 -1.4262 -0.3532 -0.0853 -0.4558 1.1196 -1.2517 -1.0159 -0.5340 -1.2204 -0.1378 -0.3509 -0.4592 -0.2083 -0.8228 -0.2147 0.2639 -0.5958 -0.7586 -0.9746 -0.0469 0.7938 0.1533 -0.5108 -0.2927 0.5156 0.1595 -0.5351 2.9766 -1.7535 1.8910 1.6545 -0.3998 0.4732 0.3593 0.1228 -0.3758 1.3038 1.1836 -1.3582 -0.4512 -0.4670 -0.6822 -0.0455 1.0004 -0.8279 -1.0272 -0.5346 -1.3797 0.5585 0.6457 -0.5195 -0.1385 -0.2549 1.4552 1.2460 -0.9297 0.0848 2.0041 -0.3111 -1.6799 -0.9859 -0.4159 0.5597 -0.5632 -0.7647 1.1253 1.4134 1.0526 -0.5960 0.7261 -1.4146 0.1020 -0.6601 -0.3683 0.7116 -0.8563 0.1908 -0.2007 -0.1802 -1.1075 -1.1067 -0.2441 -0.5627 -1.2512 -1.4306 -1.0696 0.0301 -0.4844 0.2067 0.7438 -0.1194 -0.9250 0.4708 1.1132 1.0210 2.7799 0.3786 -0.3842 -0.5479 -0.4799 -0.9258 -2.1244 0.3435 0.0832 -0.3381 -1.1094 -0.6202 0.6135 -0.0192 -0.5933 -1.2403 0.7709 -1.2628 -1.3554 -0.0424 0.1495 0.3949 0.1394 -0.4324 -0.8096 -0.2698 -0.4323 2.2528 -1.7027 -0.7913 0.3289 -1.5249 2.4988 0.2846 -0.0706 -0.0206 0.5019 0.5032 -0.8110 -1.2988 0.9827 -0.8855 -0.4944 1.0502 0.5360 -0.2116 -0.8850 -0.5019 -0.5275 0.0632 -1.7888 -0.1701 1.8363 -1.2932 0.7934 -0.7703 -0.5380 -1.4490 0.7341 0.4373 -1.5718 -0.3220 0.8912 -1.7948 -0.0607 -0.9140 -0.6498 1.9523 0.6420 -0.2641 0.1510 -0.0995 2.1958 0.7469 -0.6468 -0.0037 -1.1570 -0.2937 -1.1066 0.3764 -0.2561 0.6324 -0.5399 0.7307 -0.2554 -0.1793 -0.3380 -0.0882 -0.6568 -0.9102 0.5875 -0.5828 -0.6911 0.7575 0.2088 0.0470 -0.3914 1.0825 -0.7861 -0.2074 -2.0064 -1.6718 0.7954 0.4757 -0.4340 0.6743 0.8055 -1.3629 0.5409 0.2922 -1.8521 -0.3129 -0.7629 0.5582 -0.2107 -0.0854 -0.6636 2.4556 -0.8125 0.9256 0.6662 1.5098 0.6183 -0.3375 0.7343 0.5800 0.4594 -0.8541 -0.2896 -0.4867 1.7996 -0.6288 0.1097 -1.1505 -0.7676 2.1316 1.0809 -0.1953 1.0849 0.0020 -0.2827 -0.9368 -0.2701 1.4195 -0.2650 -0.2517 -0.2987 -0.7815 1.1722 -0.9917 0.6536 -1.3543 0.2038 2.7635 -1.1605 3.6871 -0.8911 -0.6122 -0.0415 -0.1523 -0.4731 0.7800 -0.7754 -0.7694 0.4739 0.6960 -0.0187 1.5293 -1.1054 0.0656 -0.4620 -1.3403 1.1949 -1.4439 4.9269 0.1851 -0.1396 2.4415 -0.2744 0.5411 -0.0865 1.6193 0.5496 0.1316 -0.1494 1.5195 -0.5432 -0.7572 -0.0567 0.5374 1.5951 0.1175 -1.1189 -0.2448 0.5873 -0.1833 -1.2469 0.1445 1.4803 1.9072 0.9914 1.7809 0.5363 -0.5999 2.2390 -0.4218 1.3760 -0.8054 -1.2946 -0.4864 -0.0127 1.2405 -0.9661 0.9801 0.7578 0.8989 -1.0295 0.3075 1.1405 -0.1955 2.7858 -0.5268 -0.2767 -0.6280 1.3893 0.7427 2.2657 -0.0928 -1.3219 -1.8979 0.7972 2.3020 0.2518 0.1097 -0.2681 -0.2127 -0.7641 0.3595 -0.1263 -1.1376 0.6355 0.0820 0.2996 -2.2039 -0.1036 -0.3641 -0.0398 0.6714 -0.5556 1.1475 -0.3317 -0.1164 0.3643 -0.6154 -0.7199 0.4738 0.5126 0.0902 0.1717 0.2562 0.3845 -0.7994 -0.4102 2.1659 0.1867 -1.4000 0.7538 -1.0387 -0.7254 0.5115 -0.7191 0.9213 0.7286 -1.2615 0.2678 0.8079 1.4785 -2.0869 -0.8516 -1.2819 0.4552 -0.6860 -0.7598 1.6046 -0.1546 1.7411 -1.5236 -0.2347 0.8664 -1.0044 -0.3277 0.3063 -0.7431 -0.5617 -0.7732 0.4641 -0.1430 0.1283 -0.3085 0.4696 1.8858 -0.9560 dimethyl sulfone 0.7300 -0.7059 0.2857 0.0389 -0.2327 -0.5364 0.7016 1.1577 0.1923 0.0651 -2.2006 -1.3547 1.1737 -0.4035 1.6335 2.2379 0.7448 -0.7250 -0.2557 1.4815 0.7989 0.1862 0.6393 -2.3985 1.1550 1.0622 0.6476 1.1321 0.6406 0.9752 -0.1037 0.7023 0.8815 -0.7830 -0.6055 0.7614 1.3064 0.8963 0.5023 -0.0159 0.8586 0.9861 -0.0514 -0.8448 1.0449 -0.1569 -0.6494 1.9925 0.6180 0.9577 -0.2762 -0.6403 1.0584 -0.2518 0.2796 0.4140 0.2596 -1.8218 -2.5554 -2.6834 -0.2094 0.0597 1.6395 -2.2622 1.1950 0.2566 -0.3973 -0.9801 -0.1300 1.1524 0.8292 -2.6976 0.1593 -0.2318 -0.1913 -0.0267 0.5750 2.2295 -0.7033 0.1339 0.1692 -0.6210 2.2846 -0.4560 1.1917 0.4154 -0.2111 -2.3195 0.0469 2.0194 -0.3996 0.8858 0.2788 0.5208 1.7304 0.1947 0.3435 0.9836 0.9235 -0.6530 0.6509 1.2033 0.5278 -0.7776 3.0375 -0.3295 0.7298 -1.4590 -0.2044 0.0802 0.7445 0.5393 0.9486 0.3254 0.1512 -2.4348 -2.0934 0.0853 0.5004 -0.2677 0.2876 0.2376 -2.5235 0.4483 -0.1709 0.2991 -0.0835 0.8605 0.6442 -0.5696 0.3037 -0.5144 0.2465 -1.4277 1.3300 0.5165 1.2010 0.7530 0.2498 0.8504 -0.1466 0.3146 0.3346 0.9577 -0.4874 -0.9449 -1.7713 0.0189 0.9846 0.7298 -2.0417 0.6221 -0.0889 -1.0135 0.1442 -0.6180 -0.4783 -2.0852 0.1112 -0.7672 0.7047 -0.5932 -0.9020 -0.4795 -0.4782 -0.5594 0.1801 -2.6536 0.5033 -2.4446 0.7014 -0.0248 -0.3018 0.7653 0.0608 -0.0751 -0.2248 0.3990 0.3881 0.1577 0.2540 0.6327 0.0464 0.5597 1.5891 0.5281 0.0377 0.1163 0.9552 0.4824 1.4190 0.2576 -0.5935 1.2683 -1.2751 -0.3743 0.4448 1.1857 0.1989 -0.1263 1.9471 0.7301 0.3898 0.2573 1.5435 1.4421 -0.2889 1.3055 -0.3151 1.1581 0.5570 0.7433 -0.3394 -1.2305 -0.7531 1.1904 -1.2693 0.4865 0.3791 0.4785 -1.1755 -0.4749 0.2355 0.1609 -0.3221 1.1231 0.3388 0.3198 0.3710 0.7168 -0.2988 1.4187 0.9406 0.4063 1.3487 1.0327 0.2555 1.4566 -0.5134 1.2300 -2.6052 -0.4877 -2.5545 1.4340 0.5061 -0.0119 0.2057 2.4811 0.0173 0.4468 -0.6546 -0.0075 0.3784 0.0608 -0.0893 0.6528 0.5409 0.6574 0.4487 -0.2307 0.4620 1.0423 0.5629 -1.5463 0.2700 1.0845 0.3813 -0.7970 -1.0718 -0.1270 -2.7485 -0.7561 0.2949 -0.3988 0.4039 0.3530 -0.6027 0.4913 -1.1701 -0.4860 0.0131 0.8445 -1.0510 0.1055 0.9663 0.5930 0.4097 0.3159 -0.1376 -0.4594 0.1741 0.1020 0.3053 -0.2677 0.3839 0.3000 -0.7337 0.6982 0.1033 -2.7897 0.8479 -0.2396 -0.0106 0.9629 -0.2952 -0.7181 0.2895 -0.1839 -2.8308 -0.2722 -2.4262 -1.3723 0.5616 0.4094 -0.2717 -2.6035 0.3865 0.7026 0.6005 0.6835 0.6205 -0.5416 -2.1529 -2.9366 -0.0802 -0.5393 0.3255 0.3221 0.2003 0.9681 0.9392 0.3193 -0.0102 0.3338 0.0424 -0.9789 0.0031 -2.6815 -0.1002 0.4095 -0.5665 -1.0635 -2.9065 0.7031 -2.2314 0.3994 -0.4861 0.8169 -0.2988 1.0567 0.5297 -1.4090 -0.8728 -0.0871 0.7448 0.5639 0.2368 -0.2250 -2.0895 -0.2793 -0.0547 0.1576 -1.0210 -0.6173 1.2031 0.3474 0.0215 -0.7727 -0.1176 0.1038 -0.8960 -0.1494 -2.5126 -0.2632 -0.0723 -2.2692 -0.7826 0.4048 -0.5854 1.0874 0.1649 0.0441 -0.0954 0.0275 -1.0904 -0.4965 -0.5018 -0.3836 0.5625 0.2347 -0.8106 0.3766 -1.7700 -1.0878 1.2093 0.6787 -0.9591 0.0954 -0.5049 -0.6961 -1.6234 0.0361 -0.6706 0.5708 -0.5062 -0.5001 -0.9079 0.0077 -0.1081 0.5096 docosadienoate (22:2n6) -0.2910 0.5483 1.1560 0.9235 1.0044 1.0938 -0.5511 0.0307 0.6072 0.8231 1.7722 -0.0706 0.5643 -0.9737 -1.3219 -3.5235 0.4433 0.5216 -1.1043 -0.1857 -0.8546 0.5745 -1.0017 -0.8640 -0.1323 -0.5362 -1.2558 0.7228 -1.5885 -0.1470 -2.5409 -0.7179 -0.0175 0.6479 1.0453 0.2513 -0.6219 -0.7489 -0.6881 -0.4259 -1.3373 -1.5396 -1.0853 0.9101 1.2691 0.2169 -0.0570 -1.0905 -1.3343 -0.6480 0.0198 0.3112 -1.3096 1.2996 -0.9884 -0.4427 -1.4348 1.7234 -0.1394 1.8908 -1.5268 0.0924 -1.3271 0.2767 -1.2020 -0.5489 -0.1624 0.6444 -0.6010 -0.5762 0.6166 -1.1344 -0.5179 -0.3789 0.4663 0.6681 -3.5017 -2.2268 0.7748 -1.2112 -0.8270 0.7318 -0.3006 1.6354 1.1352 -1.1301 0.0812 1.4313 0.5719 -0.9135 0.4566 -0.7265 -0.3324 -0.7480 -0.1634 -0.5260 0.4659 0.4829 -1.2742 -0.1227 -1.0783 -0.8574 -1.0579 -0.6678 -1.3980 -1.1660 0.8605 -0.4668 1.7221 0.2794 -0.1442 -0.9253 -1.5724 2.6479 1.9333 -0.8202 -0.6924 -0.3322 2.0342 0.8470 0.1348 1.3385 -1.2622 2.7273 -0.5691 0.1786 0.3168 -2.4051 -0.7111 0.7798 0.3490 1.4208 0.3207 -1.1573 -0.7656 0.1210 0.3510 -0.6706 0.1855 -0.8139 1.0619 -1.2713 1.1291 0.0974 0.7410 -1.8559 1.1890 0.3784 0.8338 -1.0321 -0.4615 0.2972 -0.1857 0.9116 0.2023 -0.0717 1.5599 0.4356 0.0476 0.1335 -0.6720 0.0305 -0.8261 0.9405 1.3338 -0.3585 -0.9015 -1.3178 -0.5003 -0.1906 0.0956 -0.2618 -0.8493 -0.0366 -0.0584 0.7347 2.0518 -1.1002 0.1476 -1.6478 -0.9682 -0.8735 -1.1439 0.0345 -0.6731 -0.0472 -1.1490 0.8175 -0.3400 -1.3250 0.2593 0.7049 -0.5044 -1.0038 0.0327 1.3532 0.4861 -0.2544 2.0451 1.0175 -1.4307 -0.4157 -0.6675 -1.3646 0.4227 1.5696 0.4680 -0.7757 1.1686 -1.3634 -0.3613 0.6313 -0.8588 -1.5294 0.2021 -1.0522 1.0799 -0.7116 1.1219 0.4604 1.7311 1.0051 -0.7751 -0.2914 -1.3835 0.5265 0.7120 0.2091 -0.8847 0.2648 0.1049 -0.8040 0.6863 -0.2630 0.7010 -0.4384 0.1012 1.9996 -0.7543 0.4260 1.2185 1.2287 0.0279 -2.3588 0.2389 0.4552 0.1599 -0.9679 0.4959 0.5831 1.1944 1.3448 -1.2510 0.2065 1.0143 -1.6973 -0.1197 0.5041 1.8981 -0.8853 0.4794 -0.5090 0.8074 0.3891 1.8626 0.9263 0.2144 0.0566 -0.3202 0.0419 0.4326 -0.9466 0.3427 0.5379 0.6760 -0.9986 1.5534 -0.9517 0.2334 1.2203 -0.9970 -1.1614 0.3272 -0.6585 0.9435 -1.4483 0.6520 -0.1932 0.1801 -1.0837 0.1911 -0.2193 -1.1975 -0.5893 -0.3388 -1.0157 0.4493 -1.2684 0.5833 0.7989 -0.1479 -0.1705 -0.1501 -0.5818 -1.2354 -1.7737 0.6636 0.1890 1.7537 0.8462 2.3886 0.0567 0.9339 -0.1104 1.3914 -0.1909 0.0007 -1.5042 -0.7630 0.3875 0.2403 1.4188 1.8240 0.8715 -0.7531 1.0512 0.6209 1.3336 -0.2230 -0.0518 -0.2871 0.2480 0.4991 0.2442 -1.1283 -0.1183 -0.0812 0.6150 -1.8860 0.1518 0.3778 -0.0265 -0.7173 -0.9257 2.1239 -0.2826 0.4723 -0.6745 2.1001 -1.0051 0.2501 0.5418 0.5913 0.4143 0.9730 -1.8099 1.7281 -0.4747 1.7655 0.0190 0.4835 0.0345 0.2791 -0.0695 1.5214 -0.6906 0.2180 -0.7362 0.5058 -0.5671 0.4090 -0.1737 0.9660 0.7249 0.2421 2.1553 0.2127 -1.2645 -0.2543 0.2014 2.0975 -2.5244 -1.4100 0.9561 0.5972 0.6664 -0.4135 0.4533 -0.4395 0.8750 0.5106 -0.2086 1.7629 -1.5382 -0.1600 0.9342 -0.7564 -0.2592 -0.1391 -2.2429 -0.2356 0.6715 0.1305 0.8043 0.0689 1.2582 1.8448 -0.2966 1.4238 1.0083 docosadioate (C22-DC) 0.6776 -0.5903 0.6732 0.2087 0.6181 -0.1344 1.0903 0.5378 0.4524 0.9472 1.4469 -0.5846 0.0095 0.5986 -0.0883 -0.1482 0.0453 0.2434 -0.1166 0.4738 0.1957 -0.7225 0.2082 1.1746 -1.8286 0.6635 1.0269 0.8050 -1.6211 0.3631 0.6954 0.0537 -1.2952 1.1301 0.3711 0.9199 0.4440 -0.3190 -0.7002 -0.4747 -1.4891 0.4201 -1.8832 -2.1700 -1.6408 0.2060 -1.8787 3.0382 0.0873 1.1945 0.4251 -0.0742 -0.1232 0.3579 0.6270 -1.0639 -1.8916 0.0693 -1.9507 0.3708 0.7505 0.3947 0.1315 0.7174 -1.3402 1.6781 0.0855 1.3174 0.1305 -1.6092 -1.8867 0.8687 -1.9641 -0.0273 -0.8966 0.4124 0.2383 -1.8540 -0.7429 -0.4219 -0.5514 1.5714 -0.2857 0.3149 -0.3631 0.2438 -0.7358 -0.2642 0.5879 0.0720 2.1624 0.6366 -0.4013 0.2869 0.1549 0.0087 0.6731 -1.7987 1.1968 0.0611 -0.1436 0.8993 0.5017 0.3720 -1.7141 -0.7743 0.8367 0.7168 0.6617 -0.6383 0.5923 0.5311 2.6945 -0.0868 1.1879 1.9995 0.1988 -0.4175 -0.7700 0.0008 0.9393 0.2813 1.1903 -0.1904 -0.3215 0.6222 0.8984 1.4155 0.3688 -0.8379 0.6269 -0.1224 -0.2177 -0.1950 0.0345 1.8643 0.9694 0.8359 0.8401 1.1811 0.5332 -1.9763 -0.5182 -0.4332 -0.3817 0.0373 -1.8614 -1.3555 0.5592 0.6334 0.9704 0.4798 2.3809 -1.0282 -0.4963 1.3898 0.5970 0.0872 -0.3230 1.3032 0.2280 -2.2467 0.9827 -0.4906 -0.3728 0.6778 0.2749 0.7626 0.3520 -0.6587 0.1097 -0.6494 -0.0274 -1.5689 0.8390 -1.4620 0.5813 -1.5882 -1.7872 0.0899 1.4297 0.5773 -1.9657 0.1475 1.1974 0.4103 -0.0134 -0.3475 -1.5822 -0.2561 0.6317 0.5023 0.8460 0.1102 0.0855 -1.4355 0.3449 0.0635 0.6777 -0.1482 -0.2086 -0.3471 -0.3131 1.7810 -0.2738 0.5890 2.3182 0.0306 0.5035 0.5506 -0.1385 0.2584 0.2490 0.9258 -0.6146 -1.9839 0.3148 1.5721 0.6940 2.9335 -0.2345 0.5518 -0.0284 -0.9334 0.6327 0.2717 -0.9028 2.3235 -0.4276 -0.1933 -0.1583 0.8157 0.4504 0.0569 -0.4571 1.1187 0.7872 -1.7805 2.3046 0.8397 -1.9855 1.1925 0.3400 0.6098 1.0485 -0.2813 -1.9797 0.2681 0.0658 -0.5212 -0.1877 1.7372 0.1709 0.1583 -0.0493 0.7789 -0.4728 -0.0126 -1.8667 0.8034 -1.2891 1.3564 0.1642 -0.1848 -0.5212 0.8795 0.2037 -0.0359 0.0461 0.7139 -0.7753 -0.5399 -0.4197 -2.0838 -0.0346 1.7108 0.5588 0.3674 -1.2390 -1.5731 0.2320 0.4185 -0.0635 -2.1854 -2.3403 0.0720 1.4142 1.6824 0.5853 0.0848 -0.8125 -0.4494 1.2236 0.7406 -0.3077 0.2082 0.0566 -0.2408 -1.2309 -2.1259 -0.9737 0.1008 1.2597 0.6290 0.5039 -0.2680 0.2280 1.1389 -0.5581 -1.1355 -1.8512 1.1580 0.2270 -0.6126 -0.1659 -0.5868 -1.1211 -0.0974 -0.4913 0.0799 -0.7477 -2.1326 0.8205 -0.2838 1.1012 -0.1462 1.7303 -0.0937 -2.0385 -0.1700 -1.0382 0.8543 -0.5785 -0.6360 0.0593 -0.7651 -0.7345 -0.7445 -0.4355 -0.3231 0.4685 -2.4660 0.7506 -0.4648 -0.3836 -1.8376 -1.7141 -2.1755 -0.0804 -0.0898 1.2451 1.1138 0.5793 -0.4013 -2.0899 -0.4997 -0.8109 0.0715 -0.1824 0.1940 0.4988 -0.9647 1.2870 0.0300 -2.0549 1.1180 -0.4659 0.5763 0.5641 -2.3061 0.0404 0.4665 0.1330 0.1100 -0.0083 0.0143 0.3823 1.2025 0.1781 1.4538 -0.7330 0.3356 -0.3583 0.4099 0.9767 -1.3910 -1.0001 -2.0699 -0.8092 0.4452 0.3027 -0.1143 0.9988 -0.8362 -2.2340 -2.2486 -0.1198 1.9929 0.1727 0.4260 0.3029 -0.2984 0.4118 -0.3400 0.2307 -0.8698 1.8824 0.1402 0.0751 -0.6692 docosahexaenoate (DHA; 22:6n3) -0.9077 -0.1368 0.1369 0.3966 0.4670 1.0258 0.8585 1.5118 0.1412 0.2120 1.3298 1.0250 1.6565 -1.7235 -2.6533 0.4123 -0.1029 -0.1408 1.5886 1.4212 -0.2958 2.0855 1.1956 -0.1314 1.4997 -0.1502 0.9728 0.1621 0.2058 0.2813 0.4135 0.0943 -0.8636 0.5102 1.9223 0.7524 1.1442 -0.4739 0.4181 0.2048 0.3333 1.4308 -0.2254 0.1820 1.9661 0.1384 -0.5899 -0.8834 1.2673 -0.6911 0.2044 1.2585 -0.0305 2.3472 0.5762 0.6384 0.7990 1.4193 0.6815 2.2192 0.1990 -0.2638 0.0705 -0.9543 0.2553 -0.5103 0.6255 0.1970 -0.2550 0.0486 1.0832 0.6784 -0.0692 -0.0735 0.0503 -0.3510 1.3128 -0.3592 -0.7547 -0.7637 1.2055 -1.2026 -0.9454 0.7146 -0.9102 1.1550 0.4009 -0.5582 -0.5968 0.7780 1.5923 1.2722 0.1187 -0.3982 0.4578 0.0505 2.1741 1.3399 -0.9138 0.6382 -0.3316 0.6283 0.0442 -1.3943 0.6056 -1.4270 0.2189 0.3802 1.1563 -0.3020 -0.7426 -0.8478 1.2078 0.3715 0.9801 -1.0570 -0.5334 -0.9901 -1.5167 1.8511 -1.0840 0.9250 -0.4083 2.0216 -0.6760 0.2548 2.0827 -1.4559 0.4249 -0.7401 -0.2029 -0.4947 1.9023 -0.3639 -0.0936 -0.7706 -0.1877 -0.6056 1.5825 0.1844 0.0584 0.4625 -0.7590 -1.4508 0.5467 0.0605 0.7415 -0.3506 0.3089 2.2744 0.4669 0.6174 0.4300 -0.1268 -0.0021 1.8914 -0.3580 0.5420 -0.4017 0.7298 -1.4720 0.1277 -0.2867 1.8522 2.1233 0.0127 0.1711 -0.5048 0.6369 -0.1550 0.5568 0.9508 -0.5074 0.1320 1.4130 0.9563 0.1381 -0.6780 0.1603 0.3234 -1.1217 -0.6331 1.7655 -0.9849 -0.9948 0.8590 -1.4222 1.3790 -0.3549 -1.2302 0.1408 0.6110 0.9845 1.9790 -0.5177 -0.0456 -0.7485 0.7067 -0.5036 0.3079 -0.1814 1.3733 -1.8028 -1.2233 -0.2526 -0.0782 0.4231 -0.4555 -1.5956 -0.9284 -1.4166 -2.1268 -0.1971 -0.7272 -0.9788 0.8108 -0.1697 -0.1072 0.2645 -1.1014 1.2717 -0.8645 0.0801 -0.8469 0.4208 -0.9097 0.7227 0.5482 0.7445 -0.3407 -0.6865 0.8349 -0.0277 -1.2001 -0.0803 -0.7867 0.2150 0.5910 -0.1387 -0.4770 -0.1673 -0.1000 -0.5114 -0.6857 -0.5383 -1.3288 -0.5994 -2.0401 -1.3422 -1.4298 -1.0418 1.2812 -1.5110 1.6667 -0.2225 -1.3865 -0.3903 -0.1797 0.9733 0.9514 -0.8185 0.3256 0.5179 0.0484 0.9351 0.7640 -0.4396 -1.1023 -1.0596 0.3778 -0.0131 -1.3596 -0.2715 -0.8452 -2.0386 -2.2325 2.0406 1.4235 0.8612 0.0549 -0.4506 0.8387 0.2760 -0.7678 0.8243 -0.0959 -0.5434 0.3748 -0.0379 0.3791 -0.5057 1.2865 -2.8187 -0.5673 -1.5796 -0.2895 0.5035 -2.0556 -1.2450 1.2599 -1.2597 -2.1647 0.8688 0.7307 -1.6364 -1.0179 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-0.1044 -0.6267 -0.0017 0.1912 0.5093 -0.9207 2.2957 -1.3670 -0.7232 0.1409 -2.7089 -1.1999 0.2862 0.3264 1.3725 -0.3635 0.7499 -1.1644 -0.5966 0.2698 -0.9628 0.6916 -2.0766 -0.8268 -1.0881 -0.3975 -1.0787 0.7603 -1.0983 1.8037 -0.0935 -0.6291 0.6485 1.2349 -0.3433 0.4558 0.7957 1.0215 1.8836 1.2145 0.5526 0.5499 -0.0706 0.5082 -0.0343 -0.7976 -0.1548 1.6610 0.1839 -1.3873 -1.1370 -0.9566 -0.7423 -0.8711 -0.2566 -1.8828 -0.5788 -0.0825 2.3162 1.4935 -0.4806 -0.5936 0.2126 0.7408 -1.3265 1.5034 0.2245 -0.1993 1.1872 -0.1692 0.9083 0.2796 -0.6354 -1.6139 0.4522 1.1481 0.5311 0.0816 1.2486 -0.1735 -0.8798 1.0673 1.4398 -1.2491 0.1211 -0.5456 -0.5560 -0.2739 0.6350 0.5277 0.7567 0.4024 -0.3559 -0.7394 -1.3443 0.0044 -0.4061 0.8170 -0.2165 -1.8448 -0.4585 0.7269 -0.1730 1.6063 0.6075 -0.2625 -0.0078 -0.4269 -0.7757 -0.4562 -1.3337 -0.6355 -0.1300 -0.3554 -0.0892 0.9118 -0.6093 -1.4148 -0.0546 -0.1424 0.9016 0.9544 1.2070 0.4319 -0.3164 -0.4872 -2.9593 -0.2391 -1.4242 0.3604 -0.5794 0.0528 -0.2644 -0.5306 2.0863 -0.9389 0.7699 0.6842 -1.8776 0.3072 0.1213 -0.0198 -0.3159 0.3223 0.3227 -2.4457 -0.9395 1.9605 1.2949 0.6895 -1.1383 0.3032 0.8339 -0.0015 -0.9034 0.7075 0.7657 -0.8179 -1.0115 2.6992 -1.1468 -0.3688 1.6399 0.0966 -1.1420 0.2974 -0.3381 1.3303 0.8218 -0.8990 0.9431 -0.3387 0.0334 1.1411 1.4752 -1.6912 -1.5275 -0.2430 -0.3256 -1.2578 -1.3319 0.2217 -0.3667 1.3423 -0.7211 2.1841 -0.2587 0.2993 -0.4864 -0.8735 0.4252 0.9802 -0.4166 0.5515 -1.0474 -0.6752 1.1033 1.7070 -1.1633 -0.2274 -0.3358 -1.9077 -0.2329 -0.6353 0.4931 1.6373 0.4474 0.3456 0.3059 -0.5035 0.6307 -0.2159 -0.3388 0.4904 -0.4320 0.7477 -0.6231 -1.0725 0.3779 -0.3688 0.3454 0.1603 -0.3234 -0.9146 1.2877 -0.7717 -1.7781 0.3615 -0.2944 0.8965 1.7704 0.8936 -0.5251 0.2122 -0.0800 0.4770 -0.2584 0.4840 -1.6865 0.6687 0.3551 2.7299 -2.0889 0.5930 0.9571 1.1175 1.4159 0.9579 -1.7617 1.5997 -2.1031 0.4585 0.1044 -0.0267 -0.4291 -0.1072 0.4814 -0.2186 3.0255 0.1923 -0.6644 -0.9079 -1.2037 1.2800 -1.0746 -0.9935 -0.7378 0.6893 0.8013 -0.2852 1.0377 0.9780 1.5333 2.3415 -0.2886 1.1860 -0.7224 -0.7607 0.0138 -2.2085 -1.3511 -0.3174 -0.3495 0.2469 0.8633 -0.5804 -1.0571 -0.0109 -0.9529 -0.0841 0.1117 2.0564 0.3947 docosatrienoate (22:3n3) 0.8000 0.2459 1.1114 1.1664 0.6165 0.8759 -0.9995 0.3440 1.1471 0.9643 0.4136 0.0786 0.6292 -2.4104 -0.7268 -1.4484 0.8226 0.9027 -2.2799 0.3219 -0.3647 0.6415 -0.5916 -0.4730 -0.1903 0.0870 -0.3235 0.1098 -2.1226 -0.0204 -0.6346 -2.1494 -0.0378 0.0059 1.6726 0.0189 -0.3555 0.1288 -0.5083 -0.3914 -2.0288 -1.7855 -0.5582 0.7176 1.8698 0.1190 0.1285 -0.8838 -1.6021 -2.3181 0.9875 0.9538 -0.1680 2.3325 -0.8316 -2.5285 -1.7663 0.8605 -0.0117 1.4764 -0.1648 0.0759 -1.3701 0.5795 0.1280 -0.8050 -0.1335 0.9935 0.1135 -2.1207 -2.3612 -0.7741 0.0661 0.3349 1.1035 1.1890 -1.1313 -2.3327 0.4860 -0.7071 0.0326 0.7498 -0.5031 0.2914 0.7914 -0.8739 0.5011 0.9103 0.3258 -1.9962 0.3297 -0.0515 -0.5426 -0.2104 0.2441 -0.3019 -2.3289 0.0613 0.1064 0.0717 0.0579 -0.5763 -0.6282 0.0531 0.2911 0.2620 -0.0109 -2.3995 1.1755 0.4912 0.5642 -0.4362 -0.6380 1.9748 0.6072 -0.2364 -0.6636 0.0606 0.8489 0.5848 0.0989 1.9141 -1.4124 2.6069 0.0243 -0.0804 0.5590 -2.4174 -1.0606 0.8557 1.4226 1.8405 0.1338 -0.0326 -0.3720 0.7722 0.1274 0.0200 0.5414 -1.0816 0.0273 -0.3792 1.0390 0.2030 1.3221 -0.7484 1.0368 0.9904 -0.2539 -0.5529 -0.6239 -0.3425 -0.2744 0.4833 0.7947 0.6783 0.8511 -0.5676 0.2331 0.0217 0.7891 0.2625 -0.8787 0.6766 0.9822 0.0993 -0.9555 -1.2726 -0.3021 0.2191 -0.0751 0.4322 -0.8265 0.2879 -0.0167 0.6978 1.6052 -0.3290 -0.1586 -1.0992 -0.5885 0.4505 -0.7165 0.4413 -0.3584 0.4291 -0.9984 0.6535 -0.3275 -0.5444 -0.1825 0.7647 0.1750 -0.2880 -2.1231 1.1319 0.1163 -2.6628 1.5489 0.6145 -0.0127 -0.0555 0.1132 -0.6650 0.7761 1.3826 0.8548 -0.6823 1.2024 0.0378 -0.4140 0.3466 -0.4309 -1.1823 0.1690 -0.8064 -0.0626 -0.2318 0.9413 0.2267 1.8863 0.5701 0.4005 -0.0577 -0.6431 0.2146 0.2586 -2.7005 -0.4589 -2.3420 -0.0488 0.0885 0.3632 0.0444 0.3784 0.6240 -0.1118 1.9689 -0.3072 0.1960 1.5526 1.1052 -0.0792 -1.6553 0.3934 -0.0299 0.5550 -1.5668 0.5572 0.8662 0.6549 -2.5595 -2.5718 0.4509 0.1438 -1.3082 0.3333 0.6606 0.8313 -2.6082 0.6695 -0.0464 -0.5846 -0.1794 2.2201 0.1876 0.3073 -0.0682 0.2185 0.1255 0.4954 -0.6328 0.4345 0.3440 0.6675 -0.2495 1.2317 -0.7612 0.4814 0.9885 -2.6406 -0.5880 0.0462 -2.5535 0.6280 -0.8682 0.2514 -2.3820 0.8387 -0.4233 0.7140 -0.0708 -0.3154 -0.1419 0.5325 -0.0012 0.0466 -1.0464 1.1459 0.6117 1.1663 -0.3759 -0.0198 -0.4665 -0.8793 -0.9318 0.6122 0.4590 1.0293 0.5248 1.4735 0.4622 0.6647 -0.0704 0.7920 -0.9807 0.5602 -1.9778 -0.4195 -2.5593 -0.0894 0.8061 0.6824 0.1398 -0.0634 0.6912 0.6989 1.0857 -0.1082 0.1989 0.1330 -0.5582 0.3349 0.5560 -0.8390 0.2291 0.5362 0.4893 -0.7795 0.4764 0.6553 0.1219 -0.1954 -0.3175 2.0783 -2.3293 0.5103 -0.6642 1.2350 0.1108 -2.1459 0.6498 1.2703 1.1072 1.1095 -0.3315 1.3069 -0.2136 1.1269 0.1936 0.6356 -0.2478 -0.5809 -0.0628 1.2819 -0.5713 0.9890 -1.0432 1.2063 -0.1919 0.9010 -2.5310 0.7784 0.4957 -0.4590 1.5904 0.7749 -0.2331 0.3512 -0.3242 1.3600 -1.3008 -1.0189 0.2202 -0.1226 1.4035 -0.2393 0.7071 -0.3094 0.9137 0.4684 -1.0184 1.0740 -0.7789 0.7096 0.3910 -0.6200 -0.0092 -2.9034 -1.8923 0.2246 0.9528 0.2570 1.0447 -2.7541 1.1806 1.2857 0.1836 0.9539 0.4570 dodecadienoate (12:2)* 0.8272 0.8755 1.2540 1.4082 0.8912 1.9448 -0.3748 0.3255 0.9317 0.4288 1.1881 0.9257 1.8053 -0.5766 -1.0192 -1.0225 1.2596 1.2309 -0.5617 0.6679 -0.6644 -0.0395 -0.8879 -1.5432 -0.3391 -1.1527 1.5666 -0.2395 -1.9146 -0.2249 -0.8209 -2.1895 0.3238 1.4161 0.9546 -0.7246 -0.9951 -0.8187 -0.1968 1.5996 -2.0786 -0.9310 -0.7580 1.7774 1.8058 0.6773 -0.2277 -0.4675 -1.7840 -0.4971 -0.5170 1.0107 -1.0953 1.4989 -1.5117 0.0696 -1.4302 1.0595 -0.4955 1.9036 -1.5093 0.8678 -0.6444 -0.3645 -0.9634 -1.1927 0.6878 0.5777 0.0530 -0.9410 0.8318 -0.1053 -0.2504 -0.5412 0.9462 0.3665 -0.8485 -0.2464 -0.6968 -0.7305 0.3466 1.6969 -0.8809 0.9772 0.3688 -1.0534 -0.6392 1.1542 0.4620 -0.3246 0.4201 -0.3392 -0.5830 -1.0349 -1.0942 -1.2900 0.7969 0.0227 -0.4841 -1.0289 -1.1988 -0.5080 -1.7047 -0.0311 -1.1270 -0.6182 0.5439 0.9397 2.1945 -0.8866 -0.2706 -0.6302 -0.0278 1.8390 1.3911 -1.7700 -1.8525 0.1785 0.9165 0.6625 -0.5247 0.6826 -1.3028 -0.1024 -0.0974 -1.1166 0.0757 -2.3309 -0.9304 0.0246 -0.7022 -0.5395 -0.2067 0.1540 -0.9957 -0.0473 -0.1655 -0.9553 -1.7585 -0.6953 0.8491 -2.7985 0.0236 0.9226 1.4511 0.1287 1.1570 0.1046 0.8171 -0.7202 0.6125 2.0262 0.2686 0.2976 1.3274 0.1123 1.1786 -0.8154 -1.1765 0.9276 -1.5890 0.3043 0.6482 1.3886 1.1850 0.7556 -0.9603 -1.5425 -0.7773 0.1855 0.6749 0.9135 -0.7990 -1.7460 0.9420 1.7322 1.4812 -1.7824 0.1646 -0.0524 -0.5674 -1.0856 -1.1064 -1.1471 -1.1013 0.3840 -1.3127 -1.1026 -0.6176 -1.7455 1.0040 0.2822 -0.1672 -0.0259 -0.3611 1.6147 0.1760 -1.3493 1.0049 0.8567 -1.0454 -0.5656 0.3314 -0.9249 0.0836 1.0477 0.5139 -0.9902 -0.7511 -0.9872 -0.6369 0.0502 -0.3067 0.0797 0.4769 -1.2946 0.0671 0.2427 0.9451 -0.1122 1.1624 0.8816 0.6438 -1.3428 -1.3727 0.5147 -0.1120 -0.1158 -1.0795 0.1195 -0.3877 -0.0524 1.0551 -0.1743 0.6744 -0.4712 -0.7829 1.0335 -1.0420 0.0774 1.2836 0.5208 1.5312 -0.8078 0.1945 1.0399 0.7151 -1.4916 0.0323 -0.0689 0.3898 0.6703 -3.0212 1.7283 1.3427 -0.8767 0.6423 -0.1108 0.6178 0.3944 -0.3692 -0.2824 0.4482 0.2643 1.3800 1.0772 -0.2753 -0.6067 -0.2374 0.0940 0.0525 -1.1485 0.1154 0.9441 0.4248 -1.0852 2.2996 -0.5654 1.2472 0.9129 -0.3080 -0.1370 0.0716 0.4396 1.4790 -0.8057 0.4784 -0.0732 -0.2408 0.6658 0.3594 1.0588 -1.3218 -0.5073 -0.4502 -1.1972 -0.6207 -0.0741 -0.3864 0.0347 -1.2720 -2.2396 0.2271 0.1323 -0.8157 -0.8086 0.3297 0.4022 1.0557 0.6585 1.4330 -0.5981 0.1294 -0.2019 1.1521 -0.9312 -0.7454 -1.3340 -0.4255 -1.3843 0.8625 1.5801 0.7764 0.2272 -0.3056 0.7782 1.3734 -0.0086 0.2975 -0.3034 -1.2837 -0.5988 1.0116 0.7555 0.3785 -1.2433 -1.3270 3.2407 -0.7456 -0.7735 0.8342 0.6400 -1.0525 0.7405 0.1539 -0.5418 0.9704 -0.1128 1.3040 -0.7231 2.5134 1.7477 -0.0205 0.2461 0.9566 -1.1494 0.9168 0.3240 1.3223 -0.7015 -0.7061 -0.2729 -0.7210 0.3851 1.6886 -0.4730 0.0696 -0.4815 0.3616 -0.3233 -0.0271 0.2220 1.3048 1.7553 -0.0775 1.2631 -1.0146 -0.6052 -1.0646 0.1224 0.9404 -2.8900 -1.5044 0.7190 -1.4207 0.9699 -0.8844 1.0240 0.3492 1.3011 0.6673 -0.2076 1.6493 -0.9562 -0.1024 2.0056 -0.8970 0.5388 -0.5788 -0.5803 1.6237 0.5435 -1.1199 -0.0201 0.3237 1.5667 1.7442 -1.6171 0.6533 -0.6821 dodecanedioate (C12) 1.4578 0.6179 1.2112 1.0041 -1.9594 2.3237 -0.2828 1.6203 1.4523 2.2254 2.7967 0.7376 0.3384 0.9814 -0.6129 0.3302 1.4352 -0.3840 -0.0429 0.3152 -0.9544 -0.8886 -0.3516 -0.8086 -0.4502 -0.5275 -0.0439 -3.0125 0.4995 1.1965 0.0132 -0.6992 -0.8468 -0.4987 0.4395 2.7220 0.0342 0.4585 0.3468 -1.1378 0.2943 -0.4698 -0.2498 -1.4117 -1.1810 -0.2365 -0.3079 0.3501 -0.3677 1.2950 -0.1245 0.4272 0.5547 1.7004 0.7157 -0.5364 -0.4609 -1.3361 0.7555 0.1413 -0.7433 0.0846 0.4781 2.6646 -0.1410 -0.6801 0.0870 -1.2676 -0.9392 0.9120 0.3470 -0.2260 0.7358 0.1851 -0.7064 -0.4416 -1.4376 -2.1334 0.1225 -0.6979 -1.5499 1.6313 1.1704 -0.3742 -0.0329 -0.3613 0.4638 -0.6074 -0.6960 -0.1624 -0.5054 0.7469 -0.4196 -0.5823 1.5548 -0.1863 -0.6213 1.3396 -1.2484 -0.0406 0.9628 0.1948 0.1660 -0.5721 -0.9509 0.2362 1.9313 -0.0507 1.1521 0.6822 1.1636 0.1923 -0.9243 1.5989 0.7519 1.0464 -1.0845 -0.5232 1.5349 -1.3649 0.9488 -0.1068 -0.7539 0.3319 0.2659 0.7944 -1.0372 -0.3655 -0.7049 -0.4059 0.3999 0.6305 -0.6063 -0.1019 0.0475 -0.7191 -0.5227 0.3894 -0.9353 0.6915 1.6951 0.0513 -1.3864 0.3958 0.8121 0.3997 -1.2197 0.5521 -1.0418 -1.2735 -0.7666 -1.3297 -0.9488 -1.4141 0.0954 0.0792 0.4693 -0.8003 0.0425 -0.2788 1.6867 -0.1688 0.0122 0.8533 2.0450 -0.0760 0.6676 0.5010 0.5145 0.4521 -0.5948 2.0737 0.3232 2.1551 1.2223 -1.1898 -0.4980 1.2441 -0.6440 -0.6446 -0.3844 -0.2356 0.1782 -0.1569 -0.4648 0.7084 1.0439 -0.5976 1.5287 0.1410 0.5838 2.7463 -0.4370 -0.3746 -0.2898 0.8035 1.7640 -0.6456 -0.5307 -0.6855 -0.3908 0.1894 0.7178 -1.6325 -0.3410 -2.7404 -1.0437 -0.2933 0.7714 -0.4361 -0.2931 -1.5084 -0.3366 -0.7661 -1.1672 -0.5851 1.4378 0.7109 0.0594 0.8982 0.3171 0.0989 -0.3030 2.0824 -0.3369 -0.6535 1.0917 0.1947 -0.2483 -0.9162 0.3201 -0.4673 -1.7360 -0.4704 -1.1541 0.0994 0.5849 0.0606 -0.4259 -0.8193 1.0717 -0.7859 0.8581 -0.1100 -1.4136 1.4834 0.2722 1.8501 0.8845 -0.0660 0.8619 0.2582 0.2869 -0.2418 -0.3552 0.5779 0.1377 -0.3890 -0.5506 0.9034 -0.7125 -0.0140 0.4190 0.3274 -0.6306 -1.2487 -0.3524 0.8664 0.1643 -0.8114 0.6462 -0.5835 -0.3301 -0.6042 -0.4574 1.2413 -0.6232 -1.2426 0.4322 -1.1681 -1.0577 0.7055 -1.1169 -1.1606 -1.3357 -1.0372 -0.9172 -0.8241 -0.0533 -0.6619 -0.0533 -0.4907 0.4285 1.4899 1.6129 0.6618 1.0451 0.0139 -0.7359 -0.5756 1.8689 -0.0001 -1.4575 0.1887 -0.8500 -1.2799 0.5947 -1.2748 -0.4310 -0.5296 0.0069 -0.4886 0.1726 -0.6846 -1.4798 1.1080 -0.1509 0.6190 -1.1115 0.2029 -1.2651 1.3148 -1.2306 -1.2168 0.0646 -0.2214 -0.6036 0.4230 -0.0970 -0.3271 -0.3189 -1.1650 -1.2815 2.3487 -1.4583 -0.0637 2.7868 -0.6272 -0.7016 2.4354 -0.1025 -0.8827 0.2216 -0.6863 0.2457 1.4833 0.9176 -1.1236 -1.2194 -0.4074 -0.8969 -1.8249 2.2941 -0.5663 0.8648 -0.5548 0.2146 -1.3750 0.2922 0.6107 1.6804 -0.5579 -1.7993 -0.1978 -1.7564 0.0224 -1.2950 -0.7118 1.1837 1.6124 1.4516 -0.2446 -0.1889 1.2193 -0.7657 3.6475 0.7198 0.5196 2.1967 -0.1582 1.8056 -0.2736 -0.6760 0.5786 -1.5193 -1.4508 -0.6873 -0.5073 0.5541 -1.0834 -1.2870 -0.5382 -1.7126 -1.0123 0.0957 0.0644 -0.0381 -0.6502 -0.9365 -0.8764 0.3435 1.4809 2.3172 0.4388 0.4435 0.2735 -0.2473 -1.4325 1.2270 0.5699 dopamine 3-O-sulfate -0.8963 -0.1662 -1.0443 0.1606 2.3519 -0.9235 2.3518 0.3123 -0.5259 -0.6560 -0.8694 -0.3603 0.0494 -0.1299 -0.1701 0.5893 -1.2649 -0.8043 -1.0430 -0.8718 -1.2326 -0.7812 -0.4360 -0.3275 -1.4356 -0.6749 -0.9582 -1.0280 -0.7073 1.8891 -0.0072 -0.3302 0.4441 0.0255 1.2380 -0.5266 -0.1549 -0.3979 -0.9417 -0.4278 -1.8066 -0.2284 2.3142 -1.1584 -0.6366 0.2000 -1.1105 -0.5809 -0.2395 2.9237 -0.6339 -1.4245 -0.9764 -0.1586 0.1853 -0.7948 -0.1317 -0.5986 -1.1751 -1.0159 -1.0078 -0.0003 -0.1040 0.5108 0.3037 0.3799 -0.3576 -0.9878 -0.5247 -0.7226 1.6456 -1.4439 -0.5593 0.8721 -0.7301 1.0827 -0.1269 2.2346 0.2062 2.2572 -0.0556 -0.6249 -0.1246 -0.9357 0.0337 -0.4481 -0.1094 -0.5026 -0.5172 -0.1168 -0.4526 -0.4625 -0.3053 -1.3322 -0.1666 -0.1336 2.1613 -0.1657 -0.0240 -0.5641 -0.4958 1.0202 -0.1116 0.0137 -1.2145 -0.7539 0.4254 1.8808 -1.2482 1.8101 -0.1352 0.6970 0.5154 1.5723 1.7407 0.3986 -0.6858 0.2332 0.7201 -0.7477 -0.1811 0.0083 -0.3140 0.5763 0.1447 -1.1452 1.4542 0.5752 -1.1037 -0.0048 1.3194 0.7338 -0.5673 -0.1290 0.7679 1.9695 2.2877 -0.7106 -0.8815 0.3168 -1.5049 -0.1362 -0.9459 -0.1904 -0.7749 -0.5437 -0.6823 -1.1259 -1.2628 -1.0157 0.5050 -0.9414 -0.0995 -0.2378 -1.4314 1.8148 -0.4088 -0.8945 -0.5543 -0.1048 2.4024 -0.8610 0.4097 -1.2615 1.7776 2.6556 0.4201 2.9740 0.5748 -1.0649 0.3722 -0.9069 2.2800 0.1490 -0.5817 -0.7814 1.4457 -1.0732 -0.1335 -0.7270 0.3476 0.1062 0.0395 0.0439 0.2687 -0.7432 1.7684 -1.4356 -0.1643 0.9222 -0.1249 -0.5192 -0.6903 -0.4438 0.0136 -1.7841 0.2103 3.0899 -0.8887 -0.7571 1.4184 -0.1331 -0.9513 -0.3381 -0.1821 -0.7888 0.9802 -0.1650 -0.5539 0.7862 -0.3057 -0.3740 -0.6946 -0.0023 0.5567 0.0284 0.0182 0.9308 -0.8115 -0.3018 0.1250 -0.5348 2.1351 1.3167 -0.2750 -0.1027 -0.0228 0.4125 -0.1174 -0.0564 -1.0566 0.3323 0.2136 -0.5460 -0.3063 1.8613 -0.1936 -0.9927 0.2642 0.1961 0.0752 -0.5294 -0.6861 -0.1753 -0.1088 -0.2338 -0.8901 0.1851 2.0533 -0.2503 -1.3258 -0.7631 -0.0446 1.5348 -0.5476 0.7657 -0.7430 -0.1336 -2.0970 -0.4577 -0.1002 4.3048 2.8571 0.1137 -0.7171 -0.6743 1.1815 -0.0661 -0.5745 0.1071 -0.0608 0.9978 0.4101 -0.2521 0.4581 -0.5652 2.5474 2.0346 -0.3736 -0.7415 3.4357 0.5726 -0.2603 -0.4874 -1.4446 0.7304 -0.2197 0.8579 0.4823 2.3449 -1.0748 1.9356 0.3958 -0.8751 2.1800 0.2472 -0.0197 0.1949 -0.0656 -0.1275 -0.9157 -0.1820 -1.0217 -0.6068 0.3324 0.0808 0.2553 -0.8772 -0.7225 -0.3714 -0.7956 -0.1002 1.5134 0.0136 0.1030 1.3385 -0.2431 -0.0670 -0.0996 -0.4382 -1.2775 -1.0666 -0.3742 -0.2743 -0.0488 -0.3600 -0.2768 -0.0482 -0.8780 -0.5886 0.2848 2.4707 -0.9905 -0.1382 -0.6840 1.3796 -0.5216 -0.1752 1.0874 0.6340 0.2963 -0.3944 0.9360 0.4156 1.7691 -0.6458 -0.3019 -0.0961 -1.3109 -0.9196 -1.1739 0.1626 -0.4185 0.2146 -0.1401 0.3078 -1.8344 -0.8223 -0.4504 0.2968 0.1588 0.1336 -0.1085 -1.1708 0.6098 0.3297 -0.2178 2.8656 0.4118 -0.4955 -0.6234 -0.7453 -0.6286 -0.0559 0.9973 -1.0704 1.4359 -0.4611 -0.2938 -0.2969 -0.6886 1.0387 0.0160 0.4131 -0.0140 0.8739 -0.0852 -0.7106 -0.6936 -0.1142 -1.3555 2.3269 0.7827 -0.6187 -0.2514 -0.2802 2.6823 -0.3633 0.0278 -1.0169 -0.4537 -0.3600 -0.5453 2.5907 -0.1561 -0.7561 -0.3921 0.3176 -0.8296 1.6171 DSGEGDFXAEGGGVR* 0.4383 -0.0038 -1.4441 -1.3314 2.9048 -1.4799 0.9866 -1.5321 -1.4592 -1.0990 -1.2622 -0.7393 2.0180 0.6935 -0.1960 0.7328 -1.5872 0.5420 -1.3724 -0.3516 -1.2663 2.1674 -1.0983 1.0835 0.2898 0.9575 -1.5696 0.0720 0.1664 -1.1400 -0.1370 0.4399 1.8296 -1.6430 -0.3207 -1.4211 -1.3612 -0.0586 0.5484 0.0770 -0.0055 0.7353 0.5303 0.1871 2.1231 0.1496 0.8703 -0.0232 0.1338 0.4077 -0.0007 -0.7195 0.5210 -1.4869 0.9016 -1.5474 0.3716 0.9329 0.4868 -1.4981 1.3273 -1.5533 2.2640 -1.3159 0.4344 0.8078 0.3299 -0.3523 -1.5690 0.0590 -0.0510 0.4522 -1.4595 -1.5715 0.8936 -0.3010 0.3456 1.0143 0.9480 0.4992 2.1170 -1.3514 0.1857 0.1935 -1.3122 -0.5822 0.6808 0.9427 0.5882 -0.0751 0.0482 -1.3490 0.6176 0.4573 -1.3582 0.0080 0.2173 -1.3592 0.4721 0.5304 -0.2330 -0.5613 0.8125 0.6564 0.1378 -1.3235 -1.4557 1.2335 -0.1437 0.2225 -0.9055 -0.5851 0.9058 -0.5862 -1.4098 0.2527 0.7149 1.0363 -1.4948 0.6430 -0.7488 -1.3579 0.1746 0.3251 1.3031 -1.4737 0.1536 0.4141 0.0723 0.3114 -1.5284 -1.2855 -1.1539 0.1384 -0.4665 -0.4754 1.1701 0.8920 0.2095 1.2773 -1.2157 1.3179 0.7212 0.5289 -1.2902 0.6376 0.5108 -1.4639 0.7314 1.7759 1.3841 2.8889 1.5988 1.2530 0.4282 0.2324 -1.3951 0.0569 -1.5212 1.7688 -1.3809 0.3747 -1.2742 -0.2311 -1.3403 -0.1076 0.2504 -1.5009 0.2618 -0.5562 0.1558 -1.4283 0.3261 -0.6421 -1.5570 1.3485 1.0300 0.5746 0.3444 0.4889 0.5193 0.0157 0.3558 0.2317 0.5797 -1.6245 -1.4357 -1.3428 -0.1130 0.0958 0.1994 -1.2491 0.5427 0.0221 0.8004 0.0594 0.4654 -0.2081 -0.1812 1.1758 0.3697 0.9150 -1.2912 0.8592 -1.4689 1.0628 1.6433 0.8869 0.0115 0.4704 -1.3752 1.2951 0.3442 1.4628 0.3881 0.1763 -1.6303 -1.6239 -0.3843 -1.5588 0.3060 -1.5196 0.2285 -0.6032 0.2167 1.2542 -0.4203 -0.4088 -0.1734 0.8664 -0.9454 0.1754 1.0183 0.1702 0.5828 -1.6111 -0.3294 -1.3467 0.7386 0.7746 -0.5139 0.0228 -1.4539 3.0626 0.4794 -1.4250 0.4842 -1.6097 -0.1211 -0.5383 0.7601 -0.8508 0.2240 0.4828 0.5186 -0.2027 1.1612 0.5370 0.4197 0.7171 -0.4631 0.3624 0.2945 0.6281 0.5621 1.3496 0.4749 -0.1130 0.1753 0.3074 0.4497 0.6583 0.5632 0.7473 0.3170 0.1327 -0.0919 1.2293 -1.5762 0.5219 0.3565 -0.1279 0.3774 0.6512 1.1008 0.5741 1.1447 2.1946 -1.5639 1.9824 0.9916 -0.0765 0.8903 0.4821 -1.4123 -0.2900 -1.5195 1.4487 0.1845 0.2746 -1.4133 0.4117 0.2121 -1.5622 0.6337 0.8908 -1.5302 1.4975 0.5148 0.1182 0.1780 0.3960 -0.0310 -0.1369 -0.0849 0.0170 0.9827 0.1294 0.9417 -1.5417 1.5923 -1.5549 1.0429 0.9546 -1.5119 -1.7215 0.8270 -0.5129 -0.2976 0.4914 0.4210 0.3985 0.0100 -1.2750 1.1759 0.0254 -1.5156 0.5441 0.1533 -0.2357 0.2809 -0.5566 0.1347 0.3179 -1.5656 0.3529 0.8761 1.9435 2.4075 0.2987 0.7340 -0.9574 -1.5226 -0.2633 -1.5304 -0.0621 0.0680 0.6702 0.0172 -0.0357 0.4963 0.7109 0.8415 -0.4799 0.9452 -1.6193 0.2776 0.3582 -1.6409 -1.6539 -1.3506 0.8063 0.6976 -1.4199 0.1750 -1.2738 -1.8009 -1.6152 -1.5818 -0.2869 0.4076 -0.4449 0.2769 -0.5702 0.7597 -1.7817 0.4170 0.2445 0.2946 0.1394 0.6677 0.0668 0.2366 0.9027 -0.0209 0.0486 -0.3119 0.3961 0.7288 2.5412 -1.7183 -1.5547 -1.3934 -0.5850 -0.7058 -1.7852 0.2779 1.1565 0.4273 -1.6987 ectoine 1.1846 0.8831 -1.1394 -1.7329 2.0899 -1.4185 -0.6532 -0.8013 1.3232 0.1396 -0.0426 0.1553 1.4585 1.6225 -0.0004 -0.2231 -0.1367 -0.5967 1.3497 -0.8230 -0.9133 0.3744 -0.6692 0.7020 1.7105 1.5122 -0.6547 0.8019 -1.6833 -0.0100 -1.1138 -0.0735 -1.7430 -0.9244 0.8998 -0.6223 0.2850 0.5661 0.1169 0.1539 -0.3078 0.2097 -1.3193 -1.0904 -0.0207 -0.7682 0.0063 1.4246 1.2120 0.4120 -2.6268 -0.6011 1.8335 1.0252 -1.3767 -0.2606 0.2943 -1.6468 -0.9492 -1.1284 0.2328 1.2769 0.7008 -0.9869 0.1096 0.0605 0.0682 -1.1381 -0.8006 -0.8082 0.5396 0.1424 -0.1709 -1.1225 -1.0592 0.1131 0.9240 0.1769 -1.4544 -0.1171 -0.8916 1.0072 1.8753 -0.8844 0.3097 -0.1874 2.2341 -0.2636 -1.0505 0.4698 1.2036 -0.0426 -1.8178 -0.2733 1.0291 -0.4084 1.3960 0.8565 1.7260 0.3002 -1.0142 1.5104 0.1350 0.9439 1.5726 -1.4818 0.1497 1.3216 1.9368 -0.7947 -0.1649 -0.3761 -0.6688 0.0393 -1.8352 -1.2436 -0.6810 0.4217 -1.4193 0.7605 -0.1378 0.7793 -0.6286 1.1618 -0.3610 -2.7425 0.4455 0.6974 -0.4833 0.6781 3.0900 2.0555 0.0587 1.3020 1.0396 1.9073 0.9809 0.8088 -0.8787 -0.4015 0.3776 -0.1623 -0.5006 1.0083 -0.7610 0.2628 0.0145 -0.5527 0.4856 -0.1033 0.3513 0.7807 0.8693 -0.4156 0.3771 -1.9811 -0.6949 0.9805 -0.6118 -0.8805 -1.5891 -1.3685 -0.0938 -2.0780 -0.8519 0.8669 0.4295 0.4945 -0.3489 1.0563 0.5403 0.7033 -0.0539 -0.0544 0.4154 0.5173 -2.4651 -0.7846 -0.4280 -0.1056 0.4694 -1.5096 -0.2924 0.7236 -0.8055 0.6426 -1.0965 0.6774 -0.7497 1.2746 1.3757 0.0291 -0.5932 -0.4900 0.0931 -1.1435 -0.9920 -0.7501 0.0563 0.0855 -0.2881 -0.4293 0.0786 0.9255 -0.1437 -1.4362 0.5765 -2.0472 0.5643 0.8009 -0.1128 0.8207 0.6553 1.5477 2.0387 0.1906 0.9054 0.4139 -0.7012 2.3420 -0.9569 -0.1639 0.8561 0.1390 0.2393 0.9059 0.0044 1.1458 1.4760 -0.2740 0.1157 0.0375 -0.0483 -0.6447 -0.8861 0.4321 0.9908 -0.4439 1.6389 -0.6991 -0.4784 -0.3921 -2.7005 0.3101 2.4911 0.7613 0.7391 0.9660 0.3646 -0.8145 -0.8393 -0.8184 1.2301 -0.7807 -1.0386 1.5050 0.6101 -1.5807 -0.9450 0.6230 -0.4821 -2.2207 -1.1206 2.3747 -1.1258 0.9983 -1.2942 -0.3635 -0.9110 -0.9204 -1.1259 0.6585 0.4947 -1.1076 1.0266 1.0300 0.4521 -0.1786 1.9717 0.1506 0.2148 -0.3323 0.8173 -0.5109 1.4750 -0.6580 -0.8787 -0.3997 -0.6842 -0.3375 0.1287 0.7584 1.1980 0.1475 1.8762 1.3745 0.8519 0.9045 -0.2733 -1.3743 -1.1295 -1.5912 0.7060 -0.5074 -1.5098 0.0230 -0.6589 1.1603 -0.5924 -2.0544 0.1131 1.6701 0.1369 -0.0058 -1.2490 0.4106 -0.9591 -0.0954 -0.1721 -0.8568 -0.4085 -0.3208 0.5289 0.5486 -1.3481 -0.0802 -0.6552 0.0426 -0.8023 -1.8147 -0.3413 1.1210 -0.3373 -0.2441 -0.1694 -0.2824 0.2592 -0.7889 1.0424 -1.2163 0.6409 -0.1992 0.2297 0.0713 -0.5161 -0.1142 -0.3933 -0.5267 0.6252 -1.0644 -0.0811 0.1722 1.8812 -0.6081 0.4053 0.9137 -1.2165 0.9572 0.5417 0.9854 -0.6632 -1.3386 -1.1958 1.9267 0.4123 0.4763 0.1416 0.1086 -0.7210 -0.2773 0.8846 0.0002 0.2370 -0.3588 0.0831 -2.6301 -0.6998 -0.1945 1.4141 0.5539 0.4973 1.9411 0.5167 0.2187 0.3460 -1.3044 0.3343 0.8429 -2.1938 2.3557 1.8059 0.0708 -0.2479 -0.1762 0.2304 0.9705 -1.1800 -0.5749 -0.2739 -0.6643 -0.6678 -0.7462 -0.4101 0.8785 0.3833 0.3844 -0.5973 1.6259 -1.0180 -2.2496 eicosanedioate (C20-DC) 1.7433 -1.0060 0.8347 2.0542 1.1912 0.2746 1.4827 0.2943 1.2940 1.5028 1.0560 -0.6769 0.7231 0.0090 -0.2218 -0.1135 0.0812 0.1404 -0.9571 -0.3362 1.0741 -0.3038 0.6223 1.5030 0.6123 0.7736 1.6967 0.8827 -0.4980 0.8576 0.6379 0.8675 -0.8178 0.6554 -0.2447 -0.0166 1.3731 0.4223 0.3610 -1.0156 0.3327 0.0937 0.0119 -1.2553 -0.0248 0.1245 -0.9939 3.2974 0.5510 0.2504 -0.6841 -0.7471 -0.2290 0.7562 -0.0003 -0.8582 0.1136 0.8193 -2.0279 -0.2908 1.0034 1.1620 0.1334 -0.2458 -0.8495 1.0737 1.3338 0.8478 0.4375 -0.8525 -0.8831 0.5227 -0.0608 -1.2529 -0.0666 0.0810 1.7394 -0.9538 -1.0087 -0.2224 -0.3472 0.5359 0.5179 0.5071 -1.6997 -0.0325 -0.2412 0.2052 0.7994 0.7170 2.2387 0.5467 -0.8001 0.8209 -1.2677 1.5943 1.1652 -0.2530 1.4404 -0.4759 -0.2174 0.4651 0.6870 -0.6607 -0.4285 -1.7747 0.7554 0.5217 0.1405 -0.4145 0.3195 0.8206 1.8460 -0.5680 1.1618 0.1719 0.3701 -0.8040 -0.3596 -0.0019 1.2819 0.0492 1.8661 -0.5959 -1.5954 0.8354 0.7874 1.6702 0.8474 -0.5844 0.1486 -0.4200 -1.0629 -0.7537 0.0531 0.6691 -0.6093 0.2239 0.6395 0.7570 0.7941 0.0981 0.7885 -0.8734 -0.8918 0.3928 -0.6921 -1.2588 0.3835 1.3094 -0.0028 0.2010 1.6324 -1.2233 0.3754 1.5984 1.4969 -0.2159 -0.2458 2.3702 0.6117 -1.3015 1.6595 -0.3671 -0.7352 0.5878 -1.7111 0.0696 -0.5357 -0.7450 -0.3611 -0.2304 -0.2563 -0.7193 -0.6500 -0.5193 0.8261 -1.3187 -0.8023 0.7581 2.0013 1.0350 -0.6564 0.3666 0.9864 0.8600 -0.1055 -0.4448 1.5503 -1.0327 -0.1418 0.7907 0.8394 -0.0632 0.6595 -1.0147 -0.0009 0.1787 0.9347 -0.1506 -0.5141 -0.8219 -0.0937 1.6113 0.4839 0.8835 2.0133 -1.0449 -0.0779 -0.1118 -0.5542 -0.1439 -0.7017 0.8933 0.2645 -0.1883 -0.5710 0.7812 -0.4701 1.8960 -0.3969 -0.4272 0.1706 -1.0936 0.3273 -0.6080 -1.2980 1.2402 -1.3423 -0.8400 -1.0512 0.2946 0.5141 0.4345 -1.2036 1.7744 -0.6610 -0.8009 1.3025 -0.5717 -1.3131 1.5499 0.6214 0.4677 0.0275 -1.0242 0.7629 -1.7297 0.2788 -1.3225 -1.0943 1.6399 1.0062 0.2071 -0.1978 1.2016 -0.3661 -0.9209 -1.7638 0.6191 -1.0091 1.5264 -0.5811 -1.1891 -1.3454 1.8038 0.5637 0.2941 -1.2913 -0.3896 -1.9176 -1.3016 -1.3766 -1.4776 0.1162 2.1572 -0.4431 0.4574 -1.6734 -1.7858 0.3053 -0.4577 -0.2656 -0.6281 -1.9022 -0.8160 2.1167 1.4240 -0.9848 -0.7597 -1.2649 -1.1961 1.1734 0.8585 0.1596 -0.4291 0.2449 -0.3537 -1.1905 -0.3811 -2.2901 -0.3468 0.4507 -0.4681 -0.7670 0.2043 -0.2842 0.9932 -3.1125 -2.3730 0.1334 0.9618 0.2528 -1.7578 -0.7291 -1.1646 -1.5957 -2.1953 -0.4831 -1.3660 -0.1562 0.0332 0.7652 0.8331 0.9143 -0.0874 1.5760 -0.2105 0.0072 -1.5391 -0.4216 0.9625 -1.5652 -0.2254 0.0591 -1.9501 -0.2970 -0.7743 0.8630 -1.8716 0.2948 0.0597 -0.2846 -1.1462 -2.2227 -1.4522 -0.3898 -0.1076 -1.4243 0.2305 1.2633 0.8148 1.0676 -0.7538 -1.6780 -0.1420 -0.4053 0.4418 -1.0187 0.2647 -1.1987 -0.8863 1.6782 -0.1194 -0.8808 1.5169 -0.5769 1.0247 0.7066 -1.3920 0.2606 1.4046 -0.7666 -0.6052 1.3085 -1.2847 0.0613 1.6260 0.5811 1.1331 -2.0465 -0.0128 0.2837 0.1560 0.1822 -1.6119 -1.2640 -0.2688 -1.0982 1.0330 -0.4903 -0.0548 2.1144 -0.6114 -0.3824 -1.4209 1.0376 1.5819 0.7669 1.3675 0.7824 0.4754 0.0746 0.1942 -0.2299 -0.5742 0.8044 -0.0869 -0.8240 -1.6840 eicosapentaenoate (EPA; 20:5n3) -0.0888 -0.1925 0.5483 0.1647 0.4051 0.6117 1.7817 1.1838 0.5435 0.1235 1.3333 0.5177 0.4985 -1.0902 -1.2398 0.8808 -0.4901 -0.2291 0.2705 2.2949 1.3377 1.6082 0.7775 -0.2033 1.0015 0.1195 1.3886 0.3048 1.7761 0.9093 1.0489 0.4112 -0.5731 -0.4595 2.7742 1.5138 1.7265 -0.1431 -0.0497 -0.1869 0.5049 1.6136 0.7153 -0.6167 1.1696 0.0852 -0.4803 -0.8772 1.8224 0.4691 -0.5833 1.0027 0.3132 1.9765 2.0488 0.2382 1.6146 1.0964 0.2383 1.3566 0.4188 -0.3263 -0.4142 -0.8603 0.3679 -0.8056 -0.4084 0.5159 -0.3257 0.2158 0.8617 1.0732 0.1629 0.3196 -0.6196 -0.5522 1.1344 -0.1981 -0.5785 -0.2934 0.8053 -0.4495 -0.1773 1.1232 0.7204 1.7594 -0.3028 -0.6421 -0.3990 0.9665 2.1046 0.5346 -1.1262 -0.4666 1.1975 -0.4130 1.5225 1.4340 -0.1596 0.8551 0.1120 1.6540 -0.2905 -1.5389 0.2979 -0.1176 -0.2373 -0.0019 0.8924 -1.1717 -1.6504 -0.7823 0.7789 0.6487 1.4117 0.0492 -0.4930 -1.5258 -1.2759 2.2255 -0.9454 0.9698 -0.9714 1.7835 -0.4236 1.3286 1.1145 0.0965 0.1571 -1.6214 0.1512 -0.5910 1.9846 -0.9482 1.1072 -0.5728 -0.5594 0.0952 0.6987 1.6724 0.6327 0.4561 -0.7291 -0.0808 0.0998 0.1201 -0.1577 -0.4163 -0.7755 1.4960 -0.4382 0.4512 -0.1093 -0.7617 0.0933 0.9969 -0.0354 0.1653 -0.9301 0.2591 -0.2636 -0.0869 -0.0735 1.8243 1.3104 -0.7729 1.6821 -0.6310 0.1485 -0.1261 0.5830 1.0355 -0.3345 1.0747 2.0750 -0.2778 -0.4853 0.4774 -0.2048 0.1316 -2.0808 -0.2529 0.3739 -0.1605 0.2017 -0.3698 -0.3902 -0.2378 -0.3406 -0.6586 1.8933 0.7713 -0.1907 1.1543 -0.7562 -0.4466 -0.5049 1.5352 -0.1278 -0.3461 0.0514 0.0925 -0.6496 -1.2478 -0.2141 -0.5643 -0.0039 -0.7212 -0.2476 -1.1667 -1.5406 -2.3932 -1.7145 -0.8461 -1.0166 0.3440 1.5576 0.0839 -0.1097 -0.1392 0.4022 -1.8085 0.4297 -0.7055 0.4114 -0.8516 1.6729 1.5611 1.0984 -0.1265 -0.1559 0.7649 -0.9282 -1.1559 1.2997 0.0768 -0.0924 -0.6965 -0.1269 -0.8595 -0.5327 0.2811 -0.3079 2.2749 -0.4364 -0.2116 -0.4345 -1.2127 -1.4910 -1.7233 -0.2295 1.1798 -1.2510 0.2826 -0.7914 -0.5846 -0.7571 -0.2956 -0.1169 0.9011 -1.4291 -0.4760 1.9642 0.1919 -0.1544 0.6258 0.6363 -1.8137 -0.9243 -1.1363 -0.6053 -1.0640 -0.9120 -1.2943 -1.9061 -3.0789 1.5111 2.3099 0.4534 -0.3783 -0.7569 1.2283 0.4267 -1.2994 0.2429 -0.3785 -0.4283 -0.2465 0.2769 0.1562 -1.1372 0.2545 -1.6875 -0.0977 -0.9925 0.1655 2.0228 -2.2066 -0.8318 1.6055 -0.1649 -1.3454 -0.2687 0.1195 -1.5384 -1.0484 -0.4793 -0.7263 0.5708 -0.3473 -0.8227 -2.1224 -1.0944 -0.6517 -0.7083 0.5692 2.3749 -0.0640 0.1183 -1.3735 -0.5919 0.2639 0.3046 -2.0281 -0.3856 0.2993 -1.9791 -0.8079 -1.3554 -1.2427 -0.0618 -1.7878 2.1221 -0.3176 -0.6459 -0.8756 0.4710 -0.3192 -0.8674 -0.0813 -0.6799 0.4889 -0.4040 2.1915 -0.9916 -1.2383 -0.5877 -0.4211 -0.0063 -1.1510 -1.2745 -0.7905 -0.4357 -1.1857 -1.2189 -0.3327 0.7065 -0.8785 0.6508 1.3185 -1.4488 -0.0757 0.1593 0.6572 -0.9699 -1.5921 0.0567 -0.2071 -0.1346 -0.5153 -1.1092 -2.0560 0.9591 0.6596 -0.9761 3.4002 -0.6057 -0.4420 -0.6854 -1.3092 -0.5454 -0.7603 -0.5106 0.5159 0.0626 -0.1815 0.9493 0.7198 0.4775 0.5252 -0.3533 -0.1711 1.4338 -1.0568 0.8296 1.5860 1.5137 -0.9555 -0.3144 -0.2731 -0.4531 -0.7887 1.2305 -1.7882 0.0282 -0.3326 -0.2228 -0.0543 0.0470 1.8709 eicosapentaenoylcholine 0.1438 -0.1201 0.5240 -1.2378 0.5584 -1.3975 1.4550 -1.4400 0.5173 -1.0593 -1.2275 0.9793 0.3759 -1.3629 -1.4936 0.4817 -1.4848 -1.2957 0.7747 1.7073 0.8331 1.0675 1.6558 0.6948 0.3844 0.7477 1.4386 0.3027 2.2772 0.5104 1.1970 1.1939 0.0934 -0.1832 1.2172 -0.5740 2.1596 0.7252 0.3887 1.1672 1.3390 1.4576 0.4512 -1.4750 1.0345 0.3319 0.1795 -1.2879 1.8035 0.6130 0.3128 1.0881 -0.1929 -0.8638 1.9611 0.2337 1.7108 -1.0596 0.3797 0.8716 1.4257 0.1204 -0.1047 -1.2429 1.2490 0.4651 -0.0828 -1.5389 0.0030 0.9146 1.2061 1.3210 0.8680 0.5472 -0.7492 -0.0257 1.5011 1.0168 0.3659 0.2415 0.8327 -0.9899 -0.1526 0.5479 1.0417 1.6907 -1.1996 -1.2647 0.5402 1.0246 1.0508 -1.2644 0.0361 -1.0447 1.2799 -1.2578 1.1757 1.0932 0.4329 0.5388 0.6348 1.2874 0.8656 -1.4988 1.0453 1.4847 -1.3738 0.1129 -0.0953 -0.5242 -0.5893 -0.1686 0.7075 0.3044 -1.3327 0.7500 0.2384 -1.2682 -1.4124 1.7116 0.8875 -0.0175 -0.0401 0.1022 -0.0672 0.4744 1.1960 0.3573 0.7909 -0.8084 0.8796 -0.5388 1.2389 0.1728 1.2984 -0.5523 -0.0517 -1.0669 -0.1189 1.8236 -0.0095 0.5489 -1.2717 0.4557 0.5134 0.2743 -1.3067 -1.3656 -1.2456 1.2447 0.3167 -1.1679 0.4247 -1.6893 -0.0810 1.5192 -1.3015 0.9454 0.2039 0.8669 0.4814 0.0604 -0.0296 1.1802 1.4234 -0.6246 1.7976 -1.3983 0.7903 0.0109 0.2307 1.0930 0.3566 1.5269 1.6538 0.2290 -1.1526 1.1127 0.1392 0.3434 -1.2657 -1.5433 1.0541 0.4090 0.7965 -1.5166 -0.1565 0.3642 0.5016 -1.2356 1.9319 -1.1968 1.0850 1.4817 -1.1802 -0.2397 0.1076 1.1904 -1.3370 -1.0962 0.8523 0.7508 -0.2742 -1.2749 -0.2933 -1.0781 -0.5433 0.3988 0.5722 -1.2969 -1.2914 -1.3255 -1.5159 -1.3764 -1.4660 0.9454 -0.0907 -1.5099 0.5081 0.2363 0.7021 -0.7797 0.4764 -0.3061 0.5499 -1.5271 1.4038 0.7248 1.3684 0.0355 0.6237 1.3311 -1.2889 -0.0144 0.0398 -1.5004 -1.3774 -1.2812 0.4829 0.0331 -1.3815 -0.2344 -0.0356 1.6923 -0.2742 0.6238 -0.2314 -1.5029 -1.4937 -1.4152 -1.4021 0.6252 -0.2403 0.8719 -1.4039 0.6670 0.4725 -0.3963 -1.3211 1.1146 -1.4095 0.1688 0.7023 0.2526 -0.0707 0.6908 0.8280 -1.5045 0.0402 0.2583 -0.1005 -1.2731 0.0417 -0.5135 -1.4199 -1.3931 0.8801 1.4156 0.8153 -1.1504 0.1767 1.5814 1.0970 -1.4660 -1.5789 0.6632 0.0297 0.5031 0.1340 0.4716 -1.5131 1.4681 -1.4159 0.1757 -1.3248 0.1696 0.3758 -1.6571 -1.5649 1.3716 -0.2273 -1.4470 0.4675 0.2495 -1.3467 -0.1801 -0.0652 -0.1035 0.7158 -1.0109 -0.2164 -1.4680 -1.4104 0.7859 0.2124 1.0678 2.1591 0.7095 0.4944 -1.4534 -0.6421 -0.8747 0.1399 -1.5130 0.3843 0.1498 -1.3734 -1.3640 -1.4009 -0.9030 0.6453 -1.2773 0.9978 -1.2171 0.2874 0.6521 -1.4359 -1.4166 0.2277 0.4350 -0.1108 1.2439 -0.0116 1.4715 -0.1966 -1.3062 -1.2313 0.1889 -0.1268 -1.5134 -1.1909 -0.8875 -1.4309 -1.6033 -1.4406 0.9884 0.4157 0.2465 0.9736 0.9026 -1.4608 0.3657 0.1317 0.1853 -0.8511 -1.4974 0.2644 -1.5656 0.5539 0.2531 -1.2639 -1.4410 0.8053 -1.3468 -1.6458 -1.2625 -0.0922 0.5268 -1.4948 -0.5476 0.2944 0.2234 0.4093 -1.6255 0.5365 0.1468 0.6070 1.1628 0.2322 -0.0024 0.6133 0.3878 -1.0428 0.2700 -0.0042 1.1984 0.6440 -1.4218 0.3385 0.5344 -0.0497 -1.4471 0.8022 -1.5049 0.7074 -0.8688 -1.3973 0.7128 0.6707 0.8375 eicosenedioate (C20:1-DC)* 0.5938 0.4873 1.1281 1.7849 1.7731 1.0596 -0.5487 0.7978 0.7207 1.0530 1.6820 -0.5346 0.8368 0.1914 0.2067 0.1601 -0.0995 0.4938 -0.9864 -0.3549 0.1828 0.4615 -2.7188 1.0959 -3.1689 -1.3467 -0.4168 0.0402 0.4964 1.0891 0.3489 0.9944 -0.8696 1.1465 0.3181 -0.4773 0.9103 1.3548 0.7103 -0.7660 0.5075 0.3985 -1.0289 -1.1898 -0.5726 -0.4727 0.6819 1.8930 0.6740 -2.1329 0.1352 -0.6165 -0.2798 0.7621 -0.1140 -3.4321 0.6295 1.2175 -1.0085 -0.0718 0.6246 1.0103 -0.3826 1.0595 0.3734 1.1297 1.0260 -0.3985 0.2307 0.6762 -2.1848 0.8938 -0.5258 -1.2567 0.8428 0.2871 1.4470 -0.9754 -0.3484 0.6046 0.2916 1.1909 0.8638 0.2590 -1.1568 0.5161 -1.0584 0.1106 0.8606 0.4840 0.8739 0.8139 -0.2568 1.1453 -1.6509 0.0115 0.7130 -0.1848 1.5451 -1.2821 0.1769 -0.5024 0.4754 0.1853 -1.5042 -1.0830 1.1177 0.1526 0.6437 0.7290 0.9739 1.1520 -0.0178 -0.0755 1.3832 0.8450 0.3572 0.6345 -0.2783 0.6629 0.8109 0.8782 0.7948 0.2328 -1.7322 -0.9747 0.9413 0.8904 1.4939 -0.0409 -0.8406 -0.8834 -1.3124 0.2195 0.4000 0.9882 0.8978 0.6127 0.5502 1.2376 -0.4034 -0.0612 0.7007 -1.3272 0.2344 0.6209 0.4908 -1.5119 0.0309 0.9679 1.1228 0.0265 0.2697 0.4699 1.0425 1.0768 1.3572 0.1112 0.6480 1.4143 0.4603 -0.8079 0.9371 0.0317 0.2420 -0.6749 -0.9365 0.6663 0.0739 -0.9660 0.0734 0.1385 -0.5412 0.2888 -0.7753 -0.4899 1.3283 -1.4113 -1.8594 1.4647 1.5816 -0.9779 -0.7007 0.6904 1.2555 0.6152 1.3221 -1.0635 1.5705 0.4514 -1.0976 0.8993 0.8341 -0.2223 -0.8512 -0.2542 0.3150 -1.0574 0.6643 0.7331 -1.9846 -0.7030 0.4596 1.5375 0.6397 1.1747 0.5951 -0.3833 0.3735 0.5708 0.1457 0.1580 -0.8888 1.3760 1.1802 1.0891 -0.1120 -0.7692 -0.3631 0.9852 -1.0071 -0.1001 -0.5482 0.2320 0.3726 0.4879 -2.0791 0.0095 -1.4790 -1.5938 -0.1203 0.5403 -1.2406 0.2597 -0.7743 1.0354 0.4419 -0.8654 0.6095 -0.7606 -0.9999 1.2507 0.9625 -0.8759 0.7397 0.5476 0.5477 -1.3355 0.6313 -0.7986 0.1169 0.1235 0.0572 -0.9870 0.2591 0.1573 0.0578 -0.6295 -1.2786 0.4497 0.2270 1.0111 -1.1214 -1.0682 0.3230 0.9223 -0.2400 0.6271 -0.0212 -0.2407 -1.3683 -1.8411 -0.4652 -0.3229 0.5620 0.7032 -0.1928 -1.6889 -0.8408 -2.4275 -0.5704 -0.2032 0.1483 -0.2956 -0.7385 -0.1109 1.2724 1.2415 -0.1452 0.3762 -0.8494 -1.3138 -0.0730 0.4752 0.0604 -1.4682 -0.7993 0.1116 -1.4151 0.0713 -1.4786 0.2564 0.5634 -2.2368 -2.0701 -0.2957 0.7433 1.4432 -1.6524 -1.7209 0.8077 1.0767 0.7974 -0.3821 -1.1921 -1.7020 -3.2347 -1.8631 -3.1611 -1.2529 0.6186 -0.1909 1.2920 0.8660 1.3026 -0.0676 1.7237 0.3387 1.0161 -1.7956 0.6821 1.1421 -0.6858 0.1550 0.0340 -0.5655 0.7337 0.4350 1.0461 -0.3701 -0.3732 -0.0592 -1.1446 -1.5203 -1.7284 -3.1889 0.1394 1.1049 -1.1443 0.8582 1.4038 0.2570 1.1798 -0.2510 -0.3052 0.2910 -0.0461 0.9483 0.1253 -1.0905 -0.0844 -1.0225 0.2290 -1.1565 0.5791 1.1927 -0.0694 0.3022 -0.8461 -0.9546 0.8741 0.6933 -0.4369 0.2144 -1.0351 -2.1115 -1.1011 0.6215 0.3710 1.0692 -1.2609 -0.7038 0.2385 0.1019 1.4371 -0.8347 -1.3230 -1.1467 -0.8596 1.2777 -2.9904 0.8256 1.0701 -0.0951 0.3015 -1.1400 -0.7237 1.8230 0.7941 1.2325 0.1404 0.8603 -0.6619 0.0981 -1.4292 0.5351 0.8863 -0.8231 -1.2362 -0.5977 eicosenoate (20:1n9 or 1n11) -0.7727 -0.4939 1.2934 1.4229 0.5797 1.3026 0.5086 -0.3319 0.6829 0.1027 1.0457 -0.2413 1.5987 -1.2630 -0.9079 -2.1598 0.7160 0.9907 -1.1240 -0.3235 -0.7238 -0.2213 -1.2467 -1.0449 0.2831 -0.4955 0.2670 0.9768 -1.8172 -0.1631 -1.5750 -1.3709 -0.5308 2.6611 1.7246 -0.0850 -1.1116 -0.9870 -1.1542 -0.3142 -1.5600 -1.8143 -0.7125 0.2877 1.0493 0.4161 -0.8688 -0.8812 -1.6539 0.6509 -0.4252 0.3543 -0.7177 2.2902 -0.6721 0.9031 -1.6244 1.9085 -0.8758 1.1697 -1.0751 -0.4803 -0.7711 -0.7263 -1.2967 -0.1522 -0.3231 -0.0690 -0.2800 -1.4138 1.6300 -1.4538 0.0409 -1.0464 0.8554 0.4704 -2.6078 -1.3019 -0.1930 -1.1406 0.6322 -0.3022 -0.1349 1.6915 0.1781 -0.8854 -0.7024 1.4440 -0.0109 -1.5570 -0.1772 -0.8503 -0.6840 -0.9935 -1.0307 -0.5114 0.0311 -0.1265 -1.3882 0.4103 -0.7405 -0.0421 -1.0041 -0.7846 -0.8061 -1.8824 0.4050 -0.0699 1.6173 -0.9639 -0.0998 -0.5202 -0.4951 2.4778 0.6068 -0.7344 -0.4872 -1.3223 0.5084 1.1609 -0.0743 1.5149 -1.0856 2.7195 0.2232 0.6814 0.6648 -1.2701 -0.1754 0.6323 0.7564 1.1129 -0.0894 -1.3028 -0.6404 -0.0695 1.3529 -0.6747 -0.1819 -1.3582 1.3722 -1.2160 0.4282 -0.1107 0.2380 -0.9050 1.5830 0.4209 0.1500 -0.9455 -1.1932 0.4034 0.2202 -0.0093 -0.0935 -0.7089 0.9650 0.2449 -0.5697 0.0458 -1.0464 0.7730 -0.5702 1.4441 0.5649 0.1114 -0.8987 -1.6833 -0.0245 0.0739 1.3502 -0.4578 -0.6496 -1.0619 1.2823 0.7313 1.5747 -1.6665 0.1949 -1.7779 -0.8548 0.2224 -1.1357 -0.7282 -2.0276 -0.8738 -2.1349 0.5621 -1.2699 -1.9211 1.3189 0.5124 -0.5173 -0.1183 0.0141 1.5258 -0.1865 -0.0333 1.0772 1.2368 -0.4599 -1.0219 -1.3385 -1.4544 0.3691 1.4095 0.9406 -1.1691 -0.1039 -2.3168 -0.4700 0.0725 0.1270 -1.1369 0.9790 -1.0506 0.4336 0.1027 1.3014 0.9997 2.6013 1.2254 -0.8756 -0.2668 -0.7806 0.7612 0.9986 0.0627 -1.4789 0.4519 0.0711 -1.0355 1.8848 0.3956 1.3340 -1.0172 -0.5652 1.6748 0.0816 0.3995 1.6090 0.5362 -0.2735 -0.9961 0.8362 -0.2058 -0.0220 -0.9831 -0.0396 0.0574 1.2730 0.6901 -1.4555 0.7908 0.7704 -1.1964 -0.4756 0.1636 1.4650 -0.0052 0.6758 -0.8851 0.9931 0.7759 1.2665 0.7794 -0.5312 0.1884 -0.4188 0.0066 -0.1885 -1.5077 -0.3156 0.6107 -0.0716 -0.7001 1.8492 -0.4185 0.0623 1.5887 -0.7481 -0.1175 0.0892 0.0670 1.4387 -2.0910 0.4115 -0.3530 0.3162 -0.4203 0.1195 -0.2944 -0.7849 -0.0895 0.0839 -0.2440 0.0003 -0.2077 0.6561 0.6364 -1.1391 -0.8127 -0.2850 0.8946 -0.7658 -1.3824 0.2052 0.2423 1.4061 0.5278 1.5756 0.4460 1.0291 -0.5105 1.4414 -0.1967 0.0147 -1.2036 -0.0426 -0.1613 -0.1348 1.4226 0.6896 1.3301 -0.9419 1.5759 0.4627 0.4548 -0.6758 0.0276 -1.0499 -0.2941 0.8313 0.5242 -0.8751 -0.5427 -0.4653 0.5768 -1.6005 -0.5347 0.8937 0.5509 -0.3603 -0.3800 1.7823 -0.5489 -0.0427 -1.5168 1.4498 -0.9299 0.5655 0.6719 0.2166 1.1310 1.2232 -1.1979 1.9985 -0.4823 0.8999 0.7310 -0.2461 -0.4371 0.0712 0.6565 1.7600 -0.6556 0.0827 0.6306 1.4031 -0.3889 -0.1016 0.1755 1.2998 1.0804 0.3408 1.0727 1.0535 -0.9449 -1.2369 -0.2963 1.7964 -1.5410 -1.5078 1.4916 1.5757 0.2280 0.9539 0.6422 0.4612 1.4954 -0.2135 -0.7886 0.9948 -1.0333 0.2690 1.5178 0.9771 -0.8158 -1.3831 -2.3596 -0.2753 0.2169 -0.4298 1.1480 0.9391 1.8957 2.2535 -0.2914 0.9429 0.4690 eicosenoylcarnitine (C20:1)* -1.2378 -1.0911 1.0995 1.1224 0.4387 0.9880 1.6121 0.8035 1.2615 1.4305 1.5119 -0.1826 1.2084 -0.4481 0.6889 -0.0399 1.6237 1.0794 0.9528 -0.1016 0.4135 -0.8514 -1.1333 -0.1828 0.7888 -1.6499 0.8995 1.9593 -1.4066 1.0812 -0.3380 0.5378 -1.0512 1.5655 0.9652 1.2120 0.3933 0.1523 -0.1206 0.6422 -0.7393 -0.9547 0.9887 0.3857 0.6804 0.9850 -0.6086 0.6809 0.0531 2.2604 0.2158 -2.0705 -0.2419 1.3059 0.2525 1.6283 0.1890 1.0251 0.2168 0.8882 -0.6696 -0.0854 -0.5288 -1.5357 -1.6168 -2.0024 -1.7120 -0.4506 0.3693 0.9144 1.2140 0.4982 1.7508 -0.2545 -0.0973 -0.1015 -1.4304 0.2300 0.1923 -0.0763 0.1202 -0.0139 -0.3031 0.5951 -0.5738 0.5056 -0.1152 0.9596 0.3529 -0.0899 -0.1080 0.8032 -1.6009 -1.1322 0.8340 0.7810 0.7712 0.2701 -1.5614 0.3983 0.6547 0.2004 -1.4383 0.0314 0.8687 -0.8551 2.0472 0.4661 0.2193 -0.5280 0.5325 -1.9470 0.3322 1.8465 0.8345 -0.4429 -0.2579 -1.5867 2.2187 0.2102 1.7586 0.6743 0.7849 -0.5810 0.0145 1.3247 0.3389 0.1668 0.1812 -0.3939 0.7167 1.6370 0.6575 -1.9149 -0.9935 -0.1703 0.8910 -1.1785 -0.4719 -0.0425 1.8543 0.5338 0.5057 1.0491 0.7289 -0.3234 -1.6644 0.5439 1.0884 0.2465 0.4809 0.9781 0.6869 0.6325 -0.7727 -0.0822 0.9069 0.8165 -0.6655 0.1180 -0.2717 0.3935 -1.4337 1.3129 0.2094 -1.9887 -0.0345 -0.5478 -1.9741 0.3383 0.6856 -0.5239 0.5601 0.2949 1.5536 0.9167 0.4783 -1.4071 0.9632 0.4028 0.1646 0.5818 -1.7908 -1.7563 -1.4003 0.4370 -0.3877 -1.5952 -0.5267 -1.5203 0.2406 1.6871 0.6238 1.1508 -0.0612 0.4527 -1.5959 -0.1090 0.1118 0.5135 -1.9106 -0.0026 -1.4689 -1.5987 -0.1228 1.6770 0.1525 0.4643 -1.6736 -0.8085 0.6899 0.0088 0.7378 -0.4304 -1.9878 0.2180 1.3028 0.3032 1.2961 -0.0502 1.8956 0.3368 -0.6173 -2.1320 -0.7437 0.2885 0.7741 0.8579 -1.8770 -1.6827 1.1874 -1.4937 1.1466 0.3273 0.9396 -1.3636 -1.8085 -1.6141 0.3684 -0.0059 1.2869 -0.2323 0.9201 1.2445 0.0636 0.4913 -1.8095 0.2850 0.4297 0.2581 -0.1336 -0.7837 0.1510 1.1170 0.2518 -0.2019 -1.8497 -1.8398 1.2503 0.4337 0.6081 -1.4940 -0.7727 0.6005 0.2675 -1.2275 -1.1816 0.0600 0.9864 0.2739 0.2179 0.1771 -0.7134 -0.0357 -0.2340 -1.8402 0.2801 -1.8425 0.1796 0.9347 -2.0756 0.2031 0.5579 -0.5225 0.7598 -1.6876 -1.9240 -0.4630 0.2619 -0.6968 -0.4276 -0.4457 -0.2007 -2.0889 -0.5302 -0.1007 0.9242 -0.7868 -0.7480 1.0655 0.1719 -0.1961 0.6196 1.4656 0.8889 -0.2372 0.7640 -1.3610 1.2832 1.5196 -1.6671 -0.3142 0.2126 -0.7135 1.5448 0.6159 0.8002 -1.7824 0.2522 -0.6439 0.0138 1.7679 -0.5094 -0.1830 -1.8522 0.7848 1.1864 -0.7592 -0.3420 0.0709 -0.3723 0.2700 0.3947 -1.4839 -0.1091 -2.2144 -0.3821 -1.8891 -0.2268 -0.3316 -0.0622 -0.7917 0.0864 -0.6221 -0.2004 -0.3443 -0.4386 0.1967 -0.0199 -0.7194 0.2191 0.3870 0.1726 0.5228 0.8872 -2.2180 1.3433 -1.9408 -2.3549 -0.3350 -0.9503 -0.4248 0.5762 -1.0543 1.0470 -0.9892 -0.5695 -0.2196 0.6959 0.1081 1.1501 -0.2074 0.5041 1.6705 0.7670 1.3543 -2.4575 0.5587 0.6104 0.4051 0.9369 -1.3767 -2.3383 0.7482 1.3664 -0.3516 0.4121 -0.2494 -0.3479 0.8988 -1.4389 0.4697 0.3049 -0.4883 0.2794 -0.5673 0.6388 -0.7060 0.1642 -0.9549 0.1082 0.9892 -0.3959 0.5814 0.1967 0.9553 1.2206 -1.8881 -0.9422 0.2903 epiandrosterone sulfate 1.4195 0.5465 2.1661 0.7035 0.1440 1.7059 0.1253 0.7259 0.1262 -0.0995 0.4046 -0.8667 -2.1887 -0.2744 -0.0406 0.3519 -0.3939 -1.4540 1.0731 0.1812 -0.0738 0.2993 -0.5838 1.6966 0.8947 1.6293 0.9068 0.5402 -1.3591 0.7470 0.4429 0.9891 0.0461 -0.6997 0.5385 0.6420 1.0100 1.6202 -0.9957 1.0115 -0.3720 1.6889 0.6127 -0.7448 -0.2983 -0.6129 1.1084 -0.6618 1.0737 1.8604 1.2708 0.9757 0.4747 0.1326 -0.2650 0.1704 0.1160 2.0290 -0.5088 -1.2342 0.4724 0.4100 -1.1080 2.0718 0.9885 1.2322 -0.7714 -0.6074 0.3572 -0.0076 0.3947 0.1758 0.3295 0.4492 0.2006 0.3813 0.5745 0.2978 -1.9475 -0.5431 0.6197 1.4279 0.7429 -0.6437 0.5037 0.3997 0.4473 -1.9539 0.2075 -0.0004 -0.0283 -0.0555 1.3715 0.9003 0.0580 -0.1819 0.2373 0.6906 -0.1458 -1.4772 1.1855 1.3821 0.9558 0.8076 -2.1969 0.3072 -3.0435 0.1313 -0.8056 -1.2616 -0.0253 -0.5401 0.6410 1.1235 -0.3791 0.0612 -0.3857 0.7483 -2.2877 0.6023 1.1243 0.8499 -0.4991 0.1363 -0.7138 0.6089 0.4592 -1.0134 -1.5924 0.2573 0.5722 1.4161 0.9424 1.4041 -0.5273 1.0609 0.2202 -1.2553 0.8284 -0.0231 -1.9954 -1.5555 -1.0299 -0.6459 -0.3299 1.1634 1.0179 0.0063 -0.0981 0.4298 -0.3086 0.3063 -0.3117 1.1796 -1.2067 1.3026 0.0468 -0.2215 -0.5701 -0.0324 -0.2478 -0.1061 -0.6933 -0.4700 -0.0050 0.5677 0.2978 0.8416 1.5219 0.0561 0.9687 1.3473 0.7251 1.3574 -0.1481 -1.6321 0.0321 -0.1978 -0.7138 -0.2080 -0.6415 -0.5324 0.9554 1.0599 -0.2868 0.6353 0.1518 -0.1894 0.3048 1.0662 0.0873 0.3438 1.2681 -0.3979 0.2020 0.2615 0.1497 -0.1599 1.3204 0.2340 2.0899 -0.1899 0.3440 1.1380 -1.0501 0.5623 0.9630 -1.3046 1.1319 0.6833 -0.8931 0.1763 0.8705 -0.2375 1.1643 0.7058 1.5151 0.7059 0.9142 0.3072 -0.5566 0.9507 -1.1524 -2.5883 0.0625 -0.0230 -1.5303 -2.2609 -0.3181 -0.9993 0.0407 1.1557 0.1304 -1.7783 0.7530 -0.0014 -0.4720 0.4657 0.3615 -2.2978 0.1047 0.7929 -1.7521 2.6710 0.7988 -0.2967 0.2355 -0.6359 0.8526 0.1453 -0.2071 0.2074 -1.7675 -0.7578 -1.4711 1.4510 1.2775 2.0274 -1.1053 0.2471 -1.2688 -0.8048 0.5000 -2.3099 1.1900 0.1152 1.2673 -0.4070 -0.4237 0.8341 -0.2810 0.0456 -0.2095 -0.0462 -0.3514 0.8852 1.4526 -0.0693 0.0654 -0.0834 0.2602 0.1559 0.2531 0.1216 -0.0009 -0.7181 2.9166 0.0981 -0.7996 -1.7547 0.7201 -0.9149 -0.1420 -1.6392 -0.8400 -0.2548 -0.5184 0.6414 -3.1492 -0.5594 -0.2550 -1.7016 -1.0782 -0.0083 -0.1059 -0.2877 0.0834 -1.1464 -0.0302 0.2742 0.0439 -1.8914 -0.2381 0.3558 -1.9342 1.7583 -0.9754 0.9392 0.4249 0.4052 0.9738 -0.5504 0.3426 -0.3089 -0.0007 -0.8179 0.1716 0.6720 -1.2309 -1.5214 1.3930 -3.7367 -0.4648 -1.4465 0.6732 -1.9257 -0.2419 -0.4694 0.1070 -0.1991 1.4923 0.9308 -2.8655 0.8057 0.1770 -0.7220 0.6889 0.5749 -0.1447 0.4143 0.0929 -1.0316 -0.6042 -0.3829 -2.5942 1.1733 -1.7443 -0.2664 -1.0658 -1.5744 -0.7122 0.3289 -0.0410 -1.0966 -0.6439 -1.1945 -0.1696 0.7230 -0.4376 0.3683 0.0518 0.4062 -1.2613 -0.9713 -0.2529 -0.3628 -0.8811 -1.3710 -1.8932 -0.7943 -0.7184 -0.7654 -0.0083 -1.0194 -0.1896 0.2201 -0.5850 1.5863 -0.4895 -1.0156 1.1201 -0.8038 2.1784 -0.1418 1.3768 -0.7003 -1.2199 1.4972 1.2022 0.2720 -2.3256 0.9440 -0.3227 -1.1866 0.0463 -0.2774 0.5327 0.2857 -0.2524 0.7347 ergothioneine -1.4924 -1.8766 0.2547 -0.6321 0.1071 1.9311 1.4224 3.4579 -0.5973 1.3849 1.0740 0.1835 -1.7257 -0.4580 0.0436 -0.5454 -0.7661 -0.2851 0.7594 -0.6309 0.6339 0.5251 0.8483 1.2275 0.0885 1.3002 -0.0477 1.2673 0.3261 2.4339 -0.0238 -0.7787 -0.1456 -0.2830 1.4647 0.9718 1.1579 -0.4029 -0.3058 0.0251 2.7289 0.6367 0.5669 0.6045 -0.8715 -0.6646 0.4173 0.2495 0.5175 0.5970 0.7009 -0.2568 -0.8076 0.6061 1.3376 0.5340 0.4962 -0.2382 1.1487 1.9433 1.2835 -1.0529 0.2558 0.3066 -0.8691 -0.7176 1.1171 -0.3270 -0.5744 -0.3243 1.1578 0.9756 1.0866 0.5797 -0.8664 1.0811 0.0670 1.1555 1.5785 0.7874 1.1021 1.1735 0.6833 -0.6897 1.5757 1.8042 2.2763 0.5716 -0.3554 1.7571 -1.7979 0.4736 -1.4164 0.1490 1.0285 0.7597 -1.1055 -0.3885 -0.1474 1.3560 0.4966 1.0122 1.1233 -1.2086 0.5348 0.0760 -0.0567 -0.5551 -3.7179 -0.2126 0.1519 0.8550 0.6542 0.5408 0.6162 0.8039 0.6809 0.2325 0.4745 1.8964 -0.3659 0.6996 0.7453 0.0031 0.5658 -0.0596 -0.9928 1.0191 -0.2764 0.9766 0.0249 0.5441 0.3880 -0.5671 0.3905 0.0978 -0.1525 1.5921 -0.9175 1.9052 -0.7058 0.2617 0.0803 -0.2834 -0.8481 -0.3718 -0.3270 0.0149 1.7502 0.5714 -1.2475 -0.8559 -0.8226 -2.2814 -1.2099 -0.7770 -1.0794 -0.2585 -2.1587 -0.3133 -0.6924 -1.1308 0.3071 -0.8875 0.0710 -0.8189 0.2018 -0.7780 1.1334 -0.0045 0.6688 0.3361 0.3129 2.2526 -0.8904 -1.9346 -1.4255 0.5491 1.4611 0.4471 -0.6723 0.2851 0.5463 -0.5242 -0.9398 -0.1842 -0.7378 -0.9705 -0.5029 -1.2569 0.1677 -0.3024 0.8268 2.5919 0.3194 -0.1464 -0.6822 -0.7095 1.1718 -0.0576 1.4328 0.2818 -0.2084 0.1290 -0.8208 1.0310 0.5463 -0.9559 -2.3880 -0.6587 0.8336 0.4413 0.2982 -0.2611 -1.5715 0.7862 0.6102 1.2774 -0.7299 -0.7805 1.4446 -0.2147 -0.5567 -0.0946 -0.0422 0.1604 0.7800 1.2199 0.1261 0.0480 -0.5806 0.0006 2.4052 0.1554 0.2599 -0.4549 -0.3601 -2.1460 -0.1704 0.6432 -0.4118 -0.5824 -0.4945 -0.4789 0.3464 0.9502 -0.7335 -0.9775 0.5789 -0.0849 -1.4745 0.4438 -0.6353 1.3074 0.2607 0.2002 -0.2072 -0.5589 -0.3681 -0.2701 -1.2606 -0.2683 1.9564 -0.3768 -0.6170 -1.9064 -0.9639 -0.6179 0.5244 1.1372 -1.3510 -0.3657 1.0367 -0.0421 -0.6957 0.6344 0.6383 0.7997 -0.2568 1.0546 0.8675 1.7224 0.4354 -0.7042 -1.2022 -1.2671 0.6644 -1.2545 1.7222 0.3063 0.1337 0.1913 -0.9823 -0.1010 0.5543 -1.8603 0.8424 -1.8313 -0.0954 -0.2596 -3.3552 0.3292 -0.6604 -0.1627 0.4766 0.0749 -0.2094 -0.9040 -0.6094 1.0356 -0.3396 0.3107 -0.5294 -0.4700 -1.0251 -0.1066 -0.0373 0.3231 0.4731 -0.9407 -0.5579 -0.3857 -0.9982 -0.6935 -0.6989 0.0437 0.1034 -1.1601 -1.2835 -1.8151 -0.0197 -0.6135 0.2610 -0.6551 1.0322 0.0693 -0.8472 -1.7077 0.0635 1.0895 0.7291 -0.4429 1.1223 -0.0935 -1.0726 -2.0213 0.4708 -0.3635 -1.0841 -0.9748 -2.2279 -1.7727 -0.6374 2.0276 -1.9754 0.0702 -0.4992 -0.0029 0.4390 -0.3949 -0.2516 0.0667 -0.4080 0.2360 -0.3218 -1.3155 -0.8372 0.0018 1.3858 0.2342 -0.0396 -1.7289 -0.1462 0.2198 0.4038 3.5981 -0.8201 -0.7604 0.3135 0.7720 0.4187 -0.7635 -0.7738 0.0209 -1.9170 -0.8514 0.5100 0.5256 0.1998 -1.1117 -0.0355 -0.4447 -1.8922 -0.7787 1.0969 0.4138 1.8663 0.2654 -0.6417 -0.4708 -1.8933 0.7647 2.2716 -0.7342 -1.5766 0.7449 0.4041 -1.6454 -0.0832 -0.5608 erucate (22:1n9) -0.2006 -1.4392 0.5609 1.2790 -1.0560 0.7615 2.9177 -0.4868 0.2760 -0.1008 0.9069 -1.2075 0.7401 -0.3501 2.8604 -2.2248 -0.0743 -0.5325 -0.7549 0.2904 -0.8048 -0.6253 -1.1078 -1.3115 0.4409 -0.2751 -0.5279 0.8992 -0.8388 0.3735 0.0151 -0.9451 0.0393 1.9908 2.3896 -0.1252 -0.2123 -0.7314 -0.8669 -0.5170 -1.2669 -1.1634 0.1370 -1.1505 0.6209 0.3107 -0.3772 -0.2415 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0.4197 1.0809 0.6093 -0.5009 -0.3461 -0.3431 -0.4984 1.0045 0.2405 0.6996 1.0037 -0.4570 0.0302 -0.4426 -1.3889 -0.1295 -0.2156 -0.3947 1.9714 -0.0085 0.0002 0.5969 1.5322 -0.9139 0.4429 -0.0494 0.0702 0.5605 3.5717 -0.4916 0.7428 0.4217 -0.9871 -0.3213 0.5027 -0.4036 0.1126 -0.3759 0.0091 0.7205 -0.0634 -0.0233 0.8208 0.0288 -0.4256 -0.9364 -0.0692 -0.0617 0.5122 1.4031 0.2328 0.4303 0.5890 -0.9085 1.5378 0.7995 -1.6222 1.3518 -0.2072 -1.2841 -0.0822 -0.1502 0.3684 1.2869 0.1104 -1.2988 1.1126 0.1376 0.0443 -0.0005 -0.2224 0.7649 -1.0323 0.2790 0.3204 -0.5696 -0.5322 0.1826 0.6752 0.4673 1.5071 1.3818 -0.1953 -0.5408 1.9546 0.6808 -0.0701 -0.1037 0.2414 0.6719 -0.0718 0.1325 -0.7177 0.4391 1.2079 0.4967 0.2710 0.3192 -0.6808 -0.4608 0.0176 0.0557 1.0640 0.2107 0.5637 0.2116 1.7675 0.1431 -0.4612 -1.4772 1.6069 -0.8875 -0.3161 erythronate* 0.5898 0.7120 0.3476 -1.6679 1.1511 0.1543 -0.9187 0.8139 -1.0309 0.7118 1.7329 -0.2435 -0.1690 2.0672 0.3650 0.8979 -0.7927 -0.7413 -0.6235 -1.2199 0.7634 1.7830 -1.3624 -0.2786 -1.6163 -0.3718 -0.4402 -0.5217 -1.3724 -1.6281 0.3885 -0.6563 1.4684 0.6334 0.4914 1.4606 -0.6296 -1.8666 -0.1322 -0.1152 -1.1603 1.6885 -0.6225 -0.3806 -1.3479 -0.5717 -0.2251 -0.3682 -0.8815 1.3471 -0.4774 -0.5374 -1.2147 0.2656 -2.1279 -0.7065 -0.0302 -0.7422 0.5038 -1.9543 -0.6501 -1.1398 0.8214 -0.1823 0.3252 0.4596 -0.3411 0.3840 0.2127 -0.1732 -0.7170 -0.1836 0.0426 -0.3165 1.6243 1.4389 0.1640 -0.8314 0.0171 0.1546 1.0533 -0.5403 -1.8712 -1.1605 -0.7047 -1.5470 0.3675 0.6003 -0.5125 -1.1998 -0.9833 -1.2946 1.2667 0.4550 -1.2013 -0.7129 -0.8686 -1.0001 -0.5763 0.5031 -0.1935 0.4500 -0.7222 1.9029 -0.0665 0.2435 1.5915 -0.5687 -0.6732 2.6909 1.4549 0.2749 -0.4439 -0.8880 0.6212 0.2633 1.5645 0.0628 0.4553 -1.7691 0.0706 -1.8108 -0.4670 -1.3860 0.4122 -1.5882 0.7902 0.2321 0.1709 0.0180 -1.0643 -0.4986 -1.5984 1.2909 0.0327 -0.4040 1.2899 -0.2615 1.5626 -1.0563 -1.9255 0.3199 -1.3715 -1.7375 0.8594 -0.6581 0.5736 1.9340 0.1340 -1.3555 0.4723 -1.3683 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2.5284 0.5896 0.7993 1.1831 -0.3454 -0.3552 1.0792 -0.2260 2.9619 0.2285 1.3179 0.1704 2.0911 0.7620 0.2520 -0.5441 -0.4167 0.8821 2.4935 0.1641 1.5216 0.7466 1.9166 -0.7688 0.1827 -1.0742 0.1300 -0.7267 -0.8478 -0.9691 -1.3987 -0.5598 -1.1553 0.9744 0.2117 0.2954 -0.6923 1.3347 1.7205 -0.1112 -1.0738 0.1963 -0.1760 0.7474 1.2117 0.2222 1.4979 -0.4624 -0.4806 -0.5534 0.4852 2.2683 -0.5141 0.2885 -0.6135 -0.6673 -0.7810 -0.8394 0.0499 0.0578 0.8019 0.8037 1.5460 1.0791 0.4763 -0.4416 1.2279 -0.4545 -0.9550 0.8739 0.0381 -2.2262 1.1223 -0.0267 1.1064 0.8536 -0.5717 -0.7726 1.2562 0.6201 0.2916 -0.0678 -0.4975 0.0230 -1.5773 -1.1996 0.1250 -1.5279 -2.7559 -0.1673 0.5452 0.1195 0.6599 -0.7544 -0.1459 0.1176 2.4392 2.3358 0.0850 0.5034 0.3469 0.0526 -0.5159 -0.2430 -0.5889 0.5307 1.0018 1.9588 0.2403 -0.0206 -2.1219 -0.3039 0.7014 0.7718 1.9048 -1.9692 0.8654 -1.8153 0.7076 -0.1826 0.7054 -1.1709 0.4835 0.1809 -0.2782 estriol 16-glucuronide -2.3708 0.4215 -2.8188 -2.6454 -1.7605 -2.0500 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1.5135 1.1396 estriol-3-glucuronide -1.1120 1.4027 -1.4633 -1.3304 0.3248 -1.5059 -0.3220 0.0576 -1.4818 -1.0526 -1.2459 0.3539 0.3539 -1.4797 -1.6582 0.5241 0.1745 -1.4070 0.8700 0.6788 -1.2528 0.5476 -1.0524 -0.0164 -1.3895 -1.3928 0.9224 -0.9899 0.7134 0.6300 -0.2580 -0.2494 -1.0231 -0.2068 -1.7534 -1.4365 1.2387 -1.1663 -0.2363 0.8410 -1.1524 -0.9395 -1.4281 0.0775 0.3558 0.3526 -1.4318 0.8191 0.8933 -1.3781 0.6402 -0.3573 1.0296 -1.5142 -1.0929 0.9781 -1.4339 -1.0911 -1.4741 0.2932 -1.2645 0.4585 -0.5376 -0.1318 1.1426 0.4334 0.4473 0.8208 0.7187 -0.1337 0.0889 0.1389 -1.4821 -0.4502 -1.4292 0.4950 0.0880 0.0732 0.1379 0.5680 0.1117 1.0405 0.2445 0.1549 -1.3063 0.7724 -1.2578 -1.3465 0.0267 0.7367 0.6250 0.2578 -1.3557 0.5601 0.6171 -1.3364 0.3219 0.0699 0.0817 -0.1434 -1.5767 0.5640 0.7245 -1.6721 1.4467 0.7999 -1.4772 -0.7467 0.5278 -0.2649 0.0438 0.3268 -1.2509 -1.4214 -1.4226 0.3936 -1.2400 -1.3556 -1.5236 0.3828 0.6318 -1.3608 1.2100 -1.4743 -1.6653 1.1308 0.4150 0.2821 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0.7851 -0.3420 1.1557 -1.1270 1.0202 0.6754 -1.3907 -1.5656 -1.5691 -1.3667 0.4495 -1.5671 0.0766 1.2818 0.2160 0.6522 -1.6201 -1.2178 0.1750 0.8464 -1.6756 0.8268 0.1881 0.5952 0.4535 -0.6458 -1.6055 0.2830 -0.0972 -1.6806 0.9584 -1.6532 -1.4260 0.8853 -0.2860 0.6545 -0.0708 -1.0161 0.1835 0.3215 0.3980 -1.6038 -0.0868 -1.7185 -0.0200 0.4096 0.7891 1.3003 0.8852 0.9749 -0.0924 1.2966 1.6224 0.4841 0.6139 1.0061 -1.3858 0.5573 0.0621 0.0367 0.6359 -0.8194 1.4593 0.8452 0.3542 0.3549 0.8622 0.7488 -1.3628 0.6207 -1.4485 1.5687 0.4757 1.1371 0.2108 1.4983 1.0005 1.1113 -1.4614 1.3674 0.7787 0.9793 1.6934 0.3647 1.5217 0.7890 0.2066 1.2281 -1.2505 -0.8861 -1.5569 -0.1556 -1.5661 0.8661 1.2350 0.0788 0.5073 -1.6886 1.3107 1.4370 1.5166 1.6825 1.2512 0.5258 0.6628 0.7567 0.9156 1.1608 1.2202 1.0488 0.8012 0.0937 0.3704 0.3697 1.1101 0.8512 1.5824 -1.5995 2.2433 1.6254 1.5621 1.6568 1.2425 1.0687 1.3398 0.4572 1.5362 1.7850 -1.2604 0.4513 0.8168 0.1137 0.7095 0.8137 1.7044 0.9068 0.2595 1.4754 -0.3480 0.9550 0.2546 2.0246 1.1234 0.6193 0.6236 0.5381 1.7879 1.1938 estriol 3-sulfate -2.7195 1.5663 -3.1571 -1.1795 -0.8624 -2.5097 -1.8845 -1.1664 -1.2108 0.4632 0.1878 0.5047 -0.8678 -3.1654 -1.9106 -0.6888 -0.2451 -0.5301 -0.0711 -1.4791 -0.1396 0.3066 -2.2333 -0.5446 -0.2006 -0.4567 -0.6852 -0.7305 -2.8713 0.6176 0.4567 -0.1176 -0.8819 0.0101 -0.3797 -1.3317 -0.5853 -0.6884 0.1224 0.3670 -0.6936 -1.0780 -1.0203 -0.6929 -0.2693 -0.2427 -0.0292 0.2582 -0.6822 -3.0503 -0.7831 -0.5844 -0.8912 -0.2319 -0.3894 0.4715 -0.7646 -1.8457 -1.2166 0.1495 -1.5941 -1.5890 -0.8048 -0.0752 -0.2377 0.6697 -0.4595 0.2030 -0.1881 -0.2097 -0.9978 0.0493 -0.0976 -0.2526 -1.0344 -1.0001 -0.3252 0.3838 -0.2191 -0.4499 -0.4808 0.3539 -0.5990 0.5143 -0.5679 0.5270 -0.2407 -1.8499 -0.2559 -0.0280 0.3949 -0.2314 0.6917 -0.8318 -0.7488 0.0750 -0.9347 -0.8198 -0.5369 -0.7712 -0.1694 -0.6577 -0.6119 -1.3528 0.0267 -2.0810 -0.3634 -0.5394 0.3267 -0.0418 -1.0746 0.8400 -1.0083 0.6448 -1.0722 -0.3017 0.1662 -0.1969 -0.2031 1.1390 -0.5363 -0.6047 0.9406 -1.5476 -0.0199 -0.3515 -0.9846 0.7612 0.7379 -1.3018 -0.5995 -1.5896 -0.9722 0.0797 1.1375 -0.1342 -0.0497 -0.1335 0.3262 -0.9205 1.0792 0.4486 -0.5754 -2.0621 0.6044 -0.8995 1.1735 -0.0964 0.8225 -0.8896 -0.6813 0.2834 0.4296 0.0920 -0.7699 -0.1175 0.4913 -0.1442 -0.3117 -0.8861 -0.2003 -0.5097 -0.9571 -0.8502 1.6865 -1.1786 -0.3691 -1.2454 -1.9901 0.9559 -0.7338 -0.1570 -1.3011 -0.1729 0.4976 -1.4098 -0.8388 -0.8895 -0.9993 -0.7742 -0.9499 0.6470 -0.5883 -0.8021 1.1641 -0.3643 0.3391 -0.5344 0.2706 -0.0160 -1.5177 0.8993 0.7564 -0.0853 -1.7084 1.1440 0.2404 0.4382 0.8703 0.5318 -1.0082 -0.7937 0.9621 1.2732 -0.3268 1.2577 -0.6532 -0.4785 -0.1776 -0.6250 -0.3007 0.2231 -1.0797 0.5401 0.0865 -2.1312 -0.5884 -0.0593 0.1140 -1.3677 -0.2996 -0.0458 0.2572 -0.2320 -0.1347 -0.4156 -0.6530 -0.1193 -0.0456 -0.4168 -1.0612 0.5490 0.8431 -0.5573 0.4718 0.8102 0.2598 1.1475 -0.8852 -0.7371 0.1268 1.1572 -0.2533 -3.5219 -0.0824 0.4851 -0.5214 -1.0702 -0.9562 -1.8833 1.2491 -0.4296 0.3816 0.2333 -0.0483 -1.3211 0.4598 0.8242 -0.5469 -0.2884 0.1689 -0.5651 -0.1357 -0.8999 0.8610 0.3250 1.0656 0.7860 -0.3169 0.6758 -0.5114 -1.6132 0.9719 -0.0287 -0.3610 0.4230 0.0439 0.0148 -0.3308 -1.9107 0.3839 -0.2247 -0.0701 1.2509 1.0975 -0.1601 1.8003 -1.2811 -0.3133 0.0920 -0.3558 -0.2759 0.1143 0.5288 -0.0071 -0.3924 0.5397 0.5963 -1.5542 -0.4842 -0.9682 0.0525 1.1787 0.0113 0.6808 -0.2122 0.6456 1.8607 1.0713 1.9715 1.8257 1.9769 1.2002 0.2046 0.7092 0.7009 1.0342 0.7784 -0.9439 -0.3966 1.1486 1.9013 0.1499 0.8196 1.0392 1.2630 0.4195 0.5502 2.0450 0.5998 0.5470 0.9689 1.5621 2.4825 0.6746 0.1739 0.0338 2.6457 -0.2441 0.7370 -0.8369 0.8877 0.3910 0.2312 0.7157 0.7609 1.0200 0.0133 0.5975 1.2931 1.2408 0.4619 -0.0568 1.6686 0.7336 0.0398 2.6785 0.4359 1.0972 -0.3974 0.8705 1.5439 0.9563 0.5761 2.2069 1.6862 0.5248 1.3965 1.4060 1.3854 0.3148 0.8557 1.9760 0.3411 1.4543 -0.8067 1.3940 0.3414 1.1619 -0.6576 1.0073 0.2961 1.0231 1.3415 0.4887 1.8722 0.1519 1.1961 2.1429 1.9205 0.1892 2.2981 1.5405 0.4835 2.1026 0.5912 1.7878 1.3108 1.1069 1.3486 1.1256 1.1897 -0.5517 0.6803 1.4963 0.1458 0.6831 0.7602 0.9555 1.0222 estrone 3-sulfate -1.8204 0.6439 0.4502 -0.1369 -0.9783 -1.1324 -1.0569 -1.0007 -1.5078 -1.2355 -0.9917 -0.2892 -2.3105 -1.9597 -1.1999 -0.6453 0.1317 -2.3119 0.7493 -0.1396 0.1790 0.7894 -0.5505 0.4263 0.7150 -0.6009 0.5321 -0.6119 -2.2785 0.3945 -0.3488 0.5591 -0.3168 0.5854 -0.0687 -0.9001 -0.7757 -0.5131 -0.3737 1.5624 -0.6612 -0.4664 0.0112 -1.2393 0.0432 0.2105 0.8057 -1.1817 0.0003 -3.7072 0.3456 -0.0208 -0.0966 0.3567 0.2193 0.3717 0.0937 0.4463 -0.9229 -0.5074 -0.5505 -0.5904 -1.7072 1.2365 0.9140 1.2051 -1.4558 -0.3534 0.5286 -0.8186 -0.5987 0.1992 0.2643 0.5190 -0.3936 -0.1160 0.3268 0.3426 -1.9990 -0.5995 1.1187 0.3932 0.0642 0.3055 0.2171 1.6335 0.0553 -3.0881 -0.1226 0.0231 -0.8477 -0.2547 1.8564 -0.0682 -0.7094 0.2254 -0.9338 -0.1273 -0.3467 -1.4107 0.9671 -0.8267 -1.3619 -0.1820 -0.9405 -0.6601 -1.7795 -1.3225 -1.3400 -2.7401 -0.7126 -0.0783 0.2370 1.2855 0.3042 0.5628 -1.0288 0.1553 -1.6473 1.2912 -0.2296 0.3326 0.3060 -0.8820 -0.1079 0.7278 -0.3997 0.7176 -1.2609 0.0509 0.3979 -0.2697 0.0369 0.5252 1.0226 1.1859 0.1066 -0.5810 0.6482 -0.9185 -0.9636 -1.4021 -0.2491 -2.0268 -0.3797 -0.2783 0.2731 0.1609 0.8607 0.3402 -0.5749 -0.5021 -1.2858 0.2526 -1.4537 0.7438 0.2206 -1.0227 -1.0517 -0.6719 -0.6657 0.1674 -2.3726 0.6495 0.6999 0.1317 -0.3384 0.4260 -0.1717 0.4070 0.2345 0.4020 0.1953 0.6603 0.7265 -2.9714 -0.0582 -0.4261 -0.7663 0.0697 -1.1222 0.7426 0.4831 0.2829 1.2892 -0.1304 0.0604 1.0715 0.9789 0.5887 -0.3120 0.3510 0.8005 -0.8478 -0.5356 1.2146 -0.3354 0.3271 1.6238 -0.1070 0.2215 -0.4162 0.7714 1.4993 -0.6099 1.1690 -0.5633 -1.5029 0.7697 -0.4319 -0.9917 0.9911 0.1106 0.3192 0.7486 -1.2859 0.6577 0.2556 1.1736 -0.1121 -0.2469 0.7855 0.1718 -2.9843 0.4277 -0.4806 -0.9393 -1.1507 1.2616 -0.9844 -0.8789 0.7184 1.4739 -1.9613 1.4361 0.4557 -1.1358 0.2465 0.4290 -2.2314 0.3140 1.6138 -1.2363 -4.1066 0.4461 0.3938 -0.4536 -1.3703 0.6354 -0.9720 1.2728 0.9845 -0.6402 0.0444 -1.5398 -0.2611 1.2128 2.0134 0.7724 -0.1293 -1.3223 -1.1971 0.7134 -1.3543 1.0389 -0.0441 1.1526 -0.1026 0.0191 0.0400 -0.2769 -0.7748 0.7590 0.1160 -0.8866 0.6938 1.0763 0.8839 0.6137 -0.6357 0.9916 0.0736 0.5386 0.4403 0.7808 -0.3173 1.7365 0.7277 0.0886 -0.2010 0.2768 -0.0906 0.0115 -0.9683 -0.0736 -0.0360 0.6370 0.6772 -3.3112 -0.1478 -0.8568 -0.4610 -0.7044 0.5295 0.1532 -0.7673 0.5756 -1.1817 1.5671 0.4202 0.0961 0.3951 1.9196 -0.0627 -1.2499 1.2122 -0.2213 1.1512 -0.8935 -0.1977 0.3069 1.7200 0.9588 1.8778 -0.2507 0.3739 0.5033 0.5971 0.3757 0.0226 1.7104 -1.7144 1.1282 1.3040 0.5410 -1.1321 -1.0612 2.2219 -0.6377 0.5902 -0.4122 1.1567 -1.9191 1.1034 0.4605 -0.8562 1.4967 -0.2559 0.4275 2.6612 1.7540 0.3605 -0.4328 1.1620 -0.9249 -0.1440 0.4607 0.7554 0.2932 -0.1046 0.4045 1.2130 0.7694 0.2806 2.0106 0.7233 0.7635 1.5189 0.9603 1.0607 -0.0124 -0.0069 1.3993 -0.6235 1.0571 -0.7592 0.4659 -1.2167 -0.1081 -0.9829 -0.0729 -0.5310 0.1858 0.4643 -0.0221 1.6706 -0.2755 1.1828 1.6304 1.0937 1.7267 1.0303 1.6049 0.1063 1.4390 0.1341 0.3588 1.6097 1.3864 0.4236 -1.0006 0.9369 -0.7902 -0.0226 0.6972 0.2898 1.0557 -0.0500 0.9428 1.3436 ethylmalonate 0.2065 -0.5485 1.7983 -1.7701 -0.6618 2.5856 0.2135 1.8550 -1.3065 -0.5561 -1.2127 0.5982 0.2659 0.5484 -0.7808 0.2443 0.2594 0.7265 0.3099 1.3070 0.0186 -0.5246 -1.2166 0.1769 -0.3180 0.5344 -0.8568 2.0111 -1.1407 -0.6451 0.8526 0.1866 0.4037 -0.8286 -0.6258 -0.5920 -0.6488 -0.4189 -0.3065 -0.7397 -0.3604 0.1475 -0.4105 -0.2810 -0.7456 -1.9204 -0.5293 -0.4230 1.1924 1.2720 -1.2204 0.8464 0.5532 -0.3001 -0.0668 0.4934 0.6144 -0.2286 -0.5332 -0.7911 0.4372 2.6843 2.1007 0.3239 -0.2411 -0.4135 -1.2951 0.5889 -0.5789 -0.6255 2.3653 -0.9862 -1.5978 1.2344 0.5374 -0.8636 -0.1467 0.6738 0.5363 0.1038 -0.2953 -0.3790 -0.7021 -0.6183 1.5930 -1.4021 0.0691 -0.4327 -0.0575 -0.2663 -0.6126 -0.7727 0.0406 -0.6340 0.9149 -0.6926 -0.2141 -1.3573 0.5626 -0.5498 -1.7506 -0.1614 0.2339 -0.3265 -0.5500 2.2088 0.5904 0.1609 -0.5645 -0.6030 -1.5479 -0.1248 -0.4536 -0.3343 2.6771 -0.4912 0.5727 -0.5061 -0.8709 -1.0320 1.4957 0.1883 -0.5307 1.1903 -1.1991 -1.3561 -1.6148 -0.0361 -1.0808 -0.5444 -0.5470 -0.4799 -0.3230 2.0971 0.0056 0.2369 -0.3525 -0.8732 -0.9797 -1.0654 -0.4248 0.7268 -0.8645 -0.6661 2.4736 0.9772 -0.9338 0.1700 -0.3644 -0.2925 -1.7509 0.3507 -1.2824 -1.0518 -0.4149 -0.0788 0.4011 -1.2496 0.0487 -1.8293 -0.1308 -0.7295 -0.6296 -0.9935 -0.9850 0.1437 0.0425 -0.3609 -1.2476 -0.8493 -0.7493 2.1660 -0.8355 0.0981 0.7048 -0.4571 -0.3754 0.6732 -0.6352 -1.5845 -1.4410 -0.6484 -0.9835 2.3353 0.1161 0.0132 -0.1036 -0.3818 -1.2670 0.2149 -1.2441 -0.7588 -0.9899 -1.0813 -0.7400 -0.2670 -0.6501 0.3579 0.5465 -0.5469 -0.1603 -0.3181 1.4562 -1.4609 -0.8567 2.6360 0.2485 -0.1501 0.4859 -0.1913 -0.3121 -0.5245 -0.5773 0.5942 2.2184 2.6902 -0.8811 -0.3071 -0.2911 -0.3512 -1.7392 0.1256 -0.2733 -0.0656 2.6325 -0.9071 0.8535 -0.9651 -0.1188 0.0125 -0.6390 0.8923 0.8152 -0.5537 -1.1374 0.1897 -0.8711 -0.4067 -1.2893 0.1376 -0.2378 1.2927 0.2255 1.4646 -0.8310 -1.0228 -0.2128 0.5349 -0.6599 1.3153 0.3225 -0.3825 0.5171 -0.7000 0.2307 1.9000 1.8181 -0.7990 2.2365 -1.0239 1.1877 -1.1763 0.3819 -1.2561 -0.4212 -0.5333 2.0880 -1.6701 1.6294 -0.2482 -0.3141 -0.3157 1.4547 0.0065 0.8622 -0.7877 -0.4051 -0.0318 0.7200 1.6023 -0.4316 -1.4527 -0.0500 -1.3469 -1.2214 0.5475 0.2062 -0.4981 0.5042 3.4391 -0.8055 0.1282 -0.8121 0.1433 0.3306 0.3479 0.3729 -0.6491 3.0033 0.2516 -0.2404 0.8613 -1.9166 0.2996 -0.4280 1.3190 -0.8205 0.8088 -0.2578 2.1957 -0.3112 -0.4251 0.7852 -0.1411 -0.3307 0.3664 0.3347 1.4545 2.0979 -0.3264 -1.0111 1.0859 -0.9302 1.7856 1.1547 -0.4092 -0.1097 0.2440 2.2601 -0.0695 0.0353 -1.2162 0.2578 -0.2597 -1.1337 0.8870 0.4600 -0.4901 0.5168 2.6641 -0.3863 -0.5082 0.5337 0.3093 1.5715 0.8077 -0.6994 -1.0294 -0.8915 -0.0369 -0.7140 4.2195 1.0743 -0.3799 -0.1849 0.0356 0.3312 -0.2820 0.0052 -0.2562 0.7407 1.2175 -0.2763 1.6410 1.1899 -1.1027 0.5865 -0.9516 -1.0955 0.2655 0.0422 0.8924 -0.6259 -0.9117 -1.0574 -1.0029 -0.3177 0.7276 -0.7781 -0.0607 -0.0458 0.9376 0.7895 -0.2297 -0.4899 1.3636 -0.9943 2.5972 -0.1003 0.3053 -1.2568 0.6320 -0.2811 0.3973 0.0415 0.3562 0.5449 0.5083 -0.6091 0.0802 0.2879 0.7019 -0.5801 0.9933 0.1724 -0.0053 -0.0725 1.8951 0.2817 -0.1107 etiocholanolone glucuronide 2.6567 1.4061 1.5279 -0.3341 0.8192 1.4649 -0.4149 -0.0737 -1.2967 0.8713 0.7526 -0.4921 -1.1671 1.5674 -0.0017 0.4250 0.9805 -1.2132 0.4629 -0.1399 -1.0503 0.2549 -0.8417 1.7408 -1.1979 -1.2020 0.0756 0.7028 -1.0461 0.6768 1.0809 0.9815 0.1746 -1.5296 -0.4784 -1.2484 0.0008 1.2423 -1.1051 1.1262 -0.9464 1.4955 0.6619 0.2393 1.2281 0.5995 1.4008 0.7863 1.0268 -0.3332 1.9689 1.5005 1.1499 0.5379 1.6139 0.4907 1.5666 1.4685 0.8219 0.7922 0.1650 0.3106 0.0250 1.0691 0.0893 -1.4734 0.2665 1.2709 0.2430 -0.1349 -0.0250 0.7386 -1.2973 0.6771 0.9381 1.0996 0.0611 0.8341 -1.0472 0.1058 1.1771 1.9913 0.6715 0.6286 0.6078 0.1663 0.2145 0.0680 1.5615 -0.9089 1.2389 -1.1567 0.2921 1.2614 0.3162 0.4671 0.2857 0.9537 -1.1561 0.1932 1.1621 2.0465 0.9873 1.0935 -1.1103 0.2317 -1.2945 -0.3035 0.8892 1.0290 -0.3970 0.1641 -1.0501 0.8684 -0.1244 -0.2080 -0.0910 -1.1617 -0.3074 0.8302 0.3958 -1.1711 0.3646 -1.2989 -0.3543 0.7132 -0.2997 -0.6081 -0.1532 -0.8731 -1.3856 1.0108 0.6901 0.1688 -1.2907 0.4646 -0.4475 -0.1744 1.2273 -0.7271 -0.9938 -1.3080 0.6486 -1.2656 -1.0868 0.9848 -1.2241 0.4638 -0.4837 -0.7123 -0.0954 1.3209 0.0819 1.7005 -1.2926 0.5081 1.2950 0.6721 0.9158 -0.7780 -1.1959 -1.5108 -1.0613 0.0730 -1.1508 0.8484 0.6524 0.3784 -0.1873 -1.2346 1.5958 0.2477 0.4026 0.4016 -1.4244 -0.9298 -1.0049 -0.0520 -1.1688 1.4462 -0.1029 -1.5531 0.3421 1.1265 -1.0441 0.7996 0.6248 -1.1520 0.9689 1.1241 0.5903 0.4967 0.3370 -1.0656 -1.0475 1.7994 -1.1584 -0.8349 0.3795 0.8198 1.0678 -1.0299 0.9629 0.4550 0.1040 -0.9101 1.4286 -0.4851 0.6774 -1.2290 0.2263 -0.3123 1.0654 1.5048 0.6812 1.0671 0.9408 0.2495 0.1055 -1.4232 -1.3087 0.9237 -1.0346 -1.5433 -1.6232 -1.1767 -1.4368 -1.5636 0.9653 1.1743 -0.0793 1.4238 -0.2214 -1.3719 1.2891 0.2630 1.7699 -1.1581 -0.6129 -0.2640 -1.3127 0.7813 0.5215 0.8097 -1.3932 0.7312 -1.3087 -1.4866 -0.0824 0.5643 -0.6634 0.9614 -1.4453 -1.3015 -1.3596 0.6271 1.7612 1.2898 -1.2240 -0.5333 0.4939 -1.1087 1.3860 -0.6180 0.6436 -0.9182 1.7211 0.8077 -0.4065 -1.3868 -0.9389 -1.1726 0.1764 1.0042 0.5724 -1.3401 0.9704 -0.8698 -1.4486 -0.1188 -0.2033 -1.4527 -0.1360 1.5787 1.2727 -0.2498 1.5538 0.0730 -1.4336 -1.5573 -0.0209 0.4170 -1.3691 0.0114 -1.2374 -0.5016 -1.3746 -0.5810 -1.5398 -1.4163 0.6999 -0.7080 0.0159 -1.4291 -0.3008 0.4550 0.0562 -0.5180 -0.3757 0.5738 0.4459 -0.1878 0.1497 1.3478 0.7721 1.0039 -1.2330 0.5836 -1.1936 0.2822 1.1378 -1.4199 0.7514 -0.0309 0.3016 1.3087 -1.3228 1.0265 -1.3550 0.4079 1.2031 -1.1762 -1.2648 -1.0678 0.5057 -1.5893 0.5485 0.7043 -1.5159 -1.0744 1.7821 1.6246 -1.4807 0.4217 -1.4386 0.3949 0.3555 0.3111 1.5185 0.4356 -1.0508 -0.6567 -0.1570 0.0227 0.7854 -0.2024 -1.5293 0.7318 -0.6058 -1.5217 -1.4111 0.5573 -0.8744 -1.6742 0.4073 0.1341 -1.5140 0.6242 -1.5287 0.1828 -1.1582 -1.4030 0.6360 0.3102 -1.6886 0.5933 0.1999 -1.4988 -1.4553 -1.4214 0.3563 1.0797 0.2544 -0.1678 1.5949 1.0878 -1.7087 0.1843 0.4142 -0.9731 -0.1208 -1.2758 0.2216 -0.1495 -1.4953 -1.5057 0.4361 1.2751 0.1447 0.9470 -1.6277 -1.4157 0.6213 -1.4759 0.6709 -1.7086 1.3170 0.9140 0.5154 0.0824 eugenol sulfate -0.2135 0.0852 -0.8869 -0.7802 2.2085 0.5840 1.6642 -0.9650 -0.8981 -0.5793 -0.7304 -0.6264 -0.8066 0.4330 -0.5250 -0.9227 -1.0131 0.0092 -0.8184 1.0762 -0.7225 0.8815 -0.5755 -0.8362 -0.8278 -0.8309 0.5571 -0.7661 0.5468 -0.2622 -1.0067 -0.7284 0.7580 0.4220 -1.1032 -0.8638 -0.8103 0.3357 1.6540 0.4167 -0.6495 -0.4898 0.7315 -1.0072 0.7842 0.1779 1.4716 -0.1580 -0.8329 2.3135 -0.2838 0.6623 -0.7914 -0.9253 1.9163 -0.9756 -0.8610 -0.6009 -0.8918 1.6016 -0.7310 -0.0671 0.0106 -0.0682 -0.1681 0.5748 0.6195 1.2944 -0.9927 0.3559 0.5763 -0.9553 -0.8986 1.9898 1.4125 1.6675 0.5332 1.4706 0.7825 0.6501 2.9492 0.8433 -0.8475 -0.9933 1.1949 -0.6002 -0.7299 -0.7962 0.0680 -0.6231 -0.3048 -0.7985 0.0970 1.3261 -0.8132 0.4153 0.6126 -0.2395 -0.7974 -0.9470 -0.9707 2.9896 0.0311 0.5526 -0.7665 -0.7786 -0.8972 1.7012 0.0538 -0.7667 -0.0890 -0.9885 -0.7228 2.3651 -0.8561 1.0854 1.2657 -0.8021 -0.9330 0.4612 0.1180 -0.8097 -0.0457 -0.9021 0.8671 -0.9131 2.6842 -0.8951 -0.9341 -1.0382 -0.9616 0.8645 -0.6259 1.6079 -0.8940 1.4165 1.8497 -0.5945 -0.8764 -0.4941 -0.6846 -0.9057 -0.8099 -0.8762 -0.7503 0.9006 -0.8458 -0.9008 0.6687 -0.7409 1.5674 -0.6988 0.8751 -1.2075 -0.8944 1.2281 1.1190 -0.7067 -0.1675 -0.5283 1.3210 -0.6681 0.5165 -0.8519 0.2826 -1.0038 -0.9661 0.6399 0.5630 -0.8531 -1.0071 -0.8707 1.0616 -0.6899 -0.9900 -0.6367 -0.6905 0.3621 -0.8067 0.1345 1.6346 1.1476 -0.8996 0.5371 -0.7180 1.0039 0.5434 -0.7961 -0.6978 -0.0821 1.0474 -0.7143 -0.7808 -0.7349 1.5788 -0.9304 -0.8003 -1.0593 -0.8763 -0.6363 0.8048 -0.7077 0.1761 0.3172 -0.9019 -0.6228 -0.9033 -0.3218 -0.8383 0.7833 -0.8228 1.5357 -0.0745 1.5179 -1.0049 0.0571 0.4693 1.1139 0.0430 1.4010 0.1966 1.2893 1.1373 1.5935 -1.1294 1.0162 -0.9986 -1.0870 -0.9464 0.6979 -0.9063 1.1850 0.9256 0.1466 1.5797 0.9782 2.0006 0.6710 1.4845 -0.3422 -0.9097 1.4763 0.3472 0.7419 1.9377 0.1388 -0.9067 -1.0328 0.0572 -0.0112 -0.9333 1.2168 -1.0031 0.8683 -0.9420 1.6634 -0.9307 0.5206 -0.8469 -1.0093 -0.1577 0.8961 0.9206 1.3163 -0.9547 -0.1399 1.6966 0.3276 -0.8318 0.4836 0.0985 -0.0794 0.9771 -0.3432 -0.9567 -0.9284 1.5498 0.1921 -1.0071 0.8033 0.8826 -1.0098 -1.0412 -1.0177 -1.0946 -0.8489 -0.9701 -0.8923 0.6979 1.7268 -0.4103 1.3210 2.2537 1.8146 1.6779 -1.1506 -0.9538 0.5754 1.5106 0.9594 -0.8605 1.3872 0.5050 2.6851 0.6959 0.8371 -0.2555 0.1587 -0.9919 -0.0800 -0.8395 -1.0093 1.4996 -1.0042 0.5430 -0.2094 -0.8537 -0.8966 0.3937 1.7212 0.5017 0.0287 0.6428 -1.0479 -0.9416 -1.1327 -0.9156 -0.8899 -0.9388 -1.0216 -0.8065 2.0059 -0.2120 0.1853 -0.9194 0.1318 -0.9527 -0.9337 -1.0526 0.1546 2.4273 0.1875 -0.0961 0.5588 -1.0009 0.5974 0.1480 -0.3079 -0.9643 -1.0460 -0.7236 0.1212 -0.9563 0.2467 -0.1523 -1.0963 1.1397 -0.9862 -1.1595 2.7336 -0.2958 0.4164 1.3682 0.2844 0.7948 -1.0381 -1.0530 1.3005 0.4496 -1.0766 -0.7995 -0.9733 0.4492 -0.8663 0.5272 -0.7465 0.1400 -1.0429 -1.0117 2.2929 -0.8977 1.0893 -1.1722 -1.1586 0.2378 -0.2207 -0.1639 -0.9540 -1.1422 1.2571 -0.7303 1.4188 0.5696 -0.9719 -1.0396 0.8627 1.8631 -0.9625 -1.1876 -0.9924 -1.1340 -0.9821 1.1282 0.6273 -1.0966 -0.1307 -0.0700 -0.1761 -0.9038 2.6722 Fibrinopeptide A (2-15) 0.2386 -0.0916 -1.4397 -0.3083 2.5492 -3.1200 0.8563 -3.1938 -1.2289 -2.5741 -2.8143 0.0577 1.8587 -0.1726 1.0055 0.5222 -0.8702 -0.3028 0.2845 -0.3460 0.5233 2.4657 0.6163 0.8517 0.7812 1.2450 -0.0860 -0.0618 0.5639 -0.0459 0.4131 0.7373 1.0621 -0.8487 -0.3394 -3.0322 0.1407 0.5719 0.2639 -0.1154 0.4375 0.0446 2.1680 0.1857 2.8366 -0.2406 1.1526 0.2214 0.2715 0.3300 0.3253 -0.9018 0.1607 -3.1298 0.7911 0.5245 0.6826 0.9864 0.8163 -0.0428 1.1477 -0.7969 1.8164 -2.8824 -0.3512 0.7038 -0.3949 -0.2699 0.3374 0.1173 0.3366 -0.1606 0.1820 -1.3616 0.5793 -0.8789 0.2369 1.0351 0.5347 0.0178 2.1892 -1.1609 0.1065 -0.0909 -2.8800 0.0950 0.3189 1.0916 0.4974 0.4622 0.1068 -0.1801 -0.0619 0.3389 -1.2611 0.3607 0.1614 0.2335 0.8585 -1.1415 -0.6230 -0.0981 0.6192 0.3204 0.2918 -0.5054 -3.0847 0.5016 -0.1336 0.8835 -1.0967 -0.7147 0.6499 0.0191 -0.8270 -0.2451 0.6235 0.2085 -2.4241 0.7656 -0.5851 0.1282 0.5711 0.6072 1.2901 -0.5218 0.3368 -0.2687 0.2765 -0.6014 -1.0914 -0.9594 0.3841 -0.6011 0.3076 -0.7498 1.3222 0.7664 0.0571 1.3916 -0.1330 1.8060 0.7746 1.0677 0.6121 0.9926 0.5052 -0.3272 0.4548 2.2050 1.7752 3.4039 1.6594 0.6412 0.6311 -0.7248 -0.0935 1.2745 -0.7532 1.6295 -0.3111 -0.0075 -0.6941 -0.2985 0.0615 0.0816 0.2532 0.1282 0.1217 -0.2855 0.0566 -0.3546 -0.4608 -0.1152 -1.2247 1.3200 1.0279 0.7848 0.6737 0.2233 0.3839 -0.1115 0.3494 0.4800 -0.1940 -0.5331 -0.8260 0.0708 -0.0068 0.0522 0.0353 -2.7903 0.3348 -0.5126 0.2603 -0.0909 0.5327 -0.2073 0.3987 1.1375 0.3698 0.0751 0.1774 0.5369 -0.2372 0.4986 0.8879 0.7140 -0.0788 0.3049 0.3383 0.8490 0.0849 0.8351 -0.6429 0.5539 -3.3378 -0.4908 -0.7544 -0.2324 0.1639 -0.0914 0.1409 0.0360 0.2518 1.4682 -0.2344 -0.8436 -0.3095 0.8501 -0.0065 -0.2677 0.3296 0.0107 -0.3328 -0.5634 -0.1946 -0.6995 -0.4952 -0.3394 -1.2166 -0.3105 -0.9046 2.2271 -0.4140 -1.2173 -0.7408 -0.0087 -0.2645 -0.1760 0.3658 -0.8063 0.5802 0.3215 1.0746 0.5847 0.5805 0.2572 0.4355 0.8018 -0.4480 0.3198 -1.5903 0.2616 0.0448 -0.1885 -0.2482 -0.6694 0.4296 0.2705 0.3484 -0.4409 0.5876 0.6283 0.6135 0.4193 0.1662 0.7877 -0.0485 -0.4067 -0.1513 0.2031 0.0754 0.0945 1.0689 0.0936 0.4419 2.3950 -0.3989 1.6607 0.2413 -0.6969 0.3184 0.6426 -0.1292 -0.6143 -0.8623 1.3602 0.0220 0.2814 -0.6151 -0.4266 0.3596 -0.3386 0.9550 1.1877 -1.4935 1.2396 0.0973 -0.9788 0.5448 -0.2572 -0.2334 0.7834 0.5416 -0.0078 0.4874 -0.4600 0.4021 -0.1500 0.3376 -3.2275 0.5590 -0.5108 -0.2823 -0.5489 0.8325 -0.5492 -0.0698 -0.0143 0.6116 0.5749 0.7935 0.8836 0.6428 0.3145 -3.1729 0.5055 0.2925 -0.0414 -0.6187 -0.3050 0.0632 0.2003 0.2585 0.0162 0.3969 1.9416 1.3237 0.1490 -0.1329 -2.3586 -0.9288 -1.3937 -1.2326 -0.1895 0.0927 0.6711 -0.0033 -0.0626 -0.0632 0.4143 0.3951 -0.3837 0.0213 -1.4643 -0.0242 0.5702 -1.2513 -0.0261 -0.9304 -0.3732 -0.6651 -1.4121 -0.2397 -2.8376 -0.5170 -3.3173 -2.8729 -0.0174 0.0756 0.0164 0.0896 -0.5153 0.3992 -0.3994 -0.3488 0.0752 -0.6120 0.6459 1.0163 0.0024 -2.5659 0.2017 -0.0835 -0.5484 -0.0853 0.5936 1.0536 1.9350 -0.8824 -3.2226 -2.9952 -0.1305 0.0526 -1.2107 0.0114 0.0391 0.2822 -1.2937 Fibrinopeptide A (3-15) 0.0239 0.2587 -1.3392 -1.2340 2.3482 -1.3742 1.2438 -1.4265 -1.3564 -0.9990 -1.1546 0.2273 1.2498 0.2700 0.9633 0.4580 -1.4815 0.0930 0.4785 -1.1160 0.5675 1.9018 -1.0014 0.8497 0.9475 0.9459 0.2402 0.0878 -1.1657 0.6846 0.8052 0.4112 0.4485 0.0406 -0.3391 -1.3191 -1.2602 0.4614 0.2166 0.6564 0.1573 -0.9085 1.7462 0.9201 2.2185 0.1854 0.9070 0.8240 0.4268 -1.2691 0.3791 0.0605 1.1905 -1.3811 1.1608 0.9863 -0.1675 1.3340 2.1088 -0.0665 0.5500 -0.0175 1.8355 -1.2145 0.4234 1.4300 -0.4405 0.4835 0.8586 0.3064 0.5790 -0.5339 0.2176 -1.4631 1.8344 -1.4508 -1.1790 0.8019 0.4271 0.1024 2.2211 -1.2526 0.0367 0.4588 -1.2087 0.1801 0.2610 1.2567 0.6707 0.5011 -0.0016 -1.2489 0.3329 0.8262 -1.2518 0.6915 -1.2812 -1.2558 0.9277 0.0317 -0.2932 -1.5685 0.4135 0.6730 -1.2075 -1.2211 -1.3508 0.8945 0.7732 0.9288 -0.7661 -1.4633 1.4224 -0.4638 -1.3057 -0.0214 0.4435 -1.2528 -1.3885 0.5269 0.3298 0.3629 0.4484 0.1774 0.9194 -0.0008 0.7495 0.8480 0.7414 -0.1737 -1.4228 -1.1816 0.8556 -1.4339 0.5284 -1.4413 1.0945 1.3117 -1.3338 0.8459 0.2019 0.4883 0.4179 1.4381 1.0820 1.1345 -1.3042 0.2428 0.0980 2.2410 1.7316 2.6094 1.4215 1.4825 0.8023 -0.1059 -1.2951 1.0452 -1.4193 1.7425 -1.2812 0.7246 -1.1764 0.4529 -1.2355 0.1477 0.3752 0.1967 0.5635 -0.0089 0.4034 -1.3256 -0.5091 -0.0428 -1.4483 1.1560 0.8578 0.5075 0.8091 0.5716 0.3957 0.2906 -0.3190 0.6335 -1.1649 -0.1472 -1.3320 0.3480 0.5508 -0.1216 0.4680 -1.1458 -1.2304 -1.1719 0.0547 0.4354 0.6882 -0.1792 0.4170 1.5463 0.0337 -1.1556 -1.1926 1.0512 -1.3704 -1.0621 0.1824 0.4858 0.6631 0.5697 0.5477 1.3321 -1.5325 0.9660 0.8977 0.6167 -1.5203 -0.2687 -1.5621 -1.4535 0.6626 -1.4154 0.2394 0.5568 -0.2018 1.9263 0.1320 -1.5667 0.5622 0.7019 0.5596 -1.1895 0.8744 -1.4207 -0.4472 0.1549 -1.3695 -1.2424 0.4647 -1.2231 -0.3662 0.8290 -1.3520 1.0685 -0.0739 -1.3205 -1.3648 -1.5042 0.2448 0.5212 0.2830 -0.2793 0.9803 -1.3588 0.3699 0.8890 0.9250 -1.3865 1.4966 0.7768 0.5850 -1.2151 -1.4909 0.6480 -1.4205 -1.0647 0.3279 -0.0987 0.7425 0.2391 0.5990 0.3009 0.4298 0.3048 0.6570 -0.1332 0.7035 0.2846 0.3483 -0.3507 -0.3591 0.1845 -1.5183 1.0959 1.4783 1.0138 0.2741 1.9954 -1.4547 0.5843 0.0945 0.3151 0.0846 0.8349 0.3440 0.1905 -1.4139 1.3133 -0.3443 0.7355 -1.3079 0.0272 -0.2303 -1.4551 0.9560 1.2775 -1.4238 1.3180 0.2396 -1.5350 1.0167 0.0911 0.2771 0.4958 1.6369 -1.3609 -1.3021 -1.3556 0.2723 0.2700 -1.3465 -1.4480 1.3030 -0.3097 -1.4116 -1.6142 0.9816 -0.0119 0.3346 0.5636 0.7155 0.9338 0.9079 0.9882 -1.3815 0.6536 -1.4078 0.7472 0.8107 0.3073 -1.3407 0.0087 0.2444 0.5628 -1.4537 -1.2799 0.4337 1.9337 1.6972 -0.0552 0.5132 -0.8696 -1.4172 -1.5938 -1.4243 0.1026 -0.1706 0.6576 0.0796 -0.2813 0.3045 0.4684 1.0319 0.3726 -0.1355 -1.5167 0.0027 0.5641 -1.5322 0.1761 -1.2509 -1.4402 -0.1045 -1.3145 -0.8652 -1.1605 -1.6873 -1.5046 -1.4730 0.5714 -0.3203 -0.0126 0.5617 -1.6447 1.1090 -1.6680 0.4862 0.3722 -0.4345 1.1210 1.8399 -1.3501 -0.9990 0.2200 -1.5069 -1.5144 -0.1309 0.9519 1.2968 1.1763 -0.4245 -1.4515 -1.2895 -0.4900 0.0020 -1.6761 -0.1391 0.2691 0.5638 -1.5833 Fibrinopeptide B (1-11) -1.0577 0.5542 -1.8022 -0.3832 0.5819 -3.5594 0.0749 -3.6084 -1.9938 -3.1930 -3.3574 -0.0878 1.2085 0.3200 0.5062 0.7393 -1.0371 0.6868 0.2393 0.3582 0.6633 0.7592 0.4893 0.6803 0.2680 0.1894 -0.1345 -1.1044 0.4171 -0.3134 0.1381 0.3602 0.3445 0.4831 0.1946 -3.4987 -0.2655 0.3340 -0.1119 0.4334 0.3258 0.9964 0.2434 0.3954 0.7211 -0.2260 1.1065 0.1381 0.2620 0.3363 -0.2450 -1.5514 0.7152 -3.5659 0.9263 -0.2416 0.3692 0.7557 0.7180 0.0872 0.7916 -0.0823 0.7783 -3.3987 0.3346 0.5197 0.6702 0.5059 0.4253 -0.3692 0.3008 0.4668 0.1739 -2.6101 0.9544 -1.8301 0.9031 -0.3582 0.4241 0.3671 0.0393 -0.8856 0.2361 0.6561 -1.6773 0.1979 0.3581 0.7351 0.3053 0.3747 0.2241 -1.1624 0.9654 0.2016 -2.4196 0.0727 0.1005 -3.4423 0.5187 0.3915 -0.0068 -0.2357 0.0117 0.7719 0.6945 -1.1495 -2.6639 0.6393 0.8221 0.0163 -1.0815 -0.7510 0.4551 0.1261 -0.3890 0.2209 0.9480 0.1562 -3.5743 0.7348 -1.1016 -0.4869 0.4477 0.6326 0.2131 -0.6211 0.7719 0.5388 0.6263 0.4146 -0.7534 -1.5987 -0.8779 0.2923 -0.3718 -0.2370 0.7389 0.5817 0.5956 1.1206 -0.2074 0.4832 0.7323 0.6609 0.4005 0.2442 0.5140 -1.1296 0.5461 0.9958 0.8719 1.0175 1.0561 1.0450 0.4983 0.3074 -0.7259 1.0046 -0.7617 0.7381 -0.5946 0.9655 0.4772 0.4416 0.3168 0.6760 0.4073 0.0847 -0.3326 -0.2474 -0.4674 -0.1134 -0.0372 -0.2309 -0.3023 1.4245 0.5609 0.5313 0.4865 0.6659 0.0468 0.2667 0.2375 0.3720 -0.0028 -0.4849 -0.3447 0.1714 0.2483 0.3802 0.3943 -3.3387 0.7624 -0.2768 0.6862 0.0747 0.8058 0.4653 0.5142 0.8742 0.3413 0.5496 -0.4339 0.6347 0.0104 0.9744 0.8361 0.8738 0.2392 -0.1234 0.6308 0.1876 0.4463 1.0071 0.1737 0.2983 -3.7068 -0.7663 -0.7096 -1.9879 0.1154 0.1357 0.7516 -0.2271 0.3538 0.4771 -0.0950 -0.2150 0.1953 0.7782 0.4181 -0.1095 0.7512 -0.3351 -0.0713 -0.0874 0.0157 0.3784 0.5465 0.3702 -0.3081 0.3606 -0.6193 0.1268 0.3579 -0.2834 0.4726 -1.0806 -1.0686 0.0987 0.8173 -0.5977 0.3076 0.3203 0.4162 0.7999 0.7877 0.4254 0.5210 0.3367 0.0816 0.3757 0.5402 0.1773 -0.3892 1.3045 0.7758 0.3619 -0.0172 0.6503 0.4340 0.2583 0.2548 -0.4191 0.4319 -0.1592 0.3479 0.8929 -0.2764 0.6051 -0.0053 -0.7854 -0.0716 0.4217 1.1525 0.5892 0.8516 0.2466 -1.1117 0.4223 -0.3121 0.4337 0.6567 0.3762 -0.0522 0.0762 -2.7919 0.9662 -0.1067 0.6339 -3.4962 -0.4216 0.4280 0.5938 0.5644 0.9323 -0.9022 1.4082 0.5063 -1.0082 0.5264 0.1663 -0.0289 0.6516 0.8547 0.0728 0.1619 0.1979 0.8194 -0.2889 1.4737 -2.2368 0.5935 0.5150 -0.7122 -0.4738 0.7220 -0.9135 0.2609 0.6939 0.1786 0.4287 0.7093 0.9170 0.8374 0.1358 -1.9718 0.5197 0.4156 0.3738 0.0770 0.3580 0.3323 0.1441 -0.4580 0.1227 0.8347 0.8427 0.6860 0.0980 0.6219 -3.0421 -0.9949 -0.1640 -0.7208 0.0549 0.1806 0.8350 -0.4535 -0.1690 0.3397 0.3111 0.8491 0.2981 0.7107 0.1612 0.5319 0.7324 -1.2665 0.1244 -2.1766 0.7355 0.9109 -0.4849 -0.4361 -3.3765 -0.8020 -3.6935 -3.3904 0.6132 0.8359 0.6516 0.6085 -0.6052 0.5400 -0.2738 0.3236 0.5367 0.3184 0.5478 0.8324 0.5255 -3.1856 0.6773 0.1539 0.3214 -0.6717 0.4362 0.9207 0.5542 -0.4109 -3.6259 -1.2859 -0.4178 -0.2067 -0.6085 0.3381 0.6915 0.5922 -0.8963 Fibrinopeptide B (1-12) -2.1098 0.5599 -2.4392 -0.7952 1.4071 -2.4795 0.2986 -2.5361 -2.4527 -2.0572 -2.2459 -0.6340 1.3204 0.1830 0.7255 0.8528 -1.0179 1.0557 0.2562 0.2087 0.3952 0.8003 0.5259 0.7426 0.2985 -0.9036 -0.4368 -1.1025 0.2187 0.0852 0.0777 0.4657 1.0229 0.3306 -0.0895 -2.4100 -0.1455 0.3282 -0.5342 0.3921 0.4677 1.0873 0.4015 0.7434 0.9397 -0.3432 0.9182 -0.0346 0.0550 0.8629 0.0365 -2.2909 0.6884 -2.4870 1.0333 0.0954 0.3972 0.9138 0.8863 0.4209 1.0191 0.3612 1.0446 -2.2947 0.6434 1.0935 0.8381 0.5274 0.5329 -0.3469 0.4980 0.0863 -0.4307 -2.5829 0.8716 -2.5581 0.8855 0.0208 0.2012 0.4879 0.7505 -2.3295 0.2369 0.5246 -2.2940 0.0289 0.1169 0.7344 0.1640 0.1564 0.1329 -1.5308 0.9673 0.1258 -2.3482 0.3713 0.2086 -2.3447 0.3032 -0.3817 0.0755 -0.3721 -0.0615 0.3770 0.6409 -2.3046 -2.4519 0.3866 0.8068 -0.4943 -1.1273 -1.1197 0.7930 0.0250 -0.5899 -0.0743 0.8871 -0.2289 -2.4966 0.4898 -1.4424 -0.7586 0.1255 0.4833 0.0061 -0.6002 0.4017 0.5459 0.6681 0.3528 -1.0684 -2.2654 -2.1147 0.1224 -0.3611 0.0082 0.5788 0.6049 0.5242 1.2146 -0.4662 0.9532 0.5735 0.5129 0.3163 0.8308 0.5448 -0.6425 0.8057 1.3055 1.2778 1.6071 1.2093 1.3116 0.4607 0.6149 -2.3786 0.7187 -1.3893 1.5385 -0.5469 0.8134 0.2372 0.9404 0.2351 0.8580 0.4669 -0.1683 -0.5108 -0.9098 0.2824 0.0138 0.3128 -0.0349 -0.4963 1.2666 0.9017 0.6775 0.5030 0.4276 -0.3004 -0.2315 0.6000 0.2776 -0.4053 -0.6032 -0.2514 0.2994 -0.3107 0.5576 0.1233 -2.2250 0.8110 -0.2846 0.6655 0.2555 0.5399 0.5786 0.5503 1.1109 -0.0643 0.9609 -0.7821 0.8891 -0.0444 0.9112 0.9254 0.8297 0.1102 -0.0535 0.6007 0.5225 0.3496 1.0730 0.7607 0.1123 -2.6491 -0.8331 -1.2730 -2.5646 -0.3803 -0.0609 0.7777 -1.0482 -0.0149 0.7382 -0.2899 -0.2277 0.0896 0.9334 0.1575 -0.4573 1.1461 -0.8262 -0.1008 -0.9303 -0.6369 0.6222 0.5556 0.8326 -0.5782 0.2495 -0.8827 1.0528 0.7478 -0.4326 0.6536 -2.6201 -1.1334 0.0969 0.7113 -1.1094 0.0714 0.4270 0.3119 0.9640 0.9527 0.5146 0.8898 0.4191 -0.4711 0.5324 0.2494 -0.3552 -0.4072 1.6353 0.8660 0.2813 -0.2001 0.5199 0.4011 0.1752 0.1406 -0.2312 0.7810 -0.0696 0.4600 1.0729 -0.5375 0.7244 0.0906 -1.0058 0.3257 0.7752 1.3075 0.6402 1.2715 0.4520 -1.4625 0.5142 -0.7240 0.1428 0.6263 0.6843 0.1952 0.1644 -2.5223 1.1090 -0.0776 0.4044 -2.4066 -0.0308 0.0374 0.6994 0.6582 0.8936 -0.9781 1.5219 0.2275 -2.0038 0.3026 0.1076 0.0372 0.6687 0.8546 -0.2094 0.3075 0.5207 0.9319 -0.6300 1.5330 -2.5627 0.7969 1.0683 -1.3144 -0.6553 0.7504 -1.2087 0.3292 0.6073 0.1463 0.3025 0.8046 0.5145 0.5979 0.2875 -2.5212 0.3636 0.2068 0.5813 -0.1332 0.3904 0.1638 0.2490 -0.4642 -0.5368 0.5987 0.9858 1.2477 0.3975 0.9204 -1.8850 -0.9430 0.0655 -0.5801 0.2863 0.0934 1.0047 -0.7622 -0.0299 0.6053 0.0899 1.0273 0.2859 0.8307 -0.0672 0.6908 0.7112 -2.6587 0.0712 -2.3299 1.5564 0.6154 -1.5568 -0.3425 -2.2669 -1.2180 -2.6336 -2.5946 0.8733 1.1716 0.6660 0.6602 -0.6990 0.6445 -0.2360 0.3815 0.4206 0.8364 0.5450 0.7697 0.0189 -2.0492 0.8128 0.6250 0.3309 -0.6926 0.4668 1.0770 0.8481 -0.9288 -2.5568 -1.6360 -0.2528 -0.4148 -0.9581 0.0750 0.6919 0.7354 -1.0565 Fibrinopeptide B (1-13) -1.5119 0.7417 -1.6879 -0.1579 1.2920 -1.7092 0.4854 -1.7410 -1.6986 -1.4811 -1.5752 -0.0542 1.5143 0.6818 0.2649 0.9462 -1.7746 0.2730 -0.0287 0.0886 0.3287 1.0001 0.0526 0.4324 0.9344 0.8113 -0.1381 -1.6140 -0.1482 -0.8753 0.4603 -0.1672 1.4822 0.8976 0.4110 -1.6760 -1.6401 -0.9745 0.0634 -0.1494 -0.2943 0.9690 0.7058 0.0041 1.4252 0.6805 0.2837 -0.6988 0.3987 -0.1689 -1.6566 -1.3192 0.9505 -1.7134 0.9742 -0.0166 0.8924 1.3585 1.0792 -1.7196 0.8589 -0.8806 1.0721 -1.6123 0.4957 0.7393 0.5630 0.4359 0.2258 -1.0863 0.2899 0.5752 0.0440 -1.7631 1.8356 -1.7560 0.4863 0.6657 0.5661 -0.2523 1.2874 -1.6357 0.7304 -0.1100 -1.6085 -0.4268 -0.0947 0.6338 0.1011 0.1218 -0.0169 -1.6334 1.4791 0.5341 -1.6345 -1.6256 -0.5983 -1.6373 1.1163 0.3294 -0.4987 -1.8278 0.4326 0.8226 1.0570 -1.6162 -1.6950 1.0841 0.4430 -0.5559 -1.7742 -0.2535 1.2976 -0.6014 -1.6676 0.3857 1.0081 0.4497 -1.7178 0.5572 -1.4463 -0.2893 0.4048 0.7413 0.6639 -1.7058 0.9125 0.6421 0.6320 0.3644 -1.7388 -1.5920 -1.5155 0.6352 -0.3714 -0.5164 0.7047 1.2585 0.5012 0.6313 -1.5502 0.4729 0.8088 0.6431 -1.5953 -0.0147 1.3657 -1.7023 0.2103 1.4306 0.3034 1.5750 1.1894 1.1214 0.0143 1.0422 -1.6616 0.3978 0.3236 1.1628 -1.6531 0.4527 0.5693 0.6925 -1.6248 0.2848 -0.2139 0.0143 0.0764 0.1440 -0.3838 -0.5070 -1.1173 -1.5558 -1.7541 1.8149 -1.5627 -0.2467 0.0908 1.2538 -1.6433 -0.1560 -1.6997 0.9778 0.5036 -1.7972 -1.6837 -0.4359 0.1904 0.0091 -0.3741 -1.5703 0.0428 0.5381 1.2416 -0.2376 1.0351 0.5279 1.1325 1.5122 0.0689 0.6724 -0.9594 1.3633 -0.5428 0.9785 1.2036 0.9851 -0.1770 0.1185 -0.2373 1.0641 -0.0203 1.4427 1.4713 0.4640 -1.7978 -1.7978 -0.5993 -1.7575 0.3667 0.1692 0.2923 -0.9960 0.5654 0.6765 -1.7607 -0.4042 0.5656 0.8160 -0.2081 0.8321 0.8032 -0.1654 0.0938 0.1872 -0.4502 -0.0432 0.7443 0.6723 -0.6636 0.8554 -1.6960 0.8459 0.4565 -0.5349 0.8016 -1.7884 -1.7747 -0.6946 0.3112 -0.1937 0.6657 -0.5309 -0.1257 0.8506 1.2037 0.2098 1.3933 0.6570 -0.1134 -0.1915 0.1451 0.1478 0.0845 1.2579 0.7152 0.4432 -0.2765 0.2730 0.6300 0.8415 0.5247 0.9004 -0.3981 -0.3426 0.5595 0.6268 -0.0923 0.3502 0.7178 0.0076 0.1254 1.1212 1.4747 1.3181 1.0911 1.1747 -0.3799 0.5280 0.6723 0.4664 1.5073 -0.5209 0.6355 0.0571 -1.7334 1.3208 0.4488 0.2069 -1.6689 0.6288 0.1561 0.6647 1.3025 1.1378 -1.7394 1.7613 0.6621 -0.6819 0.8285 0.5167 0.2494 -0.2162 1.2802 -0.9291 0.5824 -0.1122 0.7403 -1.3641 1.3255 -1.7540 0.9372 1.1449 -1.7325 -0.3566 0.7623 -1.0196 -0.3966 0.8670 0.8508 0.5654 0.3359 0.2495 1.2309 0.1410 -1.7295 0.7741 0.3736 -0.3682 0.4643 -0.2644 0.5262 -0.2996 -0.5029 -0.0692 0.8318 1.1671 1.4906 -0.7946 1.6946 -1.4034 -1.7354 0.2372 -1.7397 0.3694 -0.1082 -0.1753 -0.5428 -1.7997 0.0319 0.6875 0.9148 -0.0718 0.4996 0.1071 1.1338 0.1436 -1.8052 -1.0450 -1.6346 -0.3397 0.6051 -0.4187 -0.9120 -1.5783 -1.8992 -1.7882 -1.7691 -0.0176 -0.2412 0.6419 0.3708 -0.8362 1.0575 -0.1065 0.4914 0.5338 1.0888 0.6080 1.4883 0.6331 -1.4814 1.6921 0.1196 0.6285 -0.2792 0.4249 0.6268 1.2886 -1.8506 -1.7566 -1.6578 -0.3027 -0.5893 -1.8928 0.3642 1.3902 -0.0594 -1.8357 Fibrinopeptide B (1-9) 0.4163 -2.2541 0.1372 0.9731 -3.4200 -2.0280 -1.2552 -3.2484 1.1608 -2.2374 -1.6728 0.3851 -1.5521 1.2144 -1.7083 -1.2197 -0.0870 0.6528 0.0537 0.2026 -0.6115 -1.2297 0.3055 -0.0927 0.0153 0.3812 0.2078 1.7059 0.6389 0.4307 -0.7729 -0.3598 -0.7190 -2.0619 0.4848 -2.2257 -0.1813 0.2428 0.6253 0.4087 0.3784 -0.2467 0.1592 0.0895 -0.9139 0.9445 0.2209 1.3336 -0.0533 -0.9887 0.8762 0.8713 0.0929 -1.8781 -0.5430 1.3080 -0.1133 -0.8979 0.7951 0.2837 -0.2342 -1.2184 -2.5140 -1.8008 0.3277 -0.1872 1.1223 -0.3822 -0.0322 0.7115 0.4220 -0.7438 0.3661 -0.1666 -0.5047 0.4168 -0.7005 0.7993 0.7750 1.1234 -0.7238 0.4570 0.3707 0.5024 1.0236 -0.3815 0.2359 2.1596 1.2733 0.2589 -0.5416 -0.5807 -2.3036 0.1713 -0.9539 0.3257 0.7186 0.0507 0.4767 0.0429 -0.3162 0.1397 0.5112 0.0629 -0.2823 -0.3784 -0.2405 -4.3091 -0.6515 1.9108 0.1045 0.4574 -0.1409 0.3360 0.8709 0.2429 -0.4812 0.1700 -0.1991 -0.4295 0.3479 0.8051 0.0511 0.0197 1.4972 0.4074 -0.3632 0.2935 -0.4043 -0.7333 -1.0613 1.1870 1.2611 0.5562 0.4536 -0.8835 -0.0151 0.5581 -0.5574 0.4606 0.3884 -0.1235 0.9336 1.4678 0.4460 -0.6032 0.3494 -0.3933 -0.2580 -0.8413 -1.1720 -0.0126 -2.8609 -0.1382 0.9982 1.0170 0.3941 0.5371 0.6112 -0.3861 0.6369 -1.1164 0.1546 -0.8024 -0.0076 -0.5574 -0.8922 0.8222 0.3537 1.1783 1.0137 -0.8064 -0.6564 0.4392 -0.2101 -1.5124 0.3988 0.3170 0.3122 -0.1998 0.1927 0.6413 0.0690 0.3694 0.3411 -0.5132 0.1637 -0.2819 0.0519 0.2021 0.5290 -0.8302 -0.3736 0.9424 0.2166 0.3627 0.1097 -0.9194 0.4817 0.0589 0.5709 0.7054 0.2019 -0.7932 0.3579 0.2454 -0.0845 0.0118 0.6190 0.7962 1.0363 0.5881 -0.4475 -2.6362 0.2316 0.7497 0.0113 0.9144 -0.2460 0.4875 0.6245 0.3785 -0.8639 1.7150 0.1019 -0.3741 0.5874 -0.3170 -0.5652 0.0213 1.3587 0.7839 -0.6578 1.2027 1.2569 -0.1813 0.9490 0.0472 0.3026 -0.0428 0.7958 0.7665 0.0908 -3.1684 0.1288 -0.0565 -0.1116 0.4864 0.2464 0.9577 -0.0837 -0.5354 -0.7357 0.0142 -0.6208 0.6756 0.6234 0.0977 -0.0535 -0.7803 1.0767 0.2596 -0.0514 1.2829 0.8059 -1.6418 -0.9478 1.4766 0.7135 0.0777 1.0708 1.4701 0.8398 1.4025 0.6733 0.8829 -0.3139 -0.9282 0.4196 0.2500 0.2304 0.8457 1.0915 -0.2665 -0.6597 0.4047 0.2560 -1.8248 0.6109 -0.0904 1.1298 0.1768 -0.3371 1.1129 1.0923 -0.4202 0.3326 -3.4947 0.7135 0.0617 0.6054 0.8355 0.9832 -0.4799 -0.6669 0.5116 0.4223 -1.4878 0.3449 1.1803 1.1986 1.0654 0.2434 0.4052 0.2704 0.6200 0.7411 -0.2570 0.9344 0.8023 -0.3750 -0.6263 -0.7828 -0.4200 0.7073 0.5708 1.0450 0.3698 0.6982 1.0527 0.7245 -0.6323 0.5398 1.4559 -0.5346 1.2359 0.3310 0.2276 0.5349 -0.1060 0.4771 -0.3978 0.1253 0.1647 0.4629 0.5266 -0.1966 -2.9538 -2.5405 0.4177 -2.6767 -4.1814 -0.0110 0.8321 1.4040 -0.1712 0.3042 0.6145 0.4597 -0.0737 -0.0177 0.7766 -0.7560 -0.5336 0.0312 -0.2428 -0.8020 -0.3186 -0.5618 0.6307 -0.2016 -0.8620 0.1392 1.0890 0.4653 -4.8446 0.5112 -1.3516 -1.5232 0.2031 -0.9164 -0.1687 -0.4853 0.4181 -0.6496 0.4338 0.1411 1.1085 -0.2650 -0.3395 -0.1150 0.7856 -4.7440 0.6739 -0.3040 -0.1370 1.0959 0.6097 -0.1105 -3.4002 0.2241 0.3244 -0.0305 1.0819 0.4122 0.6067 0.1865 0.7529 0.0106 0.0476 formiminoglutamate 0.1254 -0.8448 0.0436 0.0451 0.0412 0.4407 1.6322 0.6874 0.4579 0.5178 0.5739 0.0411 0.3245 1.7069 0.3819 -0.1501 0.0578 0.1197 0.2158 -0.5305 -0.5440 -1.0729 -0.7603 -0.4159 0.0650 0.7937 -0.3317 0.7484 -0.8043 1.7117 -3.2235 -0.8015 1.5247 -1.0981 -0.1672 0.0074 -0.4254 1.2789 -0.6919 -0.6700 -0.0061 -0.3073 0.2013 -0.5970 -0.7252 0.2084 -0.3795 -0.4005 -1.3848 -0.0350 0.2623 -0.2994 0.2882 0.9440 -1.2324 -0.4699 0.0070 -1.1426 0.8774 -1.0217 -1.0888 0.5961 -0.6779 0.5400 0.3122 0.5615 -0.6676 -1.0596 -0.6512 0.4676 -0.2962 -3.1148 -0.4235 1.0673 0.2333 0.1081 -1.1319 1.3674 -0.0574 0.7243 -0.0192 0.4830 1.8779 -1.0524 0.4282 0.0471 0.4329 2.8082 -0.6001 -0.3304 -0.9144 -1.4079 -0.9519 -0.3217 0.6777 0.5857 -0.2755 0.0444 -0.2539 -1.3387 0.3164 -0.0130 -0.7943 0.2531 0.6307 0.0787 0.4789 1.8347 -1.7086 -2.7722 0.2465 0.1603 -1.6263 1.1107 1.1659 -0.0001 0.0923 -0.1782 -0.9966 -0.4375 1.4988 0.9522 0.1356 0.6456 0.8683 -0.3146 -1.6688 -0.5802 -1.5297 -0.4485 0.0418 -0.0394 1.3726 -0.3162 0.9479 3.0207 -1.0335 -0.1873 -0.1806 -1.1100 0.3192 0.1734 0.6845 2.6313 -1.0908 -0.9174 -0.6046 1.1690 -1.4813 -0.6043 -0.2383 -0.5506 -0.1472 0.2774 -0.8912 -2.6806 -0.1694 0.7524 -1.4073 -1.6961 -0.3218 0.6750 1.2275 -1.5411 -0.8725 -0.7286 -0.8643 0.2501 0.3742 -0.0710 0.2683 -0.9827 -1.2804 -0.8305 -0.3287 -0.8510 -1.9987 -0.1504 -0.1934 -1.0201 0.4653 0.7163 -1.7060 0.4505 -0.3337 1.8441 -0.0032 -0.1162 -0.6996 1.0830 0.4983 0.0377 -0.3369 -0.6886 0.3146 -0.2557 -0.6153 -0.5979 -0.6938 -0.4467 0.1901 -0.2403 -1.2493 0.0160 -0.1691 -0.0061 0.4180 -1.3833 -0.4254 -0.6046 0.8788 0.2266 -1.0482 0.8443 1.4463 0.6098 1.7982 1.0662 -1.8793 0.0322 -1.1924 0.4472 -0.0448 2.1225 0.3838 0.7065 -0.2253 1.0315 0.6031 0.3491 0.0337 -0.3675 -0.7467 -0.4458 2.0807 0.5196 -1.4859 0.7221 0.5956 0.7926 -0.2368 -0.3442 -0.3176 1.3419 -0.2875 -1.6716 1.0658 0.7927 0.3415 -0.0535 -1.6421 -1.0841 -0.9713 2.2370 -0.3019 0.2553 -0.5532 0.3310 -0.4634 -0.6238 -0.2113 -0.0063 -0.4499 1.7952 -0.7370 -2.5039 -0.2471 1.0502 -0.6796 -1.0699 0.2816 0.3354 0.2533 1.4822 -0.4022 0.2289 0.6277 -1.5594 0.8185 -0.8087 1.6781 0.0813 -0.1247 0.1393 1.7708 -0.2947 -1.4886 -0.7616 1.8636 -0.4306 0.4761 -0.4260 0.1959 1.6906 -0.7679 0.2038 1.0613 1.7296 2.2616 -3.2232 -0.1000 -0.1626 -0.5763 -0.0668 -0.4818 1.0459 0.3615 -1.2826 -0.8507 1.2135 -0.6228 -0.4397 1.0110 0.1307 0.4149 -1.1069 -0.4917 0.0668 2.1121 1.0265 0.3348 0.4678 -0.2917 0.2642 -1.4478 0.3155 -0.1970 -0.8382 -0.6289 0.0021 -2.8469 -0.6555 0.5201 1.3626 -0.5239 0.4325 1.1723 0.3704 -0.0241 -0.6656 0.4099 0.7004 0.3908 -0.4470 -0.1479 1.6075 -2.7735 -0.4756 1.1165 -0.5336 -1.0083 1.4551 -0.0965 2.2081 2.2282 -0.0532 -2.2356 0.0813 0.4284 0.2701 0.0404 0.1422 -3.0333 0.5034 0.8461 2.0233 -0.4933 1.6427 -1.1526 -0.0004 -0.8602 1.8926 -1.1631 0.6847 0.8219 0.8048 0.3677 0.6343 0.3347 0.9713 0.6942 1.6016 -0.9471 1.3080 -0.3870 1.1666 0.4949 0.2720 0.5299 0.9166 -1.1904 0.0917 0.9353 1.7868 0.0087 0.7801 1.1428 0.6580 -1.5712 -0.4586 -0.0862 -1.0067 0.3268 1.2442 -0.4520 1.7494 -0.1576 0.6299 -0.7815 0.5514 fructose 0.5300 -0.4265 0.8222 -1.6719 1.0675 -1.7753 0.4706 -2.5487 -0.1647 0.6083 -2.7356 -0.6184 0.7613 0.4524 1.0633 0.0399 -2.2106 -0.7652 -0.5160 -0.6367 0.3475 0.5775 -0.0140 -0.5082 0.4663 -0.0223 -0.4276 0.0358 -1.1643 -0.2710 -0.2955 -0.4310 1.1132 0.2403 -0.6076 -2.4251 -1.0767 0.2337 0.2187 -1.3488 -0.2453 2.0623 0.6279 -0.9462 -0.1105 0.9128 0.2864 -0.2798 -0.1316 0.5918 -0.3705 -0.3143 0.4435 -1.8623 0.0664 -0.4436 0.2228 0.5388 0.9517 -1.8412 -0.1118 -0.9567 0.9102 -1.1992 0.4834 0.2509 -0.5364 0.0763 -0.1827 -0.5988 -0.6938 0.2115 0.5368 0.7267 1.9618 2.7268 0.3189 -0.6978 0.4617 0.9096 0.3682 -1.6155 -0.8106 -0.7235 -2.6105 -0.6120 -0.2297 -0.3604 0.8367 0.2464 -1.1508 -0.6406 0.7973 1.2147 -1.4606 0.2559 1.2935 -0.4644 0.0254 0.4228 -0.1624 -0.6408 -0.1430 1.4850 0.4970 -0.5948 -2.4463 1.7821 -0.4777 0.6027 -0.7983 -0.2660 0.9921 -0.0944 -0.8060 1.2974 1.4461 -0.2177 0.0364 0.2019 -0.5298 -0.9804 0.3908 -0.8381 1.3046 0.8066 1.6267 0.4122 0.0184 0.2439 -0.8254 -0.6668 -0.2987 1.1587 0.9030 -1.1379 1.4257 0.5369 0.8703 0.4447 -1.9593 0.7263 0.6385 -1.4306 0.5075 -0.6453 0.4864 0.0318 0.5379 0.6733 1.4360 -0.6919 0.2522 1.6641 0.2775 -0.3250 0.5060 -0.0990 -0.6348 -0.6653 0.6746 0.2457 0.6964 -0.0814 0.6059 1.9557 -1.2917 0.9073 -0.9204 -0.3295 0.1799 0.5264 0.6189 -1.1046 -0.7833 0.7352 0.0658 0.1815 0.0489 0.4217 2.0317 0.3877 0.9451 -0.1021 0.2528 -1.3979 -0.4734 0.4538 -0.4040 0.5810 -0.1945 -3.0215 0.1126 -0.7116 -0.0683 -0.6869 -0.3436 0.3510 -0.1283 0.3511 0.7998 -0.1309 -1.7271 2.6950 -0.4018 -0.6795 0.3618 1.2069 0.5833 0.7205 -1.0819 1.9706 0.5369 2.4460 0.3896 -0.2569 -2.7834 -1.4744 -0.8921 -0.3308 -0.5657 -0.9319 2.2766 -0.5339 -0.1738 -0.0733 -2.1602 -1.1311 0.8564 0.9051 -0.9778 0.1768 0.4140 0.6358 0.4978 2.0037 -0.4345 -0.7496 0.1863 0.1862 -0.9556 1.7045 -2.7692 0.3669 0.8125 -1.4506 0.8054 -0.0355 0.0461 0.0852 -0.0689 0.4098 1.1801 -0.5742 1.2368 0.8047 0.0423 1.5263 0.1477 -0.0393 -0.4562 0.5277 0.7719 -0.9275 0.1280 1.1488 0.4926 -0.4558 -0.6477 -0.5971 -0.6632 1.1747 0.7065 1.5954 -0.3530 0.4681 -0.3589 0.8753 -0.2663 0.0118 -0.3778 -0.9633 0.7425 1.7196 -0.0040 1.1276 -0.2420 0.9392 -0.3323 0.1380 1.0311 0.4099 -1.1021 0.5170 1.5747 1.4354 -0.6582 1.4643 -0.1971 -0.6253 0.1559 0.2123 -0.0013 0.0360 -0.0493 1.7026 -1.5040 1.2057 -1.0412 -0.0193 -0.9851 0.9567 -0.7449 0.1225 -1.1429 -0.1266 0.9146 0.6110 0.8365 0.5333 1.4143 -0.7624 0.2638 1.5239 -0.2353 -1.8716 1.1248 0.2762 2.1570 0.9677 0.3349 1.3396 -1.6789 -1.4879 0.5249 0.2521 -2.5433 -0.1342 -0.9827 -0.1192 -0.2416 -2.0630 -0.4696 -0.0519 0.5049 -0.2138 0.7324 0.7345 0.5767 1.4636 0.8244 0.8263 -1.0965 -0.8373 -0.7573 -0.1417 -1.0728 -0.7110 -0.4237 -0.5406 -0.0409 0.1076 -0.0832 -0.3153 -0.1892 1.3440 0.0805 0.9615 -0.6125 -1.6597 -2.0895 1.2548 -1.0567 -1.6770 1.3642 -2.3409 -0.7119 -2.0770 0.2197 -0.5310 -0.5251 1.2091 0.5835 -2.3508 0.3939 -1.2024 -0.3811 -0.5369 -0.2801 -0.9510 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1.1815 1.5599 0.7021 -0.7186 1.2711 -0.0608 1.5570 0.5283 1.3217 0.8171 0.3718 -0.0830 -0.9915 -2.5156 0.3027 0.0823 1.0280 0.9665 0.0139 -0.2900 0.6374 2.0750 -0.0665 -0.2671 1.0542 1.2247 -0.1949 -2.4367 -0.4419 -0.1524 0.6244 2.0066 -2.4131 1.1023 -0.2014 0.7118 0.3540 0.0972 -1.6761 0.1602 0.4545 -0.6839 1.2405 -0.1500 -0.8175 0.0678 -0.2074 0.7503 0.6126 1.4642 1.0083 1.1433 0.1115 1.0876 1.7915 0.6870 0.5538 -2.1509 1.0725 -0.3106 0.1810 0.3229 0.4539 -0.0166 -2.4462 -2.3541 0.6193 0.3143 -1.3599 -0.2418 0.2113 1.4850 0.0936 1.6896 0.8954 0.6646 0.5654 0.3856 0.8929 0.7957 -2.3644 -0.3495 0.9047 1.3377 0.2581 -2.1577 0.5435 1.2474 -0.2330 -1.1517 1.2991 0.3833 -0.0564 0.1953 0.2985 1.4991 1.2581 -0.2614 -0.9682 -2.4890 -0.0495 -0.4184 0.0833 0.0915 0.4640 -0.0036 -0.6404 0.0486 -0.5405 0.1838 0.3762 0.1330 0.0164 0.4996 1.8015 -0.0844 -0.6123 0.2281 0.0498 0.2733 -0.6846 0.1474 -0.4442 0.2331 0.5247 1.0908 -0.6067 0.6197 -2.2029 -1.8759 0.3746 0.0345 0.9721 0.5223 -1.1923 0.6577 0.4892 0.9315 -0.2247 0.2299 0.2775 0.0399 -2.4426 -0.5182 -0.4727 0.1792 -0.8930 0.6381 -0.2053 -0.5282 -0.6184 -2.3728 1.0551 2.0565 0.2920 1.4736 -0.0436 0.7109 0.1620 1.6920 1.3070 0.8132 0.7991 0.2728 1.9500 0.9164 0.3826 1.4262 -0.2815 -2.3295 -0.3871 1.8356 0.5018 0.8788 0.7254 0.9292 0.3114 1.1978 -0.9063 0.5100 0.2351 0.3949 0.4892 -0.1147 -2.4084 0.6218 0.0701 0.4477 gamma-carboxyglutamate 0.1530 -0.2557 0.0344 -0.6946 1.6065 0.5845 -0.4408 1.3077 0.4256 2.2851 1.5839 0.3819 0.4967 0.5470 -0.5012 0.5644 0.5442 1.5560 -1.5040 -0.8869 0.0052 -0.9412 -1.0824 -0.2406 0.4189 0.2691 -0.0799 0.9855 1.1059 -0.0165 -1.1278 -0.2982 1.5391 -0.7505 -0.8612 1.9971 -0.4800 -1.4485 0.6818 -0.6433 0.2584 1.2870 -1.2807 0.5031 0.1342 -0.9561 0.5613 -0.4291 0.4058 -0.5281 0.1761 -1.5023 -0.2504 -0.3310 0.8542 0.0100 1.1999 0.2170 -0.2546 0.0793 0.3035 0.4207 -1.3333 0.1433 -0.9867 -0.3362 -0.2694 -0.6766 0.7311 0.9934 1.4429 0.9451 0.6183 -0.1020 1.0661 0.1770 -0.8565 -0.1855 -0.0986 -0.1466 0.1202 -0.1843 -0.8125 -3.2561 1.3030 -0.2381 0.3950 1.6521 0.2973 0.3106 0.2591 0.0765 0.6109 0.4545 0.8692 1.1103 -0.3712 -1.3092 -2.1609 -0.0114 -0.6516 -2.0505 -0.8555 0.8111 -0.2608 0.6350 2.3850 -1.0777 -2.3969 0.5093 -0.0371 -1.7540 -0.2698 0.3550 1.4560 0.3992 1.3275 -0.6546 1.4308 -1.8504 0.8479 0.7026 0.1793 0.2694 -0.6226 -1.4733 -1.9668 -0.3470 -0.2379 -0.3343 -0.2778 1.7799 -0.6854 -0.9437 -0.4507 -0.4958 -1.9724 0.7276 0.8079 0.4234 -0.2541 1.1807 -0.3059 0.8914 1.4843 -0.6125 0.7118 0.6325 -0.1397 0.4543 -0.6055 -0.3062 0.3614 -0.4970 0.4848 1.0679 0.6079 -0.7175 -0.6728 1.8991 1.1244 -1.7863 1.1865 -0.8502 1.3793 -0.0791 -0.6734 0.8419 -1.6245 0.4391 0.8471 -0.4295 -0.9392 0.7243 -0.9253 0.1528 0.4893 0.9204 0.0398 0.9635 1.4311 -1.3747 -1.1403 1.4078 -0.6152 0.1871 -1.8227 -0.8027 -0.9525 -0.4958 -0.5182 1.6510 0.9795 0.6042 0.0792 -0.0110 -0.1916 -2.1715 1.0607 0.7146 0.0334 0.6614 -0.1992 -0.8715 -0.0858 0.4098 -0.3943 0.5742 0.0257 0.6898 1.2542 0.9242 -0.5988 -0.7336 -0.1513 0.1392 2.2589 0.3472 -3.0131 -0.1786 -0.0836 -0.1940 0.4566 -0.1573 -0.2148 0.4018 1.2563 -1.3743 0.9833 -0.8262 0.4365 0.0821 -1.1130 1.3194 -0.9793 0.8084 -1.9596 0.7068 0.0464 0.9109 -0.3456 -2.0538 1.5961 -0.2823 -0.5524 0.3222 -0.6340 0.6297 -1.6109 0.0626 0.2778 1.1203 0.2045 -0.8182 0.5243 0.4332 -0.3419 0.2156 -0.1415 0.2685 -0.1114 -0.2062 -0.1317 0.0036 0.2015 -0.8861 -0.2986 -0.3971 0.5239 0.1456 0.3136 0.1621 0.9037 0.0183 -0.7214 -1.7336 -1.0014 -2.9010 -1.0207 -0.0294 -0.4135 -0.0868 0.4889 1.0753 -0.6290 -0.9409 -1.0764 0.4481 0.6972 -0.1152 0.3958 0.4535 0.0385 0.5816 -1.0142 -0.9352 0.6774 1.2802 0.6951 -0.2621 -0.4897 -0.1705 1.2406 -2.6576 -0.2740 -0.0307 1.0354 -1.1567 0.1355 -1.8633 0.6152 -1.6355 -1.6446 -0.3687 1.6077 0.0493 -2.8059 -0.5863 0.8743 -0.9723 0.2231 1.1919 -1.8940 -0.4338 -0.2887 -0.4173 0.9498 -0.3506 0.3988 1.2340 0.4560 0.4063 0.2965 -0.8025 0.3754 1.1769 3.2116 0.6875 -0.6764 -1.1259 0.1547 -0.9317 0.1557 -1.3693 -1.8038 0.0950 -0.2442 0.0256 1.0141 -0.1492 -0.1558 3.8366 0.4011 -0.9384 0.9381 -0.1413 -0.2233 -0.4399 -0.3707 0.7507 0.2306 -0.0025 0.2052 0.0606 1.1713 0.1405 -0.6944 0.6673 -0.5108 -0.9044 0.7742 -0.2880 0.6348 -1.5645 0.4404 0.7841 0.7646 -1.1494 -1.9688 -0.3368 1.3319 0.5879 -0.0960 -0.1071 -1.5974 0.7721 -0.6275 0.4743 -0.7181 0.2121 0.6249 0.7651 4.9598 0.6182 -1.0839 -1.0079 -0.1820 -0.6469 -3.4292 0.3281 -0.5258 0.6569 0.2046 0.2547 -0.5952 0.3593 0.7430 0.2554 0.6273 0.7925 gamma-CEHC 1.9001 1.5192 1.0974 -1.2121 2.0050 0.8147 -1.5444 0.7123 0.8789 0.3848 0.5291 -1.9406 1.6198 0.3433 -1.2989 0.1111 -0.3669 -0.4349 -0.8923 -1.9685 -0.0958 1.1186 1.6186 0.2670 0.3840 -0.8032 -1.1045 0.3391 0.4105 -0.0338 -1.6006 -0.4162 0.1763 0.5754 -1.0411 0.4328 0.4343 0.3592 2.1254 0.5373 -0.8948 0.1535 -3.1531 0.5091 0.6860 -0.2530 0.2137 -0.4342 1.4393 0.3018 -0.6025 0.2493 0.1974 -1.1162 -0.3662 -0.7127 0.7003 0.0605 -0.1709 1.3116 0.7924 0.5222 0.0078 -0.1125 1.0102 1.3107 -0.8598 1.4441 1.0582 -0.3460 -2.3963 0.8456 -0.8929 -0.9027 0.6632 1.5995 0.1694 -1.5110 1.9230 1.2419 -0.6643 0.7595 -0.3172 -0.2649 0.1985 -0.9849 0.0945 1.2410 0.9946 0.7225 0.5513 0.2287 -0.2348 0.4635 -0.6618 -2.7393 0.7499 -0.7032 0.1140 -0.9142 -0.6743 -0.2440 -0.4117 0.5896 0.4836 -0.4263 0.2914 -0.8016 0.1215 -0.3972 1.4949 -1.1444 -1.0122 -1.5189 0.4689 0.6616 1.1392 1.9669 1.8416 -1.2555 0.5489 -0.5152 0.1472 1.0066 -1.3178 0.9455 1.2109 -0.2220 0.5525 1.3716 0.0504 -0.8480 0.0139 2.2147 0.6397 0.9611 -1.2841 0.7701 -0.9216 0.1553 -0.7156 0.4333 -1.1434 -0.8933 0.8482 -1.9229 0.7813 -2.5777 0.0896 -0.4524 0.8327 0.2842 0.3399 -1.0967 -0.0840 1.1017 0.0502 -0.4725 0.7267 -1.6388 -0.5680 -1.8986 -0.3897 -0.9183 1.8459 -0.1001 -0.3633 0.2066 -1.0424 -0.4845 1.0766 0.2744 -0.9923 -1.9276 0.6574 0.6959 0.1564 -1.2867 -1.6653 0.1585 0.4332 -2.4772 1.5525 0.7622 2.0639 0.4742 0.0098 0.1305 1.4350 0.3514 0.2913 1.5902 -0.4831 -0.9914 -1.0935 0.3699 1.1330 -1.9208 1.6140 -0.7895 -0.6367 0.5135 1.4900 0.1026 0.8917 1.8606 -0.1815 -0.9449 -0.1776 1.5727 0.5788 -1.0429 0.5936 0.7676 0.8982 -0.4594 -2.4357 0.7722 1.4302 -0.8164 0.2436 1.1472 -0.0112 0.1287 0.3286 1.6173 -0.4944 -1.9417 0.2703 -1.1426 0.9743 0.3372 -0.9942 -0.0519 -0.4464 1.0052 -1.1655 -0.8088 0.1045 0.8242 -0.5734 -1.5082 1.8779 -0.8960 -1.0406 0.6969 0.0499 -0.2193 0.4470 0.7772 1.7894 0.2968 0.4568 0.1062 0.0512 0.1696 -0.0420 -1.3683 -1.5285 -0.0352 -1.5721 1.5137 0.0438 -0.7844 1.1735 0.4779 -0.0871 0.2342 1.1615 -0.3790 -0.9414 0.0639 1.5276 -0.0526 0.5704 -0.5872 0.7641 -1.3019 -1.4679 -1.2751 -0.7655 -1.0388 0.5926 0.7515 -1.2190 0.8473 -0.4873 1.6167 0.5369 0.0145 1.0705 -0.9683 0.3228 -0.0872 0.0543 0.4419 -0.0034 -0.3323 -1.1734 -1.3392 0.4899 -0.1758 -0.5459 -0.0983 -0.0017 0.3162 1.3832 1.2716 -0.4931 0.3937 -0.5543 -0.8866 0.2900 0.0377 -0.2433 -0.4806 -0.3822 -0.5997 -1.2752 -0.7772 1.7299 -1.2678 -0.3813 -1.1108 1.3189 1.1410 1.6793 0.2195 -0.0848 -0.6270 -0.4485 -0.0327 -1.0330 -0.9223 -0.5989 -0.0121 -0.2844 -1.3995 0.1748 1.0665 -1.0672 -0.7743 -2.6584 0.2268 0.6661 -0.0670 1.1511 0.9417 2.1171 0.0692 0.8339 0.9478 0.3891 -0.2505 -0.7021 -0.5040 0.4862 0.5135 0.4966 -0.8038 1.0625 -0.7014 0.9799 0.0217 -0.2205 0.6963 0.3588 -0.5202 -0.8000 -1.0877 1.6087 0.5047 1.0490 -3.3339 -1.0797 -1.4709 -1.0094 1.1382 -0.1085 1.0019 0.3164 -0.6330 1.8001 -1.2621 0.2199 -0.4680 -1.8587 -0.3655 0.5429 -1.4267 0.2221 -2.2757 1.1326 -0.0117 -2.4659 -0.2487 -0.0554 0.9423 0.6438 1.7152 -0.1807 0.0782 -0.7966 -0.1354 -0.0319 -0.3320 -0.0031 -0.2204 -0.1061 -1.0508 gamma-glutamyl-2-aminobutyrate -1.1331 -1.6893 0.3375 -1.3020 0.7438 -1.4370 0.0580 -0.0089 -0.0525 -1.0871 0.3761 0.0279 1.3756 -0.3978 0.5515 0.5818 -1.5359 0.1839 1.0004 -1.1949 0.2827 0.9300 0.8605 -1.3604 1.4025 0.5942 0.9856 -1.2864 -1.2387 0.5398 0.4000 0.8704 1.4809 -1.5871 0.0256 -1.3837 -0.3570 0.4141 0.5095 0.6537 0.8202 0.5911 1.1527 0.6431 0.9986 0.4509 0.2371 0.3213 0.6192 1.1092 -0.6145 -0.1012 0.6748 -0.0986 -1.1184 0.0944 0.8426 0.7437 -1.4126 -1.4535 1.2889 -1.5048 0.7481 -1.2868 -1.3495 0.9225 -0.5696 0.7381 0.1978 0.7746 0.9462 0.5006 -1.4188 -1.5208 0.5446 -1.5064 0.5900 1.0836 -0.1044 1.6514 1.3098 -1.3201 -1.3662 0.7489 0.0010 0.1343 -0.1414 0.4092 0.2725 1.0156 -1.6523 -1.3176 -0.0972 -1.1096 -1.3246 -1.3064 0.0112 -1.3262 0.8430 0.5950 0.9493 -1.6144 0.3552 -1.5657 1.3444 -1.2936 -0.4294 1.5545 -0.2529 -1.2859 -1.5342 -1.5160 0.9511 -1.3718 -1.3727 -1.3663 0.1479 0.7149 -0.3162 1.2320 -0.4221 -1.3251 1.0570 0.2541 1.1121 0.0385 0.7665 -1.4151 -1.4635 -1.5641 0.5163 0.1368 0.6855 0.6723 0.0689 0.8279 1.1031 0.2030 -1.3971 1.2937 -0.0462 -1.4281 1.0572 0.8307 0.1494 0.3035 -1.3682 -1.4232 1.0330 -1.2623 0.7835 1.2599 1.2597 0.3410 0.4741 0.8170 -1.3601 0.6928 -1.4760 0.9280 -1.3471 0.5201 -1.2492 1.4493 -1.3085 1.0003 0.4030 -1.4572 0.5782 -1.3766 -1.5334 0.8371 0.4177 -1.2014 -1.5074 1.1332 0.4625 -0.0226 0.9172 0.8974 0.3382 0.4901 0.2979 -1.4110 0.6804 -0.5676 -1.3967 1.0180 -1.2124 -1.2895 0.7627 0.3583 0.7424 0.0292 0.6027 0.1685 -0.3299 0.7970 0.9463 0.8443 -1.4960 0.0222 0.1023 1.0006 0.0515 1.2144 1.3736 0.2191 -1.3560 0.3810 0.3278 1.3826 0.9862 0.2909 0.8238 -0.2505 -1.5747 -1.5701 -0.2298 0.2366 0.3315 0.5270 0.8582 -1.5996 0.4282 0.7650 -0.0080 1.2322 1.1067 0.7694 -1.4269 0.7095 0.6497 1.2911 1.7357 0.1834 -1.4306 0.2213 0.4567 0.1031 1.2035 -1.5585 0.2486 1.4514 -1.4910 -1.3866 -1.4268 -1.5567 -1.5374 -0.5308 0.8120 -0.1089 0.7235 1.1702 0.7965 1.1761 1.0361 0.8305 0.7635 0.6976 0.0129 0.2194 0.4272 1.0546 1.0119 0.9338 0.8235 -1.5697 -1.3482 0.3009 0.3794 0.5610 -1.5216 0.4688 0.6869 0.3898 0.8023 0.7424 0.5323 0.6704 1.1422 -1.5288 -1.5684 0.6882 1.3658 1.2450 -1.4945 0.3461 0.2530 -1.6105 -1.5653 0.7547 1.4289 0.2230 -0.2022 -0.3506 -1.4735 0.6585 0.9687 0.2459 -1.3757 -0.1173 -1.1913 1.3648 0.4034 1.3100 -1.4832 0.7228 1.1080 0.5311 -1.3589 -0.0889 -1.4504 0.1404 0.9389 -1.4242 0.7809 0.4340 -1.3446 -1.4937 0.6236 -1.5059 0.1030 0.6462 -0.2475 -0.2043 1.2167 -1.4084 -0.3609 0.4903 -1.3269 -1.3321 1.3011 0.3587 1.0522 -1.6311 0.5682 -1.4501 0.4562 -0.1413 0.6240 0.6799 0.5003 0.8538 -1.5146 -0.5075 -1.2874 0.8154 1.2114 -0.0935 1.4237 1.1461 -1.4764 0.0144 -1.4835 -1.6173 0.5210 1.2909 0.6806 0.7117 0.0409 0.8829 0.7866 -1.6951 1.5903 -0.0091 -0.1017 0.1619 -0.2920 -1.5963 -1.3192 1.4220 0.7797 -1.3817 0.5265 1.0476 -1.7311 -1.5606 -1.5302 1.6287 0.6993 -0.2465 0.2178 -0.0628 0.0105 0.2978 -1.7166 -1.4751 1.0888 0.8603 0.6037 0.7185 -1.0850 -1.4996 1.5295 0.2124 0.4978 0.4919 0.2772 0.9158 -1.6555 -1.5066 -1.3576 -1.5464 -0.2647 0.7209 0.2135 0.8950 0.0965 -0.2087 gamma-glutamylalanine -0.4607 -1.2387 -0.6057 -0.7228 0.5597 -3.2378 1.5321 -3.2919 -1.7012 -1.8371 -1.1459 0.0469 0.7819 0.2256 0.7191 0.6067 -3.3489 -0.6068 0.4018 0.8897 0.6830 -0.4599 0.5493 0.1196 0.9268 -0.1456 0.1100 -0.4001 -0.9224 -0.4770 1.1636 1.0236 1.7067 -1.4614 -0.6680 -3.1509 -0.6396 0.2420 -0.9615 0.6228 -0.2142 0.8464 0.8694 -0.1082 1.2394 -0.1608 -0.2208 0.5910 -0.0595 0.7598 -0.7824 -1.7299 1.0167 -1.2510 0.1689 -1.0443 -0.1582 0.6588 0.5588 -1.8046 1.6536 -0.3965 -0.9445 -3.0359 0.3680 0.4563 -0.4323 1.2240 -0.3689 0.0611 -0.3589 0.2053 0.2978 -0.4341 0.7708 -0.5843 0.7395 0.7547 0.5149 1.0927 1.0086 -0.5215 0.3633 0.2081 -0.9460 -0.2739 -0.3237 -1.1143 -0.1404 0.6576 -0.6334 -1.6005 0.2966 0.1126 -3.1147 -2.2428 -0.3014 -0.2186 0.8921 0.5830 -0.2551 0.0156 0.8572 0.6235 1.0237 -1.2402 -1.1094 0.5824 -1.7149 -0.2149 -1.2832 -0.9571 0.6436 -0.0126 0.5503 0.7414 0.7733 1.0773 0.2893 1.2345 -1.9255 -0.0314 1.0424 0.6837 0.1960 -0.0014 1.2175 0.8954 0.5943 0.1152 -0.0432 0.2057 0.6261 0.8370 -0.5752 0.1780 1.3888 1.0411 -0.1744 1.0695 -0.6351 0.5566 1.2416 -0.5488 0.4126 -0.3957 0.4390 -0.4951 0.7210 1.0143 1.2037 0.8005 0.8001 -0.6575 0.0982 0.3062 0.0211 0.2781 -0.1273 1.3342 -1.3235 0.0984 -0.2405 1.0624 -1.6242 0.5441 -0.0750 -0.3008 0.4309 -0.0684 -0.6277 0.2027 1.1606 -2.5972 -0.4241 0.4801 0.8238 0.4988 1.1028 -0.0487 -0.0840 0.7663 0.6475 -0.5353 0.7164 -2.1024 -0.9178 0.7815 0.0544 0.5589 0.2096 -0.3984 0.6426 -2.4646 0.8917 0.1700 0.4480 1.2349 0.4707 0.5333 0.3716 -0.9383 -0.1652 1.5365 -0.0922 0.8356 1.2435 0.2515 0.6293 -0.2900 -1.1537 1.4217 0.7151 -0.8859 0.3693 0.2882 -2.7309 -0.1695 -0.2901 -0.3585 -0.3699 -0.9940 0.2189 -0.8892 0.6495 0.6109 -0.2581 -0.0230 0.2532 0.4846 -1.0314 0.4559 1.4809 0.3003 1.4301 0.7505 -0.4253 0.2632 0.7982 0.0855 -0.5011 -1.1376 0.5805 0.5194 0.7777 -1.8576 0.9422 -0.6919 -1.3302 -0.7243 0.9677 -0.9741 1.3798 0.7229 1.2025 1.5336 0.5196 1.0818 1.1811 0.7734 -0.4414 -0.1040 -0.1087 -0.2938 1.0358 1.3713 0.8115 0.1102 -0.2904 0.2111 0.8067 0.4397 0.0791 0.7763 0.9237 0.3182 -0.0513 1.5350 0.6208 0.4185 0.3969 0.4078 -0.3686 0.7255 -0.8449 1.6886 0.3917 0.0744 -0.5823 0.4491 0.6959 0.2441 0.2086 0.0216 0.9385 0.3006 -0.9619 1.4549 1.2029 -0.0328 -0.1464 1.0168 -0.0295 0.0554 1.0299 0.4225 -1.8948 0.8573 0.2394 0.4543 0.1643 0.9222 0.5746 0.6349 -0.6693 -0.5306 0.8534 0.6706 0.9601 -0.4069 0.6998 -2.2754 -1.4842 1.1529 0.4818 -1.3934 1.4489 0.6463 0.1474 0.1456 -0.0289 0.6985 0.6472 0.0861 1.0240 0.0160 -1.0773 0.5262 0.1209 0.0803 0.5942 0.4495 0.0970 1.1154 0.0977 0.4265 0.5692 -0.4853 0.2863 -0.2339 0.6682 1.2472 -1.8751 -1.1209 -1.7221 -0.8326 -0.7790 0.8044 0.4342 -0.6466 0.0632 1.2617 0.4292 0.5074 0.4617 -0.2329 0.7282 -0.0049 -0.0343 -0.0999 -3.0611 0.7281 0.6623 -2.0577 0.5567 -3.0732 -1.9959 -2.1877 -3.3649 -0.0510 -0.0450 1.1226 0.2961 -1.3073 -0.7006 -1.0149 0.3775 0.6184 0.9777 0.4453 0.6515 -1.1871 -2.7762 -0.5520 1.1620 -0.2267 0.2195 0.8632 -1.0277 1.0155 -2.6393 -1.9787 -1.8325 -1.0781 -0.2376 -1.6547 -0.3879 -0.1707 -0.8554 -2.0763 gamma-glutamyl-alpha-lysine 0.2379 0.6010 0.6111 0.0190 -0.8431 0.1536 -1.7963 -0.3442 0.4160 -0.1437 -0.2206 -1.8255 0.3294 0.6571 0.7744 0.2220 0.2867 0.2523 0.5509 0.8793 0.0624 0.3631 0.5790 -1.3926 0.5550 0.6763 0.8155 0.6084 0.4472 -1.6399 -0.6178 -1.3192 0.7078 -0.1042 0.5037 0.6636 0.7510 -1.1686 -0.0409 -1.6775 0.9277 0.3185 0.5310 0.6990 0.7756 -1.8418 -0.8396 0.1902 -0.2468 1.2665 -1.4594 -2.0002 0.6490 0.0452 -0.3852 1.1167 0.3831 0.3497 0.2007 -0.4174 0.4577 1.4392 -1.7553 -0.2326 -1.3929 0.2916 -1.4615 0.5331 -0.1136 -1.2775 0.9681 -1.6025 0.5312 0.2974 0.6650 0.3390 0.0746 1.1471 1.0476 -1.5762 -1.4226 -1.3896 -1.5454 0.5195 1.4696 -1.7480 0.2916 -1.4481 -1.6994 -1.1910 0.6104 0.1679 -0.6521 -1.0006 0.3149 -0.3523 0.4393 0.4308 0.5235 0.3054 0.8810 0.6829 0.4120 0.5523 0.5630 0.6382 0.6377 -1.5761 0.2470 -1.3593 0.0548 0.0177 0.3329 1.2530 1.1413 -1.4864 -1.2147 0.8305 0.6093 0.9332 -1.4139 1.1966 0.2566 0.3203 0.4051 0.5335 0.0882 0.7203 -1.4807 -1.7909 0.9548 1.2407 1.2023 -0.1192 0.7075 1.3568 -0.3152 0.3446 0.2106 -0.0683 0.3430 -0.5205 0.1498 0.6965 0.7185 0.5578 -0.1275 0.9880 -0.0574 -0.0121 -1.2627 0.0231 -0.1886 0.8786 0.0327 0.4941 1.2028 0.6477 -0.1776 -0.8432 1.3837 -1.7327 1.5402 0.1761 0.0695 0.4778 0.6534 0.7607 1.0347 -1.4444 1.4777 0.6863 -1.9290 -1.3699 0.0662 0.8057 1.2127 0.2500 -0.1654 0.5652 0.3063 0.5096 0.3188 0.1637 0.0099 -0.2628 0.2995 0.3354 -1.3169 0.0872 -1.7664 -0.1767 -0.1681 0.6184 0.7247 -1.7363 0.4324 0.8414 0.6648 0.6730 0.5683 0.5114 0.7049 0.6375 0.8350 0.8495 0.3620 0.3257 0.4660 -0.1118 0.9331 -1.4744 0.1645 0.4907 1.0178 -1.5112 0.7798 1.1969 0.0351 1.0655 -1.6847 0.4870 -0.1145 -1.8341 0.3633 -1.7810 -1.8757 0.9932 -1.6456 0.8917 0.4471 0.2048 -1.4424 0.9299 -1.7590 1.0468 0.6127 0.4040 -1.6718 1.3758 0.4741 -1.9854 -1.5774 -1.9214 1.3711 0.9377 1.1790 0.3445 0.5323 0.3446 0.4968 0.7291 -1.7381 1.6380 0.7257 0.2639 0.6375 0.4121 0.7869 -1.8482 0.1850 0.4560 1.1726 -1.8663 0.7507 0.5535 0.2276 -1.7670 0.6669 0.0153 -1.7646 0.5076 1.1003 1.0563 0.5549 0.8337 -1.5720 0.0270 0.9497 -1.1776 1.2757 0.7355 -0.2897 -1.6080 0.5927 1.3601 0.1643 -1.4964 0.5142 -1.8297 0.6935 -1.7674 1.1573 0.3747 0.9691 1.2377 -0.2668 0.0940 1.6183 -1.7783 0.6683 -1.6722 -1.4651 0.4262 0.5174 0.9216 0.2314 -0.5394 0.9771 1.1074 0.9796 -1.6868 1.9686 0.3019 0.1144 0.9348 0.6547 0.2192 1.2995 -1.8115 0.4559 0.6271 0.7555 -1.8025 0.1999 0.5710 0.2737 0.5948 0.3114 -1.7178 0.5066 0.1177 1.1828 0.8568 -0.0099 0.5806 -1.8176 0.6006 0.8968 -1.5263 0.6063 -2.0092 -1.8685 0.9581 0.3306 -0.2986 0.4487 -1.7442 -1.7228 0.0703 -0.0856 0.7539 -0.1051 -2.0657 0.3660 0.7542 -2.0097 0.7511 1.0179 0.8063 0.2552 -1.8071 0.1760 -1.9734 -1.7353 0.1095 0.2904 0.4974 -0.5894 0.1022 0.2972 0.6874 -1.6079 0.6277 -2.0398 -1.7912 -0.2694 0.8496 -1.9056 1.1434 -1.6971 -2.1145 0.1814 1.1458 0.4958 0.3630 0.7812 0.5359 0.8639 -2.0145 -0.3040 0.5554 0.4491 0.4981 0.5926 0.4477 -2.0385 0.8980 -0.0876 -1.5817 -0.3240 0.4424 -0.3221 0.4458 -0.2866 1.3875 -1.6177 -0.0541 -1.7303 -2.2182 gamma-glutamylcitrulline* -0.3623 0.5413 -0.6251 -0.4850 1.6129 -2.3567 0.6838 -1.0431 -3.2342 -2.7340 -1.1118 0.2408 1.8302 -0.6340 0.7834 -0.2796 -0.9867 0.4699 -0.0125 0.2457 -2.9566 0.4771 0.3114 0.3350 0.4624 0.0755 0.1411 -0.7095 -1.2667 -0.3048 0.6932 0.0154 1.3937 -0.8991 0.4295 -0.8281 -1.3001 -0.1562 -0.2044 0.2905 0.7682 0.6039 0.4338 0.6385 1.7804 -0.5320 -1.0862 -0.6099 0.5808 1.0214 -1.3674 -0.6479 0.4437 -3.2782 0.0196 0.4550 0.4479 1.2602 -0.1567 -0.4088 1.0426 0.4553 0.2088 -3.0343 -0.5362 0.7719 -0.1511 0.8827 -0.0684 -0.8538 0.2167 0.2035 -0.3461 -0.3897 1.0502 -0.8357 -0.0282 1.1886 -0.2832 0.6163 1.2113 -0.8594 0.2291 0.6555 -0.6746 -0.7303 0.3133 -0.3981 0.0098 0.6539 0.5737 -1.2175 0.9510 -1.5875 -1.1579 -1.2051 0.0019 -3.0979 0.7967 -0.0429 -0.2388 -0.0199 0.0191 0.2118 1.2544 -0.5431 -0.9220 0.9653 -0.2888 -0.3336 -0.9836 -0.5246 1.2854 -0.2889 -0.3186 0.3617 0.5439 0.9038 -0.5995 1.2831 -0.9558 -0.1586 0.8917 0.6173 -0.5538 -1.3036 0.7319 0.7842 0.6424 -0.0237 0.4683 -0.0803 -0.0476 0.8805 1.1962 0.4679 0.6334 0.3860 0.1791 1.0679 -2.9000 0.2155 -0.3438 0.7535 0.0739 0.7740 0.8974 -1.0420 0.2203 0.7727 0.8611 1.2435 0.8485 0.5696 -0.2885 0.1248 0.2514 -0.6326 -0.2755 0.1284 -0.9640 -0.6509 0.4318 1.1351 -1.5139 1.4666 0.1254 0.1066 -0.2852 -1.2205 -0.0569 0.1516 -0.0566 -2.5278 -3.3806 1.4314 1.1940 0.0429 0.0612 0.2180 0.2277 0.2542 -0.4073 -0.1981 0.5585 -1.0916 -0.3639 -0.3146 -0.6373 0.2133 -0.4792 -2.9466 0.9586 -0.1575 0.4752 -0.2387 0.5658 0.6858 0.3997 1.0094 -0.0629 -0.0355 -2.9947 0.5473 -0.6053 1.3641 1.3340 -0.7698 0.2447 0.0215 -1.1057 0.9993 0.6432 0.4474 1.4938 -0.0659 -0.8643 -0.2294 -0.1406 -0.4710 0.4853 -0.0844 0.3827 -0.6853 0.3711 0.8438 0.2042 0.2763 0.5258 0.1538 -0.2627 0.3622 1.2585 0.5903 0.6909 -0.9937 0.1387 -0.7818 0.4567 0.9062 0.2266 -0.1679 0.5644 1.2956 0.9089 -3.1906 1.0778 -1.3567 -3.4216 -2.0112 0.7807 -0.1567 0.5376 1.5657 0.6023 1.9600 1.2162 0.9332 0.4152 1.0301 -0.4070 -0.2597 -0.9501 -0.0685 0.5662 0.7440 1.1272 -0.6500 0.7376 0.4643 0.0741 0.5625 0.0216 0.7081 0.8696 0.0129 0.9429 1.2748 0.5021 -0.2259 0.8532 0.8005 0.1720 0.5349 0.7528 1.0864 0.7343 0.9707 -0.7799 -0.1182 -0.9407 -0.3644 1.4830 0.3413 -0.4736 -0.0952 -3.3227 0.6895 0.8527 0.6708 -0.6019 0.5274 0.0566 -0.3494 1.3701 1.2778 -1.4696 0.5453 0.4963 0.0127 0.1783 0.2640 -0.1635 -0.0860 0.9137 -1.2702 0.8127 0.8659 0.5526 -0.9116 0.4627 -1.5135 0.5307 0.0947 -0.0237 -0.0381 1.2922 0.0197 0.4529 0.0104 -0.6021 0.4065 0.6646 -0.8197 1.4962 0.0363 -1.9377 -0.0275 1.7591 -0.2283 0.4922 0.1033 0.5160 0.9382 0.0545 -0.5236 0.6734 0.5029 0.6956 0.0888 1.6371 0.7050 -0.3691 -0.1712 -2.0990 -0.7349 0.1669 1.0948 -0.5597 -0.1520 -0.1735 0.9699 1.3427 0.2592 0.8278 -0.9700 0.5970 -0.0006 -0.2359 -1.1331 -1.9496 0.8040 0.2134 -1.3000 0.4917 -3.0014 -0.7992 -1.0201 -1.8387 0.7203 0.4415 0.6648 0.7412 -0.6124 0.4810 -0.0926 0.9499 0.5352 0.1265 0.9042 0.6822 -1.2752 -2.7233 -0.0840 0.3112 0.4437 0.2063 -0.3109 0.5405 0.4103 -0.7481 -3.3659 -1.9960 -3.4366 0.1056 0.0393 0.2978 0.6210 0.0103 -0.5882 gamma-glutamyl-epsilon-lysine -0.2799 -0.4393 -3.5659 -1.3201 0.6176 1.8631 0.1496 -0.6581 0.0561 0.6795 0.8626 0.5408 0.2790 0.2553 0.0289 0.0301 -0.3138 -0.7437 0.6831 0.5704 -0.4455 -1.5639 1.0470 0.4570 0.4725 0.6675 0.5620 -0.1358 0.5707 1.3846 -2.0348 0.7370 0.7360 -1.8568 0.1854 1.9843 1.2400 0.5223 -1.4603 0.5805 1.0218 0.1502 0.1008 0.1988 0.3679 -0.1398 -0.9428 0.4680 -0.6500 0.7516 -0.2347 -0.8956 0.2717 1.3633 -0.4532 0.4753 0.6591 -0.4773 -0.1848 -0.8336 0.9696 1.0794 -0.2695 0.4529 0.1136 -0.6864 -0.0024 0.7965 -0.5368 0.1338 0.5442 -0.1532 1.3907 -0.7744 0.2812 -1.4785 -0.2033 0.6241 0.4006 0.4963 -0.0260 0.1802 0.9987 0.3445 1.4353 0.2626 0.2370 -0.6478 -0.1986 1.0129 -0.2421 -0.5305 -1.3165 0.3187 1.1263 -1.1319 0.4540 0.4019 0.5832 -0.0874 1.5075 0.9918 -0.3150 0.1274 0.1311 0.3933 2.4412 -1.4811 -0.9594 -0.3626 -0.8853 -0.6145 -0.3802 1.0536 0.0979 0.6207 -0.6064 0.4255 0.3263 -0.0666 0.8298 0.4262 0.4882 -0.4269 -0.4034 1.4229 0.0441 -0.3315 -0.5728 -1.3820 0.4062 0.9184 1.6708 0.6931 0.5293 0.8656 -0.1268 -0.2711 -0.5284 -0.4504 0.0956 -0.3798 -0.6735 0.6158 0.8621 -0.2467 -0.3621 -3.4957 -0.2970 -0.5208 -0.2111 -0.5750 -1.1091 -4.4680 -0.6249 0.0015 0.7439 -0.2730 -0.9739 0.6311 0.6698 0.0343 0.0875 0.1201 -0.5165 -0.0164 0.1875 0.9383 2.0224 -0.7439 -3.7569 0.0207 -0.0274 0.2679 -0.5271 0.0140 0.8638 0.1055 0.2197 -0.4670 -0.2063 0.1525 -0.1356 -0.7480 -0.1765 -1.8774 -0.3838 0.2752 -0.2816 -0.5966 1.5916 0.2012 -0.3666 0.4225 -0.2218 0.7576 0.5582 2.4254 0.0087 -0.1665 0.8215 0.0922 0.5101 0.6487 -0.4589 0.8251 -0.0549 0.1151 0.2146 -0.7411 1.0402 0.5961 -0.4660 -3.5202 0.3069 0.4225 0.9683 1.1114 -0.0560 1.2624 -0.2114 1.2107 -0.7353 0.4898 -0.0256 0.7939 0.8929 0.7021 0.1815 0.3455 0.1947 0.0114 -0.3686 0.7148 1.1756 0.5652 0.1896 -0.0833 -1.0097 1.2676 -3.5810 -4.0658 0.4665 0.9124 0.6770 0.8835 0.2436 -0.4704 0.2968 0.4190 0.3159 0.3961 -0.1030 2.1798 0.8030 0.1844 -0.1938 0.2802 0.9061 -0.8422 0.1699 0.1155 1.2432 1.2364 0.2760 -0.2281 -0.3873 0.0228 -0.1206 -0.7469 0.2907 0.0462 1.0702 -0.3653 0.3030 0.9041 0.4937 -0.5593 0.1327 -0.3163 0.4440 0.2006 -1.3204 -0.6422 -0.2081 0.8556 -1.0390 -0.7126 -0.1328 -0.1120 -0.2248 -0.3809 1.6683 -0.7908 -0.1302 0.0750 1.1661 -0.4057 1.4121 -0.4479 -0.2076 0.4595 -0.0145 -0.2190 0.3531 -0.3331 1.6992 0.4660 1.0679 0.1115 0.7316 0.4246 -3.6967 0.2887 -0.8415 0.7684 0.6999 0.2401 0.5808 0.3288 -0.4938 0.4036 -4.5811 -0.2000 0.3334 -0.5098 -0.4614 0.1327 -0.5052 0.2125 0.6157 0.0389 -3.5524 0.9441 -0.9173 -0.2145 2.2383 -3.7419 0.2847 0.1953 -0.3584 0.0919 0.4838 0.0648 0.4205 -1.5799 -3.1253 -0.3169 -0.2503 -0.7837 -0.3615 -0.4603 0.1047 0.3338 -0.1074 0.3568 -1.1872 0.7659 1.3648 0.1826 -0.2838 -0.1181 -0.1446 0.4473 0.1443 -0.5298 -0.0576 -0.4404 -0.6516 0.2201 0.2537 1.0524 1.2471 0.2610 -0.2802 2.1126 -1.1248 -4.0744 -1.4906 1.2725 -0.1124 -0.2022 -0.7716 0.7765 -0.7154 -0.2289 -0.1981 0.0186 -0.0846 0.5564 -0.3875 -0.2146 -1.8300 -0.1948 0.5818 -0.1095 0.1833 0.2596 -1.4035 -0.2954 -1.9606 0.2655 0.1384 0.0961 -1.0052 1.7322 -0.3425 -0.2672 -0.0562 0.6576 gamma-glutamylglutamate 0.4741 -0.3650 0.2050 0.0088 -0.4979 1.5109 -0.6871 1.1961 0.7286 1.3950 0.6095 0.5024 -1.1166 -0.2242 0.8236 -0.0215 0.4437 0.7650 0.4068 0.1015 -0.4416 -0.9812 0.4081 0.1162 -0.5120 -0.1383 0.8406 1.2374 1.0692 0.8412 0.3829 0.1325 -2.9981 -0.6137 0.6836 1.3659 0.3455 0.5473 -0.0620 0.6079 1.4465 -2.5547 0.0335 0.6560 -3.2677 -3.7049 0.8230 -0.0132 -0.1121 0.6316 0.4616 0.0630 0.0774 -3.5607 -0.1149 1.0645 0.0977 -0.4470 -0.4132 0.8659 -1.2493 0.4975 -1.8325 0.0797 -0.4814 -0.1265 0.4151 1.0687 0.7128 0.8302 1.1336 0.1962 -0.3333 -0.1662 0.1127 0.2957 -1.3688 -0.1494 0.0261 -0.1212 -0.8541 0.2207 -0.4878 0.4344 1.2700 -0.7520 0.3928 0.5948 0.4303 0.1612 0.9318 0.0783 -0.9674 -0.4648 0.8369 0.0310 0.4337 0.0857 -1.0917 0.8571 -0.1031 -3.7999 -0.4838 0.2396 -0.9812 0.5276 0.6018 -0.8885 0.0641 0.7787 0.6082 -0.6087 -0.2215 0.8158 1.2284 0.8629 0.0786 0.0582 0.0141 -0.2692 1.2803 1.6046 -0.0259 0.7399 -0.5693 -0.0603 -1.0957 -1.2938 0.2486 -0.4544 0.2592 1.5793 0.3095 -0.3735 1.0789 0.7552 -3.4114 -0.5973 0.4657 -1.3286 -0.0781 -0.1623 0.0065 0.4228 0.1637 0.4722 -0.0291 0.0553 -1.1015 -0.8524 -3.2013 -0.1118 -0.5820 -0.2410 -0.1761 0.4674 1.2604 0.5491 0.5049 0.0148 0.4931 -3.7464 0.6962 -0.5939 0.9344 0.4382 0.2864 0.9577 0.4088 0.4187 1.4975 -0.0926 0.0443 0.9950 -0.9119 -0.5951 0.4666 -0.5922 -0.8853 0.2933 0.8304 0.2643 -3.5226 1.2691 -0.5319 0.0875 0.2432 -1.9147 -0.4066 -0.3346 -3.8011 -0.3099 0.8708 0.7158 -0.8463 0.4751 -0.3038 -0.0901 0.5524 0.0367 1.2389 0.0689 -0.2683 -0.3116 -3.5267 0.6924 -1.1077 -0.0994 1.0511 0.3724 1.0782 -1.1408 -0.7043 -0.8802 -0.1066 0.3321 0.7551 0.6451 -0.1193 1.1652 0.3785 0.7252 0.1917 0.9232 -0.3176 -0.0268 1.6614 0.7150 0.4117 -0.3504 0.6703 -1.5482 -1.1367 0.9207 0.0757 0.0594 -0.0324 -0.6850 -0.2450 0.9769 1.3069 0.2400 1.0712 0.1399 0.3782 0.6733 0.3067 0.2322 -0.0461 0.4626 0.5971 0.7300 -0.6217 1.0263 0.2273 0.0889 -0.0568 0.3962 0.3178 -0.7489 0.7201 -0.2493 0.2278 1.3239 0.7487 -3.1180 0.2242 0.2908 0.9708 0.3469 -0.1407 0.3929 0.1001 0.3513 1.0051 -0.3594 -0.5453 -1.8480 -0.5811 0.3752 0.2059 -0.7923 0.5226 -0.1605 -0.7128 0.6791 -1.0767 -0.7616 0.5306 -0.6404 -0.2908 0.5428 -0.0851 -0.2927 0.2598 0.0805 0.9985 -0.7912 0.9676 1.4961 0.4542 0.6611 0.8186 -0.3611 0.6484 0.0065 0.7571 -1.8734 0.6511 0.5427 0.4336 -3.6872 0.5460 0.1615 0.0147 0.5356 -0.0605 -0.6534 0.2889 -0.3030 0.0298 1.3145 0.1445 -1.0811 -0.5886 0.5395 -0.1032 0.3638 0.2165 0.6523 0.6880 1.2794 0.6125 -0.2999 -0.6554 0.4311 0.5785 -0.7698 0.5915 0.4216 -1.5146 0.5906 0.6891 0.2908 0.0682 0.0128 0.6683 -0.0059 -1.1603 0.8357 -0.3621 -1.8078 1.1398 0.3001 0.4116 0.3947 0.4412 -0.3002 0.3548 0.7555 -0.0162 -0.3047 0.1229 -1.5526 0.0633 0.0624 -0.4987 0.3644 0.2840 -0.1008 1.1787 -1.4701 -0.0671 0.4145 0.7595 -3.2915 0.0698 -0.5214 0.1847 0.6004 -0.6730 -0.4778 0.6071 0.6633 -1.1087 0.1796 -0.0157 0.4879 -0.5796 0.6619 0.6723 0.4354 -3.0343 -1.0482 -3.7317 -0.2778 1.0714 -0.3763 -0.3881 -3.6623 0.6022 1.6547 0.5217 -0.0336 -0.1195 1.5583 1.2172 -0.3951 0.1105 1.6942 gamma-glutamylglutamine -0.4071 0.4927 -1.4610 -1.2373 1.0696 -2.7453 1.2799 -2.3637 -1.0947 -2.8613 -2.7149 -0.5850 1.6223 -1.1204 0.5917 0.6470 -0.9358 0.0969 0.7521 0.2871 0.1587 1.1419 0.6230 0.8116 0.9138 0.1202 0.3947 -0.4461 -0.5354 -0.6717 1.3054 0.8482 0.7769 0.4302 -0.0539 -1.1324 -0.1378 0.2980 -0.2982 0.6899 0.7234 1.3532 0.7851 0.4919 1.7311 -0.4604 -0.5194 0.1697 0.7689 0.9401 -0.8127 -0.9358 0.5980 -2.6968 0.2188 -0.0020 0.6275 1.3509 0.2372 -0.7616 2.1783 0.6632 0.3752 -2.8812 0.2830 1.1073 -0.1176 0.9270 0.2135 -0.7278 0.1292 1.0437 -0.2545 -0.9043 1.4228 -1.5364 1.2743 1.3976 -0.3242 0.4624 1.6530 -1.7134 -0.0860 0.6425 -1.8884 -0.6959 0.3728 -0.4617 -0.2383 0.5524 0.3198 -1.1669 0.6822 0.0958 -1.3282 -0.9600 -0.3485 -0.7614 0.3726 0.6577 0.0273 -0.4223 0.8825 0.3558 1.3841 -1.3957 -1.3046 0.9194 -0.4753 -0.2687 -1.9447 -0.9508 1.6040 -1.0258 -0.2314 0.4637 0.9489 0.7820 -1.4612 1.0618 -1.1324 -0.3878 1.0368 0.2840 0.1369 -1.2048 1.3034 0.4667 1.2526 -0.1485 -0.3574 -0.6368 -0.5058 0.7729 -0.3375 0.4668 0.5259 0.5603 0.4185 1.3905 -1.5620 0.7201 0.1290 0.5052 -0.0720 0.4404 0.5943 -0.9621 0.7203 1.4258 1.0874 1.1084 1.0297 1.2891 0.0824 0.3931 -0.1128 -0.3948 -0.1703 0.5402 -1.0350 -0.1846 -0.2815 1.0564 -1.5083 1.4111 0.3891 -0.1743 0.4856 -1.1256 0.1332 0.1537 -0.0423 -2.1076 -1.3719 1.7423 1.4040 0.3915 0.6149 0.8224 0.3400 -0.0332 0.2109 0.0935 0.0469 -1.0894 -0.8017 0.1041 -0.5982 -0.3617 -0.4891 -2.9495 1.1352 -0.7545 0.6237 -1.0142 0.4755 1.1587 0.6135 1.3018 1.0108 0.0642 -1.1064 1.6563 -0.2020 1.0751 1.0007 -0.2705 0.4073 0.4211 -1.0668 0.7851 1.0056 0.2047 0.9748 -0.5228 -1.5105 -0.9837 -0.8443 -1.1022 -0.0300 -0.3985 0.7279 -0.9013 0.2793 1.3207 -0.3191 0.2828 0.4214 0.0408 -1.0654 0.0277 1.5325 0.7256 0.5187 -0.6380 -0.6611 -0.3278 0.7553 0.2887 -0.9705 -0.2473 -0.0680 1.4726 0.8589 -1.0798 0.6818 -0.6139 -1.9114 -1.4053 0.2508 -0.0944 0.5993 1.7057 0.7023 1.4122 1.0138 1.1409 0.8812 0.8227 -0.1718 -0.1873 0.2780 0.0221 0.7044 1.6215 1.2781 -0.6681 -0.5022 0.7663 -0.1666 0.5872 -0.5049 0.5191 0.4676 -0.3550 0.6350 1.2634 0.3576 -0.3943 1.2068 0.0402 -0.5422 0.4342 0.4294 1.5005 0.7669 1.0399 -1.9813 0.7997 -0.4807 0.2429 1.1190 -0.7556 -0.6551 0.1797 -1.7221 0.8658 1.2996 0.4408 -1.2753 0.0422 0.2650 -0.5353 0.8974 0.8800 -2.3334 0.7025 -0.3157 -0.8139 0.7987 -0.1773 -0.3162 -0.1456 0.2897 -0.6330 0.2543 0.1448 0.0489 -1.4499 0.6371 -1.6319 0.4622 0.6147 0.0164 -0.9633 1.2094 -0.0788 0.1645 1.0267 0.2569 0.7837 0.4414 -1.0036 1.7614 -0.2983 -2.8932 -0.4189 1.5048 -1.1090 0.1500 -0.1229 0.2470 1.1479 -0.9074 -0.7332 0.4981 1.3766 0.4554 -0.2663 1.4374 0.6091 -1.0914 -1.1474 -2.4435 -0.7696 -0.0320 1.0916 -0.5103 -0.3749 -0.3473 0.3092 1.1282 -0.1041 0.7830 -0.8321 -0.0486 -0.0603 -0.4165 -1.2537 -1.6738 0.3514 0.3102 -3.0206 0.8442 -4.0118 -1.4571 -1.7292 -3.0838 0.6029 -0.2533 0.3051 0.8759 -1.6277 0.6045 -0.3056 1.2291 0.3132 0.3435 1.1207 1.2296 -0.5000 -1.3319 -1.0721 0.4058 0.1208 -0.0216 -0.2267 0.1518 0.8991 -0.8400 -1.8997 -1.8414 -1.4232 -0.5968 -0.2688 -0.1275 -0.1730 -0.9280 -1.6017 gamma-glutamylglycine -1.3342 -1.2954 -0.8027 0.6033 1.2173 -2.5523 -0.2988 -0.0291 -0.1120 -1.5742 0.2853 -0.1813 0.5507 -1.0369 0.6199 -0.0557 0.8171 0.4907 -1.4612 0.9774 -0.0824 -0.0265 0.2651 -0.6183 -0.3162 -1.9583 0.7727 0.8905 0.5277 -0.2556 0.1903 0.4439 0.9814 0.5502 -0.6900 0.4041 0.5257 -0.1423 0.4081 -1.0542 1.8423 -0.8200 -1.2581 0.8421 -0.1216 -0.1704 -0.7347 -1.0628 0.0407 2.0338 -0.1282 -1.8314 -0.3726 -2.5179 -0.3435 0.0172 0.5338 1.1453 -1.7493 -0.4115 0.1622 1.0472 0.4067 -3.5037 -1.4852 0.5117 0.8291 0.0320 -0.7309 0.1000 0.1349 0.4757 -0.6314 -0.9450 0.8275 0.1251 0.6958 0.8419 -0.4279 -0.5615 0.2175 -0.2939 -0.2984 -1.4518 0.7990 -1.7684 -0.5930 0.5013 0.9145 0.4209 0.0581 -0.5287 0.1432 1.8381 -0.3423 -0.7574 0.4439 -0.5703 0.3845 0.5958 1.1243 -0.1210 1.1147 -0.6698 -0.0678 0.1133 1.2422 -2.4149 -0.8651 0.8724 -0.6908 -1.8551 0.6383 -0.6491 0.0536 -0.5163 0.7255 1.3450 -0.1240 -0.6753 0.4830 0.0972 0.6876 -0.3358 -0.0329 -0.1941 -0.2167 0.6324 -0.2293 0.4738 -0.9313 1.1345 -0.1693 -0.3706 0.2396 -0.2273 -0.6737 -0.7982 0.4332 0.8029 0.6849 0.7695 -1.3295 0.6144 -0.2898 0.6084 0.1775 -0.6498 -1.1948 -0.0563 0.9638 0.6203 -0.4555 -0.4789 1.3159 -0.3061 1.5857 0.3487 0.0871 -0.3131 0.9421 0.9351 2.3085 1.1008 0.2870 0.9220 -0.0505 0.8244 0.2252 0.9326 1.3197 0.6416 0.1632 0.3617 -0.5386 1.5559 1.9877 -0.2119 -0.9602 1.5382 1.2568 -0.4104 0.3828 0.7866 1.2517 -0.5456 0.4424 -0.1835 -0.9320 -0.6568 -1.4496 -0.5112 0.8823 -0.7357 1.2211 -0.0048 1.2281 0.5126 0.5364 -0.7771 -0.5476 0.1303 0.0019 -0.0486 -0.4224 0.2373 -1.8551 0.4823 0.4910 0.9120 -1.5022 -0.2903 0.7235 -0.2453 -0.1726 -2.3634 0.7400 0.4265 -1.3681 0.5004 -1.0073 0.4938 -0.2307 0.3261 -0.1016 1.0764 0.4765 -0.0697 -0.6578 -0.3820 -0.1933 -0.5348 -0.2837 1.1047 -2.8834 0.8703 -0.9338 -0.7804 0.6663 0.9121 0.8381 0.5184 1.3454 1.4318 0.5098 0.1017 -0.5477 0.2835 -1.2310 -0.9007 0.7561 0.6257 1.8526 0.5964 0.2040 -0.0585 -0.8409 -1.0271 0.1124 -0.8541 -0.7401 0.4697 0.7515 1.0700 -0.4836 1.2011 -0.4067 -1.3705 0.3886 1.0432 -0.1370 0.2195 0.3763 -0.0253 0.0467 -1.2939 -1.3634 -0.6800 -0.3772 2.6708 -0.6432 0.2049 -0.6095 0.1428 -1.6735 3.9457 1.1446 1.0740 -1.7699 0.5325 -0.8360 -0.8497 2.0111 -1.1275 -0.3121 0.1121 -0.8971 -0.5979 1.8207 1.4975 0.0553 0.0031 1.1578 2.3118 1.0223 -0.0949 -1.4356 -4.0324 -1.6893 0.3433 0.5774 0.4968 0.7698 -0.6613 -0.4588 -0.1051 0.0536 0.2342 0.7282 -0.0672 -0.4517 0.3374 -0.0478 0.8890 1.2925 -0.2959 0.7859 1.1374 0.7990 1.2231 -0.4901 1.0869 1.0547 -0.0472 -0.7797 0.3884 0.8311 1.7461 1.0453 0.4519 -0.2540 0.1612 0.7339 0.0858 -0.8929 1.0066 0.5327 1.0377 -2.9539 1.1310 1.4698 0.8760 0.8636 -0.3767 -0.4451 -1.2740 0.1064 -0.2771 -1.0542 1.0479 -1.0929 -0.0454 0.0365 -0.7461 -0.1679 -0.7128 0.4319 -0.4544 -0.4255 -0.8605 0.0997 -0.5606 1.7899 -1.7413 0.1889 -4.8621 0.0867 0.0871 -1.1989 1.2300 -0.9755 -0.5906 0.8138 -1.9609 -1.8636 -0.5602 -0.3642 -0.9741 -1.3622 -0.3500 -0.4493 1.4000 -2.3852 -0.9367 0.7742 0.7207 0.6051 -1.0201 -1.2887 -0.6283 0.0148 -0.3841 -0.8318 0.3218 -1.1646 1.2802 0.7444 -0.5979 -0.0444 0.4834 gamma-glutamylhistidine -0.8348 0.4024 -2.4181 -1.2225 0.3377 -1.1297 0.1351 -1.2010 -0.9045 -1.1065 0.1746 -0.5921 0.0318 -1.8866 0.9196 0.8381 -0.6608 -0.9265 0.4291 0.2991 0.0220 -2.3557 -1.1356 -0.4078 0.3498 0.2377 0.5977 0.2431 -0.3520 -0.9652 -0.2430 0.2621 0.2365 -1.0556 -1.0053 1.5942 0.8501 1.2816 -0.2623 -0.1414 0.8895 0.3390 0.1109 -0.1472 -0.2345 0.3469 -1.5928 -0.2227 -0.8486 1.8011 -0.6018 -1.7155 0.4779 -0.4992 -0.8523 0.2785 -0.0039 0.0676 -0.9785 -1.4776 0.0713 1.6202 -0.1679 -0.4091 1.2865 0.1847 0.9475 -0.3840 -0.5161 -0.8573 0.2405 0.3261 -0.1795 -1.2134 0.0760 -1.8473 0.8328 1.6944 -0.5269 0.3793 0.7764 0.0769 0.3336 0.0047 1.3292 -0.2870 -0.2862 -0.7077 0.2449 0.3794 0.2487 -0.1074 -0.2492 0.9466 0.1687 -1.8420 0.5021 -0.6135 0.2002 -0.5208 0.1405 0.3329 0.5882 -1.0424 1.3365 0.0727 1.4801 -1.2446 -0.1225 0.9298 -0.4078 -0.9665 -0.0223 0.6319 1.2380 0.2242 0.1066 1.8579 0.3761 -0.4277 0.7049 -1.9033 0.2055 0.6953 0.2461 -0.4492 0.6946 0.1876 0.1010 -1.0032 1.4256 -1.0725 0.8429 -0.4216 -0.1866 0.7369 -0.8879 0.4402 0.0555 -0.3601 -0.4473 -0.2052 0.0050 0.5720 0.1152 0.1924 -0.5991 -2.9029 -1.1413 -0.7486 1.0099 -0.9715 -0.7316 -2.0827 -0.1834 0.2961 1.1711 -1.9834 -0.0194 -0.1704 1.2175 0.5153 1.7039 0.9523 -0.4961 0.5251 0.5950 0.5861 0.8464 -0.1433 -2.2656 0.4196 -0.3869 0.0469 -0.5316 1.0418 1.7976 0.2686 0.2986 -1.2418 0.1788 0.5302 1.5393 0.7413 -0.5861 0.5126 -0.1935 0.4117 -1.2119 -0.1088 0.6849 0.1405 -0.7068 -1.0304 0.8374 -0.0850 1.1013 0.6162 0.3237 0.1899 1.2800 0.6044 0.6023 0.5866 0.4603 0.3478 -0.5961 0.1068 -0.2964 -0.1219 0.1552 0.0028 0.4608 -3.7894 1.0033 0.5864 1.1461 1.3627 -1.3161 0.5342 -1.1562 -0.6268 -2.9462 0.1292 -0.3294 0.7515 0.7949 0.1128 0.1347 -0.2518 -0.6431 -0.6021 0.9043 0.8762 0.5971 0.5797 -0.5887 -0.5087 0.3526 0.9591 -3.9564 -3.8148 1.1161 0.4656 0.6822 0.7480 -1.1287 0.5510 -0.1649 -0.1040 -0.4394 -0.2635 0.6477 1.7993 0.0140 1.0038 -0.5644 1.3453 1.0632 -0.0797 -0.3946 0.5963 2.5993 1.3833 0.7133 0.3392 1.5716 -1.3109 0.7644 0.0926 0.3693 0.1727 0.4923 -1.7145 0.0828 0.4383 -1.2494 -0.2425 1.4224 0.1231 -0.1289 0.0292 -0.8002 -0.3236 -0.4976 2.8403 -0.6324 -0.0315 -0.1488 0.9514 1.0338 -0.4221 1.6628 -1.3075 0.9286 0.5216 0.1068 0.6647 2.5027 -0.8802 -0.2811 -0.3063 -0.1936 0.5884 1.2541 0.2251 0.4376 -1.1591 1.0021 0.2912 0.3702 -0.2789 -0.8748 0.2226 -0.2837 0.6588 0.2865 0.0956 -0.0917 -0.5639 -0.1523 0.7168 -2.6996 -0.2406 0.9177 -0.1745 -0.3549 -0.2987 -0.1064 0.2140 0.4809 0.1824 -0.8126 0.2281 -0.2108 0.7336 1.0520 0.5002 2.1393 0.0132 -0.0269 0.9944 0.4731 -0.0327 -0.2610 0.9270 -3.0841 -1.2947 -0.8861 -1.1586 1.5349 1.5522 -0.6707 0.1251 -0.6874 -0.1348 -1.9379 -0.3281 0.3002 0.8980 0.1120 1.3204 -0.9320 1.0960 0.5874 -0.0578 0.0041 -0.1086 -0.7844 -0.0949 -0.1324 -0.4566 0.8227 -0.1927 1.1630 -5.3028 0.0445 -0.9899 -2.9342 1.6065 0.1155 1.0072 -0.4126 -0.3638 0.2591 -0.6085 -0.1257 -0.6860 -0.1957 1.0038 0.1933 0.6591 0.4897 -1.0500 0.8333 -0.4992 0.5157 -0.0530 2.1044 0.2151 -3.0447 0.0059 -1.0892 1.2310 -0.8915 1.2176 -0.3918 -0.1670 -0.4150 0.9766 gamma-glutamylisoleucine* 1.6376 0.4847 -0.1699 -1.7880 0.1141 -1.0939 1.0742 1.8804 -0.7632 1.4886 2.0018 -0.0622 1.0119 0.1758 0.0334 0.2773 0.3686 1.1662 -0.9183 -0.8933 -1.5289 -0.8471 -1.0438 -1.7020 -1.6659 -0.0395 0.4066 -0.3600 -0.7773 -0.3199 -0.9675 -0.4108 1.3775 -1.2955 -0.8505 0.9975 -1.0101 0.8490 -0.5137 -0.5187 -0.8604 -1.3023 -1.0092 0.1030 0.2270 1.7897 0.4470 -1.6034 -1.6485 1.4069 0.4235 -0.9481 -0.4337 -0.0549 -1.4868 0.3602 -1.0938 -1.1592 -0.8464 -1.2945 -0.4048 1.3791 -0.7319 0.2925 -0.3936 -0.6910 1.0106 -0.3548 -0.8184 -1.0028 0.3828 -0.2181 -0.4930 0.2852 0.0337 0.2987 -1.2734 0.4918 0.8679 0.4878 -0.1302 0.8292 0.4446 -1.5095 2.4144 -2.0847 -1.6262 1.2086 0.9450 -1.3389 0.4143 -0.1100 -0.8978 -1.8968 0.7059 -1.4639 -1.0464 -0.9118 -0.9304 -0.2742 0.1912 -0.9383 -0.2674 0.5168 -1.5876 0.3279 1.9827 0.0987 -0.9464 0.7869 -0.9706 -1.3300 -0.7487 0.7050 0.8843 0.3003 0.6823 0.0756 1.3153 -1.9631 1.3621 0.9822 -1.0525 -0.1129 1.3298 -0.1907 -0.7786 0.5992 -0.2948 -0.1436 0.6770 0.9537 0.1739 -0.6379 0.3524 1.8169 -1.3310 -0.6651 -0.1755 -1.7019 1.6518 -0.2752 -0.9909 0.3179 0.3915 0.2188 -0.4043 0.2509 -1.2612 -2.1530 -0.0449 0.3167 1.0787 0.5400 -0.3329 0.6816 1.2770 0.8434 -0.6403 -0.9639 1.5280 -0.1230 4.7314 -0.6358 0.9593 -0.2926 0.7686 0.7755 0.6858 -0.1361 1.1050 0.1780 -1.8966 -1.3965 -0.4940 0.4015 1.7735 -0.3437 0.2716 -1.7986 2.0775 -0.0614 0.3729 0.0952 -0.0584 -0.7884 -1.8240 0.2034 -1.6259 0.1730 -0.9634 1.6595 -0.9740 -0.1754 0.3175 -0.0372 1.2533 -0.5792 -0.2478 -0.5789 -0.4446 -0.8026 0.4018 -0.3376 0.1097 -0.6926 0.1679 -1.9371 0.0812 0.9134 0.1491 0.4532 -0.6060 -0.1735 -0.0888 0.2156 2.4515 0.8726 -2.1792 1.4980 -0.5446 -0.2310 0.3251 0.9546 0.2498 1.6804 0.7213 0.8434 0.1199 1.4917 0.1397 -1.0033 -0.5559 0.6872 -0.4631 0.7120 -0.6579 0.2422 0.2859 2.0572 -0.0773 0.2035 0.5232 2.8126 0.0254 1.3979 -0.0100 -0.4178 -0.1012 -0.4787 0.7988 0.2877 -0.9627 1.1030 0.0416 0.0598 -1.2203 -0.8338 1.0876 -0.3764 -0.5740 -0.0427 1.8322 1.9951 0.2034 -0.6647 0.8490 0.4068 1.2017 -0.3946 0.6935 -0.3906 0.1144 0.5551 0.4025 0.3857 -0.7253 -2.8861 0.3857 0.4969 0.6504 -0.8502 -0.4462 -0.3274 0.4320 3.7799 -1.2953 0.3184 1.2280 -0.8363 -0.3519 -1.2154 1.5303 0.1661 -0.4073 -0.1310 0.1697 -0.1626 4.2221 -1.4656 -0.2975 -0.0197 0.6479 0.4885 -1.1937 1.8933 -0.1202 -0.0207 -0.7608 0.0171 -0.1066 -1.1307 1.6932 -0.1620 0.5825 -0.7239 -0.3594 -1.4553 0.7211 -0.3255 -0.9091 0.9377 1.3068 -0.7716 -0.4779 -0.3836 -0.9164 0.4639 -0.8475 -0.1319 0.0046 0.2149 0.1908 1.1822 -0.9925 0.2885 1.9564 0.5162 -0.4597 -0.5688 1.2803 -1.1927 -0.1290 -0.0172 -0.3329 1.0635 1.1740 0.4687 0.0504 -0.5764 0.2782 1.0381 0.2973 0.4396 0.7704 -0.2877 -0.4787 -0.9358 0.8236 0.8691 -0.6453 -0.1412 0.0003 -0.1007 0.0548 -1.1941 -1.0607 0.8738 0.4508 -1.8872 -0.5653 0.6055 0.3490 1.3747 -0.2246 -1.2277 -0.3375 -0.8515 -0.2109 1.4159 0.0143 0.0680 -0.1518 -0.1438 -0.3357 0.3633 -0.0339 -1.1328 -0.3812 0.8406 -0.5016 0.0146 2.5172 0.3959 -1.2072 -0.0399 -0.6438 -0.2234 -1.1602 -0.9553 0.1520 0.3218 -1.0039 -0.4056 -1.9601 0.0459 0.2373 0.6037 -0.4837 0.3265 gamma-glutamylleucine 0.8714 0.4382 -0.0040 -0.4307 -0.5453 -0.2814 2.1626 1.3469 -0.6141 0.6669 0.4171 -0.2859 0.2744 0.6200 -0.0620 -0.0475 0.1427 0.7468 -0.7552 -0.4380 -1.4878 -1.0965 -1.9559 -1.6391 -1.1939 -0.1402 0.7955 0.9084 -1.4208 0.0160 -1.4020 0.3355 0.8353 -0.7762 -1.2939 1.0601 -0.1807 0.3822 -1.1485 0.1443 -0.3611 -1.2398 0.3500 0.1368 0.2985 2.4109 -0.0462 -1.6378 -2.2617 1.2915 -0.3848 -0.9259 -0.1162 -0.5703 -2.9969 0.7628 -1.1006 -0.6191 -0.8060 -0.5849 -0.3014 0.9790 -1.3955 -0.1161 0.7512 -0.1442 1.3354 -0.0637 -1.2926 -1.0552 0.5659 0.2619 -0.6899 -0.1875 0.4689 0.6380 -1.1679 1.3635 1.1261 1.3598 0.1376 1.0887 1.2532 0.3121 2.2113 -2.3602 -1.3630 0.5771 0.9965 -1.4298 0.2029 -0.2287 -1.3966 -0.1059 0.1578 -1.3616 -0.4532 -0.3320 -0.3296 -0.5303 0.3385 -0.2112 -0.0446 -0.8326 -0.6821 0.2359 1.3504 -0.0719 -0.0091 0.0689 -0.5341 -0.8024 -0.0497 1.3493 1.6230 0.4066 -0.6876 0.6344 1.3546 -0.7658 1.1570 1.3448 -0.7249 -0.3425 0.6530 0.2473 -0.6002 1.2685 0.1796 0.2503 1.7281 1.1665 0.8463 -0.6360 0.0141 1.8581 -0.8132 -0.4125 -1.3974 -2.1534 1.3013 -0.9408 -0.2203 0.3447 0.3014 -0.3756 -0.4247 -0.0216 -2.3621 -1.2802 0.4392 -0.1480 -0.0974 -0.6473 -0.6837 0.1369 1.0026 0.5307 0.0183 0.0755 1.2860 -0.9053 3.8678 0.0057 0.6759 -0.6123 0.6990 0.5139 0.9674 -0.1518 2.1957 0.4282 -0.8886 -0.9141 -1.3922 -0.2582 1.2796 -0.8267 -1.3430 -1.8248 0.8866 1.0536 -0.9293 0.2176 0.0246 -0.5691 -1.7548 0.0222 -1.3498 0.5679 0.0308 0.5061 -2.0337 -0.7958 0.4525 0.1615 1.4844 0.4360 -0.1017 -0.7508 0.2140 -1.1126 0.6913 0.5791 0.9975 0.1285 0.2113 -2.1413 -0.0657 -0.5255 0.0017 0.9161 -1.0251 -0.7910 0.2785 1.0406 2.2214 2.2626 -1.1944 1.1103 -0.8215 -0.4103 -1.2689 1.4029 0.3695 1.7791 0.8871 1.4038 -0.1771 1.4387 0.1258 -1.2404 -0.6715 0.1703 0.3523 0.8455 -0.2063 -0.4814 0.5881 2.0316 -0.3963 -0.1571 1.1214 3.7196 -0.3899 1.3109 0.2701 -0.8322 -0.1891 0.0200 -0.3482 0.2512 -0.7684 1.8554 0.2398 0.0556 -1.0928 0.1741 1.8083 -0.1498 -1.1104 -0.5773 1.6735 1.3619 0.4033 -0.5770 0.1787 0.7612 -0.1470 -1.1564 0.7349 -0.3581 0.7495 0.6110 0.3027 0.4366 -0.9482 -1.8397 1.0100 -0.1447 1.0183 -0.7764 -0.2009 -0.8806 -0.3236 2.5527 -1.0056 -0.3272 1.4387 -0.3073 0.7148 -1.3788 1.3193 0.1661 0.5706 1.1433 -0.0290 -1.0486 3.1853 -1.3660 1.0815 0.7671 0.4480 -0.4054 -0.3028 1.5791 -0.0939 -2.0099 -0.2015 1.6640 0.1301 -0.1655 2.3728 -0.0709 -0.0558 -0.2305 -0.6619 -1.2926 1.2129 -0.9496 -1.4094 0.4466 0.2317 -0.3553 0.0333 0.1827 -0.5951 0.5881 -1.4465 -0.2650 -0.3272 -0.3121 0.6530 0.6087 -0.8518 -0.1532 1.3473 0.3467 0.5551 0.0739 0.6436 -1.4406 -0.1972 0.5588 0.0546 0.2222 -0.3425 -0.2869 -0.6818 -0.1777 -0.1789 0.7748 -0.6691 0.9279 0.3142 0.0386 -0.6133 -0.5995 1.3534 0.5652 0.1715 0.0361 -1.7462 0.0431 0.3702 -0.2621 -0.9226 0.6590 -0.3479 -2.5481 -0.0905 0.1608 -0.5015 1.5845 -0.4847 -3.2071 -1.3895 -1.0969 -0.6966 1.2418 0.1296 -0.1581 -0.6066 0.1309 1.0418 -0.0168 -0.5581 -1.0222 -0.1999 0.8297 -0.5991 -0.1663 1.8217 -0.4995 -0.1518 -0.4630 0.3065 0.8684 -0.6776 -0.7770 -0.7959 0.4366 -1.3325 -0.0448 -1.9846 0.7568 -0.4580 -0.6496 -0.5142 0.0415 gamma-glutamylmethionine -0.4036 0.3172 -0.7736 -1.1291 0.5051 -4.1030 1.8604 -1.6376 -0.7277 -2.8849 -2.3320 -0.6660 0.8681 -0.3095 0.7095 -0.6412 -1.2701 0.2946 -0.2594 0.1877 0.0295 0.1072 -0.3034 -0.1485 0.2413 -0.3702 -0.0534 -0.1363 -0.6250 -0.4674 0.2748 0.1460 1.3780 0.4423 -0.6080 -3.9577 -0.0385 0.3666 -0.2796 -0.0005 0.5393 -0.2304 0.8698 0.6200 1.1300 0.0043 -0.3799 -0.0620 -0.4086 0.8533 -0.3778 -0.5186 0.0634 -2.3749 0.1142 -0.1095 0.0096 0.8507 0.5287 -0.4792 0.7433 0.8206 -0.0425 -3.7844 0.4489 0.9121 -0.3772 0.4282 -0.5925 -0.4305 0.5241 0.0564 -0.4646 -0.7944 1.3244 0.0531 -0.0354 1.1695 0.5904 0.9484 0.7743 -1.3792 1.0835 0.2149 -0.5748 -0.8867 -0.3128 -0.3479 0.0583 0.0976 0.2480 -1.3431 -0.0911 0.4004 -1.1809 -0.7305 -0.2853 -0.9196 0.4220 -0.1320 -0.3785 -0.1661 -0.2037 0.3204 0.4850 -1.0518 -0.6629 0.3511 -0.3902 -0.1852 -1.1545 -2.3335 0.6220 -0.3075 0.1084 0.6597 0.4484 0.9346 -1.0918 1.0089 -0.2382 -0.0069 0.4692 0.0855 0.4636 -0.4128 0.4112 0.4246 0.4392 0.7491 0.4460 -0.0109 -0.1405 0.1146 -0.7184 1.3616 -0.2361 0.1104 -0.2179 0.3370 -1.4632 -0.1514 0.2478 0.5075 0.2623 0.3823 0.0175 -0.5953 -0.0045 0.0829 0.4176 0.8356 0.4845 0.5836 -0.1071 0.5836 0.9065 0.5816 -0.7875 0.5552 -0.4220 0.3262 1.0027 0.9210 -1.2100 0.5893 0.6971 0.1526 0.5037 -0.6107 0.5517 -0.0158 0.6181 -2.3534 -0.9912 1.3786 1.7586 -0.1730 0.3459 0.2320 0.7402 0.2045 -0.0112 0.0177 0.3317 -1.6246 -1.7004 0.2979 -0.6540 -0.2011 -0.1390 -1.8380 0.2550 -2.3990 1.2352 0.0330 0.1739 0.9867 0.5571 0.6405 0.2486 -0.7080 -0.1197 0.9446 0.3237 0.6512 0.5963 0.1409 0.4359 0.1161 -0.7231 1.0898 0.3311 0.5889 1.2906 -0.1310 -1.6480 0.1874 -0.7569 -0.0083 -0.1656 -0.0091 0.2296 -0.7673 0.5398 1.7746 0.0090 0.9165 0.4426 1.0867 -0.7371 -0.1819 0.6987 0.7665 0.8961 -0.1430 -0.3744 0.1371 1.2922 0.7593 -0.8888 0.0124 0.3313 2.1778 1.3590 -0.8474 1.3893 -0.4345 -1.7128 -0.9880 1.5436 -0.1466 0.0023 1.6235 0.8538 0.9649 0.7754 1.0241 0.8215 0.1140 -0.7315 0.3032 0.7684 0.6667 1.0277 1.1981 1.0238 0.3749 -0.1566 0.8178 0.4402 0.8298 0.4595 1.3295 0.2552 0.1448 -0.0261 0.3748 0.4026 0.0609 1.6673 -0.2089 0.0225 0.2883 0.4022 2.3141 0.0978 0.2375 -0.4828 0.6007 0.0970 -0.1468 1.0912 0.0920 0.6569 0.4183 -3.1951 0.6597 2.0899 0.0340 -1.0130 0.6016 0.2645 0.2203 0.2417 1.2587 -4.1903 0.0840 -0.3339 -0.1843 0.9212 0.5410 1.7178 -0.1539 0.3345 -0.2875 0.5431 0.4818 0.9790 -0.3976 0.6196 -2.9089 0.6494 0.7435 -0.1076 -2.0552 0.9321 -0.0593 0.5183 0.4419 0.0880 0.7583 1.2847 0.2652 0.6365 0.3604 -1.3170 0.2827 0.3649 -0.6473 0.6350 0.1562 0.4025 1.3177 -0.1643 0.1264 0.7615 0.7083 0.3218 -0.0080 1.0760 1.0913 -1.0502 -0.7503 -3.3232 -0.0083 0.2774 0.2210 -0.2020 0.1715 -0.0700 0.6326 0.4573 0.2733 0.9811 -0.7804 0.5853 0.4097 -1.0725 -1.4123 -2.6728 0.9078 0.1621 -4.0052 -0.1703 -3.8919 -1.2931 -0.7077 -4.3046 0.7847 -0.4458 0.1363 0.5412 -1.9793 0.9882 0.1049 0.9049 0.2851 0.8294 0.6574 0.3894 -0.6541 -0.4441 -0.2161 0.6895 0.4291 -0.0031 0.1446 -0.1190 0.1221 -1.5840 -3.0544 -1.8985 -0.6455 -1.2283 -0.3956 0.1166 -0.2977 -0.5819 -0.9862 gamma-glutamylphenylalanine 0.6714 1.2042 0.2909 -0.7375 -0.0760 -0.7371 1.3625 2.4020 0.3342 2.2583 1.4410 0.8375 -1.1559 0.1995 -0.3420 -0.1732 -0.1579 0.6890 -1.6230 -1.0317 -1.4563 -1.6878 -2.0089 -0.3106 -1.1182 0.2253 0.4923 1.1120 -1.2699 -0.1507 -1.4413 -0.0197 0.4029 -0.6326 0.0376 2.3828 -0.2440 -0.1148 -0.1599 0.7476 -0.3335 -3.3542 -0.5697 -0.1659 -0.0480 2.0764 -1.0214 -0.9700 -1.7876 1.8428 0.1298 0.5298 -0.6230 0.0243 -2.7888 0.0862 -0.5920 -0.7382 -1.3066 -0.3173 -1.4836 0.5509 -1.2518 1.1703 1.2911 -0.4281 0.3199 -0.0201 -0.3492 -0.6076 -0.1126 -1.9758 -0.8721 0.0043 -0.4344 0.8694 -1.4109 1.3410 0.9318 0.5012 -0.8745 0.5050 0.7222 -0.7199 2.3773 -2.0466 -0.0362 0.0392 0.8196 -1.3059 -0.0907 -0.3532 -1.1199 -0.5377 -0.0892 -1.1023 -0.3960 -0.2297 -0.7584 -0.5099 -0.1378 0.6172 -2.5463 -0.0783 -0.8950 0.1970 1.2882 -1.4042 -1.1124 1.0359 -0.1307 -0.8806 -0.6255 1.2410 1.4488 0.1008 -2.9998 0.8010 2.1437 -0.3509 1.4044 1.3161 -0.0750 -0.2177 0.5946 -0.4663 -1.3945 0.4436 -1.1071 -0.2621 1.4483 1.6594 0.6883 -0.9691 0.2791 1.1609 -0.3196 -1.2488 -1.5964 -2.3384 0.9904 -1.7268 -0.7466 0.5952 -0.2943 -0.2730 -0.7540 0.0166 -1.7756 -2.3778 0.1321 -0.6057 -0.6925 0.5735 -0.8120 -0.2795 0.8401 -2.2988 0.0914 0.2072 0.9616 0.6877 1.4657 -0.6279 1.0405 -0.7480 0.9292 0.9367 0.8595 -0.1374 1.1324 -0.5960 0.7194 0.2726 -0.3086 -0.6210 0.3598 -1.2108 -2.8161 -2.5589 0.6771 0.3603 -0.0156 -0.4139 0.0916 -0.4206 -0.5061 -0.7423 -2.9337 0.2155 1.2836 1.6510 -0.9017 -0.5960 0.2818 0.3755 0.8816 0.2964 -0.3622 -0.0476 0.0618 -0.5494 0.6586 -1.8335 0.6810 0.3316 -0.6508 -1.3772 -0.1871 -0.9968 1.0306 -0.2673 -0.8524 -1.5275 0.2600 0.8923 2.1226 1.9431 -0.9672 0.6786 -0.5405 0.3345 -1.9833 1.3261 -0.4301 0.9814 1.3066 0.2508 -0.4243 0.6643 0.7575 -0.5239 -0.5257 0.3649 -0.1431 0.0193 -0.4501 -0.3333 1.0639 0.4743 0.5991 0.7852 1.5088 1.4432 -1.3803 0.9425 0.6047 1.2219 -0.0431 1.3549 -0.0861 0.5349 -0.7065 1.2252 -0.5919 0.5757 -1.8911 -0.3534 0.5467 -0.6732 -0.2967 -0.0703 1.1049 1.2355 -0.0381 -0.4934 -0.5166 1.2935 1.2344 -0.4198 1.0801 0.9260 0.9777 1.5800 0.4936 0.3089 -1.2300 -1.2864 -0.1812 0.2872 0.0531 0.2945 -0.0724 -0.3405 -0.9322 1.4255 -0.7839 -0.9160 0.7105 1.2103 0.3414 -1.0585 0.1017 -0.2940 -0.3657 0.5823 0.7845 -0.1996 2.7291 -0.7698 0.7822 -0.1362 -0.2844 -0.3821 0.1219 1.0500 1.2410 -1.2306 0.1459 1.2720 -0.1072 -0.0333 1.4759 0.9891 0.1074 -0.2905 0.1693 -0.0079 0.8074 1.6287 0.2151 1.3585 0.9021 -0.6264 -0.6552 -0.5447 -0.5757 0.2252 -1.0434 -0.4627 -1.3674 0.0214 1.6008 0.6473 -1.2855 0.3634 2.7585 0.6023 0.5608 0.0545 0.7253 0.4663 -0.7009 -0.8330 0.9602 1.1691 0.1982 -0.4624 -0.2485 -1.4031 0.4944 -0.1786 0.5941 0.9696 1.7111 -0.5537 -0.2403 -0.3049 0.6511 1.2070 -0.5312 0.2270 -1.2573 1.3260 0.1536 -0.8994 0.4408 0.5905 0.1168 -0.3500 0.2706 0.0789 0.1475 0.8243 0.0585 -2.6542 0.3914 0.7688 -0.6555 0.5358 0.2156 0.0489 0.4259 0.9759 0.8965 0.3559 -0.2138 -1.0271 -0.8029 -0.5650 -1.2414 0.2237 0.7662 -0.3203 -0.5614 -0.9561 0.7767 0.7173 0.5420 -1.0591 -0.1615 0.3977 -1.2232 1.0527 -0.3400 1.0349 0.4037 -0.0482 -0.5069 1.2959 gamma-glutamylthreonine -0.0214 -1.6052 -0.8617 -0.2458 0.3371 -2.4106 0.9060 -2.0883 -1.4335 -1.4902 0.2371 -1.4944 1.1729 0.0500 0.1105 -0.2876 -0.1008 0.2410 0.1884 -0.6746 -1.6392 -1.4259 1.0638 -0.4320 0.9101 0.9530 0.1495 -0.1434 -0.5294 -0.6486 -0.1870 -0.2360 0.8617 -0.9100 0.2154 -0.7432 -1.3897 2.4740 -0.2560 -0.9951 -0.6447 0.0755 0.8849 0.1242 0.4449 1.1600 -0.4700 0.9397 -0.6858 0.6379 -0.3505 -0.2506 0.5169 -0.0847 -0.6948 0.5242 -0.4859 -0.8447 0.0692 -1.5008 0.6465 0.4686 -2.0848 -0.9936 -0.9618 0.7378 1.4779 0.6683 -0.5068 -1.1162 -0.1687 0.8574 -0.0728 0.0749 0.4718 0.4184 1.1267 -0.7251 0.2578 0.6171 0.1927 0.1284 0.9919 0.4751 0.5414 0.7621 1.3921 0.2975 0.4559 0.9779 -0.1704 -1.4341 -1.1120 -1.6242 0.1453 -0.9865 -0.5924 -0.3048 0.2544 -0.3977 0.9918 0.1688 0.3639 0.7720 1.7493 0.2554 1.5289 0.2769 -1.3103 -0.3132 -1.3995 0.4398 -1.4135 0.4479 0.9741 0.8240 -0.1610 1.1127 -0.2852 0.5168 0.4637 1.1755 1.1967 0.2100 -1.8176 0.2020 -0.3679 -0.2033 0.5974 -1.1309 0.4517 -0.1339 0.5132 0.6375 -0.7738 1.2245 -0.6122 -0.5800 -0.1851 0.4993 -1.1092 -0.7646 -0.5758 -0.9554 -0.1724 -0.0369 -0.7021 1.2785 0.1563 0.0992 0.2185 -1.0697 -1.2620 -0.7746 -0.7922 -1.0868 0.4142 1.1069 -1.7257 -2.3201 -0.5674 0.5369 1.9299 1.0658 -1.8823 -0.4581 -0.9754 -0.2792 0.2670 0.3156 -0.1590 -0.3499 -0.4582 -1.6294 -1.0176 -0.1610 1.9599 -0.3929 0.8561 0.3686 0.4343 0.8018 0.8613 -0.4317 -0.3421 -0.6242 -1.1348 0.0455 -0.6238 0.4523 1.2927 -0.5226 -0.4425 -0.7160 1.1490 0.1927 -0.9396 -1.7068 1.0065 0.0922 -0.2478 0.3542 -0.9874 0.2691 1.7734 1.5199 0.6518 -0.5474 -0.6145 0.2336 0.3789 0.9632 2.1188 0.4617 0.0154 0.3594 -0.5816 1.4147 -1.2297 -0.8352 -0.7264 0.3066 0.1055 -0.5856 0.6657 0.4401 -0.9094 -0.2230 -0.0942 0.7522 -0.3447 0.5935 0.8524 0.6980 1.6411 2.5919 0.1323 -0.6327 -0.8310 -0.7062 -1.2387 -0.9832 1.1659 -0.6638 -0.7285 -0.4612 0.6962 -0.5101 -0.0217 0.4305 0.3536 0.0683 0.0348 2.1405 1.3252 1.4112 -0.5360 0.5613 0.7408 0.8197 -0.5028 0.6683 -0.9322 -0.3365 0.3193 -1.1620 0.0252 -0.0198 -0.1637 -0.1085 0.3140 0.5724 0.8618 0.2363 1.3106 0.4487 -1.4491 -0.4671 -0.0113 1.0456 0.8962 0.2256 -0.1957 -0.0511 -0.7283 1.9176 0.2156 -0.4736 -0.2023 0.3029 0.3798 0.0477 -0.3960 -1.0548 -1.1881 0.1912 -0.5470 1.1986 1.6407 -1.3285 0.2150 0.4244 0.5248 -0.8761 0.9951 -0.0523 -0.4561 -0.5807 0.2653 1.0729 -2.2134 -0.2033 0.2970 0.0180 -1.1076 -1.3641 0.4710 0.5216 1.3389 0.5405 0.7644 0.3825 0.6530 -0.3824 -0.1314 -0.1129 1.5191 0.5530 -0.7441 -0.2298 0.4279 -0.1885 0.9884 0.0986 0.6358 -0.1569 0.4891 1.7161 0.5157 -0.5749 0.9136 0.3294 0.7969 0.9639 0.2100 -0.0195 -0.3021 -0.0729 1.3241 -0.9125 0.8906 1.3787 -0.3323 0.7353 -2.1092 -0.0669 -0.8921 0.7522 0.4126 -0.0738 -1.4869 1.5376 0.5782 0.9496 -0.1899 0.3745 0.8981 0.2693 -0.8475 0.5927 -0.2244 0.3009 1.5911 0.3500 0.6628 -10.2238 -0.2200 0.6930 -1.2578 0.4219 0.4550 0.9657 -0.8494 1.0888 -0.1922 -0.5693 0.0108 -0.7623 0.2288 0.3122 -0.1999 -0.0067 0.1791 0.1830 0.1112 0.0531 0.3340 1.0498 -0.0896 -0.9135 -1.3135 -1.1610 -1.2154 -0.7863 0.2932 1.2470 0.8589 -0.5179 -1.0613 -0.6003 gamma-glutamyltyrosine 1.1871 0.5753 0.1490 -0.1339 0.2774 0.2266 1.0566 0.5518 0.1315 0.3806 0.2249 0.2665 -1.1863 -0.2585 0.9046 -0.0316 0.2139 0.4467 -1.9071 -0.3450 -0.6037 -0.4009 -2.4452 -0.2029 -1.3693 -0.2425 0.4639 0.0549 -0.3198 0.6654 -1.1187 -0.3263 0.9516 -0.6584 0.1449 0.3221 1.0743 0.2845 -0.1410 0.1597 -0.5353 -1.3532 -1.7877 0.8167 0.0102 0.7688 -0.1624 -1.0002 -0.9966 2.2510 -0.3261 -0.8879 -1.1178 -0.6226 -0.7679 0.1702 -0.0007 0.2033 -1.2608 0.1087 -2.6295 0.8702 -0.8999 0.4260 0.4956 0.2133 0.4667 -0.5024 -0.8535 -0.5795 -0.1691 -0.5988 -4.4410 -0.2410 0.4386 0.1427 -3.9375 1.1413 0.5783 0.4692 0.4907 -0.0655 0.7015 -0.6552 1.7277 -1.0901 -0.3684 0.6852 -0.3232 -2.0662 0.4565 0.1958 -0.0813 0.1521 0.4009 -0.0456 -0.3245 -1.2807 -0.6504 -0.7333 -0.7489 -0.6796 -1.0269 -0.3482 -0.9533 0.7485 -0.3313 0.4489 -0.6032 0.2153 0.2562 -1.1078 0.1029 0.2312 1.0430 -0.0264 0.5472 0.6959 0.1681 -0.9222 1.4361 1.6218 -1.5193 -0.4811 1.0922 -0.7628 -0.7058 0.2358 0.1430 1.2950 0.5977 1.0360 -0.8212 -1.7677 1.0999 1.8481 -2.3299 -0.5991 -0.5876 -1.3655 0.2019 -1.1496 -0.0999 0.6384 -0.8777 0.7344 -0.8643 0.7018 -2.2650 -0.0403 0.3046 -0.1425 0.5210 -0.6110 -0.1092 0.3391 1.5803 0.2621 0.2436 0.4939 1.5827 -0.3813 1.2880 -1.0024 0.1386 0.2471 1.6028 0.8247 -0.7089 0.1026 0.5759 -0.9568 0.4022 -0.2223 0.1201 0.6540 1.6131 -0.5511 -1.6625 -0.5794 1.3354 0.1400 -1.9108 0.4042 -0.3697 -0.9321 -0.8108 -0.5338 -3.1440 -0.0019 -0.4629 -0.0596 -0.3974 -0.2184 0.7070 -0.6920 -0.6290 -0.1853 0.4182 0.1262 -0.0747 0.1223 -0.1960 -0.0936 1.0179 0.3552 -0.3107 -0.9207 0.0852 0.5532 0.2113 0.3944 -1.3991 0.4128 1.2544 0.7048 1.0523 1.6973 -1.3870 0.7546 0.1452 0.2719 0.8560 1.3099 -0.4601 1.5695 1.1644 0.4537 0.5902 -0.0438 0.4861 -2.7769 -0.3451 0.7800 -1.1657 0.2594 -0.3678 -0.6015 1.2202 1.2778 -4.4786 -4.9128 0.1253 1.8155 0.4891 0.7450 1.4049 0.6203 -0.4364 -0.0332 0.4445 0.6000 -0.7208 0.9548 0.4301 0.4124 -0.2699 0.0599 -1.2952 -0.5894 -0.1871 -0.7172 1.1128 1.9291 0.9730 -0.0561 0.6356 0.5609 0.4419 0.3815 0.6163 0.8984 0.1232 1.8071 -0.1729 0.1884 0.2901 -0.2908 0.5878 0.4439 1.4455 0.0839 0.3964 0.4993 0.6848 0.3829 -1.2474 0.6005 0.7479 0.7802 -0.5612 -0.0202 0.7201 0.6738 0.2246 1.2477 0.7654 -0.5778 2.5233 -0.1185 0.5505 1.0682 0.5443 -1.7268 -0.0684 2.1147 0.2661 -1.7904 -0.8901 0.1801 0.3666 0.5708 2.3079 0.3259 -0.0723 0.6137 -0.7367 -0.6464 1.3145 0.1511 -1.3746 0.0418 0.7264 -0.1149 -1.0657 -0.8519 -0.8876 -0.2957 0.0114 -0.3664 0.5335 0.2629 1.1702 -0.4591 -0.0227 0.9063 0.7535 0.7269 1.6079 -0.1548 0.5773 1.1621 0.4500 0.4141 -0.2087 0.5893 -4.0535 0.7702 -1.2458 0.5046 0.0852 -0.2150 0.7318 0.2236 0.1457 0.5411 -0.2525 -1.2549 0.9330 1.1796 -0.1150 -0.1308 0.0097 0.0443 0.7632 -0.9176 -0.0985 1.3400 -0.1208 -0.7477 -0.7002 0.3960 -1.0067 1.1002 0.3442 -4.2939 0.1425 -0.1148 -0.6400 0.3491 -0.6105 0.1942 -0.0728 -0.3610 0.0763 -0.0347 0.7587 -0.4333 -0.0563 0.6309 -0.8632 0.0372 0.8461 0.4056 -1.5879 0.8389 0.3589 0.8702 -1.3022 -0.6007 0.0637 0.3525 -0.1522 0.4992 -0.9052 1.0943 -0.0038 0.2714 0.1858 1.2337 gamma-glutamylvaline 1.2163 0.6320 -0.1315 -0.1245 0.6333 -0.0148 -1.0932 0.3280 0.0422 0.6636 0.9206 -0.2062 0.3637 0.6097 0.0871 -0.0995 0.3121 0.8164 -1.7390 0.1405 -0.3134 -0.9037 -2.4614 -0.4077 -1.2735 0.1358 -1.5519 0.4490 0.1929 0.0290 -1.6929 0.1533 1.1890 0.3651 -0.9442 0.9649 -1.0257 0.4578 0.3541 0.2843 0.0216 -2.2455 -0.1495 0.6650 -0.2883 0.9963 0.5399 -0.8565 -1.7050 -4.2868 0.0158 -2.3873 -1.2100 0.3240 -0.3625 0.8349 -0.5139 0.1261 0.1069 -0.3131 -1.2628 0.1635 -0.1487 0.4478 0.7557 0.8532 0.5305 0.0922 0.0854 -1.8386 0.3092 -0.6082 -1.1848 0.5847 0.6653 0.3957 0.1061 0.3762 0.8377 0.8671 0.5864 0.8887 0.9685 -0.7872 1.6074 -2.8270 -0.0135 1.1847 0.9024 -2.2110 0.4218 -1.0122 0.1502 0.7801 -0.1121 0.3073 -1.3501 0.0441 0.0967 -1.1554 -2.2966 -4.6973 -1.3409 -0.4278 -1.2446 0.8128 0.9151 0.4312 0.0943 0.4033 0.1814 0.0353 0.1656 0.5863 0.9963 0.2706 0.5244 1.0182 0.8988 -0.8614 0.0780 0.9034 -1.5461 0.2958 0.0873 0.2038 -0.5202 -0.3304 0.5195 0.4388 -0.1921 1.1233 -0.3170 -0.2690 0.2343 1.1456 -2.3231 0.0185 -0.2042 -3.6208 -0.2398 -1.1978 0.1990 0.0191 0.0246 -0.0508 0.1814 -2.2620 -4.1742 -1.9624 0.4634 0.6059 1.0192 0.3005 0.2422 0.7380 1.1108 0.8014 0.2313 0.3418 0.9977 0.2575 2.4251 0.0870 0.3298 0.0196 0.4923 0.2077 -0.8338 0.6205 -0.5247 0.2573 -1.7193 -1.0532 -1.1168 0.8134 1.3205 0.2315 -1.5894 -0.2453 1.0359 0.5092 0.2485 0.6036 -1.3809 0.6018 -1.9274 0.6658 -0.1348 0.4846 0.2702 1.1594 -3.5725 0.4074 0.4980 0.3245 0.9183 -2.1472 0.9706 -0.3122 -0.3625 0.5542 -0.5141 -0.0147 0.0305 0.1682 0.1777 -2.6151 0.2918 1.0072 -0.4946 0.7492 -1.2711 0.2184 0.6732 0.5905 -0.1040 1.1717 -1.2848 0.8457 0.1329 0.2399 0.6481 0.7080 -1.4596 1.0368 -0.9169 0.0583 0.1786 0.8494 0.4568 0.1894 -2.1838 0.8266 -1.4387 0.5064 0.0774 0.0619 0.3861 1.0409 0.1414 0.7888 0.5154 1.8429 0.2688 0.5186 0.6245 0.2592 0.1696 0.1182 0.5903 0.4429 -2.0477 -0.0337 0.4443 0.6982 0.2604 -0.9903 1.0607 -0.0659 0.0804 0.4239 1.3613 0.4410 0.4634 0.0016 0.7424 0.5135 0.7596 -1.3677 -0.8697 0.3812 0.3871 0.5806 0.7393 -0.8058 -0.3623 -2.3277 -0.3867 0.3773 0.3696 -1.6837 0.1837 -0.0627 0.4733 2.2966 -0.2010 0.9018 0.6936 -0.5862 0.4842 -0.5640 0.7235 0.6053 -0.4352 0.5116 -0.6649 0.4085 1.9486 -2.2268 0.6778 0.4489 0.5092 1.1060 -0.2931 1.4227 -0.7817 -0.2442 0.1045 0.7327 0.6175 0.1151 1.2680 0.8027 0.6169 0.1808 0.3566 -0.2897 0.6167 0.1775 0.2826 0.9398 0.3197 0.0985 0.3707 0.3877 0.2916 0.3767 -0.0780 0.1896 0.1936 0.3764 0.6533 0.9684 0.3824 -0.4551 0.8229 0.5242 0.1168 0.1291 0.5863 -0.2602 0.2092 0.0946 0.2006 0.9623 0.6453 0.6712 0.3585 -0.3638 0.2707 1.0702 0.3820 0.3934 0.5904 0.4531 -0.1804 0.3012 0.6008 -0.3005 -0.2037 -1.7453 -0.0199 -1.2372 0.0957 0.1330 0.0056 0.9142 0.0660 -4.8126 0.4533 0.4937 0.2246 0.8468 -0.9766 -4.3430 0.4778 -0.2016 0.4053 0.2269 -0.3245 -0.7445 -0.1664 0.4651 0.6208 -0.9869 -0.0829 -0.1888 0.0104 0.6257 0.4125 0.4632 1.5290 -1.3367 -0.6939 0.5456 0.5398 0.7881 0.2960 -0.0312 0.3710 0.2079 -1.0007 -0.6280 -1.7582 0.7837 0.3660 0.3185 -0.2257 0.2216 gamma-tocopherol/beta-tocopherol -0.0902 1.2917 0.9349 0.1091 0.7136 -1.2058 -0.9742 -0.6819 0.8373 -0.0414 0.9096 0.4089 0.7748 0.1312 0.1346 -0.7108 0.4779 1.3981 -2.0587 -1.5689 0.2201 0.4874 1.0465 -0.8163 0.2516 -1.9973 -0.7641 1.3194 -0.5930 0.5507 0.3300 -0.5093 -0.3203 1.6022 -0.7209 -4.1723 -0.5368 0.3817 0.6692 0.6934 -1.6507 -0.4064 -0.0293 0.2946 -0.3280 1.7175 0.5021 0.6956 0.1392 -0.5651 -1.4468 0.5363 -1.0073 -0.0623 0.1394 0.2716 0.0631 0.2553 1.1802 0.8288 1.2653 1.2572 -0.5508 1.0704 0.0719 0.4333 -0.1931 0.8492 2.0814 1.5743 -1.2602 1.2328 1.2035 -0.6192 0.9899 -0.6667 0.2050 -1.5452 0.4764 0.2235 0.4703 0.7009 -1.3292 0.1257 -0.9368 -0.8200 -0.6702 1.8001 -0.0393 0.6016 0.5764 0.6438 -0.3026 0.2370 -0.1294 -1.0965 -1.1764 -0.0127 0.1221 0.5502 0.1603 -0.2676 -0.3670 0.8349 -0.5496 0.5317 0.9167 1.7451 -0.1594 0.2557 0.0473 0.8111 -0.1476 -0.2855 -0.3479 0.0603 0.7278 -0.3095 0.1973 -0.5137 0.5910 1.5010 0.4473 -0.8028 -0.4470 0.1368 1.1597 -0.0225 0.9198 -0.4453 -1.6411 -1.3948 -0.9396 1.8651 -0.5462 -0.7251 0.6165 0.9097 -0.1141 1.0289 0.8125 -0.8073 0.3736 -0.1643 0.3581 -0.2171 1.5022 -1.2668 1.6157 -0.6723 0.2042 1.4926 1.6543 0.2279 0.6792 -0.0833 -0.5615 1.6412 -0.1603 1.2451 0.2383 -0.7971 1.4120 -0.2173 -0.0898 0.4893 -0.4592 0.4371 -0.4935 0.7468 0.6594 -0.7992 -0.5506 -2.1142 0.8422 1.2327 -0.1392 -0.6746 -0.9512 0.9454 0.1818 -1.4199 -0.3879 -0.3779 1.1199 -0.3175 -0.3688 0.4605 0.8896 0.5615 0.3431 0.1886 1.1584 0.2624 -0.8491 -0.4239 -0.4420 -0.5859 1.4151 1.2396 -0.3190 -0.1192 -0.7090 0.5074 0.4392 1.9217 0.1842 0.2333 0.9578 0.7851 0.9023 1.2871 0.6069 1.3332 1.0745 0.2579 0.3438 -0.4678 -0.5419 0.9253 0.3303 0.9266 -0.2716 0.1341 -0.0176 1.1208 -1.0820 -0.0617 -0.6134 -0.7729 1.5310 -0.1747 -1.0039 0.3695 0.7444 1.1832 -0.4992 0.3913 1.1676 -1.4940 -0.9768 0.9872 -0.1761 -2.4279 0.3029 0.3419 -1.2088 -1.2204 -0.0847 -0.9859 -0.6192 -0.1298 -0.6916 -0.6997 0.6329 -0.1652 -0.6946 -0.4544 0.5968 -1.0486 0.4670 -0.5680 -1.2530 0.3346 1.2635 -0.8322 1.4162 0.7723 0.1656 0.5109 -1.8567 0.0148 0.5540 -1.4143 0.3677 -0.7378 -0.0888 -0.8073 -0.2043 0.1827 -0.7123 -0.9133 -0.1605 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1.3007 -1.0152 1.6782 0.2765 0.4473 -0.6106 1.0172 0.5303 -0.8750 -0.9717 1.8511 0.6016 -1.1183 -0.8894 0.9382 0.6291 1.4634 1.2260 1.3776 0.7102 0.4298 0.8459 1.2971 1.3438 0.5881 -0.9394 1.4671 0.7372 1.5836 0.0666 -1.2273 -0.9354 1.1506 -0.6783 0.7765 -1.0928 0.7014 1.2290 -0.9233 0.8058 0.2885 -1.1319 1.0842 1.3626 1.8483 2.0298 1.0253 -1.1474 -0.8531 0.4548 1.8809 1.0478 0.8097 -0.6070 -0.9683 -1.0381 1.6239 0.8260 -1.0627 -0.8289 -0.8745 0.3966 -0.9306 -1.1809 -1.0751 -0.7479 1.3576 -1.0309 1.6449 -1.1202 0.4361 -0.3970 0.4002 0.1921 -0.7533 1.3779 1.0703 -0.8481 -0.9188 -1.0935 -0.8389 1.1213 -0.7766 -0.8543 -1.0997 -0.6484 -1.2547 1.0106 1.2114 -0.5882 -0.9008 -0.8462 0.7405 -0.8831 1.0014 -1.0225 -1.0699 0.8791 2.1557 -1.1331 1.4046 0.6677 -0.9865 -0.9632 -1.2943 -0.8123 1.9235 -1.0692 -0.7603 -0.9357 -0.9372 -0.9074 0.7420 0.7829 0.6937 0.8840 -0.8080 -0.8816 0.3903 0.5296 -1.1426 0.8516 -1.0506 -0.9756 -0.9915 0.7246 -1.0613 0.4290 -0.2693 -0.0225 1.2510 -1.0656 1.5454 -0.6183 1.8181 2.1511 -0.7408 1.8420 0.3194 -0.9537 0.9767 -0.9952 0.3614 0.4392 0.0629 0.3662 -0.7187 -0.7386 -0.8129 -0.0637 0.5242 -0.7547 -0.8973 -0.7353 0.5771 -0.5031 -0.8820 0.6564 -0.0079 -0.9307 1.2106 0.0997 1.3685 -1.0135 1.3192 0.0283 0.6262 0.7620 1.0118 1.3505 1.2591 -0.6443 -0.1757 0.7460 -0.8573 2.5667 -0.8535 0.6372 -0.2141 0.6828 0.9814 -1.1563 -0.9595 0.8784 -0.7396 -0.8187 0.9748 0.9358 1.3500 -0.3726 -0.7516 -1.0281 -0.8644 1.4185 -0.9394 -0.6510 1.6093 -0.7302 0.8311 0.4783 0.7930 1.1525 1.0618 0.5003 -0.9103 1.1246 -0.8863 0.0749 1.2019 1.2146 -1.0939 0.1717 -1.1866 -1.1473 0.0342 1.2136 -0.9977 0.7924 -0.7591 -1.1793 1.4643 -1.1666 0.5425 -1.1981 0.7715 0.9224 -0.2941 1.4740 1.6609 0.3980 0.3609 1.0826 -0.9892 1.5362 1.0735 -0.8325 -0.9948 -0.2150 -0.9668 1.1366 -1.0483 -0.9542 0.3441 -1.1398 -1.1301 0.2687 -1.0188 -1.0845 0.6219 -0.9854 -1.0197 0.9817 0.2656 0.6081 -0.9229 -1.1211 -0.1595 1.5064 1.6629 -1.2043 0.4595 -0.6457 0.3542 -1.1401 -0.9067 -0.6274 -1.0662 0.3576 0.6799 0.2992 0.1330 1.1221 -0.9999 0.5189 -1.1285 -0.7150 0.4615 1.1870 0.8713 -1.0915 -1.2334 -0.9180 0.7226 -0.9540 0.2806 1.1174 -1.1523 -1.1424 0.5616 0.3996 -0.9263 0.8402 -1.0527 1.3622 0.7431 0.5196 -0.9482 0.8184 -0.9733 -0.1679 -0.9509 0.8044 0.1633 1.2482 -1.1135 -1.1729 -0.9058 1.3063 0.6020 -1.0993 -1.2262 1.3532 0.5315 -0.9737 2.2705 0.1440 -0.9404 -1.0950 -1.4012 0.5087 -1.0133 -0.6445 0.7298 -0.9742 0.1737 -0.2082 1.3143 2.2919 -0.9645 -0.7996 1.3852 0.6447 -0.7378 1.4288 1.3766 -0.8148 -0.2136 0.3904 -1.1432 0.1141 0.4151 0.4029 -0.8134 -1.1059 -1.0584 -1.1518 -0.7658 -0.3985 -1.0544 -1.2622 -1.0665 0.6477 -1.1992 0.9685 -0.1128 0.5811 -1.0913 -1.0602 -0.9763 1.5403 -1.0425 0.8346 -1.1757 0.6305 0.6191 -1.2120 -0.8526 0.7676 -0.9511 -0.9549 -1.3107 -0.8606 -0.5450 -1.1758 1.0300 0.0982 -0.9905 0.7500 1.8287 0.8328 -1.3541 1.4441 1.4695 -1.0480 1.0437 -1.2676 0.7669 0.6408 -0.5889 -1.0472 0.4727 -1.1691 -1.2763 0.5520 -1.3467 -1.0631 -1.2799 -1.0720 0.8573 1.6724 0.2133 0.4836 0.3466 -1.0360 -1.0016 -1.2863 gluconate 1.3978 0.3633 -0.2694 -0.8714 -0.5643 1.1314 -1.5400 0.7256 -0.0547 0.7861 1.9923 -0.6941 -0.7446 0.7565 0.6988 0.0931 -0.6418 0.0687 -0.5510 0.2979 2.6609 1.3073 1.0379 -0.4538 0.1819 0.2516 0.6980 1.4419 0.4439 1.1427 -0.1257 -0.4017 0.8416 -0.4039 -0.6516 0.8453 0.8815 1.0019 0.5271 -0.9843 0.8792 2.1459 -0.4732 -0.5526 -1.4499 1.2027 1.2018 0.7507 0.3634 0.6334 0.4695 1.4215 0.7913 0.1147 0.1821 0.1998 1.0790 -0.7349 0.5171 -1.3026 -1.3562 0.2851 0.3665 -0.1159 -0.8574 -0.5668 -0.3161 -0.2690 1.3765 0.8613 0.0716 0.8752 1.3079 -0.4499 1.2910 0.5691 0.4856 -1.2191 -0.5348 0.0344 0.3245 0.1937 0.4682 -1.2380 -0.7030 1.0785 1.6114 0.5361 -0.5797 1.1345 -0.2035 1.2912 0.6516 3.0169 1.1441 0.9005 0.5613 0.5566 -0.0218 0.7628 0.4081 0.8589 -0.6997 -0.2062 1.1787 -1.8858 1.5340 0.1081 -0.3860 1.7664 1.4395 1.6997 -0.0192 -0.7648 0.1524 -1.0356 0.7852 -0.2139 1.7033 -1.5780 0.2386 0.4785 0.4400 -1.3864 1.2508 1.7906 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-1.0838 -0.5561 0.3506 -0.4112 -1.2260 -0.1217 -2.3373 0.2531 -0.4079 1.0920 -1.0397 -0.6491 0.4901 1.2340 0.9860 -0.4358 -0.3581 -1.0494 -0.9107 -0.2013 -0.0373 glucose 0.0917 0.1280 -3.5537 -0.4980 0.6113 -4.9624 0.0647 -5.6254 -0.3804 -5.1859 -6.2081 -0.9247 0.2543 0.0393 0.6682 0.6179 -1.2150 0.3731 0.1188 -0.0109 0.7824 0.7066 -0.2520 0.1939 0.7162 0.3348 -0.2992 0.4555 -0.2269 0.1671 0.4158 0.3213 0.5902 0.1665 0.0962 -4.5189 -0.1865 0.3126 0.5963 -0.2798 0.0070 0.7750 0.3680 -0.0309 0.1249 -0.1401 0.8332 0.5974 0.1811 0.1692 0.3840 -0.0077 0.9096 -0.8682 0.2648 0.1059 0.2745 0.5416 0.5349 -0.5047 0.1170 -0.0855 0.6567 -4.7181 0.5449 0.3420 0.1425 0.6734 0.7951 0.2520 -0.3463 0.3410 0.5297 -0.0329 0.6979 0.6365 0.4931 -0.0202 0.2368 0.2790 0.9132 -1.4096 0.0807 -0.2066 -1.8248 -0.1166 0.1507 0.6518 0.5835 0.4285 -0.0748 -0.0439 0.6470 0.7361 -0.6990 0.2857 -0.0564 0.2306 0.9172 0.6494 0.5216 -0.4067 0.4720 0.6363 0.1661 -0.4484 -4.5059 0.5794 -0.1242 0.3528 -0.7601 0.6215 0.7074 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0.1330 -0.0724 0.3891 -0.2923 0.2552 0.5884 0.4907 0.4577 0.1067 0.1078 0.6051 0.2533 0.1980 0.1586 0.5024 0.5517 0.1606 0.1378 -0.4963 -0.1187 0.1726 0.1705 0.4236 0.8614 0.2132 0.4671 0.1171 0.5106 0.1072 0.4766 0.1067 -0.2607 0.4983 1.1415 0.5008 0.3390 0.2361 0.5018 0.4270 0.3969 0.7416 -0.1147 0.2603 0.5347 0.8401 0.2718 -0.8456 0.8584 0.1484 -0.4192 0.3410 0.5972 0.1567 0.1558 0.2307 0.6630 -1.1657 0.7743 -0.6158 0.1550 -0.1808 0.6672 0.1219 0.0711 0.1463 -0.2547 0.1273 0.2635 0.4306 -0.3454 1.3071 -1.5927 0.4414 0.7280 -0.0839 -0.5177 0.8023 0.4146 0.6299 0.6464 0.6717 0.1874 -0.1203 -0.1324 0.5366 0.1848 -5.2803 0.1345 -0.2318 -0.0449 0.4943 -0.7423 0.0787 -0.1774 -0.1339 0.0727 0.4332 0.7087 0.3312 0.1395 0.5881 1.1832 -0.4357 -0.2584 -0.5716 -0.2379 -0.4039 0.2125 -0.4564 -0.2327 0.4099 0.2697 0.3743 0.0044 0.4707 0.3461 0.0593 0.6723 -0.7776 -0.5383 -2.4622 0.5825 0.0397 -1.1295 0.0412 -4.8256 -0.5703 -1.7577 -2.8910 0.3792 0.0299 0.1302 0.1982 -0.8864 0.1775 -0.4241 0.0089 -0.1500 0.2276 0.0147 0.2561 0.0626 0.4083 0.5201 0.5898 -0.2514 0.1771 0.7505 0.5834 0.5808 -1.1039 -1.6027 -0.3643 -0.3693 -0.5096 -0.6210 -0.2625 0.5376 0.1744 -0.9813 glucuronate -0.0411 -0.9321 0.5247 0.1784 -0.7205 -0.7417 0.1496 -0.0787 -0.9558 0.1705 -1.8753 -0.0727 0.5866 -0.3364 -0.6871 0.3355 -0.8616 -0.8585 -1.3024 0.3255 0.9475 0.5294 0.7283 0.5311 0.0630 0.1599 0.3503 0.0412 0.4425 -1.3635 0.4395 0.3748 0.0180 -0.4138 0.3747 -2.9187 0.6836 0.4722 0.3576 -0.9329 -0.6052 -0.6587 -1.3286 -1.6221 -0.8137 -0.2415 -0.6701 0.8601 1.1308 7.6840 0.1325 -0.3722 0.2557 0.5905 -1.3737 -0.1990 -0.1388 -0.0707 -0.3714 1.0500 -0.2864 0.5624 0.2192 -0.2961 1.8837 0.4166 -0.5892 0.5876 -0.1354 -0.3703 -0.9960 0.4955 -0.7718 -0.1668 -0.1393 -0.5235 0.9517 1.1446 -1.3130 0.5079 -1.2250 -1.0378 -1.3565 -1.6871 -1.3522 0.9086 0.1030 0.3546 0.1891 0.5429 1.2814 0.1600 -1.2930 0.0922 -0.5234 -0.2885 0.5848 -0.4406 0.7773 -0.8732 -0.6076 2.6453 0.1265 1.0493 0.3845 0.2231 -0.4370 0.1935 -1.0350 0.0370 -0.0815 1.3858 -0.2094 0.2732 0.0013 -0.3439 0.8760 0.6827 -0.8865 -0.4012 -0.7074 -0.4250 -0.4112 0.2592 -1.6633 -0.2241 0.7107 1.6284 -0.5924 -2.2266 0.5690 -1.7145 0.7801 0.4401 -0.0745 1.0994 -0.1509 -0.4286 0.1299 0.3261 0.6641 -0.5299 -0.0548 -2.0897 -0.5366 0.6516 -1.9390 0.2445 -0.4166 -0.3975 0.2853 0.0347 -0.6306 0.4787 -1.0553 -0.4127 -1.3342 -0.6024 -0.2182 -0.3262 -0.6787 1.6372 1.4465 0.6392 0.0209 0.1352 -0.0843 0.4971 1.5230 -1.5758 0.2307 -0.1781 0.6870 -1.3484 2.3064 -0.1234 -0.1230 -0.7765 -1.6385 1.6496 0.6351 0.3973 -0.0579 -1.0940 1.0691 2.5638 -0.2156 -0.4535 -0.2319 0.0080 2.1819 1.2704 -0.6041 -0.3095 -0.2988 0.1317 -1.4603 1.0694 -0.2623 -1.2531 -0.3320 -0.7967 0.3246 -0.4190 0.2418 0.3024 -0.2039 0.0233 -0.6273 0.8578 -0.2108 -0.0094 -0.1509 0.6783 0.4664 1.3627 1.4387 0.5719 0.3907 0.3383 -0.4919 0.4265 -1.4106 0.3075 -0.2424 -0.1919 0.9241 0.5973 1.0348 -0.3912 -0.1638 0.0556 0.7071 0.3826 -1.0865 -0.2203 -1.0334 -0.0503 0.5987 -0.1717 -1.8211 -0.8887 0.8356 -1.3111 -0.0868 -1.0553 -0.1350 0.2564 -0.3923 -0.5406 -1.3406 -0.6885 -0.2444 -0.5282 -1.8345 0.6781 -1.8869 -0.5802 0.5894 0.3180 -0.2200 0.6004 1.7325 -0.8184 -1.9678 -0.4079 -0.7722 0.2218 -0.7953 0.4918 -1.8327 -0.2711 -0.8480 0.2118 0.8750 -0.3550 -0.5734 1.8865 0.0762 -0.0848 -1.2257 1.2605 0.6327 1.0058 -0.1458 -0.1827 0.0795 1.2722 -0.6621 0.8480 0.4466 -0.0385 0.5749 -0.9506 -0.4720 1.0226 0.0736 1.6741 1.0150 0.1861 1.3779 -1.7293 0.2414 -0.3387 -0.4066 0.4362 -0.8971 1.5041 -0.3277 0.0393 -1.7696 0.5650 -0.7627 -0.9319 1.1285 -0.1774 0.0157 -0.1850 1.3007 -0.2335 0.1461 -0.2472 1.0581 3.5465 1.8402 -1.1763 1.4703 -1.4863 -0.9627 -0.2180 -1.3938 1.7529 0.9798 -0.2192 -0.6682 1.2120 0.6094 0.6593 1.3176 -1.4282 1.0880 0.0367 0.3001 0.0087 -1.1258 1.9450 0.0026 0.1537 -0.4990 0.3084 -0.1627 0.2879 -1.5322 -0.4782 1.5962 0.0508 -0.6634 1.0233 0.7571 -0.3239 -0.2254 -1.8204 -0.8003 1.3897 -1.0230 1.3110 0.2436 0.0701 -0.6038 -0.4122 -1.3936 2.5490 -0.1642 -0.7154 1.0319 -1.4908 0.0398 0.2671 0.0639 0.9831 -0.7123 2.6330 3.5353 0.0309 0.2067 -0.2033 -0.6056 -1.1202 -1.1074 -0.3037 -1.3175 0.1343 0.0661 0.5797 0.9746 -1.2721 0.6734 -0.0109 -0.9665 1.6342 0.5919 -0.4288 -0.7801 0.9096 0.1298 -0.7058 -0.1851 0.3299 -0.4916 -0.0431 glucuronide of C10H18O2 (1)* 0.8979 0.3703 0.8892 0.3919 -0.6366 2.1690 -1.2665 0.5403 0.5642 1.1884 1.2256 2.5099 -1.0125 1.0535 -1.2784 0.6411 0.6142 -0.4582 0.3817 0.4762 -0.6113 0.2825 -0.1175 0.1271 -0.2077 0.2461 -1.2367 -0.9626 0.7700 0.8793 0.7578 1.1812 -0.7014 1.0215 -0.4551 1.1194 0.5803 0.6529 0.5843 -1.2522 0.5423 -0.6317 -1.0717 -1.2525 -0.9188 -1.2704 0.1779 0.7864 1.1443 0.7666 0.6467 0.4715 1.0578 0.7419 1.4984 -0.7990 1.0194 -0.7642 1.1772 -1.1684 1.0229 -0.2465 1.6742 1.6775 -1.0344 1.3636 -0.5165 -1.3383 -1.2343 0.8480 -0.6319 0.5344 0.7378 0.0887 -1.0700 -0.1182 -0.9210 -1.0531 0.4585 -1.1132 -1.1130 0.7211 0.6170 -1.2362 -0.1088 -0.5758 0.9986 -0.0980 -1.2568 -0.7918 -0.6234 0.3757 0.1013 0.1920 0.8035 0.8901 -1.0434 1.6894 0.7058 1.0033 1.5362 1.2186 0.9245 -1.2889 -0.9645 -0.4870 0.7769 -1.1106 0.6233 0.7259 0.1821 0.6778 0.3565 0.7480 -0.0321 0.5742 -0.8973 -1.0063 0.7698 -1.2968 -0.0799 -1.0164 -0.4341 1.8223 0.1513 0.4421 0.3873 -0.3781 -1.1630 -1.2896 -0.4675 0.3141 -0.7954 0.5069 -1.1170 -1.2128 -1.0341 1.0898 0.3025 1.6135 1.7825 0.7751 0.3213 0.4329 0.9273 0.4696 -1.0583 1.9026 -0.2515 -0.9320 -0.0746 -0.8826 -0.9727 1.1454 0.0309 -0.9054 0.1327 0.5115 0.8452 -0.6759 0.6947 0.7074 -0.2070 0.6126 0.9986 -1.2480 -0.0008 2.1408 1.5492 0.4858 -1.2519 1.3739 1.9900 1.6916 0.6218 -0.8068 -0.8721 1.7520 0.0492 -0.0161 0.3835 0.1762 1.2509 0.7222 0.6929 -0.2232 0.3707 0.6564 0.9117 -0.0560 -0.5785 0.9546 0.5728 0.6492 -0.9078 0.4139 1.3148 -1.3150 -1.0949 0.7820 -1.2064 0.0337 0.0456 -1.0413 -1.1249 -0.7901 -1.1276 1.6018 1.0150 1.4502 -1.0313 -1.0825 0.7596 -1.1384 -1.2492 -1.1358 0.8164 -0.0825 -1.3484 0.5143 -0.1753 -0.3930 -0.8994 1.1721 -0.8722 -1.3245 1.5812 -0.0712 -1.1793 -1.0550 -0.3773 -0.9429 0.0891 -1.1837 -1.2705 -0.3255 0.3280 -1.0061 1.4334 -0.9765 0.3914 0.4027 0.2760 -1.3789 0.4928 1.3084 0.3108 0.8424 0.9572 -1.1727 0.2577 -0.5243 0.5204 -0.5378 -1.1738 -1.0360 0.3783 -1.1536 -0.5280 0.8278 0.0523 0.1836 1.4201 -0.2572 -1.1894 0.6000 -0.1213 1.4331 -0.2316 2.1309 0.3836 -1.0150 -0.5808 -1.1981 0.0914 0.7028 -1.1567 2.9733 0.1696 -0.5447 -1.2861 0.3864 -1.2929 -1.2634 0.4084 -1.0627 -0.3277 -1.1138 0.7603 0.3583 -0.4284 -1.2971 1.0406 0.9175 0.9911 -0.8623 0.4243 -1.4818 0.3259 -0.7537 1.3446 -0.7247 -1.1435 -1.2361 -1.1074 1.4509 0.9004 -0.8855 -1.2359 -1.3170 -1.0514 -1.2542 -0.3480 -1.2488 -1.3577 0.8337 0.3859 0.2985 -1.0333 -0.2196 -1.1012 0.6745 -1.5231 -1.3011 0.9347 -1.4033 1.8486 -0.0812 -1.1699 -1.2692 -0.0836 -1.0184 -1.0965 1.4727 1.4107 0.0816 0.6189 -0.2689 -0.2443 1.6785 -1.1006 -1.4392 -0.6340 0.3879 0.2687 1.3513 1.3137 -1.2562 -1.2014 0.8534 -0.9122 -0.5725 1.0425 -0.8340 0.4865 1.7502 -0.1956 -1.2263 0.9517 0.2449 1.0695 -1.1881 -1.1292 -0.3578 -1.1795 2.1080 -1.3084 -1.3685 0.3964 1.1267 1.0171 -1.2119 -1.0898 0.6505 0.7291 0.5642 1.0591 -0.0313 0.8049 -0.9095 0.9816 2.3418 3.2829 -0.3314 -0.8552 -1.4765 -1.4737 -1.1891 0.6626 -1.4066 -0.9200 -1.1002 -0.7321 -0.6182 2.7291 -0.9933 -1.4130 -1.1982 -0.7440 -1.2331 0.5793 0.0678 1.2391 -1.2761 -0.4562 -0.6166 -0.4854 -1.1829 0.6341 1.1744 glucuronide of C10H18O2 (7)* -0.6640 -1.0621 1.1752 -0.7831 -0.5744 1.7861 0.0016 0.0017 0.8712 -0.6318 0.2051 1.9722 -0.7997 0.2312 -0.9647 0.8886 0.1358 -0.8254 0.7446 -0.7081 0.7196 1.0887 0.6012 0.6005 0.7393 0.9041 -0.9398 -0.7723 0.9920 0.4671 1.0935 1.9104 -0.6133 1.6894 -1.0180 0.9140 0.6217 0.9025 0.5438 -0.9502 0.7262 -0.5681 -0.8378 -0.9482 -0.7443 -0.9578 0.4503 1.0340 1.0983 -0.2925 1.2881 0.3124 1.0557 0.6996 1.5081 -0.9255 1.4831 -0.6511 1.4865 -0.8940 1.1709 0.4161 1.6191 1.5949 -0.8170 1.2858 -0.8519 -1.0025 -0.9392 1.3585 -0.8380 0.8846 0.9233 -0.2808 -0.2680 0.8823 0.9029 -0.1262 1.2433 -0.8631 -0.8669 0.6024 -0.8304 -0.9376 -0.7718 -0.9023 0.9523 0.8432 -0.9526 -0.6657 -1.0353 0.7069 -0.3647 0.9174 1.0629 1.5083 -0.8188 1.4045 1.4642 1.4490 1.3908 1.0211 1.1041 -0.9721 -0.5938 -0.7790 -0.8659 -0.8615 -1.0424 0.5712 -0.9502 0.8539 0.9824 -0.8350 -0.3071 0.6827 1.3997 -0.7978 0.6824 -0.4662 -0.7610 -0.8016 1.1835 1.9069 -0.4246 0.2668 0.8426 -0.8654 -0.8977 -0.2199 -0.9135 0.5428 -0.6673 0.8734 -0.8645 0.0952 -0.8148 0.6638 0.6593 1.1090 1.2259 0.8813 1.3718 -0.8514 0.7321 -0.8735 -0.8308 1.8592 0.2206 -0.7545 0.7381 -0.7213 0.7218 1.6358 -0.8665 -0.7364 -0.8252 0.9636 0.9298 -0.5998 1.4213 1.5841 1.0839 -0.8329 -0.1467 -0.9466 -0.9180 2.2466 1.1405 0.5964 -0.9491 0.1224 2.3051 1.2152 -0.9329 -0.6781 -0.7164 1.4004 0.8939 0.7861 0.5647 0.2289 1.1801 1.3798 1.6959 -0.9764 -0.8526 1.4682 -0.7204 -0.7750 -1.0078 0.7286 0.8912 1.3113 -0.7389 -0.8901 -0.7954 -0.9865 -0.8532 1.6751 -0.5063 -0.7302 -0.7571 -0.8246 0.1938 -0.6678 -0.8725 1.2391 0.9515 1.8594 -0.8126 0.1574 1.7960 -0.8791 -0.9477 -0.8794 0.5623 0.0559 -1.0059 -0.9334 -0.8734 -0.9075 0.9409 0.2399 -1.0380 -0.9942 1.6094 -1.0073 -0.9040 -0.8261 -0.8738 -0.7574 1.0496 -0.9080 -0.9599 -0.9674 -0.8762 -0.7945 1.2439 -0.7788 -0.8759 0.8806 0.1405 -0.3283 1.6242 1.3838 0.2910 -0.9667 1.5275 -0.8977 -0.8938 -0.9285 0.4191 -0.8700 -0.9013 -0.8165 -0.8922 -0.8876 -0.8294 -0.9482 1.1859 -0.7709 1.4580 -1.0120 0.5123 0.6113 -0.9297 0.9758 -0.4173 1.8862 -0.9165 -0.8037 -0.9424 -0.9148 0.7343 -0.8908 -0.8913 2.7573 -0.9455 -0.7208 -0.9674 -0.9479 -0.3068 -0.9592 0.8497 -0.8317 -0.9215 -0.1469 1.1728 0.7660 -0.9729 -0.9769 0.9873 -0.9636 0.5687 -1.0530 -0.9077 0.3673 0.8122 -0.2334 -0.8383 -0.1956 -0.8855 -0.9359 -0.8611 2.0239 1.1045 0.6373 -0.9339 -0.9872 -0.8249 -0.9513 -0.5326 -0.2912 -1.0100 0.2405 1.6159 -0.8669 -0.8144 -0.9225 -0.8580 -0.9311 -1.1096 -0.9786 0.8209 -1.0401 2.2057 -0.8610 -0.8989 -0.9601 0.4679 -0.0166 -0.8502 -0.7474 1.3504 0.6320 -0.2155 0.2040 0.1290 1.3182 -0.2673 -1.0624 -0.9630 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-2.3980 -1.0885 0.8215 -0.2846 3.7276 0.5235 -0.9315 -0.2681 -0.7512 -1.1235 -0.8319 -0.5998 -0.6369 -1.1478 -0.3339 -1.7802 0.0953 -0.3797 -0.8789 -0.1717 -0.3459 -3.7514 -2.0637 -1.6270 -0.8558 -0.1945 -0.0308 -1.3328 -1.6665 -1.2728 -1.1684 1.3625 -0.9462 -0.6705 1.3308 0.8543 -1.5612 0.2088 2.1651 glycerophosphoethanolamine 0.6177 0.0571 -0.6041 0.0361 1.1075 -0.7927 -0.6202 0.2515 -0.0778 0.6299 0.6236 0.5089 -0.0463 -0.9777 -0.2103 -0.9082 -1.2667 -0.6073 0.6523 0.0611 0.6307 -0.8106 1.3895 0.8842 -0.4656 0.4009 -1.0552 1.5401 1.1332 0.3699 0.7304 1.5022 -0.7825 -0.6814 0.3856 2.3025 0.5259 0.2231 0.3925 0.4195 1.0557 0.0931 0.4136 -0.5785 1.0037 0.0845 1.6814 0.6872 1.4130 -2.6417 0.8607 0.2912 -1.9885 1.0078 1.2342 0.6325 0.4418 1.2645 -0.0704 -0.1478 1.1029 -1.1926 -0.3722 0.0807 0.2592 0.1666 0.6425 0.9912 1.6251 1.0848 0.6645 0.7491 1.0592 -0.1729 -0.1644 0.0710 1.3848 -0.2498 1.2777 0.1561 -0.9019 0.2485 0.0585 -0.3041 1.7390 -0.0523 1.2198 -1.1871 1.0996 0.8568 0.3068 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1.3163 -0.4087 0.1037 -0.1612 -0.0873 0.6925 -0.1251 -0.5782 -0.5756 0.1948 0.9882 -1.3017 -0.8610 0.7235 -1.5825 -1.1225 1.2894 -1.4017 -1.3752 0.3319 -0.5576 -2.3023 0.1388 -0.1044 0.1501 -0.0425 -1.0872 1.1679 0.5664 -1.3807 -0.0956 0.0954 -0.3766 -0.7667 -1.0110 0.6683 -0.9932 0.6774 0.5075 0.8411 -0.1056 1.1201 1.3147 0.6079 -0.7971 -0.3173 0.5327 -2.0521 0.7141 -1.0304 -0.1362 -0.4383 -1.4227 -0.0192 -0.9158 -0.8630 0.4206 -2.0658 -3.2408 -0.7377 -0.7867 0.5248 0.6197 -1.4675 -0.9958 0.7478 -1.3626 -1.9928 0.5761 -0.6052 -0.0928 -2.2452 -2.0880 1.4049 -0.6689 -0.3907 0.6551 -1.9293 -0.0946 -0.8014 1.6880 -0.6741 0.6573 1.3416 0.1644 -0.0125 -1.0833 -0.3952 -0.8792 -0.2659 0.3179 -0.3897 0.1737 -0.1946 -0.3668 -1.0549 -1.0159 -0.4792 -0.7676 -1.0856 -0.2708 0.5152 -0.4663 -1.1433 0.9984 1.3985 -0.5297 -0.1275 0.0286 -0.6424 2.0327 -2.2035 -0.2546 0.8758 0.7594 -0.2456 -0.2365 0.2238 -0.0276 -1.1957 -0.1305 -0.1609 -1.0502 -0.3457 0.5601 -1.4917 -0.5449 -1.3793 0.2451 0.7245 -1.2693 0.1608 0.7513 -1.2139 -0.8510 -1.0687 0.3573 -0.8350 -0.8457 -0.7712 -0.0811 0.2635 -0.7589 -1.4161 -0.0895 -2.2133 -0.6560 -0.8289 -0.5821 0.2619 -1.4332 -1.4081 -0.9568 -0.8016 -0.7206 -1.2054 -0.3409 -0.9553 0.7577 -1.1767 -0.1409 0.3521 -1.6563 -1.9196 1.5326 0.2929 5.6354 -0.6259 -1.5877 -0.7225 -0.2227 0.1599 -0.8520 0.3585 -0.7168 0.1695 -0.2732 -0.5680 -0.3752 0.6159 -0.4348 0.1152 -0.2941 1.4897 glycerophosphoglycerol 0.9253 -1.6812 0.7985 0.7451 -0.8336 1.2555 0.5583 1.5502 0.8681 1.5943 1.4869 -1.4335 -1.2274 0.8537 -1.5109 0.6411 0.1271 0.5729 -0.3114 0.7058 -1.1219 -1.6887 -0.9341 -0.2730 -1.2551 0.9503 -1.4673 -1.1772 -1.1181 -1.2865 0.5791 -1.1288 -0.9015 -1.5540 0.5341 1.1386 0.5598 -1.0399 -1.1716 -0.3255 0.8619 -0.8255 0.4209 0.2238 -1.1299 1.2762 0.3695 0.4690 -1.2614 -1.2474 0.5266 0.6100 0.5329 1.0014 -0.9735 0.0400 -1.2973 0.1240 -1.3363 0.1899 -1.1329 -1.4518 0.5115 1.2561 0.6966 -1.5031 1.2123 -0.0138 0.5335 0.5656 -1.2929 -1.4179 0.4481 0.6619 -1.2909 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0.5687 -1.3045 -1.5429 1.2438 -1.4807 0.4007 1.0376 0.7578 -1.5836 -1.4582 -0.3582 -0.1132 -1.1081 1.1781 0.6428 0.3695 0.6367 0.0912 0.9152 0.6107 0.2789 0.5085 -0.2593 0.2208 0.7655 0.7633 0.9055 -1.2195 0.7976 1.0238 0.5061 1.2895 0.5175 0.2141 -0.0802 0.2647 -1.3549 -1.5153 0.4541 -0.1684 -1.3890 -0.2806 0.7556 0.3388 -1.4006 -1.2544 1.3159 0.7254 -0.3001 -0.8576 0.6145 -1.1745 0.7672 0.8711 0.3281 -1.0029 0.2817 0.5108 0.5049 0.4298 -1.4295 1.9773 0.3748 -1.4252 0.4312 -1.3831 -1.3830 0.5026 0.3754 0.2295 0.3803 1.2596 -1.5267 -1.4982 0.0912 0.6524 -1.4361 -1.3380 0.5403 0.6126 0.6878 -1.5313 -1.4094 0.6600 1.4401 0.7779 0.7315 -0.2413 0.0057 0.4898 0.5391 0.8917 -1.3709 -1.4636 1.0904 0.8062 1.0021 1.1471 0.4623 0.2526 0.1898 0.8486 0.0369 -0.3549 -1.5920 0.5022 -1.2869 1.0883 0.5567 0.7597 -0.0964 0.4148 -1.7657 0.4337 0.3163 0.1601 -1.3675 1.0571 0.9645 0.5202 -1.2284 0.6611 0.7822 -1.1381 -1.3714 -1.6079 1.8758 0.0757 0.5610 0.8713 0.6718 0.0292 -1.5100 0.5819 0.9397 0.0442 -1.1795 -1.4873 -1.4282 0.5638 -1.1226 -0.7670 0.9253 1.0034 1.0387 0.6571 -1.5540 -1.4573 0.3112 0.8658 0.4741 0.9536 0.3681 -0.3553 -1.4041 -1.5230 0.1873 1.0149 0.7589 -0.0429 0.5939 -1.4399 -0.2526 1.0920 -1.6973 1.7532 -0.3536 0.5783 0.7843 -1.4565 -1.3427 0.2704 -1.6928 -0.2749 -1.7455 -0.0317 -1.7155 0.1661 -1.6531 -1.6449 -1.1313 0.4137 1.3583 -0.1009 1.1232 0.2353 0.3432 1.2149 -1.7105 -1.4659 0.6279 1.0421 -1.2714 0.9559 0.2277 -0.1051 0.0736 1.1711 0.7096 -1.6250 glycerophosphoinositol* 0.8660 0.9631 -2.0093 -1.8181 0.9610 -2.0608 -0.6576 -2.1266 -2.0159 -1.5398 -1.7960 0.7861 0.6643 -0.5088 -0.4586 1.5107 -0.9798 0.3290 1.6715 0.3298 0.2391 0.3720 1.8880 1.0352 0.0232 0.9461 0.6896 -1.8001 1.0498 0.0700 1.5671 1.0960 -0.2878 -1.2857 0.1976 -1.9620 0.6187 1.4520 1.2629 0.4590 0.9023 1.7302 1.0356 -0.2905 0.2967 -0.4002 0.8740 0.5698 1.3828 0.5303 0.3636 0.2528 -0.4364 -2.0695 1.1041 0.6956 0.5661 0.5955 0.5440 1.3752 1.7115 0.3685 0.1367 -1.8237 0.6328 0.6176 0.1546 0.5413 0.4097 -0.0345 0.1549 1.4929 0.2589 0.1869 0.4857 -0.4800 1.9468 0.6735 0.2038 0.0999 0.1099 0.4225 -0.3830 0.1743 -1.8334 1.3289 1.3460 0.0371 0.1069 1.2244 0.5823 2.8708 0.5885 1.1131 0.5622 1.1936 0.7999 0.6706 -0.4585 0.2698 -0.1190 -0.0795 0.5825 1.0402 1.2573 1.1691 -2.0245 0.3329 0.1950 0.4850 -0.3353 -1.5002 0.7062 0.2280 -1.9612 -0.0259 0.6116 0.1709 -2.0835 -0.1765 0.7270 -0.4595 0.5481 -1.1030 -1.2745 -2.0488 0.2141 0.0470 0.5429 -0.1792 -0.1988 -1.8013 -1.6005 1.3479 0.1877 0.5948 0.5226 -0.3134 -0.2538 1.1404 -1.7061 1.4757 -0.3737 0.0218 0.2668 1.2812 0.4316 -0.3088 0.5334 1.1998 1.1514 0.5208 0.1147 -0.0772 0.4792 1.8408 -1.9154 -0.3170 0.0234 1.0474 -0.5464 0.3423 1.0367 0.4209 1.5231 -0.2230 0.4471 1.0347 -0.3129 -0.7294 -0.5711 1.7277 -0.3479 0.2679 -0.3856 1.2515 0.0196 0.2899 -0.0182 1.9024 1.0724 -0.3993 1.5855 0.8015 0.5623 1.0172 -0.6364 0.2931 0.8990 0.6033 0.0881 -1.7511 1.6732 1.1293 0.3914 0.4747 -0.2354 -0.8964 0.1355 0.9640 0.2455 0.8116 -1.7747 -0.4310 0.3324 0.5771 -0.3630 1.3646 0.5656 1.4672 0.4909 -0.2925 0.9751 1.2475 -2.1689 1.0332 -2.2788 -2.2357 1.3826 -0.1307 0.2827 -0.5490 1.1478 -0.4303 0.2872 -0.5286 -0.8171 -0.2478 1.0747 -0.5086 0.9941 1.2200 0.7139 0.3083 -2.2007 0.6689 0.4374 -1.8814 0.6202 -0.0603 0.3425 0.0099 -1.1140 -1.3021 -1.2383 -1.9828 0.2824 -2.2243 -0.7714 -0.1954 -0.4413 -0.5693 -0.3020 0.5985 0.1959 -0.0514 0.0958 0.0834 -0.6305 0.3123 -0.0657 0.8078 -2.1977 -0.0502 -0.0523 0.4463 0.6295 -0.9786 0.2760 0.9252 -0.0357 0.5901 0.3673 0.0772 -0.0313 -2.0561 0.9303 0.6278 -0.5855 0.5494 -0.9334 0.3381 0.5189 -0.0480 -1.0429 0.5523 -0.0531 1.5081 0.1513 0.1180 -2.2398 1.1942 -0.6602 -0.1745 -1.9503 -0.0452 -2.1102 -0.5692 -0.4672 0.9141 0.1659 -0.8159 1.2964 -0.3194 0.3502 0.0773 0.0776 0.4358 0.7965 -0.4599 -0.3190 -1.1057 -2.0806 -0.1488 -0.6887 0.1742 0.0241 0.0597 -0.5007 -0.9114 -0.2272 -2.1635 -0.2239 0.1372 -0.5849 -2.3778 0.2359 0.2295 -2.0685 -0.3380 0.8182 0.2864 -0.1925 -1.7827 1.4047 0.5415 -2.1191 -0.9010 0.5310 0.7361 -0.2480 -0.1737 -0.2507 0.5027 0.3732 -1.9207 0.7260 0.7329 0.4489 -0.4210 -0.1722 -1.2809 -0.1785 -2.3769 -1.7146 0.6096 0.3113 0.8408 -0.0267 -0.8363 -0.3780 0.3551 1.5063 -0.3639 -0.1334 -0.6926 0.7531 -0.0997 0.7407 -0.0903 -0.1641 -0.6619 -1.0934 -1.9824 -0.0144 -1.8469 -0.4890 -2.2637 0.1362 -1.4439 0.5310 -0.5020 0.6049 -2.4135 0.5473 -1.1956 0.4919 1.0952 -0.3483 0.1339 1.1525 0.5063 -1.5161 0.1040 -2.2452 0.4869 0.3505 -0.1276 0.4316 0.1781 -0.9781 -0.3130 0.3357 -0.1143 0.0352 -2.4704 0.0765 0.4449 0.0886 -1.2915 glycerophosphorylcholine (GPC) 0.6180 -0.7557 0.4749 0.6674 0.4742 0.4897 -1.0105 1.4271 0.2411 1.1812 2.2082 0.7638 0.0142 -1.0973 -0.4952 -0.4174 -0.8210 -0.4420 0.9046 -0.0361 0.8772 0.5662 1.1437 0.8375 0.1065 -0.2459 0.4002 0.6619 0.3568 0.4163 1.5568 1.2352 -1.0787 -0.9884 0.0553 4.6143 1.0422 -0.0418 0.2387 1.1618 0.7052 0.6308 0.2191 -0.4914 0.4218 -0.2442 1.0515 0.3275 1.6187 -1.0893 0.8196 0.0727 -1.2690 0.7547 0.3490 0.7601 -0.1520 1.0422 -0.2878 0.6110 1.4075 -0.2433 -0.2685 0.1724 0.5526 0.5773 -0.2510 1.4731 2.2303 0.7133 0.8171 1.2452 0.9620 -0.3961 -0.3627 -0.4712 1.4215 0.2878 0.0564 -0.4520 -0.2231 0.1597 -1.5220 -0.6088 1.1602 -0.2714 0.3340 -0.8398 0.7689 0.7123 1.1533 -0.0462 -0.5749 0.7401 0.9498 -0.3630 0.7505 0.7185 -0.7901 0.3377 0.2262 1.1126 0.6242 0.4499 0.0471 0.7087 0.7987 -0.5768 -1.4416 0.0765 0.0159 -1.4058 0.5871 0.5054 2.5046 0.9757 1.1790 0.6678 2.6088 -0.3826 1.3405 -0.6086 0.7258 -1.4272 -0.7205 -0.6271 0.6712 -1.0292 0.5782 -0.6379 0.1649 2.1621 0.7119 1.0603 0.5468 1.1260 0.0049 -0.3517 -0.2139 0.1108 0.4016 0.2933 -0.2317 -0.9107 0.1280 -0.1617 0.4354 -0.3831 0.0035 1.1877 0.8271 -0.7633 0.5611 -0.1689 -0.4815 1.0121 -0.2205 0.9998 0.5457 0.4850 -1.1798 0.3619 1.6915 -0.3237 1.0155 -0.1122 -0.3251 0.8335 -0.6353 -0.8970 -0.5522 0.7543 0.2695 -0.2235 -0.4879 0.4815 0.1399 -1.1942 0.1979 0.8244 1.3152 -0.6032 1.1076 1.0849 0.3260 0.0323 0.4635 0.4278 0.1437 -0.3960 0.4760 2.7020 1.5624 0.1513 -0.2086 0.5848 -0.5805 -1.1763 1.3241 -0.2834 0.9918 0.1714 0.7470 -0.5757 1.0108 0.1624 -0.5656 -0.0279 -0.0536 1.7259 -0.1978 -1.7577 0.3067 -0.0924 -1.2984 1.3512 2.5049 2.1309 0.2983 0.3076 0.6705 -0.0737 0.8418 -0.1919 -0.3265 -2.0040 1.6598 0.0359 1.1820 -1.0066 -0.7231 0.2201 0.1615 -0.3338 -1.9624 0.3931 -0.3039 -0.4091 -0.0816 -0.0412 -1.7089 -0.7339 2.7578 -0.8100 -1.6314 0.1401 -0.5770 -2.1219 0.1527 -0.5721 -0.4201 0.4465 -0.9835 0.2999 -0.1177 -1.6745 -0.8339 -0.0075 -0.6131 -0.2877 -1.2250 0.6552 -0.3833 1.1876 -0.0761 0.4179 0.1641 -0.7392 0.7563 0.3251 -1.2214 -0.5545 0.3544 -1.6345 0.0405 -1.2015 0.6315 -0.2075 -0.5559 0.0775 -1.0816 -0.1456 0.0165 -0.8342 -2.7164 -0.2836 -0.9301 0.5839 0.4696 -0.4682 -0.7568 0.8061 -1.6467 -1.8970 0.0284 -0.5076 0.5665 -2.0897 -1.5517 1.7230 -0.9546 -1.2891 0.7897 -1.4049 0.2694 -0.5314 1.4023 -0.6853 0.0993 0.6966 0.0549 -0.9039 -2.2433 -0.1130 -0.1847 0.4094 -0.4127 0.0233 -1.2723 -1.6445 -0.3666 -2.1564 -0.5382 -0.5841 0.2964 -0.9494 -0.3781 0.1353 -0.4585 -0.2709 0.5115 0.1729 -0.6127 -0.8641 -0.0839 -0.3443 1.9313 -2.3010 0.4084 -0.4093 0.5124 -0.5077 -1.1292 0.2974 -0.4554 -1.9061 -0.4176 0.8486 -0.7542 0.2763 -0.3824 -0.9487 -0.7754 -2.3797 -1.0181 -0.4164 -1.1823 0.3203 0.8212 -1.9684 -1.0557 -0.2105 0.6130 -0.1734 -0.9700 -2.1921 -0.3165 -0.0055 -0.0562 -1.0634 -0.3607 -1.6613 -1.0701 -0.7316 -0.7470 0.1741 0.5050 -0.9258 -1.2518 -1.3368 -1.0389 -1.0477 -0.1575 -0.3432 0.7261 -0.9103 -0.5432 -0.0679 -1.3780 -1.1599 1.2685 0.2493 5.7892 -1.0258 -0.1395 -0.8354 -0.5485 0.1405 -0.2928 0.3519 -1.1300 -2.7102 -0.0722 -0.7534 -0.7449 0.9626 -0.3431 -0.4120 0.2857 2.3004 glycerophosphoserine* 0.6808 -1.3216 0.6719 -0.1448 -2.0552 1.1196 -1.5854 0.8879 0.9119 2.1666 1.9128 0.2836 -2.6883 -0.3328 0.8718 -0.5597 0.2317 0.2587 -0.0164 0.5883 -0.3468 -0.5523 1.7342 0.9881 -0.0940 -0.3629 0.6057 1.4371 1.1400 1.2163 -0.1384 0.5238 -1.6653 -1.6262 -0.7427 1.4831 0.4681 0.8468 -0.4963 0.5485 0.9502 -0.2096 -0.2711 -0.2354 -0.7542 0.1914 1.2040 1.2195 0.3331 0.1076 0.1720 0.3832 -0.5121 2.1051 -0.0239 1.0167 0.2894 -0.5561 -0.5450 0.7195 -0.0604 0.0051 -0.8510 1.2507 -2.7056 -0.3498 -0.2591 0.2674 0.6945 1.0219 1.2569 0.0426 0.6554 -0.1744 -0.9080 -0.0364 -0.9150 -1.6170 0.4407 0.0469 -0.8179 1.0627 -0.6299 -0.1546 1.3769 0.8452 1.3033 0.4351 0.6590 1.0408 -0.2198 0.3967 -1.6745 0.6735 1.4973 0.9236 0.9323 1.7488 -0.6072 -0.2953 0.7973 0.2744 -0.7626 0.2385 -0.8443 1.3101 1.2536 -0.8539 -0.8835 0.5075 0.3332 -1.1998 -0.4422 0.9997 1.6656 1.3036 0.2181 1.2096 1.0510 -3.1516 1.6826 0.7540 0.1593 0.0813 -3.1286 1.6956 -0.7610 0.0616 -0.0526 -1.2513 0.1763 1.8565 1.0721 -0.1816 1.1691 0.6737 -2.7144 -0.3704 -0.0932 -0.7654 1.3552 -0.7056 -0.5078 0.1071 1.2648 -0.4927 -0.6017 0.5049 -0.4434 -1.1207 -0.4957 -1.3084 -0.9824 -1.2482 -0.8122 -0.0498 0.2301 0.4681 -0.6011 -0.9244 0.4381 -0.3097 0.1426 -1.1192 1.3607 0.0225 -0.1735 0.8180 0.0688 0.4047 0.8054 -0.0154 0.8448 1.5007 -0.3896 -0.1511 0.4961 -2.4866 -0.5239 0.6314 1.1408 0.0791 -0.6169 1.2248 -0.4717 -0.3503 -0.0520 -2.6697 0.8427 -0.9184 0.8550 2.3943 0.7675 -0.4409 -0.0921 0.2297 -0.6852 -0.8733 0.3959 -0.6765 0.8142 0.5970 1.3359 -0.7395 0.7173 0.0288 -1.1437 0.2805 0.6952 -0.3167 1.3806 -1.3224 -0.5485 -2.8816 -1.8031 1.3134 1.3509 0.5622 0.3317 1.3167 0.5993 0.8598 0.0041 1.0288 -0.0225 -0.9080 1.4227 -0.0101 0.4606 0.2912 0.9044 -0.8319 -2.7124 0.3480 -0.2969 1.1940 0.2048 -0.6714 -0.7786 0.7767 0.4407 -0.4435 1.4170 -1.0382 -0.5146 1.1471 -0.1559 -0.8172 0.7935 1.4570 0.2330 1.0664 -0.5559 0.4564 0.5067 -0.1283 -0.8211 0.4757 0.0954 -0.4388 0.2788 0.1918 -0.2843 1.0947 0.3242 -2.3282 -1.0732 0.3248 1.4213 0.1035 -0.4271 0.2353 0.5774 -1.4501 0.5572 -0.1356 -0.6581 -1.1386 -1.7311 0.7984 -0.5374 0.0153 0.3566 -0.9775 -3.2608 -0.1058 -1.9451 -0.4753 0.9528 -1.1060 -0.4420 0.8068 -1.2515 -0.7044 -0.3126 -0.5685 1.2908 -1.5450 -1.1120 1.0597 0.2650 -0.4155 0.2930 -1.1301 0.6435 -0.8745 1.7450 -2.4620 0.7392 0.3978 -0.2677 -0.0816 -0.5926 0.2989 -0.7986 0.5263 0.0457 -0.2392 0.7425 1.0039 -1.1297 0.6609 -1.1684 -1.4997 -0.5753 -0.3192 0.3082 0.7648 -0.1119 -0.3082 0.7759 1.2954 -0.2486 0.7764 -0.7245 0.2036 2.3202 -1.3729 0.0984 1.2553 -0.5919 0.5883 0.3167 -0.9537 0.8168 0.6152 -0.3142 -1.1717 -1.2431 0.4408 -0.8451 -1.9440 1.1501 -1.0730 1.1399 0.1227 -0.1312 0.0376 0.5892 -0.0176 -0.0751 -0.5477 -0.1058 -0.8254 -0.3954 0.2353 -0.0629 0.5257 0.6063 0.2839 1.0153 -3.0047 -0.2716 -0.6575 0.5144 1.2813 -1.0071 0.6589 0.3276 0.5192 0.0521 -0.8090 -0.5040 0.7026 -0.4807 -0.6197 -0.3868 -0.8946 -3.3528 -0.6761 0.3590 0.4838 -0.3305 -0.7609 -0.7751 -1.1346 0.4746 -0.2295 -0.3978 -1.0938 -0.3147 0.4664 1.7506 0.0383 -0.1482 0.8627 0.8644 -2.9574 0.0387 0.6553 glycine 0.7084 -1.8659 0.6372 1.7797 -0.2331 1.6861 -1.4971 2.5102 1.5497 2.1410 1.4510 -0.7916 -2.1447 -0.0494 -0.0523 -0.8553 1.6640 0.6282 -0.5560 0.2611 0.0706 -1.2108 0.2072 -0.1473 -0.8474 -0.9738 0.5044 1.6607 1.8564 0.1432 -0.3391 0.3155 -0.3860 -0.1131 -0.8366 2.7969 0.8306 0.3469 -1.0833 -0.6266 1.6757 -1.1283 -0.7267 0.3290 -1.3769 0.2518 -0.5979 1.0376 -1.0876 0.5866 0.1444 -0.6602 -1.3421 0.7231 -0.3058 0.7369 0.2324 0.3113 -0.5612 -0.5110 -0.5975 0.1898 -1.1640 1.2725 -1.4049 -0.0234 1.3496 -0.3474 -0.2044 0.0008 -0.1247 1.2518 0.0485 -1.2387 0.2946 0.1843 -0.0172 -1.2184 -0.0152 -0.0516 -0.0859 1.8258 -0.0335 -0.0390 0.6588 -0.4771 -0.6662 0.7114 0.8562 0.5743 -0.9055 0.8786 -1.2744 1.3042 0.5215 -0.8118 0.4755 -0.2068 -0.2280 0.2666 0.7568 1.0221 0.7802 0.7121 -1.3160 0.5622 2.0723 -2.3058 -0.9925 1.2599 0.2377 1.0346 -0.5884 -0.1906 -0.2496 0.0642 -0.6241 0.5403 0.1883 -1.4553 0.3094 -0.3506 0.5421 -1.7586 -0.5367 1.0023 -0.5954 0.3870 -0.1126 0.1226 -0.5502 0.4488 0.6930 0.2621 0.2839 -1.4316 -0.7957 -1.4876 -0.2538 0.4461 0.8731 -0.5064 -0.5329 0.9685 -0.5423 -0.6970 -0.3389 0.5499 -1.6717 -1.2371 -0.7429 -1.1719 -1.6423 -1.2388 1.2643 -0.0497 1.7261 0.6239 0.5881 -0.6087 2.7996 0.8350 0.3597 -0.7445 -0.5017 0.5767 0.4210 0.6825 -0.9297 1.2223 1.5507 0.5428 -0.4351 0.9112 -0.3921 0.7259 1.6414 -0.9547 -0.6002 1.5063 1.1967 -0.0680 0.0478 0.6654 0.8637 0.3600 0.6092 -0.7558 0.2204 -0.6801 0.4295 1.9927 -0.1372 0.0251 0.8791 -0.6577 0.3667 -0.3475 0.2945 -1.0636 -0.1191 0.6392 1.8281 0.1053 0.6355 0.3148 -1.6844 0.3827 -0.0135 0.4730 0.1287 -0.3522 -0.3072 -1.2879 -0.7644 0.3505 0.8533 0.9576 -0.7425 0.9629 -1.1440 0.5016 -1.1770 1.2610 -0.3161 0.3627 -0.2565 -0.4578 -1.0853 -0.5626 0.6421 -0.7177 -1.6359 0.9791 -1.1280 1.2289 0.6403 -0.3754 0.5204 0.1453 0.4418 -0.6026 0.9544 0.0637 -0.1415 -0.2704 -1.2144 0.2744 -0.1587 0.4873 0.0704 0.0449 0.9791 -0.2898 0.8451 -0.3644 -0.8147 -0.7885 -0.9276 -1.4848 0.5167 0.7232 1.1568 0.9946 -1.0313 0.3804 -0.3133 -0.3939 -0.0302 0.5930 -0.2150 0.4411 0.3805 -1.1371 0.0882 0.0913 -1.1557 -1.8687 -0.9649 2.5334 -1.6733 -0.1445 -0.2086 0.2407 -2.1206 0.1643 0.8858 0.4436 -1.2779 -1.0679 -0.7827 0.3001 1.3071 -1.2357 0.4233 -0.2235 0.6943 -2.5653 -0.7234 1.2126 0.9214 0.4859 1.6607 0.4549 1.0513 -1.2646 -0.1570 -1.0213 -1.9703 0.1342 0.3300 0.9587 0.7795 -0.6118 -1.3694 0.0942 -0.7359 -0.2162 0.1835 0.3253 -0.0798 1.5069 -2.0815 -0.4829 1.4623 0.4901 0.8882 0.7481 1.5603 0.9377 0.3533 0.4378 0.0634 0.5035 -1.3502 0.6820 2.4300 0.1686 0.6817 0.3650 -0.3770 -0.1770 0.5031 -0.6015 -1.4551 0.8685 -1.1856 -0.7673 -2.7848 0.6365 -0.6142 -2.0755 1.6692 -0.1017 2.7463 -0.9782 -0.5331 -0.0672 -1.6107 0.0241 -1.8408 -0.7689 -0.5255 -0.4829 -0.8744 0.3282 -0.7082 -0.5810 -0.2221 -0.5817 1.8452 -0.5541 0.5129 1.3151 -0.3390 3.0593 -0.1548 1.6144 1.5776 1.5183 -1.4928 -1.9271 0.0106 -0.2820 -1.0195 -1.6564 -1.2628 -1.3773 -2.3438 -1.7659 -0.5670 2.2986 -1.1865 -0.0441 -0.0661 -0.4078 -0.1304 -0.5592 -0.9883 -0.5533 0.3231 2.5474 0.5210 0.8758 -1.1327 0.7126 0.5270 -1.2875 -0.6323 -0.6388 glycine conjugate of C10H14O2 (1)* 1.6822 0.7362 2.3577 -0.9401 0.9694 0.5298 -1.3210 -1.2396 1.5019 0.6104 1.0574 -0.6527 1.3310 0.7310 0.9154 -1.1635 0.5387 0.6935 -0.0974 -0.7929 1.5028 0.5791 -0.6246 0.4753 -1.0198 -1.0254 0.8508 1.2873 -0.8461 0.6124 -1.2979 0.4197 -0.5756 1.0585 0.0444 0.4150 -0.9932 0.7787 1.6409 0.6675 -0.7392 -0.4889 -1.0646 1.3051 0.0650 0.6930 -1.0573 -0.4735 -1.0288 -1.0162 -1.0243 1.6374 0.6101 -1.1789 -0.6747 0.3323 1.1363 1.0219 -0.3454 0.6521 -0.8632 1.0328 0.0584 -0.9330 -1.0121 0.5916 0.1175 -0.5193 1.0056 0.5545 -1.0692 1.4798 0.1467 1.0198 0.7970 1.5768 0.4867 -1.0419 -0.8480 0.6182 -1.1115 0.8871 -1.0528 0.3127 -0.9359 1.1228 0.4678 1.3314 -0.2199 1.1630 0.2567 -0.9733 1.8971 -0.6411 0.0645 -0.9596 0.7130 0.5666 -0.9676 0.8632 2.0204 0.4476 -0.8798 -1.3469 -0.9283 -0.9471 0.6431 0.5939 1.0119 -0.9221 -0.0170 0.0777 0.9968 1.8695 -1.0694 -1.0460 0.2251 0.6765 1.5900 0.3646 0.6971 -0.9965 -1.1060 -1.1527 -1.3482 0.0836 1.9472 -1.1275 -1.1768 -0.1658 0.2802 -0.1136 -0.7053 -1.2350 0.6111 -1.2498 0.4832 0.5432 -1.0963 1.9380 1.0896 -1.1411 -0.9890 -1.0981 0.3846 0.8541 0.7503 -1.1334 2.3635 -0.8774 0.4049 -0.8183 0.2902 -0.0993 0.8435 0.7708 0.1320 -0.8258 0.0984 1.2071 -1.0147 -1.3618 0.4267 -1.0623 -0.9781 1.2970 -1.2378 -1.1851 -1.2590 -0.2802 1.4240 1.3071 0.9997 -0.8091 2.0537 -0.7130 -0.8016 -0.8255 -0.4438 0.7365 -0.9840 -1.4135 0.7058 -1.1132 -0.8429 1.0532 0.4010 -0.9748 1.2116 -0.9290 0.8886 0.4510 0.2801 0.2544 -0.8474 0.5556 -0.9794 0.4254 0.3937 -0.7151 0.6371 0.8887 -0.8901 -1.0147 -1.1291 1.2900 -1.1370 -0.2213 0.0607 1.2494 0.6241 1.0019 -1.3725 1.0896 0.5080 0.1361 0.4621 1.5414 -0.2348 0.4535 1.5628 -0.2506 -0.8414 0.4188 -1.4942 1.4575 0.5654 1.2378 -1.2050 -1.0457 -0.0636 -0.8991 -1.0151 1.0814 0.3911 1.7336 -1.1485 -0.9846 1.1148 -0.9413 -1.1511 0.7646 1.2634 -1.0527 -1.2340 0.9367 -1.1460 -1.3436 -1.3219 -1.2006 1.2917 0.6055 0.3407 -1.1386 0.7004 1.8095 -1.1816 -1.1727 0.8715 0.4666 0.1791 0.4976 -1.3195 0.6125 0.0660 1.3258 -1.2580 0.8847 -1.0307 1.6743 -1.2407 -0.9894 -1.2991 0.5711 -1.2203 -1.1767 0.9113 -1.1791 0.1313 0.3318 -1.3487 -0.5190 -1.3526 0.5619 1.0490 -1.0540 2.5071 0.6432 -1.2949 0.2720 1.1566 -0.3830 1.1847 0.6807 -1.0651 -1.5295 -1.2224 1.3883 -0.5044 1.1626 1.3082 -1.2651 0.3833 -1.2849 -1.1088 -0.2400 -1.2397 1.9152 -1.2881 0.5867 -1.0389 -1.3005 -1.1900 0.2795 1.1929 -1.1480 0.4088 -1.1284 -1.0141 -0.4654 0.4535 0.4059 1.2953 -1.3646 0.5143 1.4581 -1.1529 -0.0129 -1.1916 0.6043 -0.9844 0.1159 -1.1024 -0.8840 0.7215 -1.4589 -0.0304 1.0812 0.1183 -0.8956 -1.1017 0.7994 0.0937 -1.3018 -1.3067 -1.0298 0.6299 1.0035 1.4324 -1.3628 1.2162 -0.4024 0.8972 -0.1737 -1.2389 0.1640 1.2096 -0.1600 -1.5514 1.3924 0.9154 -0.0385 0.5673 0.7309 0.2158 -1.3461 -1.3798 -1.4512 0.2426 -1.4201 0.5939 0.8655 0.5723 1.1828 -1.5684 -0.9183 0.6079 0.9903 0.8494 0.6166 0.1360 0.3568 1.0541 0.6852 1.1545 0.2192 -1.5952 0.5238 0.8653 0.4062 1.2397 0.2944 -0.6214 0.5597 -1.3583 -1.3707 0.1775 0.8176 0.9675 2.4216 -1.5099 0.4013 -1.0463 -1.3376 0.4231 0.6191 0.0590 -1.2107 -1.1472 -0.3179 glyco-beta-muricholate -1.5050 0.4018 -1.8300 1.1027 -1.3524 -0.1411 0.6068 0.7632 1.0596 -1.4518 -0.5314 -0.2818 1.2029 -0.4473 0.7363 0.8942 0.3007 -0.5478 -0.7564 -0.6313 0.1301 -0.1010 0.6570 0.0828 1.4196 -0.1785 -0.1683 -1.1642 0.5955 -0.1299 1.2844 1.0994 -1.4179 0.5554 0.5590 0.0876 0.5264 -1.5513 -1.6780 -0.5373 0.8323 -1.3438 -0.3802 0.2510 0.0234 -0.6520 -0.4841 1.3479 0.7257 0.5387 -1.7643 -0.0858 0.2890 -1.8771 0.3788 -0.1930 -0.4322 -0.4212 0.0723 0.4690 0.6006 -0.6895 1.4473 0.0665 0.1427 -0.0562 0.6029 0.9585 -0.2127 -0.9227 -1.7952 0.6946 -0.2844 -0.0050 -0.2895 -1.9494 -0.2060 0.4489 -1.6279 -1.8367 0.0528 0.1649 1.0083 -0.4423 -1.6859 0.4559 -1.6383 1.4697 -0.2859 -1.5072 0.0866 0.3900 -0.1174 -0.0042 -0.1945 -0.2526 0.2870 -1.7367 0.5414 0.2442 -0.6045 0.5767 -0.8776 0.4582 -1.6823 0.5812 0.8819 -0.4792 1.4435 -1.6844 1.9714 1.4418 0.0041 -1.7910 -0.2819 -0.4092 1.1634 0.5255 0.7344 0.1329 -1.3704 -1.7352 1.1911 0.3650 -0.1325 1.4020 0.2870 -0.0074 1.6266 0.2277 -1.9220 -1.6571 0.9758 0.6698 1.1138 -1.9385 0.3684 0.2252 0.0233 -0.0823 -1.5806 -0.0584 0.8990 -0.1440 -1.6617 0.3230 0.4870 -1.8489 -0.6299 0.6774 0.1900 0.7040 0.8407 0.0077 1.1727 -0.0510 0.8464 0.0706 0.8317 0.2182 -1.7573 0.4999 -1.6401 -0.7709 0.8925 0.8044 0.9019 -0.8894 -1.3749 -0.4608 -0.5109 0.3399 -0.4530 0.4172 -0.4587 1.3711 -1.5910 -1.5999 0.5886 0.2916 -1.7362 0.7490 1.3682 0.0151 0.3997 -0.8313 0.2040 -0.5903 0.8788 -1.6892 0.8452 -1.6172 0.6662 0.4637 0.7958 0.5592 -0.0384 0.4472 -0.6782 -1.5247 -1.9341 -0.9405 -1.6592 0.3402 1.5870 -0.5075 -1.1561 -1.1385 -1.7710 0.5905 -1.7525 -1.8071 0.9886 1.7314 0.6645 -0.3974 -0.5398 -0.6871 1.0744 0.0782 0.5718 1.0633 0.3279 0.6601 0.1617 0.0340 0.6554 -0.0550 -1.9048 -0.0984 -0.3085 0.4759 0.8084 1.7481 -0.6084 -0.0772 1.6272 -1.7238 0.1653 2.0192 -1.8587 -2.0175 1.0475 0.3679 -0.3030 -0.1636 -1.8552 0.8912 0.4783 0.8698 -0.1906 -0.3460 1.0761 0.3956 0.9418 -0.6424 0.1357 -1.8777 -0.5786 0.1087 0.9016 0.6854 -0.4916 1.8422 -0.1095 -0.4949 0.3410 0.7438 0.1131 0.0169 0.8848 0.4787 -0.3041 -0.6851 0.6898 -0.3110 -1.8829 1.1466 -0.1672 -0.8481 0.2089 0.4884 -2.0217 0.8838 0.6123 2.0162 -1.9340 -0.0923 -0.8418 0.0393 0.9055 0.9883 0.5142 1.3589 0.9360 0.6996 0.1834 0.5303 0.5963 0.4298 1.5227 -0.5226 0.9542 -0.4383 -0.4227 0.5639 0.4868 0.8821 -1.0244 -0.3964 -1.7731 0.5340 1.6709 0.1914 -0.0983 -0.0496 1.4593 0.2941 -1.7552 0.4117 1.5829 -0.2876 -0.0525 0.8923 0.6995 0.4718 0.9551 -0.7772 -0.0486 1.4594 0.0296 1.9126 -1.8167 -1.6452 -1.8714 1.1750 -0.0860 -1.0598 0.2307 -0.4107 0.6256 -1.1189 1.4072 0.6819 -1.9675 0.5321 0.7895 1.2539 0.1456 0.6819 0.0303 1.0268 -0.7494 0.7403 1.6002 -0.2382 1.0728 -0.4411 0.7083 -0.0945 0.9033 -0.7188 -1.1158 0.1227 1.3763 0.0452 0.1872 -0.5364 0.7781 0.6443 0.7229 0.9801 0.9485 2.2357 -0.2557 -1.6519 -2.2241 1.2890 0.2932 1.2847 -1.8429 0.9361 0.6029 0.2372 0.2130 0.6440 0.5647 -1.9132 -2.1426 -2.1353 0.4858 -1.8273 -1.4460 0.1074 0.2843 0.0615 1.7142 0.4934 1.8151 0.8082 1.3710 -0.4450 0.5117 0.4982 0.1193 1.0213 -0.0223 -0.9108 -0.5605 -2.1146 glycochenodeoxycholate 0.6999 0.4064 -1.4054 0.4494 -0.0027 -1.0015 0.3434 -0.0372 0.5142 -0.8208 -2.2821 -0.9179 -0.5680 2.0771 2.3938 -1.9000 -1.0801 -2.3187 -1.9292 -2.6589 -0.5051 -0.2353 -2.9066 -0.6302 0.2271 0.1582 -0.4588 0.1500 0.5448 -0.3049 -0.2818 -0.0081 0.1816 1.5556 0.5313 -0.3610 -0.1086 -0.9349 0.0617 -0.0856 0.7098 -0.2155 1.3443 -0.4394 -1.1563 0.7045 0.3829 -1.2977 0.2298 -0.3416 0.8711 -0.9843 1.4037 -1.4369 -0.4500 -1.7074 -1.1572 -0.2243 1.1694 -0.8334 0.1532 -0.9084 -0.5972 0.4408 -0.4552 1.1547 -0.9449 -0.6731 0.0562 -1.0318 -2.2963 -0.6721 -1.2709 -0.1746 1.2548 0.9791 0.0651 -0.5588 0.8664 0.0159 -0.4613 -1.1017 -0.2845 -1.3128 -1.0612 -0.2997 0.3486 0.7161 1.0933 -2.4334 -1.5849 0.1517 1.6448 -0.5363 -1.4266 0.9983 -0.7572 -0.0291 -0.5807 -1.0399 -1.2382 0.4415 -0.8049 1.1738 -0.1279 0.2780 0.1222 1.0959 0.6420 0.7653 0.7168 -0.0606 0.8087 -0.9464 0.5817 0.3660 0.6312 0.5276 0.7503 -1.7603 0.1904 -1.4024 0.4081 1.8521 0.2737 0.7471 0.3125 1.3732 -0.1534 1.4591 0.7117 1.1701 -0.7938 1.6611 1.3584 1.5815 -2.2888 -0.9224 0.0081 -0.2501 -1.0096 0.9695 -0.7563 0.0208 0.8360 -1.8855 0.1654 0.0690 0.0700 0.2219 0.8531 -2.3523 -0.0146 -0.0535 0.7590 -0.5611 0.9030 0.7442 0.3855 0.2327 1.9127 1.7219 0.4768 -1.6068 1.2262 0.9976 -0.1459 0.9375 -0.4503 -0.4719 -0.2696 -3.2809 0.5726 -0.1622 -0.6976 0.0406 0.2422 -0.6850 -0.0142 -0.2437 0.9373 -0.0181 0.9943 -1.0610 0.3788 -1.8175 0.1349 0.4060 0.5817 1.6363 0.4193 0.0559 -0.7919 -0.1477 1.0905 -0.8800 -0.2552 0.3507 -1.1462 -1.3660 -1.6177 -0.4739 -0.4191 1.3109 -3.2476 -2.4870 -1.3593 0.5131 1.4583 0.0553 0.1798 0.6519 -0.1280 0.9640 0.0568 0.3183 -0.1393 0.6430 1.5875 0.5319 -0.1126 0.9369 0.9820 -0.1291 -1.5860 1.9639 -0.5081 -0.9351 0.0537 1.3329 1.6035 0.3698 -0.2552 -0.6040 -0.2317 -2.1716 -0.4149 0.2534 0.9359 0.0915 1.2164 1.4576 -2.1899 1.4996 -0.2684 -0.5503 0.8203 -0.2062 0.7508 1.5474 -0.3351 -0.0713 0.5048 -0.0383 0.6404 0.1522 -0.6531 0.6560 -0.9215 -0.9331 -0.1894 1.9178 0.4408 1.1553 -0.3973 -0.4503 -1.0250 0.5888 0.1784 0.3680 1.5453 0.7894 0.6910 1.5878 0.1269 -0.7337 -1.7721 -0.1998 0.5730 1.4788 -0.9308 0.7926 0.0535 0.3804 -0.8298 0.4482 -0.6922 1.6647 -0.1719 2.0425 0.6666 0.4574 0.4596 1.4929 0.7142 0.9500 1.2823 0.3565 0.1216 0.4709 0.5426 -0.3598 -0.9502 -1.0283 0.8441 0.4286 0.7040 0.1305 -1.1213 -0.9215 -1.2038 0.3917 1.2872 0.1476 -0.2740 -0.5204 1.7711 0.1966 -0.2469 0.5615 0.3690 -0.0647 0.2762 1.5386 -0.4019 -1.0699 -0.7000 0.9473 0.9925 -0.0562 -0.1659 1.1875 -1.0666 -0.4895 -0.0968 0.4374 0.1463 0.3006 0.0267 0.0900 1.6309 -1.5535 -0.0153 -0.9581 0.5781 0.1547 0.9512 1.6263 -0.8458 1.7600 1.0191 -0.6424 -0.0509 0.2504 0.7988 1.2491 -1.4629 -0.5413 0.1654 1.0604 -0.6096 -1.6518 0.0671 -0.5618 -0.4665 0.9744 -0.2003 -0.4136 1.4227 -0.3727 -1.0989 1.1414 0.4994 1.2569 -0.1980 -1.1080 0.7985 0.7156 -0.0629 0.8838 -2.3755 -1.0048 0.6677 -2.0173 0.5028 -0.5118 0.4779 -1.3038 -0.9827 -2.1269 -0.7110 -1.0940 2.1458 1.0212 -0.8541 -0.4418 0.3005 -0.4716 0.6434 -1.2552 0.7071 -0.7030 0.4120 -0.6083 -0.3755 -0.8002 1.7357 0.9546 -0.5101 -0.6728 glycochenodeoxycholate 3-sulfate 1.2997 0.2669 0.3795 0.0932 0.4140 -0.5732 -0.3172 0.0194 0.9165 -0.2646 0.2438 -0.7256 0.5679 1.5864 0.3387 0.1393 -0.0374 -0.2306 -1.9034 -1.7624 -1.0080 0.0497 -0.6243 -1.9240 -1.9112 -0.0560 -2.0799 0.5062 -0.2518 -0.8235 0.7444 -1.8120 1.0575 1.1876 0.2656 -0.4778 -1.8929 -1.7435 0.3995 -0.3429 0.2158 -1.5727 0.4529 -0.2112 -1.0584 0.9320 -0.8228 -0.6793 0.1976 0.5942 0.0668 0.2499 1.2518 -0.9038 -1.6879 -0.5938 -0.3672 -1.6870 0.5751 0.7004 -0.7447 -2.0644 0.1251 0.1771 -1.3654 0.8658 -1.9609 -0.5257 -0.2731 -1.0053 -1.9396 -0.5195 -1.0601 0.0756 0.2949 0.5514 -0.6604 0.3414 0.8228 -0.6005 -0.6358 0.1217 -0.7811 -2.0753 -1.8481 -0.3802 -0.5170 1.9106 1.1126 -1.7052 -0.1572 -0.0580 0.3700 -0.4153 -1.8886 0.7182 0.3550 1.0900 -0.1918 -0.1252 -0.2453 -0.2967 -1.8330 0.8628 -1.8463 0.4613 0.6169 0.6939 -2.2153 0.9109 0.1417 0.2574 0.0464 -0.3665 0.8153 -1.9297 0.2274 0.7234 -0.5267 -2.1234 -0.0964 -1.8892 0.8844 0.2512 0.7875 0.1774 -2.0524 0.7686 0.2534 1.3266 0.2722 -0.3891 0.0325 0.8746 -1.9757 0.6008 0.1925 -0.0173 -0.1480 -1.5767 0.7137 0.4704 0.3884 0.0935 0.0521 0.2355 1.2135 -1.9851 0.4541 0.7936 0.1542 -0.1948 -0.0307 1.2133 -1.9802 -0.2415 0.1728 0.3421 0.8290 0.5714 0.0764 2.4953 0.5334 -1.9319 0.1772 -0.8187 -0.3833 0.4501 0.1684 0.4156 0.1310 -1.9527 -0.0497 -1.7687 0.0959 1.0585 0.1237 -1.7782 -0.3367 0.2144 0.7743 0.3946 0.4019 -1.1087 -1.5652 -0.1981 0.0181 0.9778 0.6787 0.2360 -0.2498 -0.9184 -0.2254 -1.8141 0.9880 0.4593 -1.8815 -1.0116 -0.6580 -1.7220 -2.0561 -1.7954 0.6484 1.3182 -0.6362 -0.3188 -0.0568 -1.4071 0.3607 1.0932 -0.5169 0.6583 -2.1394 0.3479 -0.1026 -0.0637 1.2711 -2.1282 1.6305 1.1088 -0.0811 1.0171 -1.7937 0.8236 0.7283 0.7639 -2.0763 -2.1712 0.2955 -1.9231 0.8647 0.0840 0.4010 0.6457 -0.4534 -2.1166 -0.1551 0.9218 0.8509 0.0607 0.8298 0.5950 -0.9732 1.4528 0.4988 -1.9492 0.8221 0.0065 0.8567 1.7065 0.7746 -0.0395 0.4542 0.1659 -0.3971 -1.9116 -0.5602 0.4140 -1.9275 0.2083 0.3876 1.2742 0.1404 1.4964 0.5100 0.3680 -2.0660 0.9141 0.5198 -0.2802 1.1924 1.3509 0.2742 0.7822 -0.1190 -2.0127 -1.0265 -0.4434 0.7214 0.9531 0.6294 -2.0877 0.5694 -0.8818 1.4044 0.9007 -2.0545 0.7613 0.7923 1.1972 0.9561 -0.1812 -0.1506 1.1482 0.9986 -0.8023 -2.0340 1.4584 -0.8347 0.2580 1.1595 -0.0414 0.2502 0.4148 1.0238 0.3126 0.8117 1.1848 0.7486 -0.0400 -0.1866 1.0185 0.4697 -0.7595 1.5337 -1.9859 0.1267 -0.1117 0.1694 0.2831 0.9100 0.3424 0.9780 2.7319 0.3650 0.2249 0.0934 1.2719 1.0518 0.1685 -0.1198 0.9184 -0.7161 0.2741 -0.6744 0.3997 0.3578 1.2692 0.0138 -0.0018 0.3246 -0.1684 0.4078 -0.6746 -0.5816 0.5347 0.9556 0.4191 0.2941 1.2994 0.9416 1.0782 0.8667 1.4647 2.6761 1.7080 0.6672 -0.1132 0.4851 0.4468 0.2089 -2.0299 0.1068 -0.6592 0.2596 1.3192 1.0212 0.8258 -0.0325 -0.5212 0.5172 -2.0565 1.2765 0.8688 0.5530 -0.6770 0.7036 1.2904 0.1285 0.3579 -0.7453 0.2063 -0.0861 -0.1002 0.4609 0.8301 0.6815 -0.2441 -0.5867 0.2015 -0.2578 0.2805 1.2634 1.9146 0.2713 0.3598 0.3707 0.4459 0.8825 0.5433 1.4231 0.9313 0.3919 -0.2210 0.0307 -0.9418 0.3287 1.2900 -1.2034 -0.5815 glycochenodeoxycholate glucuronide (1) -1.2683 -0.9324 -3.1930 0.4079 -2.6650 -0.9835 -0.9047 0.1264 0.6963 -1.6402 -1.1705 -0.1436 -0.4419 -0.3013 -0.2735 0.1229 0.0381 -3.1316 -1.2451 -0.5891 0.0593 0.6387 0.0101 0.4897 0.5510 -1.3256 -0.3539 0.3510 -1.2782 0.0762 0.7375 0.4987 0.3247 0.3269 -0.8203 -1.1359 -0.8418 -1.0738 0.4187 -0.3464 0.4850 -1.0902 -0.5010 -1.0771 -0.0319 -0.6693 -0.2258 0.6488 -0.0107 -0.1860 -0.0728 -0.1425 0.4507 0.7121 0.4765 -1.1569 -0.0872 -0.4343 0.1274 -0.6334 -0.8578 -1.7863 0.8784 0.9760 0.8144 0.9410 -0.0981 -0.3232 -0.1328 -0.3144 -3.1551 -0.2026 1.5602 0.2663 -0.3820 -3.3269 -0.6842 0.9984 -0.4507 -1.0668 -0.0212 -0.8965 0.4128 -0.0654 -0.3929 1.2426 -1.9777 0.6025 -0.3036 -1.4191 0.0460 0.4873 0.4318 0.1389 -0.8602 0.6339 0.1757 -0.3661 0.4226 -0.7362 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1.2627 -0.2880 1.9300 0.4571 0.6020 -0.5167 0.8322 1.3066 2.3037 0.1430 -0.0827 0.8574 -0.7160 -1.2390 1.5061 -2.2746 0.5227 -0.3117 -1.9917 -1.2467 2.1533 -1.0134 0.8195 0.0328 -3.7686 0.0257 -0.5040 0.3339 -0.0796 -0.1100 0.2549 -0.1207 -0.1658 0.9627 -0.8715 0.2732 -0.9832 -0.2944 -0.8643 0.4358 glycosyl-N-palmitoyl-sphingosine (d18:1/16:0) -1.1834 1.4938 -0.4737 0.4844 0.4297 -1.2342 -1.2882 0.0370 -0.8355 -0.2527 -0.1251 -0.6102 0.3245 1.2802 -0.3393 -1.0207 0.3246 0.5298 0.4293 1.5444 -0.0968 0.3834 -0.3219 -0.4965 0.4340 0.6165 -0.0940 1.7019 -0.8977 -0.4647 -0.5422 -0.3969 -0.0132 0.8492 0.1886 0.8243 0.8316 0.1114 1.3542 -2.0620 1.1511 0.9595 2.0065 -0.0798 -0.0285 1.2592 1.2873 -0.2871 -0.5032 -1.7699 0.9619 -0.7839 -0.8002 -3.6146 0.4201 0.8712 1.6570 -0.2257 -0.8953 -0.5452 0.0459 0.8988 0.1784 0.4310 -0.5077 -1.4224 0.7458 0.5606 0.3728 0.2006 -2.5221 0.8286 -0.0094 0.5409 0.0745 -1.6219 0.1133 0.1373 -1.0045 0.3621 1.0982 -1.5617 -0.8386 1.2363 -1.0893 -0.5642 0.8517 1.6357 1.1042 0.7432 0.6955 -0.4135 0.2795 -1.6514 1.1619 -0.7907 1.5410 1.7259 0.5035 -1.1153 1.0539 -1.1545 -0.5693 0.0744 0.4507 0.5460 0.7730 -0.8705 0.2545 2.0164 -0.9290 0.2007 0.2401 1.0411 -0.4014 0.3626 1.1652 0.0367 -0.7811 -0.1236 -0.5761 0.3479 0.1976 -2.5227 -0.2833 0.0399 -0.3552 -0.5239 0.8154 -1.5772 -0.0648 -0.1495 0.0313 0.5762 -1.6194 -0.6520 -0.4357 -1.3635 -0.6086 1.4910 -0.0189 0.9347 1.2240 -0.3783 -2.3330 -0.5211 1.2275 -0.3701 0.3589 0.4807 1.1628 0.6126 -0.1670 2.3239 0.8094 -0.4930 -0.6050 2.6266 -0.0861 -0.8928 1.4596 1.6546 -0.2665 -0.0982 -1.5332 -0.0927 -0.5929 -1.0432 0.1792 0.5282 0.3271 -1.3873 -0.8469 0.6821 -0.1295 0.8602 0.7700 1.4772 0.2735 0.0546 0.2231 -1.9432 -0.0697 -0.2781 0.6534 0.1969 1.6300 2.1605 0.1771 0.6267 -1.7318 -1.2775 -0.2345 1.4292 0.2049 -0.8461 1.3795 0.7238 0.1666 1.0673 -0.0700 0.9252 0.7298 2.6753 0.8586 0.6183 0.5474 1.5166 -0.0624 1.0699 1.0948 -0.3167 0.1579 0.9425 -0.1046 0.8092 0.1731 -0.4831 -0.0837 -1.7402 -1.2483 -0.6151 -0.0276 -0.5970 -0.1383 -0.3727 0.4136 -0.7539 -0.2083 -0.0821 -0.2321 0.5351 -0.9540 0.4747 -1.6818 -0.7356 -0.1603 0.2570 0.0702 0.1403 -0.5608 0.1374 0.9246 -1.3947 0.5206 -0.2258 -0.4160 -0.7162 -0.8555 -0.1302 -2.3192 -1.3636 0.4820 1.2492 0.9133 0.1457 -2.0395 -0.5263 1.1660 -1.0025 0.3891 0.4792 -1.5870 -1.0313 0.3773 0.4885 1.7453 0.7956 -0.4999 2.0383 -0.8064 1.0876 0.3320 -0.2784 -0.6098 -1.3805 -1.7532 -0.8540 -1.1171 1.1049 0.1767 -0.3615 1.1157 -1.2346 0.4933 2.0849 0.4980 -0.0420 -1.6825 -0.9344 -0.5594 -0.4164 0.9888 -0.5966 -1.0243 -0.7136 -1.0664 -1.4712 -0.7121 -0.8372 0.4303 0.3058 1.4639 0.2148 2.1513 -0.2001 -0.1868 -1.1110 0.0216 -0.0709 0.2179 0.4557 -1.1549 0.3254 0.5303 -0.0271 0.0378 -0.5230 -0.2975 0.9108 2.1920 2.3336 2.1418 -0.6711 -0.0578 0.0331 -0.3211 -0.0881 -0.3213 1.1571 1.3723 0.4256 -0.8670 0.3082 0.5227 -0.5585 0.6528 -1.0003 -1.5095 -0.3736 -0.9291 -1.7101 -0.1035 -0.4800 -1.4086 -0.4109 -2.1409 1.6018 1.0600 -0.4601 2.1574 0.3954 -1.2149 -0.0054 1.3927 -0.7409 -0.8536 -0.1183 -1.9315 0.2663 -2.9696 0.6798 1.1691 -1.9985 -0.3156 0.9935 -0.7131 -0.0719 0.6293 0.1961 0.1907 0.2306 1.5420 0.5020 0.4065 -1.2534 0.2219 1.5363 1.9208 -0.0668 -0.7981 1.0223 -0.6848 -1.5224 1.2146 -2.3240 -0.9787 -0.2701 -1.6248 -1.2977 0.8563 -0.2237 1.1318 0.4365 -0.4773 0.1741 -0.7789 0.1421 0.9728 -0.2186 0.3611 0.0634 -0.1859 0.3695 -0.6505 -0.2881 -0.9127 -0.7056 -2.0018 -0.8180 glycosyl-N-stearoyl-sphingosine (d18:1/18:0) -0.7016 -0.1166 -0.9287 1.0168 1.3744 -1.3684 -0.8953 0.0593 -2.6569 -0.6461 -0.5707 -0.7133 0.1217 -1.6247 -0.1548 -1.3947 0.1790 -1.4824 0.2095 0.4066 -1.2278 -0.3318 -0.7980 -0.2213 0.6761 -0.2255 -0.8214 0.3664 -1.3224 -0.0856 0.0635 0.5510 0.5565 0.8999 -0.5548 1.5117 -0.3783 -1.6249 1.0129 -0.9856 0.1993 1.4274 1.4661 -0.0620 0.3500 0.3668 -0.0168 -1.2266 -0.3787 -1.2426 -0.4447 -0.4900 -0.7276 -2.8192 0.9585 1.7551 1.0000 0.9200 -0.8192 -1.4467 0.9938 0.7695 0.6253 -0.2313 0.4164 -0.7384 -0.3633 0.3597 -0.0348 0.2984 -1.6248 0.8625 0.7847 -0.1101 -1.0017 0.3488 0.1598 0.7160 0.0318 0.5114 0.3545 -2.1257 -0.3576 1.2812 0.0174 -0.3558 1.8664 1.9293 -0.3539 1.2404 -0.1596 -0.2968 -1.4639 0.3491 1.1353 -0.7203 0.2201 0.6506 0.5098 -0.2889 1.6065 -2.3452 -0.8256 -1.2947 1.2702 1.1178 0.8911 -1.1162 0.0503 0.3009 -0.5536 -0.3332 0.1987 0.7320 -0.5497 0.4453 0.6809 -0.3336 -0.8501 0.1889 0.2883 0.3005 1.0701 -2.7542 0.4086 1.0240 -1.5408 -0.4009 0.0470 -0.7670 0.6743 -0.4242 -0.4703 -0.5548 -1.8802 -1.2173 0.0891 -0.7008 0.5868 0.3696 -0.7711 0.5379 0.3556 0.1727 -0.4967 -0.0542 2.2199 0.0392 1.7595 0.6949 0.7261 -0.1984 0.2054 1.2434 -0.3008 0.0152 -1.1320 1.3371 -0.3252 -1.3221 0.3438 -0.2501 -0.8350 1.1822 -2.1691 0.7585 -0.1972 0.2042 -1.2013 -0.3580 -2.3368 -1.3289 0.1284 0.9432 -0.1934 0.5398 0.8684 1.6003 0.1685 0.0987 -0.6060 -1.4452 -0.0465 -0.3974 -0.0524 -0.7239 0.3260 2.8541 -0.0319 0.2906 -2.8441 -1.3742 -0.5414 2.2107 0.4925 -0.7462 0.9814 0.6356 -0.3862 0.4809 0.0123 0.8815 -0.1195 1.8552 0.8222 0.6055 0.1161 1.6697 -0.9562 0.4530 -0.3438 1.2499 -0.3434 1.0239 -0.0890 -0.0040 -0.6112 0.0106 0.0665 -1.8756 0.0987 -1.5853 0.3335 -0.8749 -0.0951 -0.7960 0.8483 -0.8905 -0.2253 -0.8764 0.2025 0.0109 -0.5320 -0.6574 -0.9517 -1.4237 -0.7715 0.6831 0.5510 -0.6741 -0.3438 1.0527 0.5805 -1.3364 -0.2401 -0.4825 -0.5431 -0.6172 -0.9574 -0.7539 -2.2006 -0.0934 1.1231 0.9989 0.6382 -0.1334 -1.0576 -0.1588 1.5315 -0.0326 -0.1539 0.0680 -0.9966 -1.0339 0.4479 0.9914 1.3616 -0.1645 0.6797 1.5838 -0.0817 0.7410 0.1958 -1.0615 -1.9029 -0.1832 -0.3586 -0.2485 0.3291 2.9156 0.9087 0.1315 0.3820 -0.6054 -0.0180 1.5421 0.2494 0.0229 0.9770 -0.9928 -0.9231 -0.6462 0.6544 -2.1834 -0.7574 -0.3662 -0.6078 -1.2727 -0.0315 -0.4414 -0.6050 0.6260 0.5327 1.6199 1.4268 0.2438 -1.0265 -2.3835 0.4237 0.4962 -0.4546 0.4457 -0.2648 -0.3511 0.8244 0.6684 0.6123 0.8280 -1.0029 0.1015 1.6055 2.1903 1.1677 -0.2442 -1.1948 0.8316 1.0620 0.0567 1.2388 0.7634 -0.5931 1.6387 0.1209 0.3201 1.1237 0.5122 1.1726 -1.2109 -1.6930 -0.0698 -0.1438 -1.6827 0.0338 -1.0140 -0.4733 -0.0145 -0.8794 2.0234 1.2697 0.2978 2.1860 1.4755 -0.8975 -0.0842 0.4975 0.4447 0.6385 -0.9365 -0.8184 -0.2644 -1.7132 1.0851 0.6103 -1.5282 0.2514 -0.1651 -0.3735 -1.8567 2.4765 0.9257 1.3846 -0.2031 2.4496 0.3477 0.1409 -0.1674 0.5802 0.9676 2.4418 -0.2840 -1.0505 0.8069 0.2293 -0.6155 1.2381 -0.4657 -0.6388 -0.7910 -1.5137 -1.3314 2.8138 0.0577 2.4845 -1.3377 -0.2463 0.3997 -0.6467 0.5059 0.5752 0.9615 -0.0751 0.1157 -0.0838 1.1438 -1.4314 -0.8317 -1.4780 0.5816 -0.8583 0.6461 glycoursodeoxycholate 1.2161 0.4217 -0.4848 -0.0198 1.3380 0.2894 0.1671 0.9238 0.5879 -0.1835 -1.9235 1.0230 -0.7934 1.3966 1.8016 -1.8479 -0.0124 -0.9536 -2.0268 -1.8645 0.6378 -0.4379 0.1209 -0.4869 0.5639 0.1804 -0.2291 0.8586 0.5472 0.9553 -0.2241 1.9534 -0.4045 1.1904 0.3215 1.0264 0.2585 0.1207 -1.3630 -1.6779 1.0476 -0.2099 2.1174 0.8630 -0.0675 -0.1593 0.4401 -0.7513 0.1311 0.8598 1.1438 -0.1914 0.4776 -1.0385 0.2367 -2.2136 -0.7408 0.7436 0.7550 0.9081 0.8339 -0.3904 0.2687 0.1448 0.7435 0.6570 0.0415 -0.2563 1.1305 -1.5380 -2.0740 0.6192 -0.1060 0.5542 0.6113 -0.5364 -0.2912 -1.5718 1.8554 -1.5281 -0.8101 0.1977 0.3895 0.5498 -0.2327 0.2129 0.5681 0.1527 0.6442 -0.8966 -1.0918 -0.2488 2.5422 -0.2492 -1.1688 -0.0026 -2.0438 1.1699 0.5757 -1.5002 -1.1960 -0.1780 -0.3947 1.5374 -0.4172 -0.4653 0.3773 -0.1940 0.3556 1.7293 1.0648 -0.0636 0.2865 -0.4307 0.4492 -0.0948 1.6240 0.7125 0.7314 -0.1945 1.1740 -0.8469 1.1398 1.6356 0.6563 0.7552 0.2177 1.2441 0.6148 0.6523 2.2237 1.6642 -0.3187 1.0007 0.9891 0.9991 -0.3400 -1.7612 1.2448 -0.0858 -1.8686 0.0029 0.0992 -1.0196 1.8788 -0.7853 -0.3231 0.7620 0.4397 0.3820 1.7527 -1.8850 0.5622 -0.3729 0.5924 -0.6779 1.2776 0.8235 0.9464 0.0269 2.8359 0.0761 1.9765 -0.0943 0.6764 0.8786 -0.1080 1.0641 -0.9513 0.6373 0.0194 -0.0744 0.5587 -0.2997 -1.1401 -0.1671 0.4326 -1.8866 0.5470 1.2062 0.8136 0.0949 1.1509 -0.1049 1.0788 -0.9454 -0.6102 -0.3252 0.4313 1.9951 0.2710 -0.2400 0.5303 1.5660 1.1742 -0.4350 -0.2257 0.1929 -0.4103 -0.8299 -2.2060 -1.8951 -1.9412 0.8421 0.1353 -1.7942 -0.1111 -1.4370 0.2112 1.0477 -0.2380 0.4123 0.6629 0.9522 -1.0671 0.5725 -1.1307 -0.9970 1.6475 0.7659 -0.8188 0.3464 -0.6339 -0.6730 -2.3964 0.9135 -0.5186 0.4587 -1.0660 0.1976 1.8872 0.4374 -0.4634 -0.1815 -0.8998 -0.5449 -1.1625 0.1825 0.5887 -1.9779 -0.4161 0.7673 -2.1149 1.1531 -0.6215 -0.2537 -1.1173 0.4996 0.3560 0.4317 -1.1704 -0.0087 0.5603 0.6006 0.2968 0.4371 -2.1604 -0.4952 0.5167 -0.9199 0.4102 0.4571 -0.3362 0.7609 -1.1487 -1.8020 -0.7987 -0.5721 0.8970 0.6646 1.6430 0.6641 -0.5881 -0.4189 0.9640 -0.8257 -1.7046 -0.9827 0.9268 1.5270 -0.0972 0.0137 -1.5224 -0.7700 -1.8558 -0.1922 -2.2070 0.6333 -0.4355 0.6891 0.4305 0.4264 1.0865 0.8721 -0.8878 0.6858 1.3114 0.0513 0.6385 1.6276 0.1355 0.2403 -0.4262 -0.4041 -0.8020 0.3829 -0.1091 0.1576 -2.2337 -1.2646 -0.3142 0.2142 0.6292 0.1870 0.6312 -2.1315 0.9894 1.2794 -0.9524 -0.4181 0.6212 0.0409 -0.9585 1.8846 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guanine 1.3635 -1.4623 0.8156 1.2401 1.5871 0.7587 -0.0457 1.3342 -1.0808 1.5138 -0.8459 0.9651 1.9833 0.7043 -1.2672 -1.1137 -0.4713 0.9903 -0.9653 -0.4215 -0.8274 0.8383 -0.6188 0.3481 -0.9797 0.2940 0.0419 -0.8901 0.3994 -1.0191 0.0805 0.4524 0.9430 -1.3184 0.8895 0.8291 -0.9549 -0.7355 0.1242 -0.4757 -0.7242 1.1539 -1.0208 -1.2367 0.5574 0.1857 1.0187 0.2460 -0.9874 -0.9737 -0.9848 -0.0701 0.6512 -1.1214 -0.6638 0.0820 -1.0271 0.6576 1.4443 -0.3002 1.3433 -1.2030 -1.1754 1.9504 0.9111 -1.2546 2.9420 0.6130 -1.2142 0.1354 -1.0235 -0.0598 0.5020 0.3494 0.8470 -1.2020 1.4448 -0.9989 0.7973 0.4111 0.2990 0.6571 0.4515 -1.2174 -0.8993 -0.0269 -0.8400 -0.3050 0.5196 0.6580 -1.4085 -0.9376 0.6463 0.3887 0.2620 -0.9241 -0.9876 0.8592 0.4792 0.3450 0.2647 -0.1555 0.2507 0.0132 0.6359 0.8871 -1.0808 0.6733 0.5915 0.7915 0.2180 2.2682 -0.8287 0.0316 0.1059 0.3483 0.2968 0.0323 -0.5679 -0.0488 1.0704 0.2800 0.4528 0.3273 -0.4673 -1.1036 -0.1128 1.8337 0.1099 0.2609 0.2772 -0.4484 1.0428 0.8437 -1.0752 -0.0478 0.6013 1.1190 0.2931 -0.5019 0.2034 -1.0908 0.9474 -1.0498 -0.1976 -1.0944 1.2831 -1.0839 0.1582 -0.8532 0.8475 2.6917 1.6910 1.1370 0.7239 1.9105 -0.9945 0.2826 1.3884 1.3914 1.3997 0.6867 2.5346 0.6638 0.0463 -1.2308 -1.1780 0.0522 0.1736 0.7120 1.3070 -1.0417 -1.3605 0.8705 0.1968 0.8563 0.8466 0.6946 1.2161 -0.7654 -0.9499 -1.3393 1.0939 -1.0658 1.4972 -0.3836 1.6017 0.4567 1.0018 0.6629 -0.0280 -0.8200 -0.9120 2.2291 -0.8247 0.9599 0.8161 0.5565 -1.0480 0.4421 -1.1809 1.3008 -0.8624 -0.9826 1.0732 1.0428 -0.0511 1.0897 0.6137 -1.0056 -0.9728 0.8652 -1.3026 -1.1002 2.6365 0.9071 -1.3089 -0.2945 -1.3514 -0.5520 -0.3660 -1.1589 -0.8156 0.3495 -1.4117 -1.3219 -1.2270 -1.3505 0.5910 -0.2639 -1.0926 0.3253 0.6716 0.6128 -0.2781 -1.2737 0.7429 2.1733 0.2959 -0.2495 -1.0978 -0.4671 0.0758 1.3953 -0.1718 -1.0417 -1.0935 -0.2317 -1.2519 -0.1612 1.5754 -1.2016 -0.1464 0.0793 -0.0614 0.7277 -1.1271 0.6026 -0.5076 0.0734 -1.1545 0.2633 -1.2529 0.6057 0.1249 1.0355 0.1747 1.2755 0.0372 -0.4656 0.4694 0.2200 1.0235 -0.3202 0.3359 -0.5320 1.9687 -1.1256 -1.2396 0.7045 -1.2772 0.7954 -1.2844 0.8751 0.1221 0.3268 1.3009 0.5268 -1.2248 -0.4744 0.2345 0.1462 -0.5883 0.3139 -1.0204 -0.3186 0.8437 0.5991 -1.3348 0.1465 0.8196 2.5423 0.5072 -1.2179 0.5932 -0.7111 -1.1768 0.5203 0.2476 -1.3138 -0.9967 -0.5875 -1.1314 -0.0118 0.2672 -1.0936 -1.0188 -1.0784 0.8262 -0.1806 0.8757 1.3706 -1.5610 0.3319 1.0098 0.9768 0.0746 -1.0700 -0.1884 0.3697 1.1447 -0.9571 -1.0513 0.8991 -0.0703 -1.3785 -0.1532 0.3780 -1.3002 -0.8605 1.8735 -1.4595 -1.2695 0.2582 -0.2380 -0.9865 0.1854 0.7836 1.3160 -1.2922 0.8609 0.4366 -1.1651 1.0488 1.6565 -0.1312 -0.5674 0.4686 0.3009 -1.3143 -1.2004 -1.1609 -0.5164 -1.4624 0.1156 0.6113 -1.3042 0.2057 0.0515 -1.3392 1.9600 -1.1882 1.2966 2.8609 -1.4788 -0.8724 -0.9731 -0.3164 1.3600 -1.2073 0.7812 -1.4404 -0.2437 -1.4533 -1.5326 -1.5056 -0.3346 0.0636 -1.4330 -1.4210 1.3259 -1.0535 -0.6158 0.5795 -1.2849 0.4628 -1.4287 0.0526 -1.4984 1.9099 -0.3937 3.0844 -1.0009 -1.2657 1.2736 -1.4999 0.6181 -1.1535 -0.1738 -1.0393 guanosine 0.4859 -0.4866 -0.1335 0.9493 1.1814 -0.6312 -0.2076 -0.4799 -0.0791 -0.8362 -3.1834 -0.1971 0.7747 0.6423 -0.6761 -2.0627 -0.3470 1.3885 -0.3486 -0.1250 -0.3720 -1.1461 0.8702 -0.4058 0.5239 -0.7156 0.2034 0.1335 -0.0078 -0.4193 -1.0704 0.0841 -0.2807 0.4587 1.3642 -1.7685 -0.8509 -0.9238 -1.6478 -0.3956 -0.1801 -0.4850 0.9802 0.1898 0.2564 1.0298 0.1797 -0.6757 -0.7759 0.2169 0.3507 0.5074 -0.2583 -1.0514 -0.5239 -0.6478 1.4210 0.1894 1.1302 -0.2696 0.8315 -0.5273 -0.3441 0.1991 1.2350 0.6168 1.9426 -0.7557 -0.0136 -0.5127 0.2286 0.1571 0.0990 0.0471 -0.3883 -0.0140 2.1508 -1.2999 0.4474 0.2561 -0.5253 -0.4198 0.9369 -0.1580 -1.4992 -0.1199 -0.4482 0.5522 0.0595 0.4225 -0.0662 -0.6805 1.1850 -0.3523 -1.0002 0.6327 -0.3486 0.7463 -0.0308 -0.1838 -0.7042 -0.1382 -1.6656 0.1269 0.2220 0.3609 -1.0523 1.6468 1.0764 0.8396 0.3720 1.5130 0.1297 0.0747 -2.1715 -0.6916 -0.4984 -0.2782 -3.4100 -1.2181 0.7965 -0.0933 -0.1177 -0.5756 -0.8150 -0.9305 0.1279 0.5420 0.0614 0.8611 0.4514 -3.1833 0.5206 0.6949 -0.0400 -0.0083 1.7184 -0.3194 0.4929 -0.6056 -1.4367 -0.8530 -0.7168 0.3657 -0.4651 -0.7282 1.2836 0.0172 -0.1613 -0.4764 -0.0903 2.0194 0.1650 1.8694 1.5662 1.6569 1.0074 -0.0068 2.1425 1.1644 0.8633 0.8321 1.8047 -0.3392 -1.7875 -0.8520 0.5527 0.4092 -0.4923 1.6679 2.1240 -1.8397 -1.2717 0.3179 -0.3456 0.9165 1.3030 -0.5464 -0.0587 0.5377 0.1097 0.9205 1.7293 -0.0074 1.4808 0.3484 1.8326 -1.6958 0.8199 1.8781 -0.9932 -2.8163 -0.4149 1.9207 0.7868 -0.2293 -0.0464 0.2540 -0.2388 1.8866 -0.0307 0.6361 -0.1356 -1.4298 0.1616 -1.3358 -0.1926 0.8176 0.1233 0.7625 1.1988 0.5924 -1.2045 -0.0376 1.6147 0.0771 -1.6956 -1.7176 -0.5722 -0.2560 -0.2063 -1.2810 1.1139 0.4555 0.9660 0.4295 -1.7462 0.7546 0.6380 0.2067 -0.0920 1.3492 -0.5170 0.5308 -0.5356 -1.5309 0.6793 1.9531 1.4042 0.2176 0.2833 1.0784 -1.0431 0.9037 0.2732 -1.2503 -0.3556 0.1224 -1.4975 -0.8280 -0.4579 -0.4201 -1.0569 -0.6048 -1.0626 0.2914 -1.1119 0.4787 0.6384 -0.1898 0.4740 0.4874 -1.9144 -0.1016 0.4572 0.3927 -0.9162 1.0517 0.1477 1.0597 -0.3631 1.0924 -0.3570 -1.1629 -0.0342 -1.3911 0.5644 -1.4236 -2.6705 0.3789 0.3981 1.4326 0.3037 0.2430 1.4957 0.2686 2.0720 1.3636 -0.3295 0.7079 -1.5771 0.6702 -0.6278 -1.0726 -1.1209 0.4986 -1.2883 0.2716 -0.1582 -0.2407 0.2993 1.9294 1.2610 0.7591 1.1733 -0.4551 -2.1102 0.0706 -0.5508 -1.1271 0.1664 -0.4477 0.1816 -0.0959 1.1931 -0.3863 0.0654 0.5046 0.3394 -0.5392 -1.2016 -0.1670 0.6484 -0.9223 0.4247 0.8783 0.6719 -0.0853 -0.0493 -0.5965 0.6076 -0.3011 0.1612 -0.8053 -1.3429 -0.7255 -1.5559 1.3221 -0.0321 -0.8145 1.6360 -1.0116 -0.2409 0.8989 -0.4050 -0.0225 -0.0498 1.9895 0.5822 0.3222 -0.3321 -2.7523 -0.6232 1.4223 0.3919 0.2278 0.2978 0.2080 -1.6993 -0.3103 -0.5982 1.1253 -0.8502 0.9103 0.7965 0.9494 0.2997 1.3863 -0.0449 -0.1651 0.9988 -1.9024 1.1426 0.8467 -0.2420 -3.2301 -0.8948 -0.3343 -0.1951 -0.3033 0.1725 -1.7798 -0.0861 0.0068 -0.3831 0.1405 0.0877 0.9520 -0.1767 -0.5157 2.0199 0.7865 -2.9493 1.5186 -1.4589 0.7220 0.1814 0.1747 0.4077 1.4614 1.0023 0.9641 0.1515 -1.2447 0.8762 -2.0446 0.5082 0.0518 -1.2360 -1.9799 gulonate* 0.0362 0.1471 -2.6752 -1.1071 0.2995 -1.1140 -1.1092 -2.7800 -1.0589 -0.9670 -2.6458 0.9616 0.5932 -0.7848 1.1046 0.7638 -2.8207 0.5401 -0.0080 0.3727 1.5598 1.2013 -0.3224 0.0054 0.0504 0.4588 -0.4158 0.2198 -0.5996 -0.5089 0.3370 -0.3255 1.1496 -0.0962 0.0184 -2.5397 -0.3694 -0.0855 1.0067 -0.3030 0.1348 2.0403 -0.3176 -1.3448 -0.2340 -0.3732 0.7119 0.1702 0.2099 0.7172 0.1185 0.8502 0.8622 -0.6144 -0.1957 -2.6843 0.3944 0.2786 1.0538 -0.5585 -0.0419 -0.1633 0.7750 -0.6592 0.7763 0.4385 0.4445 -0.1255 1.3045 -0.1592 -0.2249 0.0831 0.7934 -0.0187 1.2631 0.9998 0.4187 0.1332 -0.4810 0.0311 1.1048 0.5238 -0.6144 -0.1069 -2.5164 -0.1747 0.4039 1.0159 -0.3730 0.0804 0.3863 0.2762 1.7694 0.6299 0.2209 -0.6043 -2.5489 0.7339 0.9943 0.3262 0.0396 0.2112 -0.5992 0.9869 0.7561 -2.4774 -2.6872 0.7271 0.2688 0.3047 -0.2007 -0.1683 0.2084 -0.2230 -2.6181 0.0464 0.7409 -0.2218 -2.7780 -0.0920 0.9274 -0.1737 -1.1894 -0.0312 0.7541 -2.0549 0.1742 -0.5574 -0.6250 -0.5219 0.2025 -0.4546 0.2091 -0.2256 -0.4838 0.2557 0.7332 1.2735 1.9028 -0.2370 0.0337 0.8453 0.1585 -0.4987 0.7410 0.2395 -0.3096 0.9857 0.9484 -0.4581 0.5097 0.7337 -0.2998 2.4278 1.0855 -0.0273 -0.1575 -2.1814 1.1686 0.6461 0.2716 0.9557 0.2617 0.0846 0.4243 -1.0708 -0.3203 0.8007 0.3422 1.0147 -2.7004 -0.5029 -0.1703 -0.2591 -0.2852 -0.4793 0.8791 1.6476 0.6680 1.4002 -0.0623 -0.1146 0.6641 1.0103 0.8178 0.1768 0.6544 0.8319 0.5161 0.8283 0.1767 -0.0475 0.0058 0.2610 0.1824 0.0227 -0.1778 -0.4407 0.1321 0.6879 -0.1472 -2.1306 -0.3942 0.3808 0.0568 -0.2448 0.6163 0.2379 -2.5422 0.6746 -2.4721 -0.2845 -0.4780 1.1194 1.1765 0.3381 0.5813 0.4805 0.2526 0.0044 -0.6621 -2.7110 -0.4680 0.1745 -0.1274 -0.2557 0.5143 -1.7385 0.3042 0.4173 -0.3599 -0.3370 0.4821 -0.2049 0.9369 0.1900 0.2356 0.3867 -0.2815 1.0552 -0.2447 1.7339 0.8474 -0.5413 -0.0276 -2.6454 0.1870 0.5031 -0.7398 -2.7396 0.0861 -0.1975 0.4064 -2.6407 -0.1734 0.7927 -2.6319 -0.6951 -0.0037 0.1361 0.8005 -2.2641 0.6220 0.4769 0.6432 -0.7669 -0.0175 0.9063 -0.4184 0.4900 0.0196 0.6533 1.4868 0.7503 -0.0912 0.1892 -0.2091 -1.0268 -0.2357 0.2362 -0.1284 0.1579 0.4673 0.4630 0.5502 0.1505 -0.0847 0.2097 0.7320 -0.1666 0.8494 0.3079 0.5400 2.1508 -0.6500 1.1021 -2.7672 0.9579 0.9584 0.1042 0.7032 -0.1574 0.6945 0.4997 -0.2387 -0.0424 -0.0915 0.4402 -0.0572 -0.1816 -2.4952 0.7686 -0.1203 0.2068 0.1147 -0.0433 0.0601 0.1647 0.5101 0.4817 0.1888 -2.8491 0.4398 0.9855 0.2538 -0.2461 0.4464 0.0299 1.8215 0.4874 0.9157 0.9262 0.1978 0.4389 0.4366 0.7122 1.5777 0.5918 0.2897 -0.1500 -0.3101 0.2932 0.4991 -0.5274 1.1391 0.9071 -2.3202 1.0830 0.7288 0.1792 -2.2939 -1.5782 0.0189 -0.0731 -2.7975 -0.4024 -0.3149 0.6860 -0.5313 1.1775 1.2612 0.5139 0.3242 1.2906 0.5984 0.1828 1.1098 -2.8524 -0.3199 -0.2660 -2.3862 0.2640 -0.2576 -2.6802 0.4927 -2.8884 -0.2257 -3.0494 -0.1387 0.2018 -0.4142 1.3811 0.9479 -0.2940 0.6834 0.2744 0.4208 0.1432 0.0708 0.2947 0.2320 -0.1362 0.6163 0.6668 0.6078 -0.4932 0.1783 0.2552 1.0787 0.8877 -0.0013 0.2320 -0.6518 0.1625 -0.0465 -0.2833 -0.1292 -2.6674 0.7669 1.1267 heptanoate (7:0) 2.9429 0.6305 1.0134 0.2168 -2.3318 2.1315 -1.2381 1.0986 0.5709 1.0234 1.9371 0.4373 0.9826 2.3725 0.5314 1.6974 1.3376 -0.1638 1.9581 -0.0581 -0.7770 -0.3452 0.1227 -0.3667 -0.3764 0.6527 1.5809 -2.8728 -0.3170 0.6721 1.4687 -0.8102 0.1714 0.8180 -0.6731 1.0411 -0.0177 0.7125 1.2932 -0.7606 -0.1615 0.9944 0.8920 -1.6655 -1.2177 0.3916 -1.0069 0.1363 -1.0032 0.2873 0.2501 0.2400 -0.4139 0.3440 0.0288 0.4136 -0.8709 -1.0155 0.1252 0.2761 0.0144 -0.7609 0.9603 3.4333 0.5875 0.3512 -0.0911 -0.3930 -0.5031 -0.0938 -0.8263 0.7495 0.6053 0.2632 -0.1840 1.2136 1.9232 0.5540 0.0424 -0.6561 -0.9949 0.7154 1.4157 0.1415 1.1780 -0.5203 0.2775 0.0854 -0.8129 -0.1112 0.2187 0.1359 -0.2748 -0.2270 0.4575 -0.0874 -1.4989 0.7250 -0.5029 -0.4810 1.0477 0.1770 -0.0070 1.4028 -0.4653 2.1151 0.7809 0.6468 2.1711 -0.0418 1.2151 0.4349 0.7413 0.3388 -0.6135 0.4128 -0.7523 -1.3296 0.3931 -1.2416 0.4414 -0.2232 0.1600 -0.4939 0.0968 -0.7557 -1.3028 -0.8978 -0.8177 -0.7869 -0.0224 -0.0023 -0.8590 -0.3257 0.5244 0.3800 -0.4820 0.5019 -0.8883 1.2429 0.6966 -0.6064 -1.6938 0.4414 0.2764 1.3854 0.0974 0.8572 -1.1189 -2.2113 -0.5723 -1.7009 -1.1345 -0.0171 1.4746 1.5125 -0.4593 -1.0128 1.2026 1.3536 2.2881 -0.8036 0.3245 0.1980 0.6561 -1.0788 -0.1695 -0.1997 0.2145 -0.1526 -1.1217 2.3936 -0.5156 1.6433 0.3020 -1.4945 -1.0305 1.0167 -0.3820 1.3839 0.5079 -0.0175 1.0813 0.6472 0.9639 1.6492 1.4911 0.7315 2.9182 0.7956 -0.1985 0.6109 -0.8099 0.4242 -1.1125 0.0392 1.2887 -0.8213 -1.4789 -0.8776 0.3917 0.6498 -0.9729 -0.5943 0.6057 0.2118 -1.3145 0.3748 1.6685 1.6285 -1.2142 -0.0735 0.9847 1.3342 -0.7124 -0.4030 0.5745 -0.9584 -0.7151 0.3995 -0.1074 -0.4688 1.5176 1.3896 -1.1412 -1.1013 -0.1956 -0.5525 -0.7436 -0.2966 1.0240 0.8974 -1.0250 -0.4398 -0.6036 1.4499 1.3390 0.3661 0.4491 -0.8642 0.9758 -0.0491 -0.1679 -0.5459 -1.2180 1.0637 0.1489 0.2503 -0.0520 0.1441 0.1292 -0.2741 0.0350 -0.6873 -0.3272 0.6756 0.2646 -0.3553 -1.0711 0.4365 -0.4485 0.4160 0.3935 -0.1038 -1.0435 0.2219 0.8532 1.5785 -0.9774 -1.2783 0.3810 -1.1578 -0.7390 0.9160 -0.8630 -0.2583 -1.9977 -0.0914 -0.1826 -0.4729 -2.0836 0.4687 -1.6632 1.0565 0.4588 -1.1179 -0.2896 -0.6773 -0.6776 -1.0468 -1.1126 -0.9220 0.3664 0.1771 0.4951 -0.2696 0.0628 -1.2462 -2.0205 -0.5885 0.6714 -0.1622 -1.3574 -0.0969 -0.8480 -1.2596 -0.4317 -0.2467 -1.0915 0.2582 -0.2168 -1.3735 0.4062 -0.9933 -2.6857 -0.1785 -1.4955 -0.2001 0.3749 -0.4496 1.2620 0.9400 0.2094 0.6185 -0.5470 -0.3341 -1.8344 -0.6637 -0.6557 -1.2504 1.0589 -1.3684 -1.6876 0.7841 0.8594 -0.8536 0.8525 -0.9111 -0.5521 0.9889 -0.5211 -1.4653 0.3504 0.6532 -0.4343 0.8808 -0.1931 -0.4447 1.0382 0.6368 1.4369 -1.4186 3.8545 -0.6312 0.4298 0.1573 -0.2880 -0.1682 -0.8830 0.1397 -0.1060 -0.7789 -0.8265 -0.5347 -3.2915 1.8783 -0.3149 -0.6747 1.2772 0.3709 2.1246 0.4549 1.0547 1.5780 -0.6357 0.7248 -1.1204 1.0794 1.1277 -0.6065 0.6272 -1.4871 -1.1580 -0.2322 -0.7431 -1.2364 -1.2078 -0.8525 -0.1055 -1.4791 -1.1066 -0.6186 -1.4574 -0.4039 0.3036 -1.1307 -0.3956 -0.0180 0.6040 1.3699 0.0667 -0.3342 1.1693 -1.2306 0.1433 -1.0983 -0.5554 -1.5156 0.7045 -0.0740 heptenedioate (C7:1-DC)* 0.5235 1.0028 1.1118 0.7013 0.3332 0.9281 1.2292 -0.1550 0.5613 1.1310 -0.1449 -2.2612 0.6980 0.1260 0.1631 -0.2397 1.2071 0.9114 0.5560 -0.1412 0.8678 -0.1205 0.1940 0.1327 0.8449 0.8768 0.6315 1.1163 -0.0815 -2.0608 -0.9116 -0.1400 0.7734 0.1319 -0.5564 0.4655 0.0220 0.2526 -1.8772 0.2346 0.7625 -0.2197 1.2862 0.3992 0.5309 0.8830 0.1273 -0.3427 -0.4329 0.6766 0.3572 0.6693 0.3864 1.4903 -0.2482 0.5803 1.0247 1.3053 0.2330 0.6197 -1.2799 0.6123 1.1003 -1.8917 0.0719 -0.3350 -2.0136 0.1756 0.8750 0.6673 1.5443 0.1281 1.0326 -0.4845 -1.9972 -2.2379 0.2007 0.4822 0.0027 -0.4766 -0.7757 -1.9033 -2.0173 0.7995 -1.9176 -2.2059 -1.8136 0.9763 -2.2588 -1.6309 -0.1409 1.0941 0.3619 -1.5217 -0.0918 -0.1283 -0.0419 -0.1436 0.6201 1.1462 -0.2912 -0.7464 -1.7758 1.0504 1.3505 -1.9164 0.6740 0.9495 1.8010 -1.8555 0.4925 0.1159 0.5382 2.0771 0.2942 -0.4922 -1.7386 -0.1958 0.1564 0.0149 -1.8619 0.9501 1.8991 0.0813 0.9255 0.3216 -0.6350 -0.1249 0.7366 0.2501 0.6172 0.6276 0.2894 -0.1699 -2.0984 -0.4302 1.0564 0.4242 0.0620 -1.4045 1.1322 0.3187 1.0055 1.2686 0.6463 0.7370 -1.0954 0.4630 -0.5581 1.2882 0.7499 0.4395 0.6481 1.0164 -0.1096 -1.7741 1.1286 -0.0383 0.6596 0.5336 0.8435 0.8397 0.2593 1.6849 -1.9709 1.1990 -2.2106 -0.4588 -0.7397 0.7487 -0.8846 0.5492 0.5464 0.3299 0.3273 1.2854 0.5130 0.6834 1.2921 2.3237 -0.0430 0.9453 0.8029 -2.0620 -1.7553 0.7577 0.6812 -0.0172 -0.2740 -1.3064 0.8389 -0.4559 0.2867 -0.5386 0.7507 -0.0663 -0.0472 0.4883 -2.0319 0.5007 -0.0885 0.3039 -1.8220 -1.8937 0.7574 0.2985 0.6944 0.9367 -2.0079 -0.4754 1.0678 -2.0104 -0.5851 -0.0886 -0.2834 0.4906 0.6440 -0.1341 0.2744 -0.7636 0.1327 -0.0302 0.1927 0.2915 -0.2622 -2.3531 -2.3131 0.5240 0.2951 -0.5355 -0.5917 -0.5393 -1.9537 0.7056 0.2930 -0.0207 -1.0142 0.7458 0.2756 0.4014 0.3532 0.1322 0.2997 1.3997 0.2376 0.5766 -0.1072 1.2230 -1.2706 -0.0381 0.2459 0.7691 0.4257 0.2048 0.7208 -0.6294 -2.1465 0.2987 1.0017 0.5489 0.3652 -1.8346 -0.2149 0.4953 -0.1325 -1.6167 -2.2169 -0.5996 -0.5185 0.3447 -0.1464 0.1187 -0.4546 0.8595 -0.4218 0.4842 0.4065 -0.5109 -0.0491 0.2003 1.0873 -0.6928 -0.4001 -0.6848 0.2386 -2.0137 -0.1725 -2.0480 -0.5097 -0.1267 0.2313 -2.3222 1.0256 0.5126 -0.8491 0.0013 -0.0268 1.0241 0.5346 -2.2583 0.3024 0.1862 -2.0639 1.4207 1.5354 -0.1632 -0.9625 -0.0102 0.6224 -0.9269 1.0035 -1.0512 -1.3629 -0.1080 1.5304 0.1137 -2.0534 0.0848 0.4086 0.6619 0.6927 0.6356 -0.1497 0.1273 -0.3383 0.5527 -0.0498 0.1908 -0.4937 0.9623 -1.9218 2.2643 0.7810 0.7419 0.6333 1.1137 -0.9587 0.0106 -2.3286 -1.8930 -0.3968 0.8187 0.9125 0.2823 -0.0755 0.1559 0.5348 1.2536 -0.0205 0.2236 2.3765 -0.2508 0.0688 1.3974 1.5024 -0.4679 -0.0001 0.1528 0.1421 0.8347 0.2833 -0.4899 -0.5131 -0.3136 -2.2000 0.4630 -1.2989 0.0160 0.9401 0.3775 0.3090 0.7594 0.2597 0.4012 -2.5736 -0.2359 0.0116 0.0360 -0.0487 0.1984 -2.1319 -0.4436 -0.2711 1.0410 -0.8062 -0.3506 0.5381 -0.3211 0.9213 0.8603 -1.7987 0.5834 -0.0815 1.0873 -0.7454 -0.4735 -2.5335 -0.2629 0.5570 0.1577 0.9552 0.1602 -2.0269 0.5958 0.9634 0.4841 0.3307 0.0701 0.2397 -2.5823 hexadecadienoate (16:2n6) 0.9554 0.1820 0.4861 1.0376 0.8092 0.7254 -0.0339 0.4388 0.5436 1.2028 1.5057 0.0713 0.4934 -0.6462 -3.5556 -1.4514 0.3511 0.5196 -0.0227 -0.0898 0.2222 0.6217 -1.3954 -1.6078 1.1477 -3.2573 0.3726 0.3565 -1.3956 0.1091 -0.8459 -1.1593 -1.0377 0.4577 0.9559 0.1184 0.8171 -0.4696 -0.0418 0.0585 -0.1734 -0.8372 -0.8308 0.8901 0.6793 -0.1002 -0.3860 -1.1540 -1.6801 0.0564 -0.1359 0.8944 -0.3225 2.3575 -0.9684 0.0266 -1.9340 1.2136 -0.1007 1.7911 -0.1224 0.0167 -0.7710 -0.4812 -0.8958 -1.5241 0.4983 -0.3508 -0.1985 -1.1134 -0.0299 -0.4614 0.5592 -0.0891 0.6816 0.3744 -0.9211 -1.1828 -0.4186 -1.0870 -0.0293 0.0439 -0.9059 1.8608 1.3359 -0.7752 -1.0185 1.1069 0.2208 -0.6713 -0.0344 -0.0614 0.1016 -0.5364 -0.4653 -0.7122 0.9062 0.0590 -0.8691 -0.1356 -0.1711 -0.4824 -1.1303 -0.9255 -1.5150 -0.7646 0.0194 0.1765 1.4377 -0.8505 -0.1687 -0.7674 -0.6908 1.1146 0.9212 -0.8007 -0.6180 -3.2016 1.9520 0.5756 -0.3630 2.1723 -1.3420 4.0938 -0.0795 0.3885 -0.3392 -1.2835 -0.3667 0.3559 0.1321 0.5346 0.5420 -0.6176 0.3211 -0.1871 -0.0432 -0.4310 -1.1343 -1.2752 1.1557 -2.8667 -0.2163 -0.2369 1.3753 0.2354 0.8331 -0.2561 -0.2542 -0.9088 -0.8354 0.7470 -0.7095 -0.3110 0.3643 0.1412 0.6514 0.1745 -0.3373 0.5326 -1.9486 -0.0698 -0.2192 1.4486 1.4410 0.1254 -1.3757 -1.2756 -0.5585 0.8636 0.5547 -0.3762 0.1504 -3.0753 0.7919 0.9649 1.4745 -1.0696 0.6351 -1.1866 -0.8864 -0.8471 -0.0080 -0.3115 -1.6798 0.0001 -0.6278 -0.2707 -0.4170 -1.6926 1.4505 1.6337 -0.2435 -0.0890 0.1486 1.7045 -0.3166 -1.2509 0.5796 0.4372 -0.9842 -0.2068 0.2323 -1.7606 0.6531 1.4244 1.1031 -1.2698 0.2749 -1.9993 -0.7244 -0.6384 -1.2867 -0.6425 0.4909 -0.9182 0.7404 0.6674 0.8276 0.5951 1.8659 0.6345 0.3151 -0.5368 -0.0047 0.0547 0.2494 0.2163 -1.2457 0.0094 -0.9312 0.2355 -0.2704 -0.9484 0.7334 -0.4953 -0.5563 2.2425 -0.9836 0.2187 1.5173 0.9786 1.0297 -0.9510 -0.0294 1.4581 0.6964 -1.9605 -0.1299 0.1164 1.5744 0.8002 -1.8889 1.2972 0.9473 -0.2148 0.4168 -0.0630 0.9167 -0.5456 -0.5149 -0.9907 1.3211 0.9135 1.2846 0.7872 -2.1536 -0.5354 0.5863 0.1907 0.4637 -1.8490 0.0571 1.3033 -0.0685 -3.3963 2.5589 -0.7149 1.2606 0.1857 -0.5910 -0.3206 -0.7292 -0.9525 1.0279 -1.4703 0.5906 -1.0707 1.3424 -0.3855 -0.1815 0.3219 -2.0899 -0.0910 0.4078 0.1527 0.9111 -0.9795 0.1361 0.6287 -0.7662 -1.9082 -0.6155 -0.5682 -1.6780 -1.3858 1.2711 0.2263 1.8467 0.6469 1.0916 0.2127 -0.1263 0.5953 0.5616 0.3381 0.4298 -0.8236 -0.1603 0.0890 0.2632 0.3534 0.5972 0.4961 -0.6494 0.7296 0.5059 0.8613 0.6635 -0.7072 -0.3439 -1.0435 0.9514 1.1848 0.1821 0.1306 0.5009 0.9802 -0.6204 -0.3245 0.7245 0.4490 -1.0172 0.8442 2.0493 0.1066 0.2143 -1.5732 0.7466 -0.1878 0.7499 0.7277 0.9595 0.8367 1.1262 -0.2706 1.0188 0.1011 2.5478 1.0159 0.0495 0.5977 -0.5919 0.8008 1.5858 -0.6615 0.1014 -0.0444 0.2507 -0.7492 -0.3193 0.3582 1.0668 0.2553 -0.7511 1.4186 0.0712 -0.9687 -1.2840 -0.7686 0.9115 -2.0160 -0.2450 0.5671 0.6834 0.5179 0.2026 0.3194 0.9573 1.4344 -0.0135 -0.7251 1.7952 -0.8005 -0.3897 0.9014 0.3587 0.3271 -1.0884 -1.6508 -0.3879 -0.1934 0.0810 1.0898 -0.6782 0.8143 1.1307 0.0426 1.6619 0.3096 hexadecanedioate (C16) 0.0003 -0.1913 0.1910 1.7240 -0.3406 0.3991 0.6256 1.1553 0.6220 0.3350 0.6246 -1.0109 1.5407 0.0249 -0.4048 -0.9934 1.5402 -0.6901 -0.9139 -0.8541 -0.8463 -0.4562 -1.6476 -1.3675 0.5917 -0.1538 -0.3438 -0.8756 -1.9580 -1.0953 -0.9563 -1.3864 0.1830 0.6609 0.3424 0.6763 -0.8403 -1.4894 0.8028 -0.3189 -1.5364 -1.1227 0.2532 -0.3758 0.5767 0.7157 -1.1854 -0.6361 -1.4497 -1.1699 -1.1336 -1.6061 -1.7130 0.4902 0.6033 0.4105 -0.9038 -0.1629 -1.7518 -0.6432 -2.4508 -1.2585 -0.0892 0.5879 0.1939 0.8370 -0.7613 -0.2415 -0.8739 -2.0416 -0.4106 -1.4822 -1.1006 -0.2206 0.0994 -0.0922 -4.0069 0.1019 -0.5165 -1.1410 -0.4563 -0.5422 -0.1699 1.4711 0.7108 -1.0020 -1.2694 0.8648 -0.3145 -2.1475 0.1283 -0.1763 -0.2911 -0.7966 -0.6111 -2.5439 -1.1179 -2.1858 -0.2074 -0.8836 -0.8015 -0.9891 -1.8436 0.6047 -0.3398 -1.0200 0.4963 -0.2557 0.2173 -0.9188 2.0445 -0.1647 -0.0051 1.9130 2.0270 1.6740 -1.2177 -0.4364 1.1188 -1.3068 1.4767 -0.1487 -0.5752 -0.6762 0.8523 -0.6001 -0.2487 1.3932 -0.0713 0.8311 1.5584 0.1189 -0.3631 -0.4566 -0.0113 1.1150 -1.1098 -0.8970 -1.2333 -2.7544 0.7215 -0.1735 -0.3764 -0.2699 -0.3402 -0.5727 0.2661 -0.3358 -0.9310 -0.9308 -0.3524 -0.3817 0.6231 0.6769 -0.4784 0.0621 0.5564 -1.1361 -0.6387 -0.0717 2.8228 1.2917 -1.0291 0.1532 0.6124 0.8392 -1.0077 -0.7234 -0.3689 -0.3155 -0.7637 -0.8328 -0.3585 -1.0956 0.0839 1.1177 0.5503 -1.5707 -1.4068 -1.4815 -0.1672 0.3092 3.0578 -0.8627 0.0142 -0.5581 -0.6463 -0.3066 -0.6645 -0.8912 0.0731 0.0894 -1.1256 -1.4588 1.7654 0.7833 1.0370 0.2271 0.2024 0.6087 -0.9353 -0.9071 -0.2469 0.7298 0.5033 0.4809 -0.1843 -3.6176 0.1555 -0.4666 -0.8985 -0.8592 -1.3969 2.1203 0.2470 -0.4975 0.0516 0.2519 2.6111 -0.8528 0.9821 0.9151 0.2963 -0.0182 0.9789 -0.7994 0.2288 0.1250 1.3378 0.2796 -0.7519 0.0836 0.5349 -1.1736 -0.5456 -0.1935 -0.3296 0.7203 -0.3921 1.7300 0.3698 1.8668 -0.1132 1.0026 -1.3792 0.0022 0.1370 0.0790 0.0021 -0.0670 1.1346 0.0756 1.3699 0.2089 0.1754 0.7932 -0.5006 1.2816 -0.2353 0.4903 -0.7743 0.4569 0.1704 0.9225 0.5066 0.1376 0.0274 1.0722 0.1577 2.5129 -0.2675 0.2328 1.2438 2.4090 -1.1016 0.0932 1.0463 -0.4481 -1.3860 0.1729 1.3638 -0.6782 0.9523 0.4007 0.3771 -0.4428 0.2896 1.6448 1.0178 -0.2808 0.1965 -0.2290 -0.1780 1.9672 -0.4887 2.0505 0.0914 1.1383 -0.5234 -1.4625 0.0767 -0.2805 -0.1672 1.2692 0.5942 -0.0468 0.3575 -1.8136 1.8899 0.2484 1.0484 -1.3501 1.1983 -1.4373 0.1590 0.6034 -0.5255 -0.1462 -1.2939 1.1473 -0.3413 1.8335 0.9875 1.0806 -0.2558 0.7324 1.7537 0.6864 0.5175 2.1617 -0.6316 0.0507 0.0641 -0.1516 -0.5026 0.0632 -0.1682 0.1786 -1.5569 -0.0539 -0.5521 -0.6893 0.8800 -0.4093 0.6989 -0.8294 -0.2911 -0.1906 -0.1920 -0.3155 1.3768 0.9091 0.0732 1.5300 1.3936 -0.1124 1.3812 -0.7531 0.9426 -1.2410 1.1343 -0.8793 -0.1006 -0.7023 1.6130 1.2784 0.0214 1.0711 1.3034 -0.5114 0.5043 0.7523 0.5229 0.0212 0.5951 0.2649 0.5595 -0.3932 0.5430 -0.2405 0.5969 -0.6426 0.1967 -0.7807 -0.7209 1.1323 2.4883 0.4018 0.1936 1.0070 -0.7892 -0.4491 1.5860 -0.0370 0.3867 2.4861 0.4671 0.0493 1.1642 0.3787 0.7986 0.6720 -0.6231 -1.1379 0.6746 -0.2307 1.4560 0.5287 0.5347 0.8102 hexadecasphingosine (d16:1)* -0.6272 -1.6900 -1.1486 -0.9259 -0.3633 -0.0020 0.2893 0.0441 0.3807 1.3326 2.4865 0.8772 -0.9894 0.9677 -1.4182 0.8323 0.4802 0.7450 0.4385 -0.7429 -0.8137 -0.1909 -0.5328 0.7921 -1.0256 -1.0327 0.0619 1.4028 -0.0577 -0.1172 0.0606 0.5976 -0.4712 -1.4921 -0.2381 1.1213 0.7747 -0.6888 -0.9013 0.1625 -0.6756 -0.3634 0.5441 -1.3778 0.0170 -0.9027 0.8747 0.6787 -1.0369 -1.0214 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0.1305 0.3297 0.6782 0.3918 -1.3439 -1.8305 -0.2151 -1.2422 0.2846 0.2219 0.7907 0.3474 0.5481 0.2776 -0.9939 0.9254 0.8173 0.5012 0.1618 2.8030 0.4135 -0.0896 1.2586 0.2746 0.2708 0.6293 0.6488 1.8079 1.4524 -0.9060 -1.3822 -1.2958 1.7985 -0.8217 -0.2548 1.7807 -1.6112 1.4794 0.7125 -0.0236 0.5744 0.3735 1.0955 0.6181 1.2102 0.9421 0.2104 0.7933 -1.4323 0.4809 0.2954 0.7427 1.3631 0.9893 0.6166 -1.1153 0.8448 0.3309 3.5514 1.5151 1.7621 -1.3974 -0.0832 -1.1712 0.0340 -1.7001 1.0511 -1.7832 0.4346 -1.7438 -1.2765 0.8139 -1.6328 -0.8333 0.1696 2.7118 1.0884 1.2770 0.4943 0.4492 1.7446 0.0970 -1.3361 -0.0373 -1.3267 2.0410 0.8243 -1.5629 0.2137 -1.2303 0.3108 1.4622 1.3830 hexadecenedioate (C16:1-DC)* -1.0500 -0.1270 0.1800 1.2900 -0.6200 -0.5240 1.3200 1.0300 0.4390 0.2640 0.1100 -0.2460 0.8150 0.3880 0.1710 -0.3530 0.4070 -2.9600 -1.2400 -2.6500 -0.6440 -0.8390 -2.4300 0.0186 -0.0326 0.4030 0.4520 -0.5130 -2.7200 0.2460 0.0207 -1.3400 0.1970 0.5210 -0.1680 -0.3330 0.2510 -0.8610 0.3260 0.1820 -0.2890 -0.3350 1.2000 -0.7190 0.1470 1.0000 -0.6430 0.9270 -0.4160 -1.2200 -1.3100 -1.2700 -0.5050 -0.6270 0.9830 -0.2740 -0.7110 -2.4700 -2.3400 -0.4650 -2.7400 -0.1300 0.0275 0.7390 0.5590 1.2300 -0.2950 0.3140 -0.6240 -2.1700 -0.9410 0.1390 -1.4100 0.1280 -0.4640 -0.5130 -2.7400 0.8530 0.7010 -0.5970 -0.3060 -0.4540 1.1200 0.4590 0.1970 0.3330 -0.8380 -0.0544 -0.3730 -1.2200 1.0500 0.0121 0.2680 -2.4400 -0.9550 -2.8700 -1.0200 -0.6530 0.7840 -1.3600 0.0887 -0.1320 -0.5110 0.4030 -0.0515 -0.8280 1.0700 -0.4200 0.1560 -0.4420 1.3600 1.3300 1.4900 0.7810 1.1300 1.4800 -1.6000 -2.9000 1.3200 -0.0513 1.8400 0.2430 0.3690 -0.9240 0.9250 0.3860 0.0578 1.8400 0.3340 0.6100 1.5700 0.4150 -2.5400 0.1300 0.7050 0.2750 -0.7720 -0.4520 -0.2210 -2.2600 1.2300 -0.7300 -1.0800 -3.0600 -0.4940 -0.0844 -1.2500 -0.4540 -0.5760 -2.7600 -0.0018 -0.2820 1.1000 -0.3880 -0.6890 0.4080 0.0392 -0.3840 -0.0193 0.6000 1.0600 0.2290 0.8510 -0.2730 0.0000 0.6490 0.1410 0.2820 0.3380 -0.6720 -0.8310 -3.0400 0.5110 -2.6800 0.2530 0.8160 0.3810 -2.1000 -2.1900 -2.6300 0.4370 0.8240 1.8900 -0.1400 0.5640 -0.3330 -0.0428 0.0165 -0.3080 0.2590 0.2850 0.3940 -2.8500 -0.4680 1.3300 0.2860 0.7740 1.2000 0.4150 -0.2720 -3.2400 -2.6900 0.1250 1.2300 0.3460 0.2800 0.3540 -1.8900 -0.0515 -0.0637 -1.0300 0.2750 -0.7090 1.5500 -0.1640 -0.2120 0.8300 1.2900 1.5700 0.8930 1.5300 0.9070 -0.3900 0.5790 0.9730 0.0692 -0.0800 0.8700 1.1200 0.1970 -0.6990 -0.0288 -0.2030 -0.6080 -0.1360 0.4690 0.1060 0.4220 0.6470 1.2900 -0.0028 1.2300 -0.4450 1.0700 0.1810 0.1440 0.1880 0.5700 0.1440 -0.2110 0.4370 0.6060 1.5300 0.5300 -0.8240 0.1750 -0.0746 -0.4050 -1.1800 0.2330 -0.5590 1.3100 0.7040 0.4560 0.1570 -2.5300 -0.3860 1.1100 0.3100 2.3300 -0.8590 0.4920 1.3800 1.3000 -1.0400 1.1800 -0.1560 -0.1460 -1.0600 -0.3030 1.2500 0.1710 0.6960 -0.0051 -0.7150 -0.1810 0.6390 1.4600 0.2190 0.5880 0.3730 -0.2130 0.4690 1.5400 -0.1680 1.0800 0.5010 1.5300 -0.5620 -1.9100 -0.3640 -0.6240 -0.5820 0.9940 0.5460 0.3210 0.5090 0.0063 0.2580 -0.1880 0.3010 0.2350 1.7500 -0.8520 -0.2480 1.5000 -0.2360 0.5340 0.1970 0.8750 -0.1210 0.6830 -0.0947 0.7450 1.0700 0.1200 1.1400 0.1260 0.5870 0.7240 -2.9000 0.1920 -3.0700 0.5360 -1.3100 0.0219 0.5910 -0.3410 -0.4620 -0.3010 -0.3250 -0.8270 1.1000 0.0829 0.0659 -0.5660 -0.2300 -0.4410 -0.7140 -0.0340 1.1300 0.5140 0.1380 1.3000 0.2860 0.7810 0.4760 -0.0727 0.7440 0.2490 0.7070 0.1610 0.3870 -1.0500 0.9560 0.9360 0.1290 1.2100 0.9220 0.0616 -0.0585 0.5750 -0.0718 -0.2870 0.5790 -0.9900 0.1960 -0.0128 0.4210 0.2630 -0.4240 0.7020 0.8580 0.2410 0.2040 0.2150 1.0700 0.0476 1.0400 0.6830 -0.7210 -0.1630 1.3000 0.5300 0.1720 0.7320 1.3400 1.1100 0.8660 0.8920 0.6920 0.2050 -0.8680 -0.3410 0.6460 -0.6340 0.9600 0.3250 -0.6470 0.8590 hexanoylcarnitine (C6) 0.5789 -0.1629 1.9339 1.6971 0.6786 1.3882 0.2861 -0.7075 0.7262 -0.1613 1.3535 0.6403 2.8520 0.5665 -0.2767 -0.8489 1.1315 1.8551 -0.3617 0.7259 0.2128 -2.1833 -1.6036 -1.0131 -0.5858 0.5681 0.5682 0.0140 -1.8653 -0.3631 -1.5967 -2.1680 -0.7961 0.2611 1.1969 -2.0185 -1.7478 -0.1073 -0.6837 2.6704 -0.7263 -0.3588 0.1421 1.9675 0.3415 -0.7392 0.3642 -1.2810 -0.5634 0.8308 -0.8155 0.1013 -0.1960 1.1939 -0.2716 2.5993 -1.1229 1.9297 0.2644 1.4666 -1.6916 -0.1948 -0.4651 -1.3864 -0.2672 -0.3765 1.7828 0.4498 -0.0726 -1.0499 1.8224 -0.9231 -0.4411 -1.5998 0.5642 -0.5690 -1.6178 0.0177 -0.4519 -0.5825 0.2340 -0.6725 -0.1767 0.4560 -0.4950 -1.4079 -1.5716 2.7339 0.5042 0.3757 0.1824 -0.4257 0.3584 -1.1901 -0.5061 -0.6352 -0.5804 -0.6738 -1.2095 -0.2399 -0.7409 -1.3862 -1.1799 -0.1743 -1.0755 -0.1499 1.4326 0.4065 1.4521 -0.3319 -1.1024 0.2658 0.1193 1.3809 0.3975 -1.3788 -0.7734 -0.1996 0.4119 0.0032 -0.3948 1.9310 -0.5097 -0.0818 0.3682 -1.4927 -0.1146 -0.3031 1.3380 -0.8350 0.2443 -0.4255 -1.1743 -0.6140 -0.9030 0.2433 -0.9840 0.2014 -0.8960 -0.4420 2.0173 -0.6995 0.0441 -0.3221 0.5008 1.1486 0.2034 -0.3986 1.0150 -0.3779 -0.8704 2.0336 1.4186 1.7002 0.1251 -0.8055 2.2677 0.1869 -0.6555 1.1363 -0.5346 -0.5039 -0.6558 1.3206 -0.0174 -0.9891 -0.1357 -0.7681 0.0748 -0.5973 0.5069 -0.4778 -0.0737 -0.9243 0.1366 3.0471 0.3864 -0.6974 0.1656 -0.2509 -0.9595 0.6213 -0.9322 -1.4691 -1.4018 -0.2979 -0.9508 -0.6577 -1.5907 -0.6550 0.5141 -0.3929 -0.9421 0.9987 0.6650 0.4312 -0.1910 -0.8971 -0.3509 1.8583 -0.6965 -1.1885 -1.0509 -0.4056 0.1432 1.0210 0.5219 -0.5037 -0.6537 -1.2381 0.3457 -0.7866 -1.5574 0.0059 0.7995 -0.9145 0.7184 -1.0145 -0.4613 -0.0119 0.1535 0.1339 -0.4015 -0.7559 -1.4963 0.5155 -0.2882 0.2639 -0.6575 0.0480 -0.0594 -1.0622 0.0366 0.3647 1.0278 -0.8634 -1.0745 1.9652 -0.5190 0.2208 1.3700 0.1211 -0.0608 1.5753 -0.5705 0.9432 -0.0502 0.2432 -0.4425 -0.7280 0.5393 -0.7892 -0.0965 1.2091 1.1974 -0.4914 1.1795 0.0113 0.6622 0.1211 1.0287 -0.4018 -0.1658 1.6058 0.0419 1.6428 0.5974 -0.0603 1.4040 0.3056 0.2384 -0.6854 -1.0086 1.1373 -0.6068 -0.3245 0.7052 -0.6754 -0.1551 1.0866 0.6243 -1.2050 0.1676 0.7257 3.2410 -1.1613 0.7386 -0.5864 -0.3962 -0.9369 1.3610 -0.2091 -0.2916 0.4430 0.2188 -1.0437 0.2137 0.0835 0.6336 0.0643 -0.9714 -0.8332 0.3940 0.2179 -0.4280 0.2064 0.0336 0.9507 1.2230 0.8062 0.3332 -1.9593 0.7370 -0.8455 1.4685 -0.6243 -0.1564 -0.0709 -0.7688 -1.3544 -0.4968 1.5345 0.7188 0.1046 -1.0266 1.1841 -0.0812 -0.0850 -0.5083 0.8234 -1.1642 -0.1588 1.7422 0.9751 0.2983 -0.7249 -1.2442 1.5964 -0.9032 -1.1181 0.6002 -0.5089 0.4761 -0.9754 -0.9395 0.1315 0.2228 -0.7605 0.4795 -1.4102 1.8659 1.2217 -0.0645 2.0834 0.8547 -0.7119 2.1227 0.5629 -1.1962 -0.0958 -0.3247 -0.3716 -0.5216 -0.6956 0.2257 -0.3913 -0.2181 -0.3147 -0.6937 -0.8110 0.2837 1.4272 1.2706 2.2323 -0.3900 -2.7565 -0.5373 -0.5976 -2.2253 0.5809 1.7701 -1.3400 -0.8032 1.3727 -1.3491 0.6471 -0.5678 0.0419 2.1143 2.9454 -0.0657 0.9008 0.2219 1.5667 0.4100 0.8074 -0.7603 -0.6999 -1.8430 -1.2812 0.8396 0.0941 -1.0874 -0.1020 0.6580 0.3096 1.7126 -0.7425 -0.5820 0.4930 hexanoylglutamine -0.6530 1.0118 1.4208 1.1725 -0.4799 1.0244 0.5783 -1.1361 0.7340 0.7039 1.6432 0.6812 2.1680 0.0603 -1.2289 -1.0813 2.1047 0.8902 -0.9328 -0.7373 -0.7985 -1.4243 -0.5888 -0.9598 0.2250 0.1735 1.0574 0.5046 -0.7942 -0.9778 -1.1985 -0.8052 -0.5547 1.2730 1.2274 -0.9952 -0.9198 -0.7074 0.5032 -1.2007 -0.6939 -0.4687 0.4014 0.7174 -0.8063 1.3812 -0.9871 -0.9620 -0.9518 -0.9351 0.1944 0.0253 -0.1507 0.7944 -0.6321 0.2955 -0.9919 -0.6273 0.3430 1.5799 -0.8108 0.4146 0.3680 -0.8633 -0.9452 0.4366 -0.0645 -0.0303 -1.1795 -0.7839 0.9423 -1.1267 -1.0438 -1.1870 1.0271 -1.1634 -0.8111 -0.9624 -0.7952 -1.0343 -0.0879 -0.9061 -0.9718 0.9164 -0.8601 -1.1100 -0.8063 2.9045 0.4271 -0.1199 0.9556 -0.9039 -0.9102 -0.6153 -0.9192 -0.8893 -0.9496 0.7977 -0.9043 1.0946 -0.4251 -1.3089 -0.8306 0.5474 -0.3066 -0.8735 1.5864 2.0767 1.4612 -0.8598 -1.2013 0.0435 -0.4571 2.1400 1.0864 -0.9703 -0.7844 -0.9089 -0.3737 -1.2464 0.9057 1.0446 -0.3399 -0.1000 0.3749 -1.0628 0.7444 -0.0830 0.8749 -1.2418 0.8163 0.0961 -0.6592 -1.1398 -1.0371 -1.1509 -0.9416 -0.6148 -1.0133 -0.4746 2.5222 -1.0552 -0.9211 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0.0127 -0.2965 -0.2349 -0.6583 -0.9217 -1.1154 -0.9562 1.3882 0.0638 0.5318 -0.6094 -1.2796 -1.6324 -0.2932 0.2031 histidine -1.0445 0.2532 0.3593 0.0079 1.3098 1.6075 -0.1728 1.8954 1.2866 0.4772 -0.0065 -0.2969 -2.5986 -2.1829 1.5310 1.0211 0.9223 0.3332 0.5530 -0.4004 0.2517 -0.1287 -0.7744 0.7701 -0.0963 -0.9082 1.4816 1.3554 0.9990 0.1650 -1.2472 -0.2341 -1.4145 -0.2689 -0.5631 1.6654 1.1762 0.4912 -0.2295 0.4063 1.3554 -0.9408 0.3115 0.1515 -1.2568 -0.4462 -0.2446 -0.0905 -0.8682 -0.4702 0.3205 -1.0351 -1.4308 -0.1456 0.0057 0.8569 0.3654 0.7992 -2.3285 0.1196 -0.8957 1.0694 0.5595 0.8090 1.0629 1.7587 0.9761 -0.8183 0.8977 -0.2227 0.6481 -0.3433 -0.7412 -1.6842 -0.1426 1.1561 -0.6952 0.7642 0.1271 -0.1625 2.1708 1.1660 0.0844 -0.3665 1.0449 -0.8606 -1.0071 -1.2387 -0.2974 -0.1470 -0.5264 0.1727 -0.5497 1.3427 1.0326 0.1984 0.1718 -0.9369 -1.0028 0.2882 -1.3314 0.4706 -0.0820 -1.1544 -0.4518 1.0327 -0.1170 -1.6961 -1.7164 1.0469 1.6149 -0.2277 0.8957 -0.0170 -0.0886 -0.0034 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-1.5656 0.5590 -1.4517 0.5651 0.0906 -0.3173 0.3043 0.1290 -0.7725 -1.7600 0.4717 0.0219 1.9502 1.1059 1.7578 -0.3238 1.9016 -1.8334 0.7460 0.4878 -1.0001 1.3210 -0.8092 0.2402 -0.6379 0.1113 -0.4438 -0.6633 -0.6454 -0.5187 0.0957 -0.8804 0.7965 0.5038 -1.3081 0.0980 -1.1020 0.6688 -0.1266 1.2480 -0.8748 0.5577 0.9834 -1.7318 0.7849 -0.4784 0.9760 -0.6633 -0.3019 -0.0128 -0.7278 -0.0127 1.5065 -0.6983 0.0368 -0.0879 0.8819 -3.0009 -0.1708 -0.5376 0.1879 -0.6437 1.8235 -0.7120 -1.5570 0.7627 -0.9659 -0.2423 -1.5420 -1.2752 -0.8464 1.2818 -0.4570 -2.1832 0.8889 0.7523 -0.2740 -0.6311 1.1103 0.1873 0.3070 -1.1461 -0.4370 -0.9347 0.1519 0.7523 0.8211 -1.6008 2.3727 -0.6513 -0.5017 0.6320 1.3270 -0.7089 -1.5619 -0.5949 0.0441 0.0871 -2.1090 0.7558 -0.3184 1.0728 1.3639 -0.3897 1.3490 0.7175 -0.9274 -1.1399 -1.2602 -0.1169 -0.0874 -0.5644 -0.4811 -0.1412 -0.0341 0.2538 -1.1301 0.3498 0.0202 -0.9634 1.5979 -1.5482 -1.7301 0.5311 0.9294 1.7498 1.0693 -1.0732 1.4819 1.1733 -1.2444 -2.0674 0.4286 -0.7009 -1.1145 -1.3358 0.7800 -0.3225 -1.5080 0.2520 0.9650 1.6778 0.7599 -0.7720 -0.0639 -0.2754 0.8109 -0.4854 0.9559 0.4962 -1.2183 1.7399 0.7747 1.1342 -1.8686 -0.1334 0.3631 -1.4679 -0.6350 -0.2659 histidine betaine (hercynine)* -1.2932 -1.1079 -0.1505 0.4055 0.5354 -0.2117 0.8745 1.2988 -0.4936 0.7642 -0.4095 0.6241 -0.8698 0.0821 -1.0057 -0.3044 -1.6992 1.5122 0.7691 0.0332 1.0371 0.1939 0.8545 0.3635 0.3328 1.9175 -0.0615 1.0737 1.1232 3.0312 -1.1239 -1.0740 -0.0267 0.6660 1.8516 0.7538 0.5202 -0.7223 -0.4101 0.8417 2.8387 -0.3135 0.4515 0.7157 -0.1388 -0.2440 0.4530 0.7192 0.0854 0.6082 0.3941 0.1879 -1.8079 -0.7915 0.1332 0.5981 1.0691 -0.2640 0.6871 1.8411 1.4697 0.3021 -0.7045 -1.6455 -1.0705 -0.1695 2.0702 -1.1816 -0.4467 0.1436 0.8525 0.3610 0.8515 0.8489 -1.4754 0.3138 0.5816 1.5698 1.2023 0.8507 0.1097 0.0973 1.0708 0.5318 0.8879 2.0977 2.4611 -0.6484 -0.3048 1.7997 -1.2097 -0.3139 -1.3319 -0.4359 0.1978 0.4138 -0.0248 0.0736 -0.6280 1.0632 -0.1337 -0.1855 0.4265 -1.4075 1.1337 0.2854 -2.3889 -0.4030 -2.8979 0.3015 0.9028 0.8334 0.9418 0.2260 0.4258 -0.3820 -0.3647 0.1286 -0.9854 1.9226 1.0622 0.8880 0.0006 0.6666 0.3721 -0.6030 -0.4220 1.2270 -0.0845 0.6079 0.4841 -1.0474 0.6235 0.3195 0.5398 1.4389 -0.3957 0.4745 -1.1727 1.2485 -1.3856 -1.3587 0.0192 -0.4090 -1.5599 0.4161 -0.2435 -0.4777 1.4559 1.0396 -1.0684 -0.4744 -0.0050 -2.3303 -1.5536 0.1799 -0.8050 -0.3527 -1.1830 0.0027 -1.0060 -1.6925 0.8443 -0.5186 -0.4105 -1.0629 0.9656 0.1085 1.1274 -0.2410 0.3075 -0.1934 -0.1183 1.1812 0.4605 -1.1539 -2.0055 -0.0759 0.4097 0.6782 -0.0057 -0.4989 0.7383 -0.8483 -0.5899 -0.2091 0.0698 -0.7039 -0.6909 -1.2186 -0.3930 0.7371 0.1505 3.0140 -0.0916 -0.1585 0.2309 -0.5918 1.2252 -0.2405 0.6853 0.6859 -0.4334 -1.8290 -0.0736 1.3153 -0.6340 -1.3906 -2.1558 -0.2535 1.4358 -0.2948 -0.2622 -0.4988 0.1240 0.5188 0.2324 -0.0725 -0.3425 -1.3145 0.8772 -1.2245 -0.8361 0.1727 0.9936 -0.0739 -0.1379 1.1396 -0.2299 0.1362 0.3650 0.7673 1.0432 -0.4971 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-0.1384 0.6360 -0.2242 -0.1605 -2.8323 0.1208 1.5982 0.7275 3.4515 -1.2367 -1.6353 -0.0901 1.3720 1.2908 -0.4830 -0.2399 -0.9913 -1.1094 -0.2311 0.3294 1.1414 0.3271 -0.2328 0.0449 -0.0904 -1.4649 -0.8041 1.5547 1.2854 1.6058 -0.5817 -0.3036 -0.8437 -0.1419 2.3033 2.2860 -0.0272 -0.4904 -0.4397 0.6307 -1.0107 -0.1479 -0.8773 histidylalanine 0.6166 0.5630 0.9044 0.4607 1.3289 -0.8909 0.0823 -2.0879 1.3595 -1.5490 -1.7526 0.2314 0.6533 1.1988 -0.0521 -0.1315 -0.3448 0.9129 0.0583 -1.6941 -1.7565 -0.1883 1.0245 0.7610 0.5829 0.5588 -0.0006 1.2144 -0.1211 0.6918 0.0782 -1.7621 -1.5159 0.8136 1.2663 0.6548 -1.8750 -0.3341 0.5263 0.8644 0.4476 0.3272 1.1424 1.1488 -0.5116 0.4136 0.0715 0.6235 -1.9066 -1.8891 0.2491 0.4501 0.4977 -2.0316 0.4025 0.5885 0.6968 0.7879 1.1905 -2.0457 0.5803 -0.3235 0.1464 -1.8186 1.3410 1.3153 1.1993 0.9166 1.1899 0.9333 0.8204 0.2713 0.3038 0.0427 1.7928 1.0198 -0.3757 -1.9169 1.4553 0.4165 0.5464 -0.7929 0.7201 -0.0076 0.7470 -0.5525 0.2562 0.5610 0.0106 0.2274 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-0.8810 0.5516 -0.5380 -0.3919 0.2614 -1.5247 -1.0937 0.2257 0.3375 -1.0031 -0.3624 -1.8616 -2.1024 -0.4714 0.0521 -0.6639 -1.7676 -0.0373 -0.9170 -0.5216 -2.1201 -0.9948 -1.7295 0.3474 -0.5523 -0.1123 0.2667 0.6722 0.1326 0.3051 0.4723 1.6678 -0.1224 2.4341 0.3001 -0.9467 0.6842 -0.3178 0.1424 0.8621 -0.2556 0.2048 -0.7017 -0.4757 1.3768 -0.1981 -1.2574 0.8549 0.7714 0.3763 -0.2799 homoarginine 0.1595 -0.4597 0.5604 0.6987 1.8012 0.1047 0.0241 -1.0398 0.7317 -0.2409 -0.9985 -1.0171 -0.6235 2.4486 0.6500 -0.0788 -0.3688 0.4491 0.6888 0.3337 -1.2032 -0.6970 0.5739 0.8497 0.6222 0.0369 0.0452 0.5397 -0.0117 0.9574 -1.6036 -1.6237 0.1094 0.9510 0.3538 -0.1272 0.9713 2.0081 -0.8828 0.2226 0.2098 0.6822 0.6609 -0.0716 -0.2703 -0.8532 -0.8404 1.7843 0.3335 -1.1857 2.5877 0.9125 -1.6554 -0.2729 -1.0612 1.7832 0.2664 1.4136 0.5072 -0.3902 0.1220 0.3545 -0.5334 -0.2842 1.1040 -0.3752 1.7349 1.0179 0.6444 0.3022 0.9017 -1.1548 0.9398 -0.0924 0.4417 0.5786 -1.6076 -0.0432 0.9576 1.3376 0.1192 1.3638 1.3359 -0.0537 1.4686 -0.7220 1.5625 1.1955 1.0151 0.4631 -0.9995 -0.9489 -0.1355 0.0902 -0.3551 0.0233 0.7011 -0.6009 1.3762 -0.5739 -1.4742 -0.0555 -1.8163 0.2715 -0.3588 -0.3083 -0.9687 -0.4030 -1.3675 0.6859 0.8326 0.6794 0.7514 1.5131 -0.4501 -0.2935 -0.3000 -0.9804 1.2591 0.2004 0.1313 0.2895 -1.2761 -1.2570 -1.0859 0.4257 -0.4336 -2.1575 0.2601 0.2818 0.2256 -0.7159 1.5764 0.2752 0.7717 0.6855 -1.0174 0.0512 -0.8373 -0.5280 -0.4318 -1.2419 -1.4339 0.5201 0.0960 0.1566 -0.7262 2.3064 0.0797 -0.0483 -0.1838 -0.2715 1.6042 -0.5868 -1.6471 0.4059 0.1806 1.1249 0.2609 0.5013 1.0791 -0.5604 0.2102 -3.1845 -1.8528 -1.0700 0.0244 0.3127 1.2350 -0.3435 0.8507 -1.4602 -0.7336 -0.4323 -1.2076 -0.3696 -0.0184 -0.2060 -0.8281 -0.7211 0.4474 -0.6626 0.0272 -0.0299 -0.6434 -0.6234 -1.5011 -0.0411 -0.4348 1.4905 2.0067 -0.9154 0.0609 0.7754 -0.0776 0.2912 -0.0769 -0.7413 1.0281 1.0707 0.3240 1.2637 0.3019 0.9825 0.9424 1.6592 -0.5348 -0.0014 -2.8223 0.4892 1.0071 1.6336 -1.5758 0.8185 0.9074 -0.0567 -0.1724 0.8285 -1.1309 -0.5846 0.9826 1.0052 -0.1161 0.6429 -1.6902 0.9181 -0.6140 0.9930 -0.1768 -1.0358 0.4743 0.1066 -0.4994 0.5286 1.5693 0.6141 2.0211 -0.0338 -0.5715 0.9831 1.3285 -0.6030 -0.5903 -2.6001 1.4477 0.4586 1.6544 0.8580 -0.5733 -0.9634 -1.4035 0.7594 -3.0835 1.1021 -0.3534 -0.5617 0.4032 1.4944 -1.2542 -1.8608 -1.1812 0.7444 -0.2357 -0.1953 1.1005 -0.1943 0.7804 0.4315 0.3466 -0.6882 0.4223 -0.4437 1.2646 1.3015 1.0565 1.2152 1.5969 -0.1441 -0.9878 -2.3376 1.2838 -0.0124 0.8640 0.0428 1.4821 -0.3925 -0.9088 -1.2359 -0.2463 -0.4172 -0.5418 0.2053 -0.3381 0.1846 0.2406 0.5896 0.5442 -0.7688 -0.3279 -3.0368 -0.2622 0.8728 1.3737 -0.4353 -1.5865 0.4131 0.0683 -0.6544 0.3692 0.7115 1.2043 0.2936 0.1833 -0.3333 -1.0857 0.8706 0.5567 0.6103 0.7969 1.1283 0.2497 -0.3984 1.6054 0.3497 -0.8042 -0.5061 0.2315 -1.3085 0.0080 -0.3312 0.8259 -1.2519 -0.6938 0.6032 -0.8852 -0.7589 -0.4225 -2.2940 0.3750 -0.7158 2.0246 1.3924 -0.0425 1.2657 -0.8987 -1.8951 -1.7213 0.0842 -0.0174 -0.7701 -0.9754 0.3440 -1.2625 0.2956 1.3664 -0.1583 -0.2578 0.8041 -1.1645 -1.1122 0.2913 -0.5705 -0.8315 -0.7367 0.3699 -1.2322 -1.6675 1.6773 -0.2831 -1.6618 0.0433 0.3635 -1.6414 2.3567 -1.1724 0.2136 -0.5999 1.2371 -1.0430 0.6407 -0.8111 -0.9047 -2.2661 2.1165 0.1067 -0.6442 0.2165 -0.7377 0.8384 0.0344 -0.9149 0.4498 -1.2081 1.8043 -1.6855 0.2031 1.0957 1.6202 -0.0509 -1.4041 -0.4144 -0.5435 0.5912 -1.6252 -0.0211 0.2117 -1.4057 -1.2691 -0.1952 -1.3663 homocitrulline -2.0593 0.0882 -0.3841 0.0201 1.4306 1.4790 -0.1608 0.2984 -1.2314 -0.3362 -0.9386 -0.1493 0.2933 -0.0313 -0.0736 1.1289 0.4193 -1.6857 1.1354 1.0191 -0.7260 0.1141 0.2476 0.5450 1.2324 0.1568 0.5772 -0.1966 1.1039 1.0394 -1.9558 -0.4390 0.1201 0.2140 -0.1486 0.2942 0.2390 -0.4068 -0.2864 0.4342 0.6436 1.6780 1.2123 -0.5864 0.2851 -0.4448 -1.1286 -0.2689 0.2813 0.8169 1.3149 -0.3278 1.6025 1.5880 0.1308 0.2230 2.3430 0.1037 0.3195 -0.2334 -0.1046 0.4635 1.0808 0.7851 0.7237 0.7106 -0.4842 -0.9867 -0.8263 0.7444 1.5310 -0.6629 0.9845 0.3876 -0.3897 -0.5305 -0.4712 2.4856 0.8613 0.8264 -0.7056 -0.0465 1.1389 -0.0317 0.3342 0.5608 0.7829 -1.5616 -0.7726 0.7983 0.3878 -0.6194 0.4046 1.0934 1.5398 -0.6868 0.0791 -1.2157 0.2933 0.1832 -0.1385 0.1005 -1.3652 -0.7182 1.0363 0.7400 0.3743 -1.2727 0.2879 -0.4889 0.4707 0.7018 1.8480 -0.0439 0.9044 -0.4944 -0.3687 -1.4580 -1.2049 0.2784 2.2789 0.2260 0.6646 -0.7015 0.7698 0.9812 -1.8234 1.2339 -0.9608 0.2901 0.6112 1.5392 1.0991 0.0975 -0.9659 -0.6300 -1.4804 0.4819 0.8820 -0.7506 -0.7470 0.1729 -1.5296 0.1585 -0.7093 -0.4316 -1.4457 0.1333 -1.0248 1.1528 0.1203 -1.3221 0.0030 -0.3546 0.3170 -0.5051 -1.3898 -1.7748 -1.6390 -1.5071 1.9003 -0.7446 -0.0465 -0.2460 -0.6194 -1.4462 -1.2708 0.4038 0.4779 -0.9703 1.2785 0.0444 -0.5081 0.0601 -0.6445 -1.0551 -0.6623 0.0069 -0.0204 0.0871 0.2611 0.7523 -0.7655 -0.2291 -0.9196 0.1267 -0.2062 -0.7821 -0.8201 -0.4879 1.0723 -0.7449 -0.4294 0.5004 -0.8845 -0.2321 -1.2728 -1.1534 -0.5589 -0.5390 1.7224 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-0.3849 1.1544 -0.4974 -0.9060 0.8923 -1.6381 0.6523 1.5001 1.7425 0.2404 0.1757 -1.5500 -1.2121 1.3233 0.1666 -1.4729 0.4949 1.0853 -1.9505 0.2071 -0.0377 0.0373 -1.4726 0.2584 0.1647 -0.4079 0.4902 1.9251 1.1160 -1.1397 1.8046 -0.2907 -0.4251 -1.6197 -1.0068 0.0998 0.7786 -0.0191 -0.6573 -0.7895 -0.4175 1.3386 -0.2137 -1.3251 -0.2911 0.6003 1.0919 1.6970 -1.5312 1.0702 0.2220 0.5169 -0.3697 0.3320 0.7118 0.8843 -0.2697 0.1737 -0.1578 1.4139 0.9339 -0.9949 -0.2519 -0.4718 -1.1732 -1.2754 -1.9662 -0.1157 0.3695 3.0977 -1.6364 1.3974 -0.4032 0.4309 0.4860 -0.5431 homostachydrine* -0.3159 0.5256 -0.3467 -0.1151 0.6263 2.2366 0.3607 -0.3894 -2.1865 1.8357 -0.8329 0.7332 1.2462 0.4525 1.9694 0.6609 -0.6436 -1.1090 1.0257 -0.0388 -0.1613 -0.8340 -0.2217 -0.4057 -0.8708 -0.5971 -0.8501 -0.5362 -0.5136 -0.3253 -0.1155 -1.2474 -0.4429 -0.4352 -0.4357 0.2975 0.5862 0.6127 2.2410 0.3184 0.8041 -0.7544 1.1929 -0.2870 1.0582 3.8830 0.3436 0.6074 -0.1555 2.8138 -0.9487 0.4291 -0.4724 -0.8785 0.7225 -0.3351 0.0184 -1.1001 -0.1475 -1.8741 -0.5459 -0.7210 0.0497 0.1049 0.4911 -0.9946 0.2921 0.0305 -0.3645 0.2387 -0.7249 -0.0173 0.7858 0.9168 1.5970 -0.1412 -0.4661 1.5244 -0.3534 1.5715 -0.6616 -0.2999 0.9649 -1.8914 -1.2472 0.1206 -0.2447 -0.2235 0.0494 0.3429 -0.8765 -0.6084 -1.3064 -0.2319 0.0942 0.8445 0.7977 -1.1040 -0.4086 -1.3917 0.7292 0.2296 0.3309 -0.1289 0.1912 1.7759 -0.6039 0.8424 -1.7854 -0.6578 0.2810 -1.6161 0.0722 -0.4699 -1.9402 0.8604 0.3953 3.1308 -1.4147 -0.3820 -0.0595 -1.2705 1.0312 -0.8305 0.0017 -0.2893 -1.9324 1.5783 -1.6123 -1.4514 -0.9659 0.6368 0.4638 0.4093 -0.0421 2.2063 -1.6391 -0.5710 0.3080 -0.3075 -0.2269 0.1680 -0.0984 -1.1582 -0.4443 0.9833 -1.4262 0.4883 0.5658 -1.0287 3.0014 -1.4035 -1.3017 -0.1766 -1.2470 -0.3976 0.4798 -1.0502 -0.9205 0.2952 0.1019 -1.4677 2.1557 -0.4257 -0.7685 -0.8784 0.3535 0.8144 1.5371 -1.1291 -0.3983 0.0033 0.4974 -0.3501 -0.8861 -0.1433 2.2064 0.7520 -0.3126 -0.6497 0.9334 -0.4359 -0.5851 -0.3942 -0.7230 1.6775 0.3012 1.2723 -1.0480 0.2445 -1.2367 -0.3122 -0.9401 2.0877 -0.8995 -0.6582 -0.4694 -0.4602 -0.7639 -0.7230 0.7144 3.1315 -0.3522 2.1689 -0.7854 -0.1024 -0.9826 -0.2334 -1.0811 1.8424 1.8959 -0.8916 -0.9526 1.2149 0.4588 0.9060 3.1455 -0.4542 -1.2721 -0.6044 -0.5853 1.4168 0.0654 -0.2910 0.0898 -1.3853 -0.6287 -1.1890 -0.1208 0.8787 1.3274 1.9106 -0.6452 0.0122 -2.1940 0.3107 -0.4146 -1.8939 -0.6339 0.0489 -0.1349 -2.0028 0.1016 2.1812 -0.0144 0.5367 -0.0474 0.7649 0.2369 1.0357 -0.6639 -1.1214 -0.7166 1.1881 -0.0460 -1.3529 0.3156 -0.6768 -1.5685 0.3403 -0.9767 -0.8987 0.4902 -0.4655 -0.2441 -1.5334 0.5109 -0.1869 0.3323 0.6695 -0.1725 1.2078 -2.0144 1.6552 -1.0138 -0.6059 -1.1452 0.5726 0.5755 -1.0919 -0.6148 -0.9507 1.3546 0.3693 -0.3698 -0.0384 1.1733 0.1099 -0.0684 -0.3456 0.2736 -0.1262 0.2385 1.2007 -0.3873 -0.2556 -0.0795 -0.2572 0.1755 1.2397 -0.4278 0.4202 0.4281 -1.3817 -1.5218 0.8150 -0.0748 -1.0279 -0.7762 -0.1533 -0.0359 -0.7934 1.0339 0.4405 0.2148 0.0258 0.7510 -0.2275 1.0701 -0.9323 -0.9098 -0.8604 -0.0521 0.0339 1.0799 0.9612 -0.5760 -0.7672 -0.5637 -0.0816 -0.5309 -0.2542 0.4179 -0.3947 -0.7835 1.3097 0.8963 -1.2809 -0.7681 1.3497 -0.7956 1.8477 0.0263 0.0270 -0.6710 -0.4395 -0.5523 0.0122 0.0814 -0.2478 -0.7437 -0.0382 0.2578 1.6917 1.3501 2.3505 -0.8507 1.0717 -2.0581 0.5491 1.1684 1.2274 0.3523 -1.2035 0.4711 -0.4401 -0.3287 1.5265 -1.3210 0.1197 0.6009 1.2247 -0.4551 -0.2902 -0.3472 0.5710 1.2335 -0.0877 -0.1483 0.5785 -1.0157 1.8438 -0.3196 1.0188 0.1400 -0.0400 -0.8590 -0.6456 0.5886 -0.0144 -1.0378 0.1734 0.9983 2.3210 0.1555 0.4854 0.6591 -0.3502 -0.4256 -1.3075 -0.7794 -0.0030 -0.8270 3.0758 -0.3664 1.1843 -0.1445 0.3162 0.0973 0.0228 HWESASXX* -0.6214 0.7976 0.9502 1.4421 2.1891 -1.0097 0.8442 -1.0696 0.5880 -0.5652 -0.7611 -1.0748 1.3273 2.2227 -1.1542 1.2019 1.0251 1.2082 0.4991 0.4256 -0.7542 0.3165 1.3279 0.1650 1.0134 -0.8950 -1.1093 0.3054 -0.7503 -0.9236 -1.1255 0.0512 1.2270 1.5577 0.6064 -0.9380 -0.8681 0.6182 -0.8053 1.1441 1.3746 1.1313 0.8367 0.9287 0.8842 0.6888 -0.9285 -0.9046 -0.8977 -0.8833 -0.8966 -1.1293 -0.8431 -1.0176 -0.6017 -1.0844 1.0594 0.9589 0.7426 -1.0315 1.0573 0.6126 0.3553 -0.8161 0.9582 1.6080 -0.6236 0.4007 0.5577 0.7159 0.2617 0.5049 0.5792 -1.1178 1.5547 -1.0938 0.8603 -0.9078 1.4541 -0.1224 1.8189 -0.8543 1.8738 0.7741 -0.8143 0.1772 -0.7629 0.5238 0.4826 0.6884 0.2327 -0.8529 0.7448 -0.5834 -0.8702 0.6769 0.9032 -0.8681 0.8624 -1.0476 0.5844 1.0661 -0.7828 1.0755 0.9152 -0.8261 -0.9809 1.3441 1.1531 -0.8116 1.0537 -1.1020 1.8981 0.8259 -0.9272 -0.9143 -0.7407 -0.8576 -1.0274 -1.1721 -0.7934 -0.8666 -0.9686 -0.9855 -1.1629 0.7842 0.9486 -0.9788 -1.0317 1.2515 0.4388 -0.7838 -0.6268 0.7314 0.0457 0.2175 0.1851 1.0088 -0.9546 -0.4549 -0.7025 -0.9931 -0.8682 0.9698 1.4199 -0.9939 -0.9152 0.4522 -0.8200 1.5766 1.7527 2.2627 1.2438 1.8446 0.9371 1.7492 0.9221 0.9920 1.1879 2.3083 -0.8892 1.6682 0.9943 0.7802 -0.8479 -1.1215 -1.0718 0.5858 -1.0809 0.4780 -1.1259 1.4597 -1.2375 0.3977 -1.1015 -0.6424 -0.7122 -0.7228 -0.8641 0.6265 -0.8664 0.6881 1.4981 1.0955 -0.7484 -1.1761 -0.9565 0.6725 1.5745 1.4069 0.4164 -0.7413 -0.8300 -0.7688 1.3348 -0.0579 1.8709 0.5131 -0.9551 -0.6414 -1.0770 -0.7352 0.2707 -0.9003 -0.9892 0.1826 -0.9901 -0.2305 -0.9044 -0.9195 -0.8844 0.4634 0.5897 -1.0018 1.2180 -1.0006 -1.1871 -1.1740 -1.2290 -1.1001 0.8279 -1.0537 -0.7400 0.6393 0.0695 0.8263 -1.1129 -1.2300 -0.6321 1.6815 0.4865 0.4593 -0.8894 -1.0522 -1.1457 1.3834 0.7352 0.9417 1.5395 0.4183 1.5078 1.0055 -0.9757 0.6575 -1.0719 -0.9451 -0.9939 0.3579 0.2060 1.4865 0.9742 -1.0918 -1.1203 1.0874 0.3957 1.4423 0.6287 -1.0177 0.4980 -1.1274 0.8952 -0.8083 -1.1406 -1.2383 -1.0570 1.3884 0.4869 0.8086 -0.8956 -1.0663 -1.0705 -0.8676 0.1354 -1.0661 -1.0599 -1.0228 0.7899 -1.0251 -1.1239 -0.7185 -1.1608 -1.1276 -1.1705 0.2708 1.2306 2.2072 1.1580 1.1614 -1.1100 0.2325 -1.1701 1.0238 -1.0498 -1.1560 -0.9277 0.2713 -1.0550 -0.1817 -1.2086 1.0921 -0.9326 0.3028 0.7207 1.6453 1.1787 -1.2139 -1.0682 0.8113 -0.0396 -1.1953 0.4456 -1.1290 -1.0267 0.1513 1.1959 -0.9927 -0.9239 0.7961 0.0855 -1.0820 1.3653 -1.0971 0.1293 1.1616 -1.0407 -1.2893 1.4439 0.5484 0.8786 -0.1949 0.2615 0.1327 -0.9534 -0.7710 -1.0108 -1.2539 -1.0528 -1.0281 1.1120 1.1525 0.8624 0.0356 -1.1534 0.0684 -1.1149 -0.8953 -0.8134 1.5647 2.3252 1.6438 1.3394 -0.3891 0.8498 -0.1319 1.8015 -1.2406 -1.1987 0.6138 -0.0048 -1.1916 -1.0890 -0.3710 -0.9921 0.8981 0.2729 0.5244 0.9056 0.4931 0.2363 -1.2147 0.5649 -1.0812 0.3143 -0.9402 -1.3459 -0.7804 0.5838 0.2117 -1.1301 -1.0983 -0.9813 -1.3074 -1.3412 0.1835 0.8969 -1.3654 -1.3647 0.3033 0.6053 0.4694 1.8205 0.8555 -0.5584 0.6553 -1.1669 0.6044 -1.2987 0.6832 0.5134 0.9436 -1.2898 -1.0929 0.8424 0.8736 0.5506 -1.3645 1.0757 0.3530 0.6243 0.0660 hydroxyasparagine 1.0954 0.0601 -1.1769 -1.5085 1.6714 -2.0073 -0.8461 -1.6624 -0.8849 0.8987 0.1790 0.4799 1.7411 0.8868 -0.5798 0.1344 -1.5121 0.7947 -0.5645 0.4237 -0.3097 -0.2480 0.2932 0.5985 0.1065 0.7754 -1.8770 -1.1546 0.0520 -1.7081 -0.4502 0.2698 1.0871 -0.4556 -2.1275 -1.0316 -0.4648 0.9380 0.5164 -1.5630 -0.6261 0.9785 -1.0011 0.6139 1.5022 -1.5696 0.4376 -1.3880 -0.3727 1.6955 -0.0240 -0.8002 1.3517 -0.4413 -0.8022 -0.5692 0.5216 0.5658 0.9949 -1.1430 0.5210 1.1729 -0.7533 0.4383 -0.7635 -0.8903 0.2141 1.2240 -0.4852 0.4210 0.1413 -0.1963 -0.3034 -0.0309 2.0036 -1.7785 0.5571 0.7976 -0.1154 0.6145 0.1702 -0.2787 -1.2422 -0.9248 -1.0622 -0.5232 0.7047 0.5911 -0.2790 0.6503 -0.2043 0.1086 1.5786 0.2622 -0.9949 -0.0475 -0.0536 -0.0738 -0.1945 -0.5663 0.9809 -0.7531 -0.5452 0.7314 0.8202 -1.0040 -0.6639 0.4556 0.8230 0.5497 -1.7729 0.4042 -0.5490 -0.1321 -0.6820 -0.6994 -0.0147 0.5742 -0.5508 -1.2885 0.0298 -0.2069 0.3623 1.4754 -0.3491 -1.6733 -0.2769 -0.2003 -1.2394 -0.5111 -1.4386 -0.9979 -0.1023 -0.6661 -0.5622 -1.5131 -0.3443 1.7757 0.7788 0.7615 1.8462 0.7760 -0.0757 -0.4047 1.6200 0.3085 0.4194 1.1503 0.6928 0.5470 0.4075 1.0723 0.2570 1.6160 0.4395 -0.4650 -0.7030 -0.2272 -0.9038 0.9641 -0.3574 -0.6701 1.3844 0.6416 1.2550 0.0683 -1.8478 -0.2480 -0.8633 -0.4632 0.6409 -0.6994 -1.3823 -0.8630 0.2087 1.2508 1.9350 1.5732 0.4671 -0.3189 0.2926 -1.2627 -0.9088 1.2063 -2.0858 0.5112 0.3129 1.1021 0.1824 0.9029 -0.8089 -0.9277 0.1212 -0.3422 1.9475 -0.3129 0.4490 -1.0061 0.3912 1.0938 -1.0183 1.4412 0.1685 -1.2125 0.6157 0.7657 0.6864 1.3407 0.6302 0.4421 1.8592 1.1515 -0.0966 -0.2682 -0.1050 0.0551 -0.8385 -0.8649 -1.3250 -1.3552 -1.6480 -1.1657 -0.2364 -0.2722 -0.2284 -0.2722 -1.5886 -2.6216 1.0678 0.8060 -0.4840 0.3514 -0.3562 0.1766 -0.9525 -0.4004 -0.1620 2.2005 -0.8588 1.2112 -1.1507 -0.2632 0.7852 0.5031 -1.1856 -1.5282 -0.1751 -0.4298 -0.3745 -0.2859 0.9765 -2.1825 0.2528 -0.6399 -0.4406 1.3945 0.0846 0.2498 -0.4052 0.9211 0.2922 0.4433 -0.3315 -0.4042 -0.9736 0.9727 -0.2666 -0.0552 -0.3953 0.4809 0.5229 -0.1657 0.7120 0.5532 -0.4285 -0.0243 -0.0755 -0.0991 -2.1913 2.3678 -1.1171 -0.1653 -0.7827 1.3223 0.2097 0.1798 0.7980 0.8074 -1.8188 -0.5326 0.3662 -0.7031 0.4664 0.7148 -0.0598 0.0926 -1.2280 2.4805 1.8812 -0.9040 -1.7034 -0.7172 0.3371 -1.0755 0.3767 -0.6872 -1.1338 1.1181 0.4464 -1.3708 0.1711 0.1952 -2.7403 0.0368 0.2589 0.0798 0.3080 0.5079 1.2401 0.1885 1.1643 -0.6946 0.0865 0.1827 0.9863 -1.4886 -0.1950 -0.0795 -0.4619 0.8615 -0.4760 1.3686 2.3905 0.4287 0.6339 0.0377 -0.2565 1.1001 -0.9737 -1.1048 -0.7879 -0.9523 -0.4019 -0.2259 -1.0565 1.9828 1.1183 0.0101 2.2811 -0.2847 1.5996 4.7338 -0.1219 -1.0155 1.0238 -1.9915 -0.6320 0.7975 -0.6953 -0.0522 -0.2907 0.3740 -0.9104 0.9843 1.2122 0.2546 0.9679 -1.0102 -2.0610 -0.0574 -0.5925 2.0560 1.0333 -0.7359 -0.2593 0.0672 0.2407 0.5186 -0.6568 -0.6157 2.0015 2.2493 0.7203 0.6738 -0.6982 1.5470 -0.5969 -0.0526 -0.4052 -0.6301 -0.7008 0.4441 4.0135 0.5377 -0.2582 -0.8564 -1.2140 -0.3316 -0.6779 1.3252 -0.2193 -0.5114 -1.5006 0.2246 -0.5509 -0.1400 0.5161 0.4051 0.1751 -1.2671 hydroxy-CMPF* -1.2809 -0.2853 -1.3233 -0.5078 1.3023 -0.4409 1.5596 1.3511 0.3055 -0.3447 -0.1610 0.3636 0.1361 -0.7049 -0.1168 1.7992 -0.0123 -1.3492 -0.1940 1.3977 1.2734 1.3204 0.7472 0.6569 1.0514 1.2738 1.4011 0.7299 1.2224 1.4235 1.8215 0.2230 0.2198 0.1795 0.5059 0.2731 2.0000 -0.3842 -0.0861 0.4707 0.6170 0.3092 0.6340 -0.7327 -0.2120 0.5600 -1.3650 0.1302 1.8808 0.1956 -0.2167 -0.3090 0.3470 0.1731 1.4602 0.5744 1.8536 -1.0195 0.9334 1.2642 -0.0404 -1.0807 0.8519 -1.1647 0.1937 -1.2074 0.7027 0.7475 -0.5605 1.1677 0.9457 0.9485 0.4533 0.6165 -1.1304 0.3699 1.1078 1.4191 0.3707 0.4130 1.8348 0.3451 1.3028 -0.1147 -0.3547 1.8819 1.4180 -0.5663 -1.3195 1.0142 1.0579 -1.1795 -0.8371 -1.3136 1.6048 0.7713 1.0962 0.0982 -0.0221 0.0840 0.1180 1.6519 -1.0640 -1.6903 1.3656 -1.9416 0.1631 0.6090 -0.3465 -0.9790 0.4635 1.3664 0.7771 -0.2428 0.2022 -0.1797 -0.4576 -0.0139 -0.3785 1.7860 -2.0424 0.0049 0.4807 -0.9738 -0.4448 1.3919 0.8926 0.7698 0.2095 -0.5126 -1.2937 -0.3788 1.6215 0.0897 0.7190 0.7026 -0.2850 0.7755 0.5156 2.0401 0.6937 1.0938 0.4044 0.1213 -0.9533 0.6631 -0.5406 0.5780 0.6451 0.4391 -1.4485 0.1018 0.5166 -2.3571 -1.2046 0.2570 -2.1424 0.7227 -0.7343 0.5244 -1.3767 -0.0612 0.3746 1.2904 1.6163 -2.2018 1.6243 -0.2096 0.7292 0.7043 1.1055 0.7534 0.8831 1.1046 0.8273 -1.2342 -1.9273 0.3167 0.8587 -0.5741 -1.1256 1.0801 -0.2024 0.0646 -0.2328 -0.7003 -2.2683 0.4419 -0.3975 0.3356 0.4091 -0.5671 -0.8039 1.0470 -0.8153 -1.5557 -0.7308 1.1711 -1.4825 -0.7819 0.7564 0.7172 -0.0992 -0.3457 -0.1364 0.4036 1.0871 0.1168 -1.3908 -0.8660 0.0778 -0.0912 0.3816 -0.6591 -2.7569 0.9896 0.9424 0.2332 0.5240 -1.8850 0.3737 -0.5817 0.0550 -1.3481 1.1036 -0.7318 1.3084 1.5140 1.0696 0.3074 0.1020 0.0683 -0.2924 0.2011 2.5891 -1.2740 0.4435 -0.2537 -0.0789 0.1275 -0.0947 -0.3988 0.0370 2.5505 -0.3203 0.4448 -0.9573 -1.4740 0.5553 -0.4071 -0.7695 0.1485 -0.5345 0.8072 -0.2122 -0.0425 -0.6559 0.8059 -2.0364 1.5738 -0.5220 0.9699 1.7560 0.0526 -0.8155 -0.8442 -1.1582 -0.0408 -1.2339 -0.7528 0.3711 -0.1721 -0.5491 -1.0742 -1.2727 -0.1066 -0.7266 2.0660 0.7865 -0.5942 -0.2593 1.0855 0.0477 0.7391 -0.5289 -0.5202 0.2086 -0.2992 0.1731 0.1571 -0.6947 0.4552 -0.7306 0.4470 -0.2078 0.1626 1.6603 -1.4941 -0.4767 0.5422 -2.6514 -1.7809 -0.5121 0.6827 -2.2441 -1.1518 -0.4914 -0.5691 -0.0902 0.6828 -1.3907 -1.9420 -0.8465 -1.1544 -1.8119 0.8984 1.6911 0.3559 1.8292 -0.7356 -0.1402 -0.4260 -0.4066 -2.2212 0.2932 -0.0713 -0.9186 -0.7317 -0.8901 -1.5067 -0.1027 -1.2455 1.1998 -0.8198 -0.7746 -1.0088 -0.7726 -0.8436 0.4655 0.0721 0.8184 -0.8500 0.7067 2.1921 -0.3471 -0.8044 -1.9572 -1.4333 -0.9841 -0.6546 -0.2099 -0.5417 -0.7717 -1.0157 -1.7665 0.2593 0.6470 0.4973 -0.9011 1.0097 0.5664 -0.2393 -1.5314 -1.4923 -0.6155 -1.2045 -0.4352 0.8484 -1.2763 0.1057 -1.8324 -1.6871 0.7661 0.0257 0.6480 0.0776 1.0470 -0.1594 -0.2953 0.1842 0.2927 -0.3829 -0.3345 0.1575 -0.9160 0.3785 1.5561 -0.1400 0.8885 -2.0035 -0.7199 -0.7444 0.4312 -1.7101 1.0168 0.8910 1.4942 -0.8573 0.7122 1.9982 -0.3691 -1.2793 1.6559 -1.6966 0.3080 -0.1008 -0.9145 -0.7072 -0.5950 0.8696 hydroxy-N6_N6_N6-trimethyllysine* 0.2947 1.4289 -2.8028 -0.6114 1.0502 0.3072 -2.3867 0.3403 -0.1020 1.7041 1.7136 0.1926 0.4872 0.7937 -1.0383 -0.1941 -0.3088 1.1897 0.2682 -0.6650 -0.3447 1.8698 -0.3356 0.5442 1.0913 0.5474 0.7852 -0.8107 0.9965 -0.2875 -1.6844 0.1840 0.1339 -0.1093 -1.2828 -0.5076 0.6729 1.3587 1.7382 -0.5248 0.6389 0.0194 -0.0217 0.2637 0.3158 -1.4441 -0.3690 0.6039 -0.1536 0.6465 0.0285 -0.2645 0.0727 0.0028 0.9214 -0.9144 2.5916 -0.6006 1.4066 -1.4774 -0.6615 1.8516 -1.2414 0.4331 0.1642 -0.4340 0.8092 0.5747 -0.3050 0.4084 0.4581 0.7857 -0.1578 -0.5593 1.4948 -1.8859 0.8701 -0.5870 -0.1654 0.5206 -0.1307 0.4842 0.5938 -0.6848 0.4535 -0.2267 0.7013 0.0591 0.2358 0.8373 0.3738 -0.4522 0.3792 -0.0913 0.0036 -0.1081 -0.3678 0.1829 0.9416 -0.3271 1.2618 -0.5623 -0.3503 -0.2772 0.0764 0.1243 1.1926 0.0750 1.4624 1.4934 -2.5689 0.9426 -2.2496 -0.5345 -0.1831 -1.2552 0.3023 -0.8104 0.0260 0.0028 -0.7400 -1.3950 0.2791 1.2915 -0.8301 -1.4798 -0.3442 -0.4184 -1.8796 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-1.4823 0.8477 0.3550 -1.6057 -0.7551 -0.4042 -1.3261 0.3817 -1.5136 -1.1565 -1.3107 -0.7484 0.8582 -0.1550 -0.9960 0.0881 -0.8392 3.2577 -0.7965 -0.1705 -0.6161 -0.7247 0.5529 -1.8576 -1.0255 -0.9570 -0.3639 -0.3728 -0.1904 0.4337 -0.4198 -0.5215 0.3111 0.3731 1.3635 0.0844 0.5517 0.3715 3.0003 -0.5332 1.8611 -0.7993 -0.9141 -0.5418 -0.3322 0.6371 -1.8742 0.0575 1.3566 0.2119 0.3766 3.1789 -0.0109 -0.9230 2.5371 1.1476 0.4873 1.0285 0.5736 0.6607 -0.6752 0.1877 0.5431 -0.7695 0.1938 1.4063 0.3697 -0.6165 0.4715 0.3020 0.1873 1.5465 1.1974 -0.2246 0.2376 1.4469 0.0205 -0.7204 -0.6673 0.1259 0.7421 0.4695 -1.1679 0.2484 0.3435 -0.3394 -0.1625 -0.0063 -0.5342 1.5829 2.2942 -0.3516 -0.5416 0.6389 0.8170 0.9626 -0.1481 -0.1202 -0.6925 -1.2855 0.1026 -0.5458 0.6174 1.5854 0.2032 1.8443 -0.8750 -1.0364 0.1506 -0.1548 -1.0889 -0.2649 -1.8379 -0.1425 3.3386 1.2982 -0.3610 -0.4128 0.3551 0.4306 0.3959 0.2668 -0.2931 -1.1910 -0.5993 -0.5664 -0.9222 0.2829 0.0133 0.5654 0.1282 -0.0871 -0.9957 -0.4719 0.3806 1.1190 0.1512 1.3226 -0.8273 0.2221 -0.3206 -0.1273 0.5027 0.1297 -0.7459 -1.3221 -0.8040 0.0616 -0.3757 -0.7468 1.1364 0.4990 -0.7053 0.2327 -0.0578 -1.0075 0.4059 -0.7899 -0.5192 0.1501 1.6849 -0.8944 -1.2736 -1.0033 1.3854 -0.5451 0.2535 0.6900 -0.7671 -0.3803 -1.0735 -0.2866 -0.8031 1.1506 0.4094 -0.2957 0.5423 -0.1603 -0.6550 -1.2532 0.4064 -0.2905 -0.4268 1.2385 -2.0571 0.4401 -0.2346 -1.3580 -0.5219 -0.0286 -0.2136 1.0788 -0.8550 1.3302 -0.2531 1.0807 -0.4917 0.0587 -1.1662 -1.3771 -0.5063 -1.5154 1.2140 0.1313 -0.1384 -0.0862 -0.7565 1.3739 0.4101 -0.1847 0.0711 0.3227 -0.1172 0.1701 -0.6015 0.0773 -0.0986 0.2474 2.7048 -0.7632 -0.9133 -0.4525 -0.4033 -0.2066 1.4320 2.9746 1.1016 0.3323 -0.7900 -0.0653 2.6994 0.2152 0.6583 0.0314 -1.8838 2.1337 0.4627 -1.0123 -1.1429 0.0525 0.9469 0.0135 -0.7050 -0.2402 -0.0935 0.9142 1.5348 -1.1120 0.0467 -0.5073 0.8670 -0.4855 1.5850 -2.6906 -0.7148 0.6737 0.3312 indoleacetylglutamine 1.6295 -0.3520 -0.0717 -0.9983 -0.5933 2.0263 -1.3415 -1.2693 -1.1716 0.3441 -0.9526 -1.2793 -0.3606 -1.1669 0.0521 0.5192 -1.3350 -0.1671 -1.0549 -0.8685 -0.9178 -1.5587 -0.7171 1.2792 0.4595 -1.0763 0.1167 0.4926 0.0677 -1.1156 -1.3196 -0.2152 0.5137 0.4791 0.7157 -1.1228 0.7715 -0.8282 1.6369 0.5265 0.8005 0.0698 -1.1111 0.6531 1.2795 0.6921 -1.1031 0.6845 0.1479 -0.5170 0.9419 0.0695 0.1785 1.5019 -0.7623 0.0739 0.6620 -0.7464 -0.2649 1.4462 -0.9294 0.5809 0.1286 0.1245 -0.5582 0.5408 -1.1292 0.0278 -1.2979 -0.4369 0.8423 -1.2454 -1.1729 -1.3264 0.2343 1.0401 1.4170 -1.0913 0.4694 1.0532 -1.1508 -1.0275 -0.0490 -1.3066 0.3643 0.2349 -0.9349 0.4819 0.9745 -0.7843 1.6466 0.0147 0.5512 -0.7297 -0.1448 0.7620 -1.0819 0.0560 0.7482 -1.2345 0.3112 -1.4274 -0.9435 -1.3634 -0.9902 2.2208 -1.1748 0.1501 1.3628 1.7076 0.9326 0.1604 -0.9214 -1.1153 -1.1169 -1.0942 0.5448 -1.0344 0.4006 0.7353 -0.9694 0.6571 -0.0442 -1.1945 -0.1642 -1.1972 0.0909 -1.1682 1.2096 0.4466 0.3471 -0.9667 -0.7898 0.0051 1.6086 1.1514 0.2687 -0.7459 0.7107 -0.6013 -0.8793 0.1121 -1.0427 -1.1418 -0.9700 0.7219 -1.0927 -1.1726 -0.9980 -0.9419 0.8566 1.1870 -0.9903 -1.6151 -0.0343 0.1111 -1.0839 0.8807 -0.5262 -0.6365 -1.0659 0.0513 -0.9313 -1.1103 -0.4500 0.3164 -0.1001 0.2305 -1.2880 -1.1013 2.9128 -1.1335 -1.4477 -0.8837 -1.3101 1.8265 -0.8748 -0.8986 -1.0381 -0.8546 0.9710 -1.4235 -1.1735 0.3553 -0.2406 1.4178 0.9240 -1.0320 0.8252 0.8547 -1.4261 1.3432 -1.0034 0.8743 -0.9155 0.3153 -1.0356 -1.3974 0.5894 -0.7970 0.5960 -0.8948 0.3355 0.7865 1.9923 -0.7751 -1.1758 2.5658 1.1575 1.0891 0.5360 0.5619 0.4798 -1.1883 0.5555 0.7338 -1.4025 0.0650 -0.2834 -0.0578 -1.1886 0.1952 0.4113 0.7560 0.8775 1.3642 0.6112 0.3962 1.0284 0.4044 -1.1834 -0.9637 -1.0662 0.7270 -1.3437 -1.3605 0.7283 -1.0414 -0.2589 1.3153 0.2003 -1.3835 1.7255 0.7256 -0.5978 -1.1364 -1.1848 0.3540 -1.3433 0.3228 1.3497 -0.0853 -1.3171 0.4266 -1.2288 0.7373 1.3968 0.4656 -1.1025 -0.3698 1.2701 0.2752 -0.0917 -1.4435 1.1319 -0.7883 -0.5297 2.3176 1.8106 0.2610 -0.0700 0.9648 -0.8387 0.7842 1.1427 -1.2114 -1.2077 -1.2135 0.1132 -0.8768 -0.4460 -0.3799 -0.0839 1.4192 0.1335 -1.1020 -1.2698 1.3151 1.1438 0.6044 0.4344 -0.1527 -1.2419 0.8184 0.2003 0.4024 0.2345 -1.5884 1.1550 -0.3666 0.3082 0.5307 -1.1868 -1.3103 0.2306 -0.5928 1.4683 -0.5241 0.1948 0.5770 0.9942 0.1387 0.0641 1.6930 1.1269 1.0253 -1.1145 0.2285 -1.0658 0.9035 0.1209 -1.3011 1.2850 -0.7205 0.0242 0.3357 -1.1891 0.6642 1.1011 0.6229 0.2681 -1.0480 0.8383 -0.9512 0.6829 -1.4654 2.2400 -1.2302 0.9643 -0.9625 -1.1441 0.3792 -0.4009 0.0953 1.4244 -1.0811 0.6702 1.0762 1.2425 0.6646 -0.9246 -0.0786 -0.4314 -0.2905 1.3509 1.7087 -1.4160 -1.2878 1.6019 -0.5860 1.2097 1.1803 2.1049 0.9090 0.9264 -1.3625 1.0326 -0.1608 -1.4107 0.2994 -1.0296 1.5489 -1.1362 -1.1337 0.4288 -0.9869 0.3979 1.6115 2.1715 0.8083 -0.1289 -0.0616 0.7735 1.3591 1.5987 1.8736 1.2419 -1.2520 1.6328 1.7420 -0.9326 0.9671 0.5073 0.9722 0.8700 -1.3873 0.9052 0.0021 0.0074 1.1721 -1.5128 0.7670 -1.0961 1.4146 -1.4589 1.0196 0.3696 0.8981 1.1407 0.8214 indolelactate 2.8549 -0.1604 0.9002 0.0034 1.8847 0.8711 0.6395 1.3124 -0.0054 1.0644 -0.1226 -1.1998 -1.1107 1.0370 1.0612 0.4842 -1.0726 0.1326 1.4526 0.0796 -0.3825 -0.2469 -0.8013 0.7329 0.3955 1.0435 -0.0065 0.0884 0.6446 0.1338 0.6795 0.7210 1.1337 -0.4982 -0.1058 2.3311 1.2154 2.3924 -0.2482 -0.7650 2.4689 1.8637 0.0044 1.0437 -0.3945 -0.8251 0.3411 0.3106 1.5373 0.1230 0.6512 -0.3072 0.8849 1.3654 0.2225 -0.6580 1.5072 0.1061 0.2509 -0.7297 0.4484 0.9938 -0.4106 1.2044 2.4901 -0.0138 -1.1362 -0.5944 -0.4630 -0.8577 -0.4104 -1.4791 0.0743 -0.5842 -0.6492 1.7329 0.8366 0.1305 0.5243 -1.1217 0.6837 -0.1356 -1.2718 -0.7597 0.2769 1.7305 1.0609 -0.8114 -0.7097 0.3503 0.5789 -0.3986 0.9660 1.3156 2.9801 -0.1603 -0.3705 -0.8922 0.9369 0.1842 0.8910 1.0754 1.2306 -0.6536 2.2910 -0.9966 -0.0165 -1.7245 -0.0293 1.4651 0.0610 -0.4209 -1.2589 -1.1061 -0.7727 -0.8409 1.0414 3.5900 0.6897 0.1233 -0.1806 -0.3925 2.0101 -0.7222 -0.9682 -0.6627 -0.4778 -0.8981 0.5013 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-0.1201 0.0881 -1.4439 1.0747 0.1790 0.3239 -0.9343 0.6304 -0.7695 -0.9994 -0.0666 -1.1634 -1.8509 0.9605 0.7511 -1.3147 0.7005 0.6156 1.1264 0.0853 0.4366 1.0197 1.0696 -0.7301 1.2344 -2.3347 1.1710 0.6932 0.4328 0.9023 0.2421 0.8228 -0.4232 -0.1375 0.7236 1.2593 -1.9886 -0.2979 0.2779 -2.4395 -2.6059 isobutyrylcarnitine (C4) -0.3186 -0.2448 1.0091 -0.9286 0.2793 0.6998 1.4642 0.8726 1.2084 -0.9184 -1.4084 -0.2645 0.0673 -0.8551 1.9543 -1.1002 -1.0153 -0.1292 0.6688 0.5898 -0.1377 -0.5190 -0.2681 0.3646 0.0185 1.8203 0.0453 -1.3272 -0.2627 0.9034 -2.0345 0.2130 0.6018 -0.5560 1.3690 -0.0625 -0.1322 0.9386 -0.2362 1.1647 -0.8793 0.5860 1.0669 0.5544 0.7531 0.3628 -0.6860 0.1053 -1.7657 -0.3445 0.0272 -0.9388 1.4925 0.1510 0.1251 -0.5914 0.2978 -0.7143 0.1527 -0.6185 -1.7274 2.0174 0.2306 0.7320 2.6608 2.5761 0.6833 -0.6897 -0.5484 0.4521 0.6340 -1.1194 0.3884 0.6459 -0.5695 -0.5885 0.6146 1.7310 -0.4407 0.6909 -0.4220 0.1707 1.7659 -1.0491 0.7454 0.4278 -0.0626 -0.9864 -0.2424 0.0811 -0.4490 0.0807 -2.1731 0.1051 1.0281 0.7382 -1.0584 0.6282 -0.8135 -1.3036 0.0315 1.2574 0.4281 -1.3950 1.8095 1.4059 -0.1651 1.8197 -0.6450 -0.5413 0.9119 0.0397 0.3287 -0.8087 -0.0704 -0.6189 -1.0366 0.7488 -1.4198 0.9709 1.1417 -0.6741 -0.5571 -0.4645 1.0577 0.5135 -0.2023 -0.7222 -0.0824 -0.9242 0.8127 1.2918 0.1263 -0.9241 0.7463 0.8949 -1.6916 -1.7538 0.2644 -0.5768 -0.9378 0.2032 1.0673 0.3895 -1.1615 0.8406 -1.7418 -0.3185 -1.1731 -1.0672 0.4213 -1.1777 0.9827 -0.8670 0.2333 -2.0143 -0.1463 -1.0968 -1.3632 -1.0095 2.1278 -0.2847 0.1688 -1.4480 -0.5659 -0.4343 0.8039 0.8172 -0.6376 -1.1366 0.8396 0.3188 0.1137 -0.2021 0.2456 0.3427 -2.1013 -0.6361 -0.3185 1.1121 0.6274 1.5931 0.9392 -1.8278 0.1819 -0.2994 0.2528 -0.5031 -1.0487 -0.0706 1.7054 0.0832 -1.3613 0.6904 0.1774 -0.1209 -1.3527 -0.5955 0.0608 -1.4418 0.4675 1.3938 -0.9182 0.4354 0.8013 0.4998 -1.1826 0.7045 -0.8913 0.0232 -0.4685 0.3630 1.5022 1.0670 1.1951 1.0096 -0.0316 1.1461 -0.9807 1.0224 -1.3170 -0.4678 -1.6475 -0.5894 -0.2412 1.4822 -0.7827 1.6295 0.9999 0.9258 -0.0325 -0.2017 -0.4061 0.5872 1.5463 -0.2701 -0.0663 -0.6256 1.8624 0.2908 -0.5267 -1.6188 1.5644 2.2118 -0.3856 -1.0027 0.6824 1.9647 1.2637 -0.5644 -1.2510 -1.9947 0.1069 1.8754 -0.2810 -0.4001 -0.1278 0.8329 -1.7186 -0.4514 -1.3678 0.8589 0.5503 1.2484 -0.2852 -1.0360 0.1284 0.8649 0.4924 -1.9572 0.8456 1.5130 0.6328 1.3218 0.6521 0.2750 -0.5691 0.1561 1.1332 -2.0947 2.2893 2.0159 -0.5941 1.0138 1.1868 0.9693 -0.4412 -0.1128 -0.1483 0.3548 0.3886 -1.3434 0.7848 -0.8316 -0.6060 1.6405 -0.7224 0.7464 -0.3429 -1.0870 1.2301 -0.7624 0.9483 -0.4351 -0.9825 0.0165 -0.1224 -1.5875 0.7314 0.9673 -1.5781 -0.9599 1.0251 -1.7743 -0.0384 -0.7535 -1.2850 1.1518 1.6460 0.2471 -0.7444 -1.3365 -0.0163 -1.0710 1.4607 0.4533 -0.1189 -1.1927 -2.2032 0.0342 0.2636 -0.1541 -0.3592 0.1892 -0.8550 -0.5906 -0.2087 -1.2377 -0.1281 -0.9936 0.4823 0.7858 0.7982 -0.2130 -0.4014 -0.7515 -2.0493 -0.7424 0.7309 -1.4532 -1.5852 0.9921 -1.8303 0.0919 0.8818 0.5897 -1.0843 -0.9582 0.1703 -0.4141 -1.2945 -0.4734 1.0751 0.3356 -0.4964 0.8441 -0.0881 0.2515 -1.3253 -0.0078 0.1196 0.1929 -1.2602 0.4120 -0.9052 0.9822 -0.9399 1.1948 -0.6947 -0.3207 0.0144 1.9230 -1.1122 2.1757 0.8426 0.6919 0.5134 0.0302 1.2418 0.5214 -1.6620 0.5156 -0.1877 1.7209 0.6335 -0.8690 0.6050 -0.2407 0.0002 -0.1836 -1.5005 -1.3358 1.0141 3.0296 -1.0577 0.8041 -1.5727 -0.1434 -2.2589 0.3332 isobutyrylglycine (C4) 0.2581 -2.9211 0.1572 -0.5721 1.2701 0.2713 0.4121 -2.5478 0.3219 -0.9070 -2.1336 0.8874 -2.2501 0.1065 0.4208 0.0932 -0.6772 -2.2895 -0.0243 0.4964 0.7891 -2.9338 0.3660 0.3828 1.2318 0.4360 -0.1933 0.4753 -0.3409 0.2838 -2.6102 0.9603 0.3757 -0.0780 0.1678 -2.3506 -0.3292 -1.9557 0.5244 0.1714 0.5112 -1.6474 0.2388 0.4809 -0.0554 0.2146 1.0206 0.8779 -0.0444 -0.0712 0.3979 0.7022 0.0590 -0.0372 -1.8715 -0.4256 0.7399 -1.8460 -2.4026 0.0925 0.2052 0.5957 0.2690 -0.3580 1.0998 0.3587 0.4690 0.2360 -2.5801 0.5001 0.2687 0.1200 0.7212 0.6614 0.0550 0.6148 0.6430 0.5814 0.0328 -0.0078 -0.0495 -2.2212 0.8568 -0.2871 0.4512 -0.6702 -0.2702 -2.2237 -2.6170 -0.0617 0.2402 0.4106 0.5572 0.9573 0.7921 0.4361 -2.2979 -0.7971 0.7251 -0.2482 0.0838 0.2933 0.8658 -1.3503 -0.0618 0.5812 -0.4535 -0.0026 -0.0861 0.7269 1.1703 -0.4271 1.0692 -2.3433 -0.1756 0.1878 0.7885 1.0820 -2.4930 1.3234 0.4382 -0.0082 -2.3784 -0.6705 1.0939 0.2888 0.0907 0.4086 0.0440 0.4720 -0.2478 0.1303 0.8414 0.9847 0.2359 0.5483 -0.4169 0.6158 -2.3726 0.2234 0.1470 0.7818 0.3381 0.4000 0.8995 0.4339 1.2296 -0.5797 0.3928 -2.1053 0.7437 -2.0418 1.6400 -0.7094 0.4823 -2.0721 0.2006 -0.1998 0.4725 0.1463 0.7501 0.6123 -0.6142 0.2958 0.0468 0.6352 0.6455 1.0680 0.1785 0.6576 0.2974 0.2331 0.5031 -0.1516 -2.6053 1.0853 0.3103 -0.1307 -2.2353 0.5158 0.3921 0.3513 0.2955 -0.4388 0.4456 -0.1758 -2.3835 0.4370 0.0347 -0.0446 0.8387 -2.0864 1.1815 1.3432 0.6201 -0.5202 1.4358 1.0483 0.6481 -1.4304 -2.5371 0.1637 -2.1248 0.9670 -0.2072 -1.8831 0.4853 1.4216 -0.3870 0.0970 -0.0667 0.2969 0.4087 0.1870 0.7279 0.7930 -0.6358 0.3673 0.3385 0.7011 0.3881 0.1554 0.6543 0.2754 1.5826 1.7606 -2.6188 1.7130 0.0327 0.4575 -0.0170 -0.6699 0.3249 0.0672 0.6994 -0.2068 0.7236 -0.3179 1.5326 0.6594 -2.4404 -2.7040 0.0390 0.0170 0.6911 -0.7244 -0.4523 0.1286 0.9476 0.4970 -0.4192 -0.1788 1.3100 0.4014 -0.1364 0.1344 -2.4743 0.1370 0.5262 -0.4393 -0.1798 0.0929 0.0358 1.0460 -0.1583 0.9002 -2.5633 0.4831 0.0046 -0.7703 0.5591 0.3204 0.8214 0.5455 0.6354 2.1933 -0.5668 0.6844 1.5530 -0.1246 0.3864 0.6089 1.3036 0.0361 0.8727 1.1365 -0.2777 1.0580 0.0634 -0.0577 0.0546 -1.6175 0.9981 0.1275 -0.9708 0.9910 -0.3831 0.2585 -0.1159 0.3559 1.1869 -0.2363 0.3376 0.1713 -2.3837 0.5343 -2.5492 -2.0320 0.0993 -0.1675 0.1249 0.6619 0.9733 0.2807 -0.6891 -2.4391 0.0445 0.2526 0.9370 0.2938 1.1715 -0.5176 -0.9493 0.4756 0.4169 0.9020 0.6397 0.5677 0.0434 0.4838 0.2381 0.7148 -2.3860 1.2105 -0.4742 0.8403 0.8764 0.1721 0.3710 0.0312 0.1829 0.2028 0.9087 -0.1590 0.4092 -2.2971 -0.0153 0.1538 -0.0967 -0.3916 0.9493 1.1805 -0.6923 1.0078 -2.5478 0.4989 -2.7468 -0.1231 0.2820 0.5554 0.7237 -0.5940 0.9175 -0.6068 0.0922 -0.6676 0.3121 0.4192 -0.1825 -0.2592 0.1945 -0.0712 -2.3702 0.5651 0.2058 0.8864 0.3832 0.0373 -0.6041 0.3231 0.5488 0.8399 -0.3589 -0.2807 0.0037 0.4629 0.4278 0.6631 0.2663 0.1596 0.5434 0.2724 0.2753 1.1648 0.5051 1.0342 0.1281 -0.1609 -0.6381 0.3545 0.1113 0.1141 -0.1096 1.1851 -0.8256 0.3448 -1.1749 0.7492 -2.4410 0.4921 isocitrate 0.9316 -1.8411 -2.7998 -1.4081 3.0000 -1.6936 -0.4165 -1.0327 -1.1915 -0.1931 2.7930 -1.0037 -0.6394 0.3571 -1.3703 -1.1055 0.0787 -0.5143 -1.3112 -0.1037 -0.3718 -0.2612 1.2476 1.1087 0.4823 -1.2704 -0.8604 -0.4085 0.1361 -0.9985 -0.1425 2.1377 1.9318 -0.4602 -0.6543 0.6342 0.3234 0.2833 -0.2042 1.9475 0.9018 1.5149 -1.1476 -0.0668 1.3177 -0.0192 -0.8486 0.6356 0.6319 -1.2087 -0.4316 -1.2903 -0.1011 0.0296 1.6246 -0.4671 0.6213 0.8534 0.9918 -0.4803 0.7494 -1.3491 -0.4007 0.5882 -0.7610 0.1944 -2.0529 -0.5354 -0.1400 0.8482 2.3265 -0.4306 0.8762 -0.6031 1.4795 -0.8903 1.8216 1.3078 0.5436 0.0376 0.1568 -0.7610 -1.4041 -1.3168 -1.0033 -0.7701 1.4421 0.5967 -1.1915 0.0921 -0.3905 -0.0700 0.6546 0.5199 -1.0522 -0.0211 -0.3459 -0.0894 0.0270 0.1033 -1.0035 0.5061 -0.1619 1.6847 0.6603 -0.3479 0.8067 0.9229 -0.4694 0.0278 -1.8492 0.2251 0.0784 -0.6037 0.6319 0.8954 1.2488 0.7692 2.0170 -0.9713 -0.8849 -1.1886 0.5315 0.7478 -0.2567 1.1863 0.7320 0.7217 0.4578 1.4071 -1.9792 -2.4790 -1.2385 -0.0260 -0.3779 -1.2824 1.2067 1.3316 1.0148 0.5100 0.2786 1.5640 -0.4666 -0.1356 1.5364 -0.8403 -0.5270 -0.8336 -0.4967 -0.3464 -0.6108 0.8292 -0.9394 -2.1640 -0.2031 0.7535 -0.0127 -1.8958 -0.1639 1.8128 -0.1854 -0.0765 -0.8161 1.4170 -0.6526 0.7160 -0.6944 -0.4657 -0.3342 -0.5866 -0.8463 -1.5872 0.8652 -1.0558 0.0981 -0.5280 0.1757 0.2397 1.1545 0.2334 1.1234 -0.4121 1.0917 0.2551 -0.0979 -0.6467 -0.3788 0.0109 -0.1972 0.5236 0.1570 0.5399 -0.6994 -0.3276 1.3719 -0.3794 -0.5717 -0.6368 -0.2622 0.7663 0.5231 0.5807 0.0833 -0.2576 -0.8499 -0.5637 -0.4892 1.8346 0.7082 0.4180 0.8675 1.0649 0.9218 -0.1715 -0.7405 -0.5495 1.5979 0.4771 -1.2301 -0.6222 -0.0531 -0.0438 1.0341 -2.2079 0.5598 0.6649 0.0970 -1.0868 0.5518 0.0789 0.0095 1.1307 2.2908 1.2586 -0.0061 0.3789 -0.2728 1.3534 0.8476 1.9794 -2.5664 -1.4803 -0.4065 0.5190 0.4071 -0.5348 -0.8452 -1.6062 0.5944 -0.4034 -0.0079 0.3205 1.0251 -0.6929 1.4860 0.7764 -0.3741 0.5324 1.6518 -0.0670 0.0428 0.1575 -0.5384 0.0530 -0.6493 1.6889 -0.5894 -0.7696 0.6658 2.1706 0.0125 -0.8812 1.5144 -0.5920 -1.3453 -0.2619 1.2645 1.3667 -1.2294 -0.7021 -0.0670 0.5596 1.1341 0.2810 -0.2387 -1.2754 1.8720 0.7232 0.1079 0.1129 0.2611 1.5533 1.4434 -0.3413 0.1261 -1.0469 -0.2841 1.5826 -0.5977 1.6233 -0.9480 -1.2486 -0.3644 -1.3460 0.1179 0.3031 1.0073 3.0698 1.2489 -1.1341 0.7682 0.3689 -1.4958 -0.3456 -0.1801 0.5592 1.4158 -0.2881 0.3629 -1.2558 -1.1698 -0.3119 -1.3525 -0.6597 -0.5258 -1.6909 1.3714 0.5568 -0.1435 0.4018 0.3267 0.5472 -0.5607 -0.9952 1.6579 -0.2149 2.3869 1.3483 -0.2748 -0.9508 0.0413 0.3223 0.6129 -0.7780 0.5915 -0.8637 -0.9278 -0.7792 1.3956 -0.1274 1.2669 -1.2320 -1.2465 -1.9417 -1.7185 0.1049 0.7295 0.6813 -0.8273 0.4107 0.3257 0.1087 -0.1281 -0.5075 1.2695 0.7311 -0.2202 -0.2548 -0.4423 -0.9865 0.4006 -0.1234 2.2972 -1.6227 -0.0221 2.1973 -0.6251 -0.2105 -1.7844 -1.1413 -0.6879 -0.5577 0.6644 0.4954 -1.0705 -0.5485 -0.9075 -0.0443 -0.6907 -0.4853 1.1354 0.7264 1.0908 -0.7508 -0.8148 -0.7954 -0.8212 -0.4915 -1.4812 0.3339 -0.5584 -1.1782 -1.7336 -0.1655 0.6085 -0.4392 -1.0998 0.6095 -1.7120 -0.9964 isoleucine 0.2337 0.0888 0.5336 1.2023 -0.3758 0.6090 1.6249 1.6796 0.2184 -0.0561 -0.5746 -1.2583 -0.6476 0.8859 0.1727 -0.1867 0.4480 0.7778 -1.3953 -0.3194 -0.7142 -0.9843 -1.9852 -1.4718 -0.7339 -0.6075 0.8351 0.2443 -0.2575 -0.5298 -0.4243 -0.0235 0.2159 -0.1563 -0.8713 0.8572 -0.0378 0.2923 -1.7959 0.0834 -1.4622 -3.6293 0.2155 -0.0901 0.3541 2.4702 0.2824 0.3910 -2.1476 0.0407 -0.1992 -0.8016 -1.2446 0.4106 -2.2994 -0.3748 -2.0751 -0.6265 -0.6213 -0.3198 -0.9156 0.1248 -0.9767 0.9821 0.6692 0.6744 1.2120 0.8710 -0.1963 -0.9131 0.0058 1.0896 -0.2980 -0.4843 0.5485 0.3558 -2.8156 -0.7488 1.4368 0.9480 1.3851 1.7631 1.6636 -0.1491 0.7440 -2.2980 -2.2493 -0.3465 1.3936 -1.8785 -0.2929 0.4954 -1.5919 -0.1550 -0.6294 -1.0100 -0.1561 -0.6406 0.2503 -0.2405 -0.0802 1.7852 0.5384 0.7581 -2.7913 0.0291 0.7714 0.4359 -0.0992 0.2203 -0.0476 0.8037 -0.5713 0.7885 0.4992 0.3363 0.0571 0.2156 0.5694 -1.4543 0.0154 -0.1456 -0.2097 -1.7454 0.8466 0.7981 0.7071 1.6147 1.5759 1.1446 1.5426 -0.9571 -0.3119 0.3539 -0.1054 1.5025 -0.8647 -1.2293 -0.6979 -2.8042 0.1613 -0.9376 -0.5675 0.3966 0.1440 -1.3333 0.0449 0.5795 -1.8098 -1.6182 -0.8120 -0.1337 0.9157 -0.5148 -0.3875 0.3745 1.1728 0.3752 0.6120 -0.1228 1.9348 -0.9017 2.0586 -0.8468 -0.3512 0.0066 0.8788 0.8081 0.5498 0.3615 2.1557 -0.0079 0.0664 -0.9968 -1.3889 1.0760 1.6908 -1.9703 -1.4487 -1.5290 1.5403 0.2442 -0.2125 0.2713 0.4420 -0.7022 -1.2033 -0.6159 -0.7296 0.6587 0.3646 0.5359 -1.5164 -0.9833 1.7839 -0.2944 0.5754 0.3985 0.4551 -0.4886 -0.1167 -0.9521 1.4984 1.4201 1.2649 0.4730 1.0660 -1.3128 0.4351 -0.2983 -1.1573 1.5075 -1.5546 -0.5517 0.7207 1.5171 0.8611 1.7177 -0.9873 0.9039 -0.4874 0.0124 -1.5465 1.3657 1.1698 2.5699 -0.4600 1.3338 -0.4928 2.0432 -0.3361 -0.7665 -0.3830 0.4212 1.7155 1.0501 0.8997 -0.3265 0.9042 1.3908 -0.2980 0.0650 0.5081 2.3917 0.9678 0.8988 -0.0890 -1.2241 0.5812 -0.1822 -0.0520 0.2008 -0.2908 0.6954 1.2112 -0.1082 0.0489 0.1609 0.7092 -0.7502 0.4077 0.6417 1.5888 1.9438 -0.1900 0.3926 1.2007 1.6111 0.2083 -0.7451 -0.2726 -0.3052 -0.4680 -0.7567 0.5888 0.6288 -0.0178 -1.6817 -1.0150 0.3497 -0.1923 -0.8648 0.5076 -0.2876 -0.8807 0.4062 -0.4331 0.0851 0.1582 -0.0659 -0.6875 0.1240 1.2315 -0.4584 0.8523 0.6224 -0.0680 -0.8694 0.3976 -0.9602 0.7164 1.8635 1.5916 -0.6804 0.3261 0.6831 -0.1176 -0.2500 -1.0752 0.8117 0.7703 1.3020 1.2101 0.1895 0.0232 -0.3542 -0.0784 -0.7154 0.6498 -0.7504 -0.5330 1.0263 -0.4040 -0.4607 1.3516 0.4026 -0.1667 0.9554 0.6553 0.4624 0.2438 1.3026 -0.8188 0.0370 -1.2386 -0.2814 1.3843 -0.0747 0.2521 -0.8377 1.3127 -1.6952 0.2588 -0.3414 -1.4175 0.2809 0.4555 -1.6251 -0.0272 -0.4688 -0.3030 1.0902 -0.0201 1.1703 0.9578 -0.1304 -0.7059 -0.7617 -0.9173 -0.5923 -1.0023 -1.2284 -0.1145 0.3228 0.3997 0.3410 -1.5074 1.1712 0.7017 -2.7990 0.7656 0.3510 -0.1076 1.1236 -0.8674 -2.5727 -1.5195 -0.7019 0.0861 0.6882 0.0964 -1.0194 -0.0081 0.2594 0.7568 -0.9006 -1.1431 -1.2739 -0.4997 -0.2357 -0.8284 1.1475 2.4008 -0.1479 -0.1615 -0.9934 -0.5211 0.5252 -0.9243 -0.1713 -0.0440 1.3417 -0.8553 -0.7521 -1.9165 -0.5672 0.7070 -0.1625 -0.8947 -1.8407 isoleucylglycine -1.4369 0.1490 0.7286 1.2344 -0.9413 -1.8319 0.9788 -1.8920 0.4149 -1.3812 -1.5837 -0.1479 -1.6820 0.8807 0.4753 -0.1650 -1.9554 0.9294 -1.6960 1.2623 1.1666 -0.2996 0.5514 1.3459 0.8602 1.0407 -1.9294 1.2543 -1.5647 0.2461 -0.2282 0.8224 -1.3377 0.9412 0.5323 -1.7570 0.2522 1.3854 0.1408 0.6894 0.6803 -1.2609 1.0399 0.7954 -1.5782 0.7791 0.4267 0.2245 -0.2946 0.1257 1.0523 0.5068 0.3990 -1.8398 0.8287 0.5186 1.0940 0.8977 0.6015 0.1706 1.1794 0.3468 -1.4091 -1.6341 0.1936 1.0787 1.3888 0.2844 0.3711 0.9988 1.1917 0.1562 0.1040 0.8278 0.4141 -1.9150 0.7638 0.1437 1.1305 0.6562 -0.4845 -1.3308 0.7762 1.0137 -1.6340 0.0634 -1.5796 0.0828 0.9068 0.8402 0.5024 0.1607 -0.0610 1.6907 -0.9301 0.1531 0.7074 -0.3406 1.2833 0.7748 -1.8995 -0.1365 0.3621 -0.0847 1.0124 -1.6450 -1.8023 -1.7902 0.9581 1.1257 0.2682 0.3192 0.4211 -0.6898 -1.7478 0.6081 0.7441 -0.1756 -1.8501 0.5837 -0.0730 0.2481 0.4460 0.5170 0.1008 -0.0412 0.9452 0.8426 1.1274 0.8051 0.9423 -1.6037 0.6724 0.6694 -0.3653 -0.2934 0.4223 0.3021 0.6906 0.8157 -1.5212 0.2930 0.8891 1.2151 0.4719 -0.1974 0.5220 0.0030 0.6729 0.0638 -0.9417 0.5496 -1.6376 -0.7341 0.4935 1.1068 0.1934 0.5055 0.8273 0.6144 -1.7062 -0.8956 0.2752 0.0905 -1.6687 0.5983 -1.8927 0.0106 -0.0842 1.1245 1.0243 -1.7664 -0.1256 -0.3564 -1.9263 0.7838 1.6115 -0.2500 0.8703 1.4273 0.2489 0.6702 0.8424 -0.2997 0.9957 -0.5189 -0.3295 0.1294 0.6269 0.5505 -1.1610 -1.5605 -1.6465 -1.5872 0.8530 -0.9957 -0.1320 0.7122 0.5669 1.1462 -1.8959 0.8818 -0.1211 -1.7130 -0.6344 -1.4357 0.5671 1.4518 -1.7238 0.7188 -0.4396 -0.2813 -0.1351 -1.8208 0.3461 0.3150 -2.0132 -1.9959 -0.9674 -1.9223 -0.1004 -1.8750 0.5825 0.1411 0.8183 0.7527 -1.9374 0.5078 0.8042 0.9974 0.5771 0.6584 0.3070 1.1145 0.6227 -0.1013 -0.1210 0.3036 0.3108 0.7618 1.0126 1.3370 -1.7948 -0.1283 1.1369 -1.7660 0.3904 -0.0603 -1.9607 -0.1698 -0.2772 -1.9143 0.5108 -0.0929 1.0943 0.9055 0.3244 0.9026 0.4691 0.2289 1.1803 0.6058 0.4201 -0.0390 0.8392 0.2445 0.0301 0.6225 -0.2968 0.9995 -0.1346 0.8738 0.3015 -1.8870 0.5706 -0.4639 1.0695 -0.3087 -1.9491 0.6690 0.3027 0.6662 1.0289 -0.2549 -2.0651 1.2950 0.0011 0.2565 -0.9884 -0.1033 -0.2261 0.6912 0.0092 -1.9815 0.1928 0.4796 -1.2229 -1.2590 0.6044 0.2921 -1.7542 0.8553 0.8099 -0.0311 1.0341 -2.0365 -1.8912 -1.5412 0.2872 -0.9701 0.8676 0.8808 0.8705 0.3829 1.1935 -0.0441 0.7292 0.8249 1.1065 0.7256 -1.7796 -1.9206 -0.5829 -0.4815 0.6375 -0.3470 1.2043 0.5306 0.9837 0.9999 0.3656 0.0798 1.1819 0.1057 -0.0763 0.2636 -1.8767 0.0671 0.1693 0.2013 0.5522 0.6484 0.9299 0.3095 0.1189 0.2151 0.3775 -1.0156 -0.1834 0.1697 -1.5710 0.0930 -0.3980 0.1874 0.0128 0.7597 0.5413 0.7584 -2.1514 -0.3192 -1.9129 0.7054 0.3818 0.7633 0.8370 0.0352 0.7746 0.4960 -2.0232 -0.1024 -1.6712 -0.7963 0.5043 0.2737 0.3689 -1.6074 -1.3173 -1.9970 -0.6503 -0.1438 -0.3573 0.2781 0.6031 -2.1478 0.5455 0.7863 0.5424 0.8398 -0.2324 0.9676 1.3907 0.1531 1.7779 -0.0301 0.0397 0.3045 -0.1104 0.5935 1.0104 -1.9252 -1.0642 1.8450 -1.7283 0.9868 0.3105 -2.1907 0.2333 -1.8701 0.1692 -2.1024 isovalerate (C5) 1.9550 -0.0685 0.2622 0.4584 1.8753 -1.1710 1.3969 -0.8413 -0.4743 -0.7681 -0.0850 -0.9444 -0.5523 1.7032 -0.8754 -0.2208 -0.6048 2.5326 0.0166 1.3104 0.3256 0.1989 -0.4012 -0.5208 1.2947 1.1349 0.8624 0.7849 0.3979 -0.2792 -1.6794 0.9411 -0.8440 1.0907 0.3978 -1.5122 -1.2320 0.0557 0.7823 0.7859 -0.5954 -1.2536 -0.3359 -0.0313 0.8263 1.0705 -0.1144 1.1922 -2.0973 -0.0926 0.4432 0.3993 -1.7055 -1.0184 -0.7092 0.2051 0.0723 -0.2554 -0.7951 0.4359 -0.1367 1.2022 -0.4205 -0.7111 0.5562 -0.1688 0.8152 -0.6669 -0.3306 0.6207 1.9709 0.7079 0.6731 0.3739 0.0491 1.2177 -0.6698 -0.6613 1.6266 2.9798 0.3881 -0.5762 1.0023 0.6994 -1.3964 -0.7194 -0.9026 0.2761 2.2230 -0.2460 0.4493 -1.3414 -0.8748 0.4661 -1.5634 0.9398 0.9752 -0.5966 0.3650 0.3115 -0.1240 0.9744 0.3149 -0.4580 -1.0860 0.0888 -2.1023 -0.7607 0.1830 0.5532 0.0971 1.2755 0.0377 -0.2063 -1.3801 -1.0199 -0.2831 -1.2013 -1.3415 0.4563 1.0527 0.5372 -0.0223 -0.9845 0.2404 1.4483 0.5094 1.6538 0.3380 1.4240 0.3500 -2.3211 0.6803 -0.2480 0.1406 0.4909 -0.4193 0.1211 -0.3499 -1.4816 -1.4652 -0.5476 0.2498 0.7292 1.4316 -0.1744 0.3728 -0.0426 -0.8828 -1.3384 0.2130 0.2865 0.5132 -1.0721 1.2442 0.7104 1.3619 0.7982 0.6938 0.7392 0.5694 -0.4468 0.9419 0.5301 0.2534 -0.0600 0.5255 0.4009 -0.2456 0.6316 1.0889 -0.3319 -0.5622 -1.1185 -0.7682 -0.1102 -0.4260 -0.9886 -0.0387 -1.1296 0.4900 -0.1062 0.8731 -0.2533 -0.0066 0.9896 0.5589 0.1927 0.2264 0.6911 0.3030 -0.4184 -0.3931 1.3190 0.5821 -0.1157 1.7796 -0.3039 0.7397 0.3667 0.4440 -0.1909 0.9728 -0.5412 -0.0353 -0.2282 -0.1149 0.7480 -0.8345 0.3534 0.8570 0.5943 -1.9453 -1.2227 1.2282 -0.3398 -1.4835 -1.4272 -0.8040 -0.2272 -0.6373 -0.1593 0.3288 -0.6802 0.8547 0.2909 -1.9247 1.4747 -1.0374 1.0424 -0.0376 0.0591 -0.5232 1.2269 1.7057 -0.6003 1.1459 0.2891 0.5363 2.0268 0.2262 1.8853 -1.2380 1.5876 0.8756 -0.1607 -0.9700 -1.8559 0.3981 0.2082 -0.6905 -0.0131 -1.5357 -0.5629 0.8566 0.1166 -0.2806 0.5866 1.2378 -0.7158 -0.1033 -1.0295 0.8476 0.2029 -0.1320 0.6856 0.2093 1.8335 -0.6240 0.5737 0.2959 -1.2981 -0.3653 -1.4136 -0.0841 -0.6948 1.3103 -1.5147 0.1124 0.2751 -0.0605 0.0433 1.4938 -0.2551 1.2784 -0.1916 0.1753 0.6429 2.0588 -1.6251 -1.4075 -0.4361 0.1514 -1.0601 0.4940 -0.3509 -1.5846 -3.1113 1.8133 -0.7839 0.8062 0.8040 0.0102 -0.3044 -0.1872 -0.8327 -1.9660 -0.0286 0.3507 0.9264 2.1261 0.0099 0.7137 -0.0853 0.6039 -0.8023 0.7877 0.2614 0.9094 0.3067 0.2891 -1.8551 0.6065 0.3476 1.4910 1.5526 0.7471 1.2924 1.4848 -0.2256 0.7024 -0.6075 0.2640 -0.8209 -1.0697 1.1675 -2.7363 0.7376 -0.6984 -0.2274 0.8156 -0.7501 -0.3561 0.1769 -0.0375 -1.0533 -0.3092 -0.1077 -0.2589 0.0647 0.8816 -1.4908 -0.4690 0.4238 -0.5095 0.3338 0.3470 -0.2323 -1.2359 1.1049 -0.4383 -0.1369 -0.3109 0.3244 1.2389 -0.5442 -1.1661 0.3657 -1.5502 -4.6473 0.1284 -1.3239 0.6355 1.2566 -0.5670 3.2681 -1.3249 -2.8719 -2.2010 0.7211 -0.1548 -3.4567 0.2187 -0.9314 -0.6792 0.5278 0.3560 0.2072 -0.1602 0.5245 0.0050 1.2982 -1.4225 -0.4387 -0.7769 0.0589 0.4077 -0.1190 -0.2191 -0.3493 0.3805 -0.5336 -0.1019 0.1452 -0.6148 -2.1627 -1.7044 0.9202 -0.9011 -2.1446 isovalerylcarnitine (C5) 1.4179 0.6654 1.5361 -0.1884 0.6747 -0.9714 2.2284 -0.0526 0.6325 -0.8260 1.6577 -0.8775 -1.3101 1.2405 1.3690 -1.0265 -0.7460 0.5130 0.3338 -0.5936 0.1487 -1.6173 -0.3301 0.6521 -0.9761 2.3375 0.0700 -0.2665 -0.9857 -0.2203 -2.7531 -0.7874 -0.2386 -0.2550 0.3145 -1.1386 -1.8856 1.2870 0.6281 -0.2827 -0.7085 -0.5299 0.8213 -0.7357 0.3462 -0.1176 0.6651 -1.3781 -1.8775 -0.4148 -0.6477 -1.2026 1.5066 1.0010 -0.2957 -0.0587 -1.3643 -0.1440 0.4571 -1.0935 0.9311 2.4359 -0.6017 0.6677 1.4336 0.5693 0.4583 -0.1265 -0.2915 1.4796 -0.2873 0.5270 1.2654 0.7797 1.0873 1.1767 -1.1779 0.4215 0.4714 1.1922 0.9236 0.5233 1.9153 0.3509 0.5221 -1.3755 -1.3040 1.6581 0.2056 -0.4382 -0.1089 -1.3502 -1.8079 0.0955 0.6829 0.7884 -1.7655 -0.9917 -0.4049 -0.3932 1.4119 -0.8100 0.2847 0.2842 -0.6546 0.8664 0.0273 1.2196 0.0822 -0.6025 -0.2398 -0.6766 0.0309 0.9004 0.5240 -0.3524 1.3211 0.1803 -1.0095 -0.3992 1.3033 1.0724 -0.0490 -0.5672 -0.2329 -1.5172 -0.0137 0.1028 0.2404 -0.5050 0.8078 -0.0114 -1.8670 -1.3921 0.7073 0.9695 -0.7462 0.6695 0.7802 -0.3764 -0.6716 1.7556 1.7516 -1.1601 -0.6977 -0.3267 -0.9346 0.9271 -0.2482 -0.8338 -0.8911 -0.4509 1.1620 -0.9991 -1.3380 -1.4449 1.3839 -0.4571 0.2267 0.5086 -0.4564 -0.6823 0.4510 -0.6269 0.1032 0.0229 1.1359 -0.8762 -0.4872 0.2258 -0.1032 0.1931 -1.2278 -1.1454 -1.0195 0.0956 -0.6590 -1.3033 -0.7828 -1.4542 0.0791 1.3615 0.7297 -0.5855 0.4723 0.5506 0.5373 -1.1431 0.1099 0.3266 0.3056 1.3317 -1.5207 -0.4251 0.7309 0.1334 -0.6705 -0.3330 -0.2494 0.2177 -0.0930 -0.5377 -0.6426 0.6417 0.2185 0.0455 -0.0679 0.6314 -0.4292 0.7484 -0.0889 1.7774 -0.8691 2.2538 1.3694 0.5139 -0.9180 0.1604 -1.4419 0.0006 -0.0529 0.9718 -1.9127 -0.2332 -0.5212 1.5292 -1.1307 1.7621 0.7913 0.8766 -0.0656 -0.6383 -0.5686 0.4548 1.7142 -1.2872 -0.4176 -0.9390 1.7535 1.0166 1.6901 0.7076 -0.2475 3.1850 0.3622 0.1991 0.0755 2.0796 0.5314 -0.2742 -0.4666 -2.5468 -0.4107 0.9938 0.1044 -0.4178 -0.2498 1.1596 -0.5140 -0.6122 0.6033 -0.4849 0.6688 0.6676 0.4835 -0.1862 1.5010 2.1301 0.9813 -1.5787 -0.5257 1.9538 -0.2139 1.3424 1.0196 0.1503 1.1704 -0.8544 -1.2298 -0.3877 0.7507 0.0652 0.6346 1.2707 1.1792 -0.2754 0.2195 0.3772 0.9518 -0.7996 -0.0922 -1.6104 2.8724 0.5022 -0.7740 0.9491 -0.7920 0.0419 0.1627 -0.9527 0.1418 -0.1864 -0.9649 -1.7169 -0.9950 -0.0380 -0.1825 0.6404 -1.1575 1.4782 -0.2395 -0.6462 2.0510 -0.8353 0.0998 -1.2977 -0.6053 0.9104 1.1100 -0.4380 -1.0557 -0.9088 1.1730 -1.7647 -0.2766 1.2319 0.3120 -0.4034 -1.1575 -0.6010 1.5376 0.8099 -0.8460 -0.7035 -0.9102 -1.0965 0.0412 0.4184 -0.4924 0.2283 1.0320 -0.1491 0.2070 -1.1466 -0.8518 -0.5671 -0.9893 -0.9790 -0.3482 -0.5863 -0.1928 1.1399 -0.3429 1.2613 -0.7012 -0.5353 -0.5512 -1.1805 -0.4581 -0.5881 0.2383 -0.3275 0.8425 -0.6987 0.8511 3.2486 -0.6713 1.5317 -1.3207 -2.3154 -0.0910 1.3861 -1.3864 0.4931 -1.9309 -0.9095 -1.4779 0.0821 -1.2988 1.4687 -0.0018 0.8268 -0.9681 -0.0046 0.1195 0.4927 0.1574 0.1726 0.4781 0.2242 -1.8752 0.5075 0.2067 2.2109 0.0863 -2.0919 -0.1602 1.1520 1.0300 -0.7243 -1.7082 -1.0171 -1.2471 1.6260 -2.1076 -0.1993 0.3938 0.5695 -1.7794 0.0311 isovalerylglycine -1.4224 0.5415 -0.6210 -0.2660 0.3128 -0.4797 0.7369 -0.0053 1.0104 -1.3449 -1.7047 0.6172 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0.8123 1.1412 -0.0998 -1.7403 0.7845 0.0241 -1.5748 1.1106 -1.7018 0.2412 -0.3699 -0.2461 -1.5710 -2.0972 -0.3682 0.9365 0.0151 -0.1081 -0.8576 0.0183 0.8793 0.5271 0.5776 0.2011 -0.3124 -0.0409 1.5766 0.1122 0.5612 -0.1373 -1.4103 -0.1856 -0.2523 -0.0338 0.0701 0.4233 0.3817 0.9207 -0.4562 1.0446 -0.3365 0.2516 -0.1774 0.0978 -0.0417 0.4332 -0.3406 0.6216 0.4971 0.8538 -0.2347 0.4353 1.1294 -0.0166 -1.4211 -0.5002 -0.1268 -0.0733 0.6465 -1.9722 -1.3821 -1.2925 -0.7528 -1.8792 -0.0625 0.0213 1.2836 0.7132 0.9822 2.3042 0.7312 -0.2523 1.6497 -0.1119 0.4788 -0.6933 -0.0442 0.3193 0.8703 1.8622 2.0882 -2.2413 2.2565 0.6634 0.5396 0.2272 -1.6906 -0.2421 0.2760 0.6790 -0.5196 0.4155 -1.8171 3.0070 -0.2394 -0.5693 -0.6373 0.0160 0.9751 -0.4140 -0.0683 0.1024 1.6645 0.6417 0.0175 -0.2023 -0.3526 1.9809 0.1566 -0.0171 -1.8356 -0.5758 -2.0532 0.2684 -2.2529 -2.0875 -1.6904 -0.3101 1.0618 1.6086 -1.4111 -0.8121 1.3972 -1.8721 0.0471 0.6287 2.1034 0.9391 0.7793 0.6583 1.6590 0.4284 1.0344 1.5754 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-1.2864 -0.0552 -0.1790 -3.0752 -0.5449 -0.0115 0.5947 -1.7772 -1.4639 -2.4108 0.2769 -0.3373 0.7381 1.3297 0.7567 -1.0139 -0.9132 0.0564 -0.1607 0.2972 -1.1257 -2.1882 -1.3411 -1.2068 -0.1447 0.3569 -1.3827 -1.0785 0.1725 -1.6995 0.4070 0.0894 0.3666 -1.5426 -0.1405 0.2978 -0.0113 0.5180 0.2767 -1.2023 0.8553 1.6428 0.2155 -0.8748 1.1335 -1.0080 -1.3658 -0.7878 -1.9301 -0.3577 -0.4369 -2.5956 -0.4460 0.0966 -1.0172 0.5279 -0.9138 0.9028 -1.3488 -0.7645 -1.2356 0.5815 0.2961 0.0649 0.8524 1.2034 -1.4542 -0.6175 -1.1621 0.5929 -2.3991 -0.6704 0.2895 lactosyl-N-palmitoyl-sphingosine (d18:1/16:0) 0.5278 -1.5582 -0.5117 2.0009 0.5419 0.8392 -0.1724 0.8484 -0.0414 0.6939 0.2531 -0.6652 0.5192 -1.1061 0.4263 0.3889 -0.2352 -0.1505 1.5274 1.7055 -0.7964 1.0613 0.0911 0.2668 1.8686 1.5001 0.7976 0.7513 0.1424 -0.5643 0.5839 0.7138 0.7255 -1.0986 1.0901 1.4465 1.5502 0.7051 1.6412 -1.0834 1.1561 2.1475 2.5658 -1.6588 0.4538 1.1442 -0.4987 1.2920 0.4800 0.4131 0.0293 0.0358 0.0715 -1.3901 0.3044 0.3856 1.4014 0.5744 0.1820 -2.0536 0.2096 0.5352 -0.4224 0.8536 -0.6450 -1.2496 0.0595 0.5660 0.1879 1.9658 -2.0133 1.0785 0.7096 -0.7857 -0.0010 -0.8817 0.2095 -0.2769 0.2116 0.2311 1.0802 0.1175 0.0101 1.6559 -0.8964 0.1554 1.3934 0.4381 0.5315 1.3309 0.9349 0.9881 0.2781 -0.2109 0.6977 -0.5956 -0.4205 -0.4223 0.9112 -0.5922 0.6162 0.2000 1.1648 0.0544 0.9258 -1.0539 0.2798 -0.5314 0.2604 1.7854 0.4693 0.2972 -0.3878 1.2570 0.7702 0.0238 0.5900 1.3231 0.0725 0.5852 0.4509 0.1972 1.2673 -0.8873 0.5986 -1.2394 0.5354 -0.8240 0.8315 -1.8312 0.2247 0.4859 1.3257 0.1677 -1.3397 -0.1973 0.5977 -0.0929 -0.5133 1.8023 0.3481 1.2707 0.4823 0.8899 -1.3688 0.6624 -0.1802 1.2542 0.4171 0.4658 1.4043 -0.1067 1.0117 1.2964 0.4301 0.8488 -0.5721 0.2550 0.2524 0.1772 1.0585 0.8256 -0.5526 0.0704 -0.6712 0.0663 -0.5314 -0.9266 0.5154 -0.1883 -0.5137 -0.1852 -1.1631 0.2813 0.6717 1.0854 2.9917 0.7461 -0.2155 0.4465 1.0156 -0.3579 -0.6396 -0.1171 2.0524 -1.1657 1.5703 1.2661 1.0689 0.7827 -0.7163 0.1734 1.7194 1.6941 0.1208 -0.7577 -0.1961 0.1552 -0.5747 2.2961 0.5410 0.8123 0.5549 2.1936 1.0534 0.7129 0.5607 1.2677 -1.3487 0.8792 -0.1097 -0.5825 0.9901 0.9106 0.1457 -0.1576 -0.2076 0.8827 -0.1272 -0.0256 -0.8979 0.5673 0.0792 -0.7328 -0.6441 -0.6535 0.6561 -0.1557 -0.2051 -1.5605 -0.7050 -0.0880 0.6210 0.7129 -1.5924 0.5522 -0.7337 0.1547 0.0037 -0.5498 -1.3033 -0.1896 1.1251 -1.6941 0.2694 0.4700 -0.7353 -0.0513 -0.6972 -1.3749 -2.3356 -0.7602 1.4953 0.7058 -0.1472 0.1093 -1.6968 0.3075 -0.2823 -0.0908 0.0927 -0.0891 -1.2503 -1.4553 -0.2646 0.6527 0.2938 -0.5037 -1.6207 -0.3875 -0.9553 1.4957 0.2293 -1.3054 1.4691 -0.3660 0.0681 0.4830 -0.9861 0.3652 -0.0509 0.5332 -0.8295 0.3827 -0.0801 0.6814 -0.4753 0.8001 -2.4482 0.1520 -0.5830 -1.2245 1.4731 -1.8393 -1.7792 0.2850 -1.2127 -0.7584 -2.8609 -0.0579 -0.0787 -0.2043 -0.1102 -0.2201 0.8297 -1.2006 -0.5350 -1.7311 -1.0589 -0.4758 0.2979 1.0516 -0.4168 -1.2557 -0.4241 0.2864 -1.9605 -0.3190 -0.0205 0.4836 0.4399 0.4788 0.5022 -1.1646 0.2133 0.3458 0.9128 -0.9132 -0.1031 0.9541 1.1534 1.4923 -2.7630 0.0040 0.2090 -1.5138 0.1013 -2.0720 0.3030 -0.6886 -1.7401 -0.9835 -1.1577 0.1202 -2.5584 -0.6296 -3.1175 1.0240 0.4827 -0.2671 1.0964 0.8364 -1.7159 -1.0300 0.4236 -1.0992 0.5347 -0.1959 -2.1273 -1.1449 -1.6449 0.7434 -0.3459 -1.6204 -0.3290 0.3753 -0.8889 -0.3704 -1.3233 0.3586 -1.4326 0.4678 0.3318 0.3528 0.2006 -0.6782 -1.8693 -0.4696 1.2801 -0.9839 -0.7317 1.1400 -1.5438 -0.4939 -0.2140 -2.0034 -1.3359 -1.4257 -3.4027 -0.3154 -0.1289 0.6948 0.8363 -0.4024 0.6538 -1.4998 -0.8990 -0.3128 -0.4219 0.3207 -0.0382 0.5667 0.1713 -2.5980 -1.0197 -1.5285 1.0373 -1.7075 -0.6745 -0.3173 lanthionine -0.9371 -0.1877 -1.3073 -1.1469 -0.7471 -1.3530 0.4942 0.9603 -1.3180 0.1828 -0.0567 0.3547 0.7379 0.7992 0.4498 -1.3444 -1.4794 -1.2272 -1.2028 0.1728 0.0718 -1.7002 0.6091 -0.0597 0.2399 -0.1015 -0.2824 0.6135 1.4639 0.7252 -0.1234 -1.0798 -0.8241 0.3914 0.7815 0.5173 0.2183 -0.9791 0.1672 -0.0914 -0.9704 0.8486 0.4287 0.0964 0.0680 0.5872 0.9300 -0.3718 0.5105 1.4850 -1.2223 -1.4914 0.7355 -0.3330 0.0971 -1.4232 0.9586 -0.8983 0.1012 -0.4133 -0.2848 -1.4380 0.3921 3.0811 -1.2105 1.3531 0.1598 -0.0459 -1.4426 0.4828 1.7359 -1.3908 0.1498 0.3645 -1.2536 -0.0305 -1.0806 0.5125 0.8968 -1.3067 -1.2973 -1.1757 2.3484 -1.4514 0.1489 0.6248 0.6588 -1.1758 -0.1639 -0.9358 0.7698 0.5502 1.4364 -0.8817 0.0522 0.3662 -1.2296 0.7198 -1.1714 -1.3800 0.9679 0.0827 0.6489 0.3499 -1.1391 0.1941 -0.4328 2.1600 -0.8576 0.5901 0.2967 -1.4364 -1.0710 0.0691 -1.2641 -1.2416 0.8891 -1.1826 0.3994 -1.5244 0.6214 -1.1996 0.4452 0.0552 1.1785 -0.2452 -0.7149 0.3653 -1.3550 0.4931 0.3906 0.5622 -0.9413 1.0384 -1.3135 0.4065 0.0624 -0.8979 0.3801 0.2637 0.4063 1.1488 -1.1908 0.3841 -1.1192 -1.3336 1.8603 -1.3190 -0.5270 0.3615 0.6643 -1.0408 1.0865 0.2373 0.1498 1.3159 -1.2314 -1.0461 -1.3878 -0.4346 1.1434 1.7062 0.7272 -0.8141 -0.0807 0.7399 -0.0894 -0.5048 0.0971 -1.2486 0.5133 -1.2805 0.9372 0.6914 0.7979 -0.1660 -1.0250 -1.0487 0.1250 -1.0050 2.0430 1.0414 0.3247 -0.1140 -1.0611 -0.2609 2.0606 -1.1803 -1.0405 0.8304 0.2596 0.7776 0.2529 0.6782 -1.0652 0.3980 -1.1839 -1.5409 -0.0984 -0.9482 -1.4105 -1.0447 1.7936 1.0895 0.3307 -0.9266 0.6057 -0.5113 -1.2369 2.3868 0.1934 1.0149 -1.5301 -0.1758 -0.0806 -1.3274 2.1692 0.6314 0.5684 0.6168 0.3422 2.0617 -0.3538 0.8892 0.6881 -1.5477 0.2138 0.5822 1.4558 0.1158 -1.3298 0.1734 0.4965 0.5963 -1.4879 -1.5045 1.4576 -1.1897 0.6344 -1.1497 0.2102 0.0186 -0.3618 -0.2772 -1.4076 -1.2834 -1.3311 0.7394 0.8349 -1.3800 -1.3666 -0.1250 -1.4617 -1.3247 -1.3744 0.6083 -0.3158 0.0334 -1.2499 0.3714 0.9787 1.1516 -1.4840 -0.1261 -0.6497 -0.9397 0.2276 -0.0415 1.4247 -1.4095 -1.4155 0.2287 0.4959 0.5907 -0.0653 0.1060 0.4962 0.6857 0.1751 -1.0270 2.1413 1.7006 -0.2896 -0.1433 -1.6005 1.1529 -1.4150 1.7363 1.1345 0.6555 0.4864 -0.1523 0.1460 0.6606 -1.2592 -0.1858 0.2797 0.4672 -1.5748 0.9579 0.0406 -0.4674 0.5128 2.0000 1.9826 0.4871 -1.4149 -1.0370 1.5067 0.0639 -1.2359 0.6151 1.2708 -0.6766 2.6821 -0.0420 1.3175 1.7138 0.3039 0.7388 -1.2876 -0.3756 1.0970 0.4461 0.1924 -1.6445 -1.3352 -1.3096 -1.3701 -1.4840 -1.1869 0.3746 0.2532 -0.0803 0.9086 -0.1551 0.4900 -0.6841 1.7636 0.5389 1.3758 -0.0097 1.7896 -1.4698 0.5540 0.1383 1.1736 -1.4715 0.1546 0.0186 -1.0742 1.6932 -1.4022 1.2828 1.1451 -1.6017 -0.5298 2.7794 1.9808 0.9456 1.0113 0.5660 -0.3670 -0.2817 0.3579 -0.5331 0.8964 -0.0050 0.4376 1.0156 -1.1779 0.3917 -0.0101 -1.2808 0.5608 1.1819 0.8192 -0.0460 -1.4845 0.8423 0.7266 0.9151 0.2530 0.5584 0.6012 1.2436 1.3565 0.0881 0.1722 -0.5785 -1.0821 -1.2832 2.0691 0.1149 -0.3320 0.3018 0.3870 0.9507 0.4023 -1.4369 -0.0159 0.3320 -1.2436 0.7025 0.0645 -0.3375 -1.3636 -0.5828 0.7458 0.1834 laurate (12:0) -0.2735 0.7256 -0.2167 1.9682 0.4748 0.4753 0.7448 0.2480 0.6449 -0.0862 0.2915 0.8055 2.2721 -0.3118 -0.2847 -0.6485 -0.0061 0.0152 -1.4362 0.4523 -1.1164 0.1802 -1.4138 -0.8505 0.5854 -0.8538 0.1820 -1.3739 -1.4991 -0.3460 -0.7993 -1.3469 -0.2722 0.9354 4.1758 0.0881 -0.5066 -1.4079 -1.0955 0.1393 -1.2274 -1.0128 0.5079 0.1977 0.5943 1.5303 -0.7760 -1.4705 -1.2229 -0.3191 -0.3774 -0.4417 -0.3680 0.4303 -0.8357 -0.6193 -1.9079 1.2415 -0.9262 0.2808 -0.9384 0.2296 -0.4728 -0.0127 0.2798 -0.8498 0.1415 -0.0936 -0.2675 -1.2313 -0.0059 -1.1685 -1.0738 -0.7292 -0.5210 -1.0797 -1.2281 -1.3316 -0.6934 -1.3430 0.1160 0.9635 0.0151 1.2038 0.9997 -1.0627 -1.1280 -0.6657 -0.5780 -1.4544 -0.2284 -1.0307 -0.8948 0.1117 -0.0107 -1.5896 -0.4663 -0.2756 -1.2055 0.8471 -1.3234 1.3439 -0.7902 -0.6780 0.0129 0.4299 -0.3057 2.3444 1.3098 -1.4012 -0.1317 -0.6345 -1.0228 0.5286 0.0049 -0.5726 -0.7490 -1.0551 -0.2958 -0.2702 -0.3415 0.2083 -1.5016 1.0339 -0.2507 0.4824 -0.9043 -0.1814 0.4351 1.4265 1.2211 0.1368 -0.6593 -1.0638 0.0174 0.9376 1.1280 -0.4772 -0.8918 -1.4398 -0.5359 -0.6516 -0.3188 -1.2346 -0.8029 -0.6603 1.0953 -0.2859 -1.1869 2.1520 -0.2577 -0.4983 1.1774 -0.7468 2.6513 -0.0276 0.7684 0.6826 -0.3405 0.5441 -0.6129 -0.1243 -0.6824 0.4768 -0.6667 0.4768 1.4098 0.0815 -1.2094 1.0666 -1.1182 -0.5867 2.2170 -0.7436 -0.8096 0.3407 -0.0107 -0.7638 0.1499 -1.8393 -1.1911 -0.4485 0.3214 -0.9620 -1.6501 -0.3583 -1.3520 0.0678 -0.5439 0.0631 0.6445 2.5757 -0.8496 -0.5653 1.3223 -0.0232 0.3785 0.6490 0.9940 0.2655 -0.8207 -1.0913 2.2061 -0.7065 0.2750 0.0896 1.9795 -1.1579 0.6403 -1.5565 -1.6654 -0.6222 0.1872 0.1494 1.1605 -0.6754 -0.5840 0.6239 0.8015 0.5220 0.0425 0.3906 1.2269 1.3899 -0.2407 -0.3659 0.9945 -0.1513 -1.0936 0.0210 0.7003 -0.5707 -0.6983 -0.8001 -0.5960 -0.8152 0.5487 -0.5570 -0.4422 -0.1797 1.2762 0.3243 0.3753 1.2641 -1.0905 -0.7377 0.5333 -0.1570 -0.9773 1.4819 0.4044 0.5806 -0.4127 0.4699 -0.4223 3.1689 -0.6676 0.9262 0.0343 -0.6352 -1.4893 -1.4747 -0.1862 0.9893 0.8359 1.7385 -0.2708 1.8743 -0.1664 -0.6065 -0.0484 -0.9809 -0.3597 0.4480 -0.3013 -0.0172 2.2735 -0.0795 0.7285 -0.3950 0.5066 1.8528 -0.5731 -0.1048 -0.0011 -0.9682 -0.3336 -0.5381 0.5836 -0.0644 -1.1276 0.3793 -1.1610 1.4256 0.5217 3.2133 0.5228 4.0698 1.0029 0.7802 -0.6061 1.4588 -0.4485 0.4954 -0.9380 -0.7182 -0.8388 -1.5414 1.3455 -1.0053 0.0153 0.8099 1.3326 0.4005 -0.2230 2.0016 3.1180 0.7992 -1.0576 0.6503 -1.1174 -0.1438 -0.1404 -1.3479 0.2670 0.2434 1.1576 0.9542 1.1060 0.3014 -0.6741 -1.3217 1.1704 0.6490 -0.7567 -0.1750 1.5912 -0.0749 -1.4706 -0.8377 0.5116 1.4284 1.3190 0.0439 1.2066 0.0631 0.4665 0.1583 -0.3573 -0.5003 -0.2722 1.7853 0.3879 0.1723 0.6898 -1.2735 0.2673 -0.1883 0.8159 0.6895 -0.0087 -0.7537 -0.8624 1.2874 -0.6368 -1.2926 -0.2320 -0.5219 1.3421 -0.6677 0.1532 -1.1872 0.1934 -0.1601 -0.1371 0.7966 1.1923 -0.2055 -0.5987 1.2507 0.5538 0.4315 -0.5440 0.5095 -1.5740 0.0538 1.6487 1.0641 0.6410 1.4665 -0.6998 -1.7875 2.5117 -0.5014 -0.7259 1.4267 -0.6947 -0.8672 -1.9971 -1.3944 -0.0650 0.3024 0.5951 -0.3450 1.1889 0.5907 -0.0328 0.2016 0.6688 1.9953 laurylcarnitine (C12) 1.1946 0.5616 1.2378 2.0216 0.7916 1.2028 1.4601 -0.7685 2.2899 0.3053 1.2259 0.0648 2.0847 -0.2719 0.2091 -0.0366 1.5768 1.2978 0.5077 0.4818 -0.2237 -0.5890 -1.2487 -2.7927 0.8993 0.0576 2.0831 -0.0278 -2.0336 -1.2101 -0.6396 -1.6191 0.5075 -0.3749 1.6341 -0.4156 -0.5670 -1.2488 -0.2607 1.2622 -0.8699 -0.7512 0.7493 1.1685 0.9061 1.0556 -0.3987 -0.9472 -1.6512 -0.4426 -0.4039 -0.0613 0.0026 1.5551 -1.2113 3.0612 -1.0305 1.0586 -1.0135 2.0441 -1.9222 -0.0233 -0.4383 -1.1504 -1.6689 -0.3391 0.9916 0.8281 -0.2778 -0.6595 0.8672 -0.8795 0.1586 -1.2518 0.4972 -0.5517 -0.6102 -0.4695 -1.1995 -1.6734 0.5623 -0.1744 -0.8855 0.6307 -0.7161 -1.4236 -1.7811 1.7968 -0.0215 -0.0524 1.4032 0.1247 -0.5322 -1.7378 0.1003 -1.2031 -0.6860 -0.4708 -1.0205 -0.1913 -0.5314 -1.4580 -1.5299 -0.1076 0.1132 -0.3655 1.5537 1.0057 1.4267 -0.5233 -0.9328 -0.6787 -0.6176 1.2911 0.1832 -1.8319 -2.0298 -1.0453 -0.1743 0.9729 -0.7466 1.4304 0.2678 -1.4015 0.2987 -1.0578 0.6132 0.2319 0.6307 -0.8070 -0.2355 -0.0686 -1.1082 -1.6564 -1.7336 -0.1560 -0.1244 -0.9980 -1.0324 -1.5124 0.9781 -0.6081 0.3841 -0.0521 0.9151 0.7885 0.2533 -0.0354 0.7502 1.1548 -0.5670 1.9826 1.3124 1.2168 2.0218 -0.5802 1.9868 0.2882 -0.4535 1.0286 -0.1231 0.7737 -0.9166 1.4596 -0.7026 -1.1165 -0.0534 -0.8865 -0.7869 0.2456 -0.1665 -0.1751 0.7917 -1.1544 1.0564 1.7653 0.9543 -0.4391 1.2337 -0.3568 -1.7264 0.2340 -1.0628 -1.5352 -1.6498 1.2016 -1.0362 0.9911 -1.5261 -1.8096 -0.4073 0.4208 -1.0901 0.8228 0.0761 -0.0965 -0.3101 -0.3291 -0.0315 1.6426 -0.1878 -1.1355 0.2323 -1.1208 -0.5017 0.2468 1.0103 -1.1283 -1.8273 -1.2437 -0.0903 -1.3088 -1.0324 0.3416 0.7160 -1.2182 -0.3751 -1.4711 -0.1344 -0.8105 0.2682 -0.2958 0.3442 -0.5799 -1.1246 -0.4493 -0.2314 -0.2911 -1.1183 -0.3719 -0.6908 -1.6615 0.0879 0.0601 0.2266 -0.1667 -1.4759 1.8021 -0.3445 -0.1696 1.3136 -0.3239 0.4288 1.7817 -0.8751 -0.4534 0.2998 0.3495 -0.8360 -0.6913 -0.0920 -0.2931 -0.5369 0.8124 1.1011 0.6085 0.4976 0.4309 0.5120 0.0020 1.7950 -0.8801 -0.3186 -0.1078 0.4265 0.9491 0.3599 -0.0857 0.2333 0.3795 0.1521 -0.8777 -1.0694 1.2127 -1.2167 -0.0066 1.0739 -0.0851 1.0371 0.7061 0.9301 -0.5429 0.2585 0.0834 2.5556 -1.1695 -0.2158 -0.9223 -0.5603 -1.2595 0.7095 0.2200 -1.3087 0.6864 -0.2188 0.6418 0.2276 1.2776 0.3720 -1.0207 0.8071 -0.9557 0.5380 0.5888 -0.0954 -0.7128 -0.8441 0.5949 1.2095 -0.0400 0.2763 -1.4924 -0.1479 -0.1157 1.2188 -0.3037 0.8135 -0.6127 -0.3354 -0.5745 0.6506 1.3604 -0.5618 0.4202 -0.6948 0.7250 0.5559 0.0199 -0.0921 0.0147 -0.8644 -3.3685 1.9258 -0.1317 0.9611 -0.3111 -0.9188 1.7496 -0.4704 -2.3619 0.2414 0.4298 0.1289 0.3154 -0.2374 -0.6553 -0.6524 0.8461 0.0767 -1.2886 1.0039 1.6495 0.1927 0.7401 1.4159 -0.3428 1.8322 0.8841 0.3620 0.1744 -0.7711 -0.3008 -0.4987 0.7827 0.7902 0.1377 -0.7959 -0.2879 0.5382 -0.1777 0.3562 1.5280 1.4113 1.2059 0.9109 0.3601 1.2757 -0.0592 -2.0946 0.7997 1.0756 -1.6122 -1.5531 0.9103 -1.8973 0.9077 0.0816 0.6800 0.8497 2.4684 0.5359 0.4219 1.3173 1.3250 0.5535 1.7402 -0.6526 -0.3813 -1.0757 0.1354 0.6653 1.0736 -0.9164 -0.3960 1.5124 0.9668 0.4935 -0.3039 -0.4232 -0.2889 leucine 0.1896 -0.5326 0.7008 1.1654 -1.0767 0.6291 1.4674 1.4696 0.3553 -0.3751 -0.6738 -1.3487 -0.9366 0.6570 0.2229 -0.2180 0.4563 1.1660 -0.3422 -0.1290 -0.8835 -0.8614 -1.5685 -0.8199 -0.8244 -0.7596 0.7285 0.2718 -0.3522 -0.7248 -0.4017 0.2508 0.1780 0.2216 -0.8169 1.6673 0.0611 0.4846 -1.9614 0.1875 -0.4987 -2.3955 0.5653 0.1629 0.0631 2.2041 0.2588 0.6390 -2.7018 -0.5727 -0.1776 -0.9880 -1.2714 0.4464 -2.4055 0.6099 -1.7932 -0.7326 -0.1271 -1.0863 -0.8483 0.1078 -1.6734 0.6885 0.8960 0.9884 1.5108 0.9629 -0.5628 -0.7839 0.0282 1.1961 -0.4417 -0.4967 0.7907 0.5595 -1.5661 -0.5671 1.6811 1.5113 1.5289 2.0694 1.7259 0.2722 0.9096 -2.3858 -1.6135 0.0565 1.8437 -1.6856 -0.3398 -0.1210 -1.9038 -0.0920 -0.5561 -1.2079 0.1624 -0.5695 0.2238 -0.6283 -0.0859 1.6675 0.8433 0.7792 -2.0027 -0.3833 0.8481 -0.3965 -0.5292 0.0693 -0.1263 0.9045 -0.7103 0.5864 0.8494 0.4623 -0.8570 -0.0170 0.5334 -0.5774 0.0802 0.1415 0.0455 -2.1193 0.5257 1.2275 0.5021 1.1837 1.4187 1.0108 1.2498 -0.9535 -0.1056 0.3873 -0.8260 1.1196 -1.4619 -1.5085 -1.4602 -1.8613 0.0411 -1.3819 -0.1878 0.3495 -0.6768 -1.4833 0.0163 0.6186 -2.2417 -1.6114 -0.3990 -0.3554 -0.2924 -1.1215 -0.0610 0.1628 0.9919 0.5997 0.6206 0.1479 2.2637 -0.6103 1.8592 -1.0404 -1.1199 -0.3309 0.7633 0.8577 0.4661 0.4498 2.5110 0.3209 -0.2550 -1.0485 -1.5822 0.2050 1.3960 -1.8532 -1.5522 -1.2185 0.4790 0.2078 -0.6381 0.4994 0.1380 -0.9064 -1.1884 -0.5018 -0.6291 0.2966 0.9376 0.6170 -1.6684 -0.9187 1.6376 -0.4897 0.5871 0.1145 0.4442 -0.6891 0.8680 -0.8904 1.6823 1.2134 1.4949 0.8572 0.6015 -1.1979 -0.3888 -0.1306 -1.0834 1.4610 -0.9656 -0.3096 1.4092 1.9549 0.7666 2.0667 -1.3934 0.6734 -0.8408 -0.0344 -1.3708 2.1631 1.0165 2.8789 -0.6494 1.0983 -0.4819 1.8981 0.1511 -1.4699 -1.0300 0.4989 1.4281 1.3113 0.8424 -0.7948 0.9676 1.7140 -0.9539 -0.3526 0.8002 2.8574 0.9767 0.9715 0.1928 -1.1610 0.3981 0.2480 -0.0994 0.3164 -0.7398 1.0847 1.1864 -0.3346 0.1964 0.3621 0.6163 -0.5343 0.2186 0.7724 1.2033 1.6066 0.2108 0.1127 0.7599 1.4555 -0.5428 -1.0023 -0.1747 -0.4529 0.1775 -0.3059 0.7808 0.5053 -0.1128 -1.6829 -0.6514 0.2550 -0.1084 -0.9274 0.4117 0.1634 -0.5837 -0.0158 -0.2287 -0.4480 0.7681 -0.1417 -0.2112 0.1620 1.2589 -0.4355 0.9575 0.5786 -0.6504 -0.8640 -0.0489 -1.0719 0.6582 2.0036 1.6037 -1.0156 -0.0221 0.7606 -0.0141 -0.6296 -0.9402 1.1557 0.6216 1.6861 1.8480 0.3306 -0.8233 -0.2668 -0.6659 -0.7522 0.7202 -0.3562 0.2250 0.2902 -0.3892 -0.3414 1.6373 0.8151 -0.2227 0.5031 0.7003 0.9603 0.2194 0.7096 -0.7467 0.0138 -1.1763 -0.2919 1.4888 -0.6817 0.3567 -0.4737 0.9246 -1.0344 0.3819 -0.0038 -1.0300 -0.2328 -0.9197 -1.4310 -0.6193 0.0067 -0.8544 0.1328 -0.2546 1.2560 1.4445 0.0777 -1.1820 0.7121 -0.0863 -1.4049 -0.3983 -1.0267 -0.7606 0.4236 0.0607 0.2414 -1.6257 1.0583 -0.2147 -2.4216 0.6634 0.4129 -0.8175 1.1100 -0.4626 -0.5225 -1.8394 -0.4595 -0.1494 1.3582 -0.1496 -0.9113 0.0755 0.5160 1.0988 -0.8376 -0.9732 -0.9283 -0.2510 0.4307 -0.6475 1.1355 1.5677 0.7234 -0.2178 -1.2899 -0.1997 0.6691 -1.0270 -0.7417 -0.8806 1.4946 -0.9173 -0.4445 -2.0744 0.4133 -0.0109 -0.4261 -0.6464 -2.0689 leucylalanine -2.5564 -0.2955 -0.4498 1.0041 2.0410 -0.5582 0.4601 -1.3286 -0.0347 -1.1282 -2.3020 -0.7110 1.8672 -0.3278 0.9216 -0.1792 0.7037 0.8366 -0.3137 -0.5031 -0.4047 1.8063 -0.5872 0.1988 0.0556 0.4370 0.5315 -0.2892 -0.8805 -1.0782 -0.7932 -3.1969 1.1242 0.2735 0.6255 -0.6793 -0.5520 -3.0773 -0.9257 0.0028 -0.7357 -0.6006 0.6036 0.0055 0.7912 -0.4088 -0.1631 -0.6867 -0.8346 0.5334 -1.2905 -1.7679 0.1180 -3.0886 -0.3338 -0.4282 -0.6235 0.9611 0.2634 0.6249 -0.1868 0.5494 2.2364 -1.1931 1.1671 1.1219 -0.9944 0.3226 -0.2192 -0.4599 0.8936 -0.8185 -0.2907 -0.0912 1.4133 -0.2243 -1.0474 0.5280 0.3232 -0.3251 1.8866 -1.1666 0.9727 0.4557 -0.2092 -3.5514 -1.3804 0.3948 0.5004 -1.1631 -0.8245 -0.9850 -0.8527 -0.5944 -3.4012 -0.5071 -0.4478 -1.5819 -0.5409 -1.1303 -1.0225 0.7233 -0.0409 0.9107 -0.2933 0.3526 -2.1357 0.9278 -0.0783 -1.5829 -0.5447 0.1009 0.8258 0.7605 -0.0452 -0.7795 0.3044 0.0637 -0.7666 0.2498 0.1260 1.3527 -0.9237 -0.4029 0.9732 -1.0466 0.6696 0.5778 0.1083 -0.2063 0.6769 -0.4367 -1.3561 -0.8445 1.0602 1.4865 -0.2300 0.0033 -0.1383 -0.5745 1.0455 -0.0340 0.2923 0.8401 0.0795 0.0162 0.6633 -0.5501 -0.2639 2.3111 1.4230 2.3774 2.2656 1.2085 -0.8026 -0.4607 0.2293 -0.3847 -0.4066 1.4210 -0.4093 -1.1884 -3.1875 0.3484 -0.7155 0.7939 0.1017 -0.0318 0.9303 -0.8361 1.2834 -1.1371 0.0386 -1.4618 -0.8583 1.2905 1.0222 -1.8785 -0.9127 0.4715 0.3778 0.4922 -0.0422 -0.2726 0.0419 -1.8129 -1.1327 -0.9346 -2.2816 -0.3323 -0.3120 -3.2408 -0.1855 -1.5038 1.2510 -0.0205 -0.6818 1.0105 0.3271 2.0096 -0.1762 -0.8612 -1.4889 1.7592 -0.6674 1.0492 1.3433 0.4178 0.0302 0.2868 0.1111 0.4022 -0.2708 1.9438 0.9893 -0.3766 -0.3161 -0.5244 0.0714 -0.0255 0.7280 1.6274 -0.2613 0.3402 0.8423 1.4726 -0.8958 0.8378 0.3355 0.5726 -0.3541 -0.4288 0.7448 0.1746 0.7974 -1.1346 -0.9911 -0.3609 1.2312 0.9146 -0.1496 -0.1087 -1.2962 1.5574 0.5371 0.0497 0.2114 0.6569 -0.3947 0.0957 0.7133 -0.0679 0.2046 0.5849 0.1611 0.9262 0.0550 -0.7125 1.6613 0.0660 -0.0583 0.3896 0.4085 0.1886 0.0740 0.7964 -0.6939 0.4541 0.2109 -1.0250 -0.3777 0.5993 0.4234 0.9106 0.8654 0.3259 0.7120 0.8386 -0.5091 -0.0252 0.2670 0.1453 0.6224 0.4357 0.4537 0.4280 -0.3776 1.0471 0.2128 0.3191 -0.2453 -0.6260 0.9223 -0.3294 0.2124 -0.1723 0.0666 2.2486 0.1960 0.6216 -0.1173 0.1664 -1.4887 -0.5160 1.1014 0.9054 -0.6268 0.6142 0.2245 -0.4055 1.9814 -0.1769 1.1052 -0.6473 1.3420 -0.0416 0.3630 0.5353 1.0180 -0.4459 0.3248 0.1004 0.6735 0.1845 -0.5168 0.5582 0.8879 -0.1018 0.1232 0.1714 -0.3235 0.3656 0.1983 0.9564 0.7369 -0.4635 -3.5861 0.4873 1.1789 -0.2258 1.0424 -1.1193 0.6870 -0.0574 0.1578 -0.6815 0.7778 2.5184 2.2256 -0.1082 1.8466 0.4270 -2.5156 0.3687 0.4590 0.1068 0.3403 0.6466 -0.3385 1.1600 0.1289 -0.3870 1.0176 -1.0670 0.9220 0.4094 0.0224 0.7551 -0.7498 -1.0066 -1.1578 -0.6267 -0.6354 0.2935 -0.9769 -0.4116 -1.3421 -0.7724 -3.6700 0.5230 0.2204 0.2447 -0.1370 0.8106 0.1578 -0.3861 0.3166 -0.0912 0.2202 0.3262 2.3693 -0.3989 0.9297 0.5105 -0.3718 0.0434 -0.7831 0.1237 -0.3178 0.9962 -0.8448 -1.0847 -2.1377 -0.2081 0.5733 0.4358 1.4731 0.1266 -0.6178 -1.6781 leucylglutamine* -0.9219 0.6400 1.4010 0.7763 2.1841 -1.2473 0.7447 -1.2948 0.6548 -0.8794 -1.0545 -0.7042 1.2873 1.2716 0.7883 0.0748 -1.3448 0.4663 1.2220 0.2621 -1.0212 0.8857 0.9295 0.7372 0.7990 0.6829 -1.3182 0.9375 -1.0188 0.7115 1.2003 -1.0320 0.0656 0.8030 0.3835 -1.1808 -1.1228 0.3221 -1.0731 0.9020 -0.9466 0.4791 1.0431 1.1312 0.4867 -0.2659 -0.1553 0.0962 -1.1473 -1.1406 0.3615 0.6329 0.7638 -1.2536 0.3938 0.6011 1.3280 1.2354 1.2411 -1.2669 0.8804 -0.2208 0.7232 -1.0821 1.9616 1.7988 0.5309 1.1785 0.6839 0.7147 0.6154 0.0615 1.0090 0.5545 0.8491 0.1480 0.2351 -0.3620 1.2887 0.8889 1.5093 -1.1061 1.2810 0.0180 -1.0864 -0.6544 -1.0362 -1.1074 1.1130 0.6622 -0.3657 -0.4526 -1.1175 -0.5685 -1.1380 0.4643 0.3635 -1.1285 0.9474 0.1187 -1.2999 0.0691 0.9462 -0.1096 0.6914 -1.0928 0.1367 1.0656 0.7242 0.0399 -0.0088 -1.3090 1.9279 0.4401 0.7819 0.6575 -1.0084 -1.1122 -1.2629 -0.3344 -1.0632 0.4154 0.5082 0.6888 0.3068 0.5526 0.4758 -0.2061 -0.5766 0.3718 -1.2911 0.3076 -0.1988 0.6254 -1.2153 0.7984 -1.1372 0.9439 -1.1936 -0.7788 -0.9956 -1.2239 -1.1179 0.7198 0.5742 -0.2129 -1.1563 -1.2186 0.1943 1.7378 1.5849 1.4449 -1.0768 1.3568 0.1937 2.0536 0.1901 0.5078 1.4849 2.1432 -1.1360 0.1651 1.5939 1.0112 -1.1162 -0.1721 -1.2916 0.9909 -1.3107 0.6329 1.1412 1.1769 -0.7577 -0.9982 -0.4660 -0.9253 0.6145 -1.0099 -0.8298 1.4740 0.1064 0.9856 2.4102 0.5123 1.0761 -1.3799 -1.1997 1.2049 0.4238 0.9504 0.2655 0.1032 0.5385 -1.0465 1.0573 0.4021 0.6110 -1.3923 -1.1893 0.8849 -1.2890 0.1154 0.1134 -0.0710 -1.2125 -0.9106 -0.3271 -0.5872 -1.1557 1.0045 -1.1363 0.4794 0.1308 0.2352 2.1954 0.2081 -1.3990 -0.2704 -0.7379 0.1497 0.8160 -1.2785 0.3109 0.5148 0.5213 1.2900 -1.3357 0.0875 0.2315 0.6482 -1.2278 1.2463 -1.1362 0.6398 -0.1828 1.0646 -1.2299 1.1142 1.6884 0.6991 0.5446 0.8743 -1.2106 -1.4499 -1.2872 -1.1927 1.2434 0.2226 -0.1110 0.5882 0.6139 -0.0001 -1.3300 1.1521 1.0509 1.5413 0.4965 -1.2466 0.9740 -0.1174 0.1997 -1.0661 -1.3476 -0.0685 -1.2780 1.1802 0.0950 -0.3869 -1.1506 -1.2905 0.5492 0.4227 -1.3368 0.3947 1.1282 -1.2484 0.9925 -1.2499 0.3764 1.1369 0.4136 -1.3475 -1.3693 0.8660 0.0496 1.1619 0.4268 1.0804 0.3900 -0.6385 0.5359 1.5341 -1.2723 -1.3725 0.8182 -0.4380 -1.2830 1.1777 -0.1428 0.6758 -1.1851 0.7426 0.0685 0.2866 0.8585 -0.2425 -1.2955 0.4162 0.2722 -0.3694 -1.1542 1.1055 1.1138 -0.3033 1.1396 -1.2318 -1.1760 -1.2160 0.1458 -1.3077 0.8015 -1.3198 0.5410 1.1180 1.3463 -1.4735 1.0832 0.2906 0.7123 -0.2272 0.6949 -1.1226 -1.2010 0.2236 -1.2398 -0.3275 -1.2868 -1.2660 -1.3799 0.5868 -1.1964 -0.2444 -0.7408 -1.3382 -0.2120 -1.1497 0.0580 1.5818 1.0889 1.9444 1.3109 -0.7082 -0.0671 -0.0795 0.6900 0.3945 -1.4096 -1.3060 0.4244 -1.4038 0.0412 -0.3278 -1.2215 0.7171 -1.2740 0.4434 0.9303 0.0917 -1.4045 -1.4220 -1.1083 -1.2991 -0.9078 -1.1913 -1.5204 -1.0842 0.5832 -1.3874 -1.3507 -1.3144 -0.5096 -0.2734 -0.1392 -1.4997 0.8662 -0.0836 -1.5408 -1.2809 0.4011 0.4954 2.4606 -1.1882 4.0340 0.0279 0.2781 0.5351 -1.4856 0.4644 0.4729 0.2030 -1.4839 -1.3069 -1.1616 1.4149 -1.4420 -1.5379 0.4047 -1.2727 0.5688 -0.2479 leucylglycine -2.6410 -0.0416 1.9695 1.1335 2.4839 -0.6922 0.3545 -1.2095 0.7404 -0.8394 -0.1104 -0.3797 1.5395 1.1957 0.6042 0.3213 0.1959 1.1450 0.8144 -0.6213 -0.0845 0.7024 0.5682 0.4538 1.0736 0.8008 -0.8822 1.0663 -0.6894 0.5654 -0.1866 -1.4981 0.2966 0.8567 -0.5091 0.1646 0.2512 -1.2640 0.2082 1.0356 0.2076 1.0213 0.9279 1.0776 -0.2744 -0.9146 0.1768 -0.2869 -1.0915 -1.1938 -0.2940 0.4189 0.3178 -0.6321 -0.1077 0.2409 0.5986 1.2009 1.0109 -0.6843 1.2622 0.0799 0.6726 -1.0938 1.4090 1.7531 0.1813 0.6321 0.1314 0.3146 -0.1345 0.4723 1.0252 0.8541 1.1872 -0.4837 0.6579 -1.6380 1.0885 0.2933 2.4099 -1.3108 1.0940 0.1656 0.4300 -0.6683 0.1774 -1.6932 0.6674 -0.0477 -0.2445 -0.0716 -0.9317 -0.3041 -0.4401 -0.1411 -0.1379 -1.0928 0.2549 -0.1772 -0.3928 -0.4936 0.7634 -0.5767 1.4606 0.5995 -0.1856 0.7626 0.6163 0.5267 0.4405 0.4165 2.1420 -0.2056 1.0481 0.3242 -0.7095 0.0359 -0.3431 -0.1575 -0.0450 0.2932 0.4100 0.6212 0.4571 -0.0067 1.1119 -0.1347 -0.2568 -1.1537 0.9390 0.4938 -0.3697 -0.1441 -0.7160 0.2054 -1.1678 1.0507 0.5483 0.7994 -0.2826 -1.8960 -0.5470 0.8316 0.9692 -0.6692 1.0761 0.1602 0.2828 2.1539 2.2022 1.4449 1.3920 1.9156 -0.0380 0.8116 0.9688 0.3049 1.1037 1.2664 -1.4012 -0.7126 1.1116 0.5364 -1.2628 0.1740 -1.2642 1.1790 -0.3353 0.9372 1.5423 0.8345 -0.5062 -1.6725 -0.5589 -0.5493 0.3132 -2.8009 -1.1228 1.4772 0.0511 0.3792 2.2501 0.1888 2.0579 -1.5534 -0.5317 1.0551 -0.2469 1.0247 -1.1731 0.4955 0.5929 -0.5845 1.1171 0.0244 0.7990 -0.1906 -0.8639 0.4198 -0.8304 0.8964 -0.7917 0.5097 0.0844 -1.1213 -0.2388 0.5758 0.2577 1.8907 -0.4013 -0.2561 0.5942 -0.5596 1.2396 -0.7057 -1.1267 0.0855 -1.0951 -0.2526 0.5303 -0.0989 0.2895 0.6759 0.1056 0.7871 -1.2741 0.0243 0.0883 0.9392 -0.5715 0.3612 -1.0140 0.5261 -0.4916 0.5917 -0.9363 0.2597 2.1945 2.4532 1.5705 1.2461 -0.1113 -1.4806 0.2495 -3.1062 0.8855 -0.7619 -0.6737 -0.3691 0.2044 -0.1467 -1.0141 1.3384 0.5026 1.9423 -0.1872 -0.5728 0.4613 0.0935 -0.0307 0.1646 -1.0952 -0.3791 -0.5155 1.5950 -0.1811 -0.9711 -0.9829 -2.1187 -0.5776 0.5646 -0.7155 -0.5342 1.3514 -0.6137 -0.0676 -1.1986 -0.4029 1.4008 -0.9325 0.1013 -1.0538 0.1424 -0.5567 1.8736 -0.6668 0.5796 -0.2667 -0.7418 -0.0665 1.1766 -0.2692 -0.5579 0.6243 -0.6418 -2.7305 1.2115 -0.9124 0.1898 -1.4747 1.1569 0.4598 0.9510 0.2796 -0.9293 -0.7651 0.2691 0.5045 -1.1357 -0.2870 -0.0155 1.2822 -0.5280 0.5859 -0.7760 -0.2855 -0.1144 -0.0998 -1.4263 1.7544 -0.2918 0.0290 1.3458 0.4413 -0.6131 1.2863 -0.4713 0.3026 -0.8612 -0.2126 -0.3228 -1.0722 0.0189 -0.7397 -1.5870 -3.2785 -1.2493 0.4041 -0.0099 -0.0048 -0.9304 -0.3210 -1.3310 -1.1446 -1.3755 -0.1374 1.3258 1.3079 1.0616 0.8089 -2.2202 -0.9122 -0.5324 1.1177 0.9332 -1.2876 -0.3008 -0.9923 -0.7403 -1.1577 -1.1946 -0.5231 -0.2930 -1.8203 -0.1562 0.5192 0.0442 -0.9872 -1.9359 -1.4029 -0.1258 -2.0115 0.1992 -0.8695 -3.0007 0.4145 0.2961 -1.6718 -1.5211 -1.7908 -0.6900 -0.1756 -1.2819 0.4661 -0.6419 -1.3592 -0.9841 -0.0110 -0.1883 2.3144 -0.9064 4.4548 -0.0537 0.2955 -0.9894 -1.1118 0.6141 0.2487 -0.5104 -1.3718 -0.2070 -0.7261 0.4659 -0.4999 -0.5250 -0.0995 0.1389 -0.4230 -0.4662 lignoceroylcarnitine (C24)* -0.9611 -0.3890 -0.7831 -0.6207 0.7427 0.1937 1.1660 -1.4159 -0.4627 0.1480 0.7275 0.0540 1.2519 -0.7128 -0.7686 -0.3712 -1.2483 -0.2232 0.7349 0.7285 0.5082 -0.4070 1.8683 -1.3563 -0.8208 -0.0249 2.9660 0.6050 -1.3485 0.8175 0.1056 0.6380 0.7469 0.8490 -0.2604 1.0393 0.2741 1.6436 -1.0620 -0.5010 -0.8197 1.1908 1.0766 -0.9857 0.9370 -0.1499 -1.0955 0.7102 -0.2616 4.2095 -0.8278 0.6236 -1.1356 -0.2492 1.2854 1.2003 2.6188 -0.3609 -0.8914 0.4593 -0.1737 -0.1506 0.1560 -0.2753 0.3913 -1.0761 -0.2016 -0.0220 0.9748 0.8174 -0.5793 0.8582 0.9009 -0.1579 -2.5212 0.0621 0.4999 -0.3375 -0.2018 0.1601 -0.8798 -0.5921 -0.5255 0.8071 -0.3030 -0.3201 0.3060 -0.3959 -0.9008 2.2802 0.4230 1.5623 -0.9008 -1.3607 0.7669 -0.5879 -0.2131 0.6035 0.5415 0.1122 0.6501 -1.6207 -0.4257 -0.2088 0.6822 -0.8336 1.0674 1.6572 -0.2052 -1.1127 -0.0896 -1.3623 0.7282 1.2763 0.3229 -1.2164 -0.6981 -0.0184 0.8758 0.5466 1.1063 0.3298 -0.3290 -0.0462 -0.7448 0.5371 0.3239 1.1426 -0.5348 0.5562 0.5007 0.0430 -0.4101 1.6812 -0.2542 -0.8910 2.5578 -0.1481 -0.6514 1.2506 -0.0791 0.5372 0.1588 -0.5963 0.9982 -0.1303 -0.3330 -0.3813 1.3541 1.3343 0.8806 2.3022 0.3821 -0.3053 -0.9450 0.4604 -0.7117 0.6691 -0.5645 0.4413 -0.0309 -0.1182 0.0485 1.1751 0.9135 2.5445 -0.5331 -0.1795 -1.2118 -0.3815 0.9839 -0.0084 -0.2284 -1.0090 1.9277 -0.3750 -0.7574 0.1209 0.7251 0.4717 -0.9517 1.0341 0.1271 -2.3786 1.3505 0.6111 0.2935 1.2643 0.2285 -1.9492 -1.5463 -0.1273 2.0571 1.5609 -0.6096 -0.7381 0.4346 0.6682 -0.3146 0.1474 -0.3129 -0.0213 -0.6779 1.3242 0.6459 1.3620 1.8814 0.3644 0.0079 -1.4648 0.1462 -0.1426 3.7022 0.3792 0.7690 0.6207 -0.1282 -0.6525 -0.3047 -1.1040 0.2734 -0.7546 0.1433 -0.4241 0.1251 0.1142 -0.5939 -0.4685 -0.9229 -1.9300 1.3457 1.1409 2.7651 -3.7494 -0.4965 -0.4418 -1.0320 -0.1040 0.0665 -0.0252 0.5810 0.1187 0.9821 1.7385 -1.7285 -0.2256 -0.3142 -0.3658 0.2229 -0.0564 -0.5190 -0.6988 0.9438 0.0236 -0.1442 1.6580 -0.1952 -2.4208 -0.0998 1.2835 -0.8485 -1.1024 -1.7950 0.1308 0.9378 0.7405 -1.1827 -0.6774 0.8261 -0.2767 -0.4447 0.2997 1.2276 0.4521 -0.0812 -0.0632 -0.6779 0.5922 -0.7321 0.2819 -0.2722 -0.9749 -0.1820 0.4444 0.0365 -0.6078 -2.2275 -1.2717 -0.3926 -1.8798 0.1199 -0.4069 -0.2881 -2.6681 -1.6130 1.0815 1.8556 -1.4189 -0.1869 -0.4273 -1.5245 0.0797 0.0540 1.2576 0.5488 1.2484 -0.6015 0.7950 -0.0722 0.9320 0.2756 1.2276 0.2569 -0.7049 1.0681 -1.5650 0.2546 -0.6672 0.3831 -1.6477 0.3861 0.4294 0.0820 1.1423 -0.4399 -0.0645 0.5794 -0.1751 -0.9320 -0.7627 0.1300 0.8051 -1.3134 -1.2180 -0.3507 0.1938 -1.5412 -2.1493 -2.9039 -0.0645 -0.6917 -1.3978 -0.9826 -0.6319 1.4269 -1.0421 -1.2529 0.9558 -0.8279 1.2694 -0.0677 0.1187 -0.5665 0.1263 0.3815 0.5992 0.3186 -1.0865 0.2576 -0.9141 -0.2783 -0.3628 0.0900 -2.1182 0.6675 -0.3022 0.0996 2.2538 1.2087 -0.7415 1.1253 -0.9600 0.1334 0.2322 -0.8184 1.1179 -0.2479 -0.1321 -0.5599 0.2447 -0.0364 0.9595 -1.7130 -1.0171 1.6909 -0.8422 -0.1294 -0.1201 -0.0861 -0.0436 -1.1389 -0.8506 1.1743 0.6932 -1.0057 -0.0455 -0.1810 0.7068 1.0361 -1.0287 0.1465 -0.5981 -0.8555 -0.5814 0.7081 -0.4455 -0.9817 0.4144 -1.2964 -1.0431 lignoceroyl sphingomyelin (d18:1/24:0) -1.1502 -0.7522 -0.1574 0.3617 1.2784 0.4913 -0.4582 -0.6313 0.0983 -0.1745 -1.5275 -0.4699 -0.1019 -2.4106 -0.4003 0.2275 -0.3920 -0.5645 1.6135 0.8425 1.2237 2.7018 1.1319 -0.3617 0.6248 -0.2659 2.1853 0.6571 0.5880 0.1575 1.9805 0.7008 -0.4083 0.5776 0.2285 0.3315 0.7383 1.1884 2.2493 -0.0243 -0.0065 1.9504 1.0901 -0.5790 0.0596 0.5313 1.5972 0.8542 -0.1257 -1.7377 0.4736 1.7459 0.0266 -2.9901 0.6488 1.3169 1.5138 0.9963 0.1034 1.3731 0.1615 0.8063 -0.4350 0.4320 0.9048 -0.2897 1.8527 0.2746 0.5504 0.9869 -0.6898 0.8694 0.3415 -0.0464 0.3860 -0.1908 2.0502 -0.4327 -0.4507 0.5954 1.7806 -1.5516 -0.4125 2.0071 -0.8521 0.0955 -0.3975 -0.8703 -1.3685 1.1964 0.5274 0.4567 -0.3242 0.1573 -0.0871 -1.4251 1.2518 0.6137 1.0435 0.6214 1.2944 0.2035 1.5571 -0.1330 0.6500 -0.1582 -0.2198 -1.1689 -0.6912 1.1688 -0.5353 -0.9045 0.0638 -0.9382 -1.1236 0.5810 0.3857 -0.5366 -1.8670 -0.0866 -0.7250 0.0224 -0.4435 -2.2145 0.2621 -0.5769 1.2011 0.2055 0.0100 -0.6290 -0.6671 -0.6501 -0.2879 0.4144 0.6220 -1.5939 0.2661 -0.7774 0.0458 0.5079 -0.5926 0.2621 0.1788 -1.0597 -0.4344 0.1860 0.7481 -0.5887 0.8863 1.6258 0.6615 1.2313 0.8453 1.4546 0.5618 1.5488 0.0856 1.2496 -1.2594 -0.3204 0.4154 -0.1231 0.3551 1.2599 -0.4942 0.4093 1.0978 -0.4030 -1.5112 -0.3096 1.0895 -0.1261 -2.0594 0.1985 -0.0264 -0.3189 0.9045 0.7359 0.2380 1.2701 -0.9324 -0.5085 0.5421 -1.0264 1.5963 -0.2929 -0.0221 1.4497 0.4193 0.8883 -1.6121 -1.6026 0.5889 0.1042 -1.9489 -0.5613 -0.6302 1.0027 -0.0663 0.7205 1.0512 1.1119 0.4740 1.1187 0.0917 0.3978 0.8092 -0.4425 -0.5381 0.4421 1.4898 0.2808 0.9695 0.9047 0.4981 0.2817 -0.9811 -0.2863 -0.9614 -2.0161 -1.2221 -1.0049 -0.5557 -0.5512 0.5156 -2.0278 0.3704 1.2173 1.0064 -0.7296 0.6875 0.7968 2.3836 -0.3585 -0.6878 -0.4771 -0.4039 -1.3187 1.4930 -1.2254 -0.6802 0.1501 0.3579 -0.9077 -0.0499 -0.6163 -1.2300 -1.2201 -0.1596 -0.4305 -1.3239 1.2428 0.8094 0.0795 -0.1164 0.6980 -0.4588 -1.4077 0.4648 -0.3396 0.2436 1.1491 -0.3342 -1.5643 0.2710 -0.6092 1.3430 0.5901 0.0971 0.6520 -1.1445 -0.9684 -0.4444 0.0317 -0.7329 0.1547 0.7110 0.7168 -0.8170 -0.0708 -0.2801 -1.2355 -0.5294 -0.3027 1.2719 2.2774 -0.7993 0.4816 -2.0594 -0.8015 -0.4591 -0.2413 -1.6379 -1.7199 -0.0089 0.2579 0.1570 -1.5630 -1.9361 1.2368 0.5963 0.7848 0.2945 0.8041 0.1623 -0.8956 -1.1668 -0.3342 -1.3402 0.6602 -0.1226 1.8839 -1.1112 -0.3903 0.9134 -0.9623 0.4872 -0.3883 -0.4237 -0.5115 0.7139 0.9021 2.8582 -0.1338 0.2553 0.1167 -2.0639 -1.1232 -0.2380 -0.9139 1.4923 -0.0886 -0.0824 -0.5757 -0.3498 1.3244 0.2553 -1.8514 0.0112 -0.7843 -2.1428 0.3353 -1.9335 -0.4644 -1.2701 -2.3619 -1.3736 2.1049 0.6027 1.2653 -0.1851 0.9812 -0.7939 -0.5221 -1.7764 -0.1239 0.2334 -0.9258 -1.5046 -1.1438 -2.4568 1.1716 0.4938 0.6089 -0.6231 0.3172 0.0490 1.4790 0.6881 0.2833 -0.5986 -0.7409 0.5050 -0.2248 0.2098 -1.8854 -1.0708 1.3549 0.1106 0.4464 -1.2491 0.5170 -0.4622 -1.3349 0.0839 -0.6553 0.4000 0.5926 -0.9776 0.5883 0.1657 0.1224 0.0896 0.8895 -0.1561 -0.7392 -1.5668 -0.0757 1.2799 1.3318 1.0919 0.3980 1.4779 -0.6718 0.0267 -1.4446 -1.5591 -2.0223 -2.8057 -1.3892 linoleate (18:2n6) -0.3428 0.7561 0.9639 1.7100 0.9697 1.3687 -0.4977 0.9504 1.3169 0.1917 1.1906 0.3345 1.6670 -1.5227 -1.9924 -2.1180 0.8271 1.2983 -1.1606 -0.6374 -0.8659 0.4933 -0.8907 -1.2221 -0.0440 -1.4682 0.3743 0.0990 -1.8056 -0.3219 -1.0100 -1.3247 -1.8300 2.5026 1.6728 0.6707 -0.9972 -1.2343 -0.5242 0.3675 -2.1369 -1.8381 -1.7024 1.0711 0.7180 0.3437 -0.6433 -1.2233 -1.2000 -0.1095 -1.0076 0.1647 -1.7069 1.5722 -1.2529 0.4737 -0.9068 1.7115 -0.7896 1.7894 -0.5924 0.6650 -0.8629 -0.7205 -0.7727 0.3167 0.6170 0.7942 0.3275 -1.3504 0.7742 -0.5498 -0.5535 -0.3838 1.2195 0.7501 -1.5036 -1.7936 -0.1948 -1.5021 -0.0172 0.0146 -0.6354 1.3707 -0.1921 -0.9832 -1.1497 1.0317 0.1261 -1.0022 0.8297 -0.4479 -0.4084 -1.3148 -0.9008 -1.2366 0.5073 -0.1590 -1.0384 -0.1919 -1.4329 0.9503 -1.1031 0.0860 -1.3985 -1.7344 0.9088 0.7314 1.9891 -1.0871 0.2208 -0.0959 -1.3406 1.7154 1.3326 -0.9677 -0.9237 -0.4692 0.8870 0.7970 -0.4115 1.2420 -1.4254 2.6902 0.1984 -0.7839 0.7235 -2.2875 0.5265 0.8284 0.4314 0.3073 -0.6148 -0.7642 0.1250 0.2143 0.3878 -1.0378 -0.3632 -1.1168 0.2740 -1.2099 -0.5004 -0.3274 0.5667 -0.4720 1.8825 -0.1171 0.1734 -0.9784 -0.0591 0.4604 0.2669 -0.2589 0.2479 -0.5456 1.4280 -0.4272 -0.2697 0.6241 -1.3247 0.6953 0.0862 1.1046 0.8221 1.0742 -0.6516 -0.8376 -0.4452 -0.0419 1.4237 -0.2098 0.0172 -1.9870 0.5196 0.9908 1.1029 -2.3970 -0.3633 -1.3159 -0.1933 -0.7776 -0.0835 -1.3070 -1.4550 0.1429 -1.6125 0.2363 -1.0506 -1.9305 0.8623 1.2433 -0.2606 -0.5332 -1.1386 1.3901 0.2705 -0.6851 1.2751 0.8595 -0.8039 -0.7775 -0.8696 -2.0779 -0.2402 1.6911 0.6919 -2.2744 -0.0016 -1.2902 -0.7949 -0.2645 0.2475 -0.8655 1.2509 -1.0398 1.0079 0.5481 1.1314 0.6382 1.5715 1.3595 -0.4438 -0.3077 -0.6712 0.7511 0.3290 0.3275 -1.2798 -0.3359 -0.5042 -0.8593 0.3143 0.2086 0.7750 -0.6339 -0.7325 1.4277 -0.4533 -0.2669 1.5920 -0.1778 0.5581 -1.3829 0.5438 0.6233 -0.1879 -1.3325 0.4333 -0.0733 1.5075 0.6577 -1.9088 1.1688 0.8409 -1.8030 -0.1015 -0.1431 1.3390 0.1272 -0.1280 -0.3908 0.3169 0.7743 1.3839 0.8882 0.1423 0.2305 0.0545 0.5253 -0.3054 -1.8472 0.1633 0.2062 0.7378 -1.2264 2.5684 -1.2029 0.1509 0.6443 -0.6851 -0.1300 0.4224 -0.4565 1.8157 -1.3213 0.4149 0.1465 0.4463 0.2994 0.2131 0.2441 -1.7633 -0.2791 -0.1996 -0.4013 0.3812 -0.3494 0.4451 0.8364 -1.4415 -1.5901 0.1427 0.1858 -1.1022 -1.1915 0.8038 0.0109 1.2118 0.1552 1.3578 0.3374 0.9436 -0.6923 1.6800 -0.6007 -0.9608 -1.4332 -1.4938 -0.9599 -0.4311 0.8311 1.5410 0.8749 -0.0984 1.2372 0.1299 0.8117 0.1526 -0.2675 -1.1633 0.1944 0.7992 0.5957 -0.3870 -0.0973 -0.1867 0.8896 -0.5949 -0.3972 1.2479 0.6970 -0.5748 0.2087 1.5804 -1.2161 0.6906 -1.0455 1.9094 -0.7419 1.1928 0.4554 0.4272 1.2073 0.7896 -0.4486 1.5716 0.6389 1.7875 -0.1294 0.3731 -0.4002 -0.2274 1.1160 1.5549 -0.8428 0.1434 -0.1655 0.8431 -0.8419 -0.0440 0.0805 1.1757 0.9407 0.0202 1.3137 0.9600 -0.6716 -1.2454 0.3667 1.4392 -1.9929 -0.7443 1.7147 1.1392 0.5421 0.1078 0.9001 0.4859 1.7579 0.7260 -0.7444 1.6494 -0.6849 -0.4205 1.6055 -0.3105 -0.1857 -0.7569 -1.2127 0.3724 0.4191 -0.2806 0.9238 0.5012 1.5806 2.1976 -0.6931 0.5594 0.0446 linolenate (18:3n3 or 3n6) -0.2655 -0.1192 1.0225 1.8867 0.8481 1.2636 0.0054 1.4505 1.5277 0.0177 1.7915 0.4257 1.4189 -1.0961 -1.2484 -1.9521 0.7096 0.9905 -0.9333 0.0435 -0.0851 0.1995 -0.8392 -1.6551 0.7085 -1.0675 0.3669 0.1811 -1.6911 0.1772 -0.8108 -1.1858 -0.7787 0.9365 2.4868 0.8283 -0.4606 -1.6912 -0.5616 0.2699 -1.8194 -1.0586 -1.2858 1.0485 1.0952 0.0863 -0.8112 -1.2090 -1.0472 -0.1226 -1.1440 0.2445 -0.7979 1.5160 -1.4373 0.5482 -1.3609 1.9158 -0.6270 1.4154 -0.3867 0.7497 -1.1354 -0.7255 -1.1477 0.3312 0.6442 0.2154 0.5671 -1.7716 0.6679 -0.4643 0.0779 0.3373 0.5784 0.7941 -1.7557 -1.4639 -1.5147 -1.2297 -0.1355 0.2137 -0.8325 1.5975 0.3353 -0.7256 -0.7057 0.5924 -0.3052 -0.9212 1.0597 -0.9683 -0.6180 -1.2035 -0.5629 -1.0874 1.2789 -0.0897 -1.2661 0.4926 -0.8916 1.2491 -1.2588 -0.0127 -1.4130 -1.2188 0.4560 0.8693 1.2710 -1.3318 -0.7582 -0.3861 -0.1045 1.2785 0.4935 -0.8183 -0.5031 -0.4892 1.1032 0.7618 -0.8109 1.4048 -1.7067 3.9402 0.3753 0.3495 0.6342 -1.1819 -0.0395 -0.1146 0.7991 -0.1695 -0.1926 -1.2991 0.3535 1.0260 0.2340 -0.2565 -0.7146 -1.4005 0.8417 -2.1463 -0.4925 -0.7980 0.5900 -0.2905 1.7155 -0.3518 0.2175 -0.7069 0.2367 0.5624 -0.2337 -0.8498 0.4334 -0.3244 1.2927 -0.1242 -0.3685 0.8210 -1.4061 -0.1861 0.3834 1.3573 -0.0266 1.4223 -0.5378 -0.6670 0.1470 -0.2528 1.2183 -0.0167 0.3450 -1.9319 0.4447 0.6018 0.8222 -1.7301 -0.2040 -1.8438 -0.5029 -0.7913 -0.6093 -1.3115 -1.6881 0.0826 -1.7019 0.1140 -0.6339 -1.3217 0.8794 1.4380 -1.3514 -0.5771 -0.8612 1.0726 -0.2071 0.0500 1.5239 0.6632 -0.3912 -1.0847 -0.3633 -1.8297 0.1089 1.8939 1.1992 -2.2880 -0.0530 -1.4227 -1.3790 -0.7868 -1.4216 -0.6443 1.7017 -1.1695 1.2040 1.4681 0.8266 0.7954 2.4373 0.6342 0.0133 -0.6253 -0.8772 0.7367 1.6654 0.6007 -1.5485 0.2070 -0.7745 -0.3240 0.1064 0.0364 1.0232 -0.1062 -0.5062 0.9883 -0.6806 -1.0195 1.2758 0.5702 0.2367 -1.1468 0.1086 0.8893 -0.0412 -1.6758 -0.5130 -0.6685 1.4153 1.3941 -1.9123 0.4827 0.1718 -1.1873 -0.4938 0.2002 1.2052 -0.8998 -0.3903 -0.3459 0.6673 0.4725 0.7149 1.2152 0.2721 -0.5235 0.4097 0.1796 -0.5720 -1.9781 -0.3346 -0.2092 0.1647 -0.7528 2.5048 -0.4053 0.5841 -0.3895 -0.1984 0.1584 -0.1815 -0.8751 1.8506 -0.9416 0.6439 0.3817 0.7562 0.7306 0.0821 -0.1676 -1.4671 -0.1901 0.3795 -0.2979 0.3650 -0.2133 1.1057 1.2572 -0.9811 -1.9539 -0.1115 0.8504 -1.0995 -0.3922 0.0612 0.1541 0.9069 0.0416 0.9837 0.0445 0.9282 -0.4669 1.6844 0.3179 0.1145 -0.9919 -1.5176 -1.0838 -0.6875 0.3794 1.4159 0.1188 -0.2384 1.6433 0.0964 0.2705 0.2154 -0.3219 -1.0378 -0.8854 1.7671 0.6946 -0.4674 -0.4220 -0.1836 1.2324 -0.8193 -0.0207 1.1319 0.8093 0.2424 0.4548 1.7132 -0.6374 0.4105 -1.5824 1.3476 -0.9406 0.7091 0.6191 0.0951 0.8798 0.2266 -0.6558 1.7028 0.0134 1.3957 0.1875 -0.0935 -0.7382 -0.2842 1.2923 0.7528 -0.9702 -0.0983 -1.3086 1.4879 -0.6207 -0.1547 -0.2542 0.8987 1.5215 -0.6194 1.9546 0.8043 -0.6468 -1.6129 0.3817 1.1722 -2.1212 -0.8374 1.2899 1.0553 0.3609 0.3060 1.0947 0.6451 1.6062 0.7660 -1.6695 1.9041 -0.7478 -0.1562 1.6076 0.2225 -0.2239 -0.9552 -1.7517 -0.2997 0.0370 0.0774 1.1612 0.4116 1.6218 1.7065 -0.5776 0.1035 0.3756 linolenoylcarnitine (C18:3)* 1.2042 -2.0246 1.3100 1.1414 0.4637 1.4842 0.2480 1.7826 1.9365 1.5362 2.2565 0.1203 0.8548 -0.8695 0.9662 -1.6369 1.3664 0.2392 0.9571 -1.3153 0.4826 -2.0358 0.7405 -1.5079 -1.5178 -0.2751 0.9855 0.8490 -1.3469 0.9386 -0.5973 -0.0676 -1.0896 0.1735 0.6940 1.7954 1.1804 -0.3513 0.3777 0.8282 -1.2561 0.3342 -1.5585 0.4914 0.8004 -1.8147 0.1400 -1.5005 -1.5287 0.7534 -1.5175 0.2818 0.6323 1.7308 -1.2038 1.0059 0.1484 0.7968 0.4261 1.1594 0.2910 1.2730 -1.7304 1.0999 -1.4967 0.5654 0.5283 -1.8709 0.4167 0.3395 0.1036 0.6366 1.5371 0.5129 0.7911 0.3698 -0.6562 -0.5563 -0.3547 -0.3665 -0.4017 0.8522 -1.5540 0.7163 0.8353 0.5566 0.2181 0.6600 0.6887 0.1090 0.6039 0.7967 -1.4913 -1.1467 1.2663 0.2446 1.3699 -1.5120 -1.4575 0.4272 1.1596 1.3170 0.4282 0.8267 -1.0502 0.1921 2.0850 -0.0009 0.5413 0.3028 0.2885 0.0074 0.5101 0.8406 1.1613 0.1406 -0.2343 1.0699 2.2503 0.3765 0.9706 1.0365 -0.6544 -0.0228 0.4172 1.2908 0.5923 -0.0624 0.2760 -1.8223 0.1964 0.4489 0.3167 -0.0469 0.5412 0.5117 -1.5124 0.9298 -0.7673 -0.1890 2.2337 -1.6278 0.0888 0.2009 1.3988 0.2119 0.3447 0.8906 0.8133 -1.3699 0.7920 0.6593 -1.4217 -0.6429 -0.1949 0.0799 1.3305 0.5366 -0.2634 0.6978 -1.5073 -1.8215 -1.3673 -1.5698 -1.5020 0.4464 0.1978 0.3883 -0.1277 -1.5382 0.9675 0.6560 0.4076 -1.3383 0.2185 1.3564 -1.3084 -1.3554 -1.4768 -1.2769 0.4094 -0.1037 -1.6269 0.0020 -1.3417 1.2358 0.0454 -1.4892 0.5265 -1.0066 0.2389 2.8874 0.2270 0.4636 -1.3475 0.1571 -0.0203 -0.1930 0.0231 0.7108 0.8832 0.0588 1.1510 -1.4772 0.1728 1.7089 0.5860 -0.2222 0.0713 0.2134 0.1150 -1.5595 -1.8385 0.2067 0.1843 0.5297 1.8171 1.7259 0.7090 -0.2277 1.4155 0.0022 -0.2769 -0.0707 -0.7467 0.2686 1.3516 0.7341 -1.1902 0.1506 -0.0565 0.1671 -1.5075 -0.1528 0.3795 -0.3537 -0.2510 0.4385 -1.7574 -1.4486 0.3267 -1.8677 1.4731 0.2272 -0.2855 1.4632 -0.1935 -1.8234 0.8217 0.0536 0.6671 -0.0193 -1.7712 0.5921 -1.6750 0.4502 -0.2545 -1.6617 0.3724 -1.8022 0.2193 0.3221 -0.2169 0.3937 -1.7020 0.8018 0.5835 -0.6535 0.7963 -1.7260 -0.1067 0.2683 0.0644 -1.0410 0.1436 -1.6606 0.6236 -0.6138 -0.0779 -1.3019 -0.2957 0.2459 0.8858 -1.7592 0.7723 -0.6528 0.0988 0.2701 1.0382 -0.6432 0.0822 -0.4990 -0.5531 -0.8809 0.2129 -0.6546 1.0285 -2.0427 -0.4268 1.2107 0.4552 -1.7375 0.5877 -1.7803 -1.5906 0.1241 1.4437 1.3289 0.1741 0.9671 0.6626 -0.6373 0.4470 -0.5645 0.6015 0.4476 -1.5774 -0.7309 -0.2826 -0.7349 -1.5770 1.0042 0.0837 -0.4569 0.4156 0.8660 0.9403 -0.3167 0.1357 -1.7876 0.5585 -1.4918 0.4021 0.3289 0.0825 -0.2695 0.9880 0.5514 0.7968 0.4452 0.0702 -0.2785 -0.1275 0.0567 -0.3237 0.2383 -1.4237 -0.5618 -0.6279 -1.8374 0.4367 0.6053 0.5956 -0.2388 0.7576 0.1210 0.9455 -1.7296 -0.0732 -0.4125 -1.7669 -0.8108 0.3804 -0.3370 -0.1880 0.3370 -0.5183 -1.9107 0.3658 -0.4245 1.2629 -1.7319 -0.0527 1.7585 -0.5205 1.4083 0.1830 1.6316 0.2535 1.1061 0.1274 -2.0160 -0.5374 0.2832 0.0335 -2.0924 -2.0662 0.3489 -0.3449 0.4506 0.0214 0.6417 1.0282 0.1056 -1.8479 -1.8612 0.0426 0.8243 0.4057 -1.7250 0.4599 0.9966 0.4884 0.5682 -0.0867 1.3537 0.6294 -1.6962 -1.6578 0.1698 linoleoyl-arachidonoyl-glycerol (18:2/20:4) [1]* -1.5241 0.4051 1.2043 -0.1051 -0.4068 0.0512 -1.0734 0.8379 -0.1868 0.5674 0.4273 0.2369 -0.1633 0.3723 -1.2355 -1.2445 -1.2740 0.1264 0.6286 -0.0202 0.2978 0.4839 1.0015 -1.3548 0.1841 -1.8386 -1.9139 0.1720 0.3977 -1.4850 -1.9000 0.0268 -0.6998 0.2759 -0.0475 0.6207 1.0902 -0.3975 1.6112 0.3130 0.4567 0.9503 -2.0356 0.4632 1.2833 -0.8220 0.6335 -0.1272 -0.9278 -1.7854 0.9187 0.6997 1.2145 0.8761 -2.4901 -0.5186 -0.3808 0.2250 1.9506 0.3114 1.1439 1.2495 -1.0511 0.5001 1.2220 -0.0891 0.4033 0.4432 1.1795 -0.2460 0.0286 1.3954 -0.6094 0.0224 0.1814 0.6131 0.0587 -1.0332 0.8872 -0.1526 -0.6361 0.2750 -0.9430 -0.3809 0.8830 -1.3468 -1.4023 -0.1459 -0.5054 0.9406 -0.1986 -0.6705 1.6583 -0.4953 -0.9723 -0.2917 0.6365 0.5793 1.1467 -0.7386 -0.2156 -0.6415 0.2665 -0.4159 -1.9757 0.2277 0.5191 0.2932 1.1508 1.8340 -0.4545 -0.2931 -0.1909 -0.3951 0.6950 0.6154 0.4370 0.6741 0.7451 -1.0164 -0.5084 2.4826 -1.6699 3.0119 0.1815 -1.9442 -1.5452 -2.2566 -0.4906 0.0614 -0.3262 1.1343 1.2166 -0.2956 -0.1329 -0.1127 1.0245 0.0665 -1.2943 -0.7107 -0.4983 -3.0292 -0.4310 -0.5005 1.4792 -1.9281 1.5318 -0.7308 -0.3163 -0.5341 0.8098 1.2472 1.0526 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0.5606 0.9676 -1.3898 1.3220 0.6809 -1.4434 -1.7125 0.2362 -1.0635 -0.1271 -0.6630 1.2852 0.3624 -0.6058 -0.7796 -0.6350 -1.1963 -0.8205 1.1734 0.0927 0.1888 -0.0789 0.6896 -0.2119 -0.1729 0.4478 0.2051 1.5278 -1.2388 -0.0994 -0.8656 -0.8411 -0.0737 0.3491 0.6328 0.8853 0.1247 0.2325 -1.1818 -1.0922 1.8800 0.6699 -0.0766 1.3026 -0.2243 -0.0799 -0.4505 -0.1116 0.4424 0.5579 1.2999 0.6680 0.0350 0.6043 -2.0600 -1.1332 0.4205 1.0065 -0.0470 1.4667 -0.0465 0.3705 0.8201 0.7663 3.1828 0.4667 0.5309 0.2559 -1.3188 -0.6248 0.1694 3.0474 -1.5353 0.2169 1.5095 -1.3786 -0.3233 1.2183 0.6497 1.5681 -1.2838 -1.1150 -0.6780 -1.7053 -0.2757 0.9338 -0.8145 -0.8509 1.4274 -0.6474 -0.7902 -1.5826 0.1674 -0.1326 -0.4065 -0.5984 -2.9155 0.6827 1.2464 -1.2185 0.0478 -1.3030 0.2222 1.9186 0.0347 1.4124 0.3556 -1.7573 -0.2739 -2.5492 0.3569 0.1788 0.2360 1.1388 1.8416 -0.0073 -0.1565 -0.3771 -0.7524 -0.2488 -1.0174 0.2598 -0.4328 linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]* -1.7255 0.1990 1.1032 0.0236 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1.0389 -0.0051 -1.3731 0.5879 1.0055 -1.2005 1.3007 0.0803 4.2149 0.1446 -1.1697 0.4729 -1.2449 0.5943 -0.7913 1.4100 -0.7716 -0.2419 1.3726 2.4167 -0.6995 -0.4779 -0.2149 1.7676 -0.5018 1.4959 -0.9297 -0.4682 -0.3949 0.3106 0.0323 -1.4073 1.4491 -0.6538 0.1343 -1.2871 -0.3399 -0.2666 -0.6171 -0.6688 -0.2647 0.7373 -0.6905 -0.2534 2.6432 1.6209 -0.3424 malonate 0.0023 0.5186 -0.7677 -0.5002 0.2515 -0.5879 -0.1929 -0.2758 0.0956 -0.4344 -1.2839 0.0356 -0.1224 0.7779 0.0557 0.5369 0.3229 0.9996 0.5852 -0.5147 0.8338 -0.0224 0.2266 0.1045 0.3159 0.0899 0.2891 0.3438 0.3686 -3.4176 -0.1257 -0.5502 1.3841 0.2800 -0.6443 -0.4141 0.5950 -0.3719 0.5837 -0.7374 0.4157 0.4371 -0.1248 -0.1025 0.1117 0.0649 -0.6075 -0.0199 0.0763 -0.4150 -0.7760 0.4278 -0.0385 -0.4613 0.5635 0.1384 0.5633 0.2431 0.7647 -0.0665 0.4172 -0.2331 -0.3546 0.5084 -1.3196 0.4764 0.5604 0.0940 0.9538 -0.5310 -0.2373 0.4253 0.2769 -0.0475 0.8358 0.2608 0.2955 -0.8364 0.1129 0.5744 -0.6419 -0.0027 0.7725 -0.2870 -0.4744 -1.2247 0.4604 -0.2783 0.3831 0.6049 0.1535 0.2637 1.2669 0.4128 0.3555 0.2693 -0.0196 -0.0628 0.3056 1.1029 0.1716 0.0890 -0.3427 0.5819 -0.1676 -0.1526 -0.9053 0.2221 0.5863 0.7968 1.0043 -0.2160 0.8793 0.4576 -0.4081 0.4489 -0.3605 -0.3217 -0.3971 -0.3577 -7.3852 -0.3080 -0.0489 -1.3977 0.1777 0.1542 0.5023 0.6111 -1.0377 -0.3737 -0.5641 -0.2676 -0.5706 0.0948 -0.4082 0.1255 0.3131 0.4634 0.9101 -0.0206 0.6015 -0.1902 0.3408 0.2824 -0.3690 -0.2574 0.3448 0.6901 -0.1683 -1.2427 0.0487 -0.1729 0.3390 0.2780 0.2860 0.4056 0.0132 0.3323 0.4732 0.4417 0.2785 0.3091 -0.2430 -0.1797 0.3676 0.2804 -0.5814 0.4741 -0.6221 0.1101 0.9684 -0.4398 1.0902 -0.9946 0.0009 0.4460 -1.0006 0.0583 0.2115 0.8390 0.8970 -0.3205 0.4809 -0.7842 -0.4005 0.1233 -0.5473 0.3340 -0.5515 0.6351 -0.3462 -0.7155 0.6536 -0.8604 0.9302 0.0932 -0.0949 0.2854 0.7964 0.0004 0.1657 0.9084 -0.1558 0.0534 0.3859 -0.2341 -0.4917 0.4827 0.3771 0.7552 0.6758 1.0454 0.9211 0.7367 -0.7888 0.8669 -1.1038 -0.5524 -0.0409 0.2761 -0.1376 0.4649 0.8168 -0.8937 0.2193 -0.4409 -0.1009 -0.5062 -0.6542 -0.4979 0.4373 0.3101 0.9203 0.5006 0.4646 -0.0198 0.3303 0.1677 -0.4321 0.9622 0.9426 0.6648 -0.0236 -0.0385 0.1376 0.4832 -0.5428 -0.1238 0.1888 0.1212 0.8676 0.6271 0.9317 -0.3375 0.2348 0.3665 0.2803 0.2180 0.0360 0.2549 0.0729 0.3208 0.8194 -0.4273 0.8373 0.3081 -1.0592 0.2341 0.3180 0.4228 1.2742 -0.8032 0.2700 0.8902 -0.3820 0.2580 -0.2811 -0.1582 0.0393 -0.5000 -0.0328 -0.2753 -0.4786 1.4547 -0.5675 -0.3885 0.0854 -7.6120 0.5998 0.3046 0.2868 -0.6645 0.4913 0.9827 -0.2519 0.1014 0.6318 1.0124 -0.1488 -1.0301 -0.4020 -0.3406 -6.9820 -0.0969 -0.1966 0.9304 0.5457 0.9829 0.4749 0.1706 0.4347 -0.1887 -0.3069 -0.4651 -0.5580 0.5076 0.3312 -0.2420 0.4333 -0.0207 -1.7239 0.2322 0.1616 -0.4014 -0.1721 -0.4413 1.0119 0.1849 1.3081 -0.7596 0.6634 0.5101 0.1477 0.1489 0.7975 -0.0434 -0.7813 0.8544 -0.1326 -0.4475 0.4331 -1.1346 0.3901 -0.0051 0.4336 0.1805 0.4102 0.3833 0.5106 0.4547 -0.4194 0.2595 0.9936 0.2252 0.0971 0.2502 -6.1212 0.2202 0.1409 0.7878 0.7271 0.4220 0.3374 0.4067 -7.8070 0.9051 0.0997 0.7300 0.3488 -0.2538 0.2977 0.5015 0.4904 -0.2967 -1.3325 -1.0889 -0.0284 -0.5048 0.6223 -0.0874 0.7542 0.0609 0.8249 0.6090 -0.3310 -0.3252 -0.0021 -0.9960 -0.0578 -3.8451 0.4964 0.9101 0.3899 0.9073 0.1752 -0.8117 0.0127 0.3589 -0.1814 0.4261 0.1865 0.3002 0.0285 0.8059 0.3456 -0.1609 0.3072 0.2156 -0.6662 -0.7408 malonylcarnitine -0.5818 -0.0862 0.4575 -0.8636 -0.3375 -1.1297 -1.3075 -1.2119 0.8464 1.2819 -0.7930 0.8075 -0.9209 -1.0807 0.8475 1.6163 -1.2985 0.8114 -0.9361 0.9917 1.3336 -1.5886 -0.4940 -0.9653 -0.9558 -0.9623 -1.2590 -0.8391 -0.7536 -1.0102 -1.2813 1.1612 -0.4381 -1.3919 -1.4642 0.2436 -0.9247 -0.6412 -0.8387 1.2163 -0.6281 1.2788 0.3495 0.9006 0.8774 0.7034 1.0100 1.0155 0.8032 -0.9507 1.3147 0.2972 -0.0807 -1.1406 -0.5523 -0.3653 1.0213 0.3726 -1.0740 1.3290 1.2262 0.6776 -1.2088 -0.8539 -0.9478 0.1244 0.9769 1.1363 -1.2539 0.8180 0.7575 -1.1854 -1.0877 0.6006 1.1099 -1.2411 -0.7755 0.2061 -0.7557 1.2908 -1.0648 -0.9006 0.6309 0.3005 0.8728 -1.1790 -0.7777 -0.8986 -1.2890 1.1459 -1.5070 -0.9016 1.0113 -0.5148 1.7012 -0.8853 0.3784 -0.9299 1.3157 -1.1708 0.5272 0.6373 1.8386 1.2879 -0.8481 0.1323 -1.0883 0.2494 -1.5406 0.8494 0.6461 -1.2459 -0.7616 0.9017 -1.0129 0.7635 -0.7380 -0.9083 -1.1555 -1.3566 0.3761 -0.9277 0.9103 -1.1082 1.0147 0.6261 -1.2093 -1.0814 1.0754 -1.3413 0.5684 -0.8155 -0.5880 0.2162 0.7350 -1.2246 -0.9507 -0.5306 -1.0452 0.9705 -0.7015 -1.0977 1.4336 -1.0469 -0.8205 0.6795 0.8120 -1.0888 0.2005 -0.1447 -0.6934 1.3132 -0.8534 -1.6606 0.1557 1.6104 1.1238 1.0087 -1.1803 -0.3954 -0.9504 0.5274 -0.7750 -1.0046 -0.9056 1.0573 -1.2104 0.9173 -1.2337 -0.9977 -1.2824 -1.0363 -1.4454 0.5276 -1.2625 -0.5986 -0.7014 0.7449 1.8257 -0.6774 -0.9150 0.5590 -1.0888 -1.0653 -0.7500 -1.3584 1.2079 -0.9024 1.1749 0.6185 0.1399 -0.7557 -0.8684 1.1286 1.4087 0.0593 0.5773 0.8844 0.7540 1.1305 0.4304 1.0023 -0.8046 -0.9524 -1.0848 0.8014 0.7233 -0.0238 0.8781 0.8680 -0.9475 1.1644 0.2314 -1.1095 0.1618 -1.1024 -0.1528 0.2950 -0.1714 0.2846 0.3734 0.9507 -0.7470 0.7212 0.8328 0.0722 0.6234 0.2543 0.9225 1.4082 1.2435 1.1022 0.3801 -0.3735 1.2102 0.2922 -1.1061 1.3932 -1.2740 1.8774 -1.1087 -1.3573 -1.0744 1.1925 0.6666 -1.0382 -1.1029 -1.3338 -1.3077 0.8019 0.0779 -1.2424 0.6002 0.8742 0.8883 1.6146 0.0462 -1.1343 0.3621 -1.2942 1.2851 -0.8343 -1.3060 0.6717 0.7929 1.0622 -1.2346 0.9822 1.4094 -1.2059 0.8807 0.0427 1.0973 -1.2025 -1.1905 -1.1394 -1.1359 -1.1422 0.0572 1.9830 -1.3393 0.1400 -1.3451 0.8313 -0.1318 0.6727 0.8775 -0.3854 0.3872 0.6890 1.4843 0.7963 0.7776 0.9687 -1.0086 0.5453 1.4112 0.3591 1.2060 0.6813 1.0965 1.3698 0.1371 0.5623 1.4671 -1.4087 0.8415 1.7340 0.5922 0.5946 1.3874 0.6662 -0.0784 0.7355 -1.4510 0.5276 -1.0093 1.0114 1.7244 -1.2316 1.0409 0.6420 -1.7070 0.6657 0.6883 0.5463 1.2337 1.1974 1.1677 -1.3080 -0.9149 -0.9264 0.1739 -0.7959 -1.1238 0.6847 -1.1937 -1.1587 -1.3646 1.2283 0.6562 0.7689 0.9768 1.1118 1.1164 -0.9668 -0.8443 0.3052 0.7225 -1.3565 -0.7648 2.0243 1.4633 1.3272 1.7108 -1.4568 0.6641 0.6316 1.2631 -1.3902 0.1446 0.5817 -1.0949 0.6205 0.8735 0.7830 1.2121 -1.4604 0.2558 0.5998 1.1921 1.2880 1.5308 -0.0290 0.5474 -0.8325 -1.6663 0.8543 -1.3019 1.2557 -1.0905 1.1515 0.1905 -0.2123 -0.2631 -1.6364 0.1130 0.1887 -1.5418 -0.0788 -0.7759 -1.0457 1.5573 -0.6229 -1.3502 -1.3647 0.5486 0.3461 -1.6261 0.1259 0.5263 -1.2380 -0.9858 1.1771 0.8605 0.3911 -1.1479 1.8312 -1.1032 0.7916 maltose -0.3109 -0.2765 -3.0518 -0.1119 -1.6525 -3.0954 -0.4054 -3.1483 -2.0660 -2.6620 -2.8870 0.8210 -0.3299 0.2052 0.5377 0.6106 -3.2040 0.8357 0.9780 -0.2684 0.0309 -1.0121 0.1290 -0.0008 -0.1759 0.5304 -0.0174 -0.3406 0.8441 0.1397 1.1293 0.2499 -0.1061 -0.3741 1.9193 -0.2314 -0.2365 -0.4991 -0.0757 -0.3221 -0.3163 0.2233 1.7597 -0.7363 0.0375 -0.1406 1.4281 0.4058 1.3292 -0.9325 0.1981 1.0209 0.2958 -3.1024 -0.1404 0.7266 0.0921 -0.5752 -3.0419 -0.1551 -0.0736 -0.7276 -0.1237 -2.8936 -0.9965 0.2422 3.1165 1.0204 0.7252 0.1377 -1.5458 0.0629 0.6171 -0.4361 0.4719 0.4343 -0.0409 -1.1788 0.6700 -0.2789 0.3246 0.5183 0.0713 0.3159 0.1948 -0.3000 1.2317 0.9257 0.9282 0.8301 0.0469 -2.0038 -0.9205 0.3260 -1.0321 -0.8482 0.2333 1.0616 0.0509 0.4432 0.8634 -0.0684 0.7844 0.7326 0.0083 0.7493 -3.0642 -1.1873 1.0542 1.0407 -1.2982 1.5381 0.0690 0.3591 1.0960 0.8514 0.8468 0.8521 0.2594 0.5688 1.0566 1.3601 1.4085 -0.1061 0.1392 -0.7192 -0.6086 1.3827 -0.1024 0.0189 -0.3089 0.6877 1.1096 0.3964 -0.0616 0.6637 -0.3459 1.0411 0.1375 0.3682 0.4240 0.0919 1.1596 0.5836 0.3176 0.9211 0.0199 0.8205 0.1055 0.4320 0.9300 -1.2437 0.0022 0.1520 -0.5886 0.5202 -0.4220 0.4616 -0.1955 -0.5883 -0.2873 1.0789 1.8685 -0.6056 0.6249 -0.3572 -0.1006 1.1245 0.5549 1.9266 -0.7303 -0.1361 -0.1998 0.1132 0.8955 -0.2829 -0.0002 -0.0858 0.2480 0.4023 -0.4695 -0.0933 -0.4407 0.8658 0.5619 -0.8122 0.8574 -0.1305 1.2753 0.0815 0.2438 -2.8399 1.0911 2.3120 -0.6878 1.1089 0.5332 -0.0333 -0.0581 -1.3003 0.6148 0.3712 -0.0095 -0.2900 0.9867 1.1735 0.0783 0.2878 1.2956 0.3557 0.9152 -0.5139 1.0473 -0.0960 0.2835 0.8608 -3.2812 0.5765 0.4114 0.9064 1.3765 0.0326 -0.2734 0.6958 -1.8321 0.1924 0.1019 -1.1423 -0.1916 -0.2783 0.2317 -1.4754 0.0853 1.0036 -0.7904 -0.7865 0.3622 -0.6426 -0.4809 -0.0100 -0.9533 0.6559 0.8677 -0.5761 0.4484 0.6054 0.1572 0.5481 -0.0589 -0.3875 -0.4806 -0.3628 0.7356 0.3549 -0.1228 0.1316 -0.3817 1.5691 0.5291 -0.2964 -0.4266 0.8466 0.8997 1.0671 -0.1529 -0.9512 0.3927 0.4290 0.4542 0.3435 0.5433 0.5816 1.0714 -0.4752 0.4674 0.5406 -0.1137 -0.2726 -0.5734 0.1112 -0.8182 -0.3978 0.1641 -0.7455 -0.5325 0.7977 1.7889 1.3511 0.7516 -0.0263 0.9815 0.3506 0.4415 0.2554 -0.3289 0.5518 -0.8078 -0.8599 -0.7648 0.4721 2.0111 2.6244 1.0477 -0.1314 2.1984 0.3500 0.1568 -0.0588 -0.2640 -0.2633 0.2551 0.3415 0.5437 0.1942 -0.7165 -0.6558 -0.1714 0.5274 -0.1873 0.2126 0.1541 -2.8220 -0.1570 -0.0603 -0.4740 0.6127 0.3828 -0.1823 -3.0913 0.0502 1.1612 0.3717 -1.8822 0.3121 0.2302 -0.5193 -3.1474 -0.3866 0.7091 0.1826 -0.0746 -0.3985 0.4424 0.3914 -0.0529 -0.0006 -0.6544 -0.4483 -0.4127 0.2854 -0.9138 -0.8108 -2.5363 1.7525 -0.7564 0.4186 -0.2580 -0.2430 0.3846 0.1713 -0.2870 -0.4297 0.8961 -0.5574 -1.0139 -0.2319 0.1290 0.2069 -0.7485 -0.2294 -2.0824 -0.0720 -0.2360 1.1983 0.5870 -2.9418 -2.6245 -3.2707 -3.2228 0.7283 -0.0616 -0.4494 0.0817 -0.2232 -0.0293 -0.3860 -0.0513 0.3491 -0.6101 -0.3651 -0.9411 0.4265 -1.6448 -0.1450 0.5569 -0.2183 0.3812 0.7349 0.5599 -0.0022 -0.9409 -1.7006 0.4691 -1.6965 0.2300 1.0155 1.2079 0.3884 0.8211 0.4882 mannitol/sorbitol -1.1965 -0.6865 -0.3365 -0.6911 -0.2961 1.4480 4.9000 -0.8810 -0.6553 -0.1968 -1.7199 -0.4722 1.8906 -0.4224 0.5575 -0.5963 -1.3976 -0.8923 -0.6399 -0.2840 0.0434 -0.6429 -0.6570 -0.5670 -0.8470 -0.5590 -1.3189 -0.5897 -1.0284 -0.3811 -0.6878 -0.8550 -0.1252 0.4673 -0.2757 -0.2348 -0.6671 -0.1738 -0.8226 -0.9233 -0.4727 -0.5076 -0.6489 -0.2239 -0.5435 -0.0341 -0.7899 -0.2395 -0.3867 -1.7326 -0.1108 -0.4924 -0.9864 -1.2259 -0.6780 -0.6474 -0.8877 -0.1507 -0.4155 -0.7336 -0.9260 3.0183 0.1655 -0.8384 3.7614 -0.5358 -0.1887 -0.2560 -0.4746 -0.3530 -1.2548 -0.6999 -0.3045 -0.3284 -0.4527 1.7111 -0.8529 0.0169 -0.1908 -0.0662 -0.6156 -1.1990 -0.7781 -0.6629 -0.2268 0.0011 -0.5192 -0.2094 -0.9392 -0.5209 -0.7968 -0.2453 -0.1092 -0.0235 -0.7658 -0.7346 -0.4079 -0.3431 0.4351 0.1720 -0.5187 -0.1022 -0.6861 3.8281 -0.7179 -0.2524 -0.7659 -0.3800 -0.7875 0.2536 0.6581 0.1629 -0.3610 -0.4879 -0.5988 1.5561 1.7801 -0.8549 -0.0615 -0.2937 -0.0284 -0.5049 -0.3173 -0.9241 2.4771 -0.0171 0.1033 0.2984 -0.1268 0.4027 -0.4221 0.9524 0.0454 0.6211 0.0666 2.9813 0.9704 -0.4213 -0.4179 0.1714 -0.7744 -0.0803 0.5852 0.0956 -0.7804 -0.3314 0.1203 -0.0039 -0.5277 -0.5472 0.1063 -0.7660 -0.7642 0.6589 -0.6437 -0.6435 0.2061 -0.3274 -0.2899 -0.5835 0.0834 -0.4151 2.4059 -1.0066 -0.6030 0.7184 -0.1590 1.3308 0.2391 -0.5253 0.0291 -1.3254 0.9093 -0.4825 0.7290 0.0054 0.5295 0.0299 0.0236 -0.2523 2.4686 -0.0992 0.7584 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margaroylcarnitine (C17)* -0.0715 -1.2750 0.9849 1.3388 0.1253 0.7291 1.0775 0.4893 1.1036 1.1650 2.4298 0.5549 -0.0476 -0.0484 0.8158 0.3649 0.7337 0.9062 1.2900 0.5728 0.3417 -2.5799 1.0289 -1.8624 1.4998 0.9091 0.2192 2.0408 1.1568 0.5442 -0.0242 0.4233 0.5275 0.6304 -0.1594 2.2323 0.5412 0.3325 -1.7386 0.1864 0.5876 -1.1722 1.9312 0.4605 0.8682 0.7167 0.1038 0.6896 -0.4485 0.4463 0.2244 0.1069 -0.2956 1.6836 0.8518 0.9816 -0.0677 0.3882 0.2272 1.3441 -1.6519 -0.5333 -0.7045 -0.1764 -0.6114 -0.4653 -1.9410 0.6745 0.9108 0.4082 0.9225 0.2936 0.4705 0.1953 -1.9109 -0.5022 -0.7028 0.4342 0.8453 -0.1271 -0.0236 0.6108 -0.5788 0.7828 0.8547 0.0643 -0.7177 0.8470 -0.4723 -0.3224 0.3653 -0.3223 -0.3210 0.1937 1.3868 0.3977 0.2970 -0.7066 -1.7882 1.2254 0.6001 -0.2612 -0.9852 0.2043 1.5603 1.2320 1.7755 0.7027 -0.2463 -1.7336 -0.0224 -2.1776 0.4324 1.7071 1.2188 -0.0384 -0.3825 -0.1091 1.2685 0.7495 1.2893 0.8348 1.4531 -2.0655 -0.2425 1.5110 -0.6931 0.5210 0.7004 -0.6175 0.6939 1.0937 0.6896 0.0820 -2.0065 0.2910 -0.3613 0.3071 0.0051 -1.1816 0.5227 0.4657 1.0598 0.7491 0.3050 -0.2043 -1.8910 1.0271 -0.0387 -0.7321 0.6476 -1.6035 0.8933 0.7490 -0.7540 -1.6347 0.9676 0.9576 0.1434 -1.2175 0.8530 -0.0784 0.5476 0.7592 -0.6702 0.6395 -0.0870 -2.0770 -0.0759 0.2822 -0.7318 -0.2440 1.1852 -1.5998 -1.2836 1.7138 0.3451 -0.4314 1.2810 0.2454 -0.9727 0.7225 0.8176 -0.4584 -0.0376 1.7571 0.3042 -1.8138 -0.4607 -1.7437 0.0777 1.9215 0.1385 1.7128 0.6540 -0.0216 0.2689 0.1169 0.0125 0.4547 -0.1232 -0.5011 -0.3796 0.2117 0.6148 1.3083 0.9498 1.3296 -1.8946 -0.2583 1.1073 -0.7419 -0.7497 -2.0324 -0.8804 1.0937 1.4493 0.8991 0.7237 -0.2491 0.2951 -0.5378 0.9394 -0.5593 0.0772 0.2370 0.1008 0.1939 -2.1034 -0.3264 0.0751 -1.7127 -1.8539 -0.0714 0.2576 -0.3239 -2.0328 0.1645 -0.4246 -0.2265 0.6854 -0.1909 1.3170 1.8869 -0.3997 -0.0933 0.4292 0.7473 0.4974 0.8365 0.2876 0.1759 0.3516 0.9067 0.3924 -1.8573 -0.9627 0.4160 1.1349 -0.1273 -0.5894 -1.7201 -2.2542 0.4251 -0.2198 -1.4496 -2.1704 -1.0043 1.4071 0.0233 0.2951 0.1397 0.6827 0.7337 -0.0836 -0.2031 1.0041 -2.0690 -0.9690 -1.0307 0.6755 -2.2600 0.6946 -0.2787 0.6475 -0.9418 -2.1510 -1.9806 1.1449 -2.3772 -1.2102 0.2996 -0.3605 -0.5514 -0.6796 0.1431 0.6828 -0.1500 -0.3992 0.0148 0.4353 -0.4338 0.4094 0.2608 0.9953 -2.3683 0.9502 -1.5878 1.4131 0.6271 0.6990 -2.2221 0.0656 0.7448 0.6734 -0.3418 0.6033 -0.5686 0.0176 0.5076 0.9176 0.9473 -0.3612 -0.8754 -1.0474 0.6944 0.7664 -0.3759 -1.3116 0.9871 0.5923 -0.3572 0.2247 -0.1153 0.4345 0.4387 1.3189 -0.5842 -2.3123 -1.7207 0.0231 -0.1211 1.0411 -0.7810 -0.2945 0.4528 -1.7357 0.8917 -1.2140 -1.5345 -0.3698 -0.3124 -0.9935 0.2987 0.4415 -0.5273 0.2310 -2.1717 -0.4158 -2.3679 -1.4628 -0.4582 0.4028 -1.7884 1.0908 0.0667 -0.1522 -1.0684 0.3783 -0.1874 0.8979 -0.7300 -0.3670 0.5269 -0.4056 1.6945 -0.1080 0.0228 -2.2668 0.2608 -0.0426 -0.1047 -2.5679 0.7939 -0.6937 -0.0144 -0.3716 -0.3099 -0.2370 0.3696 -0.2803 0.3638 1.0643 -1.3579 -0.8351 0.0979 -2.5182 -0.0065 0.3230 -2.1729 0.0429 0.4084 0.0462 0.1156 0.4577 1.2486 0.7568 -1.1669 -2.0439 1.2660 mead acid (20:3n9) -0.7102 0.7809 0.9113 1.4489 1.2433 1.6475 -0.6777 0.4636 -1.0374 0.9772 1.1333 0.8552 2.0245 0.3403 -1.1780 -0.9953 0.6359 1.4604 1.2698 1.5148 -0.7511 0.6550 -0.6218 -0.8758 -0.9321 -0.9454 0.2896 -0.8145 -0.7536 0.4581 -1.1300 1.1788 -0.5096 -1.2729 2.1568 -0.9889 -0.9206 -0.6786 0.1247 -1.1114 1.6040 -0.4986 0.6462 -1.1689 -0.7994 -0.3240 -0.9005 -0.8509 0.8228 -0.9781 -0.9188 0.8541 0.7859 -1.1219 1.1720 -1.1124 -0.9720 2.2430 0.9095 -1.1500 -0.7580 0.7664 0.4338 -0.8898 -0.8732 0.8010 0.5579 1.3843 -1.0931 -0.7658 -0.9953 -1.0474 -1.0441 0.5836 -0.9327 -1.1372 -0.7677 -0.9678 -0.7603 -0.3266 -0.9110 -0.0170 -0.9800 1.4381 -0.9353 0.1233 1.0677 -0.9016 0.6899 -0.6839 1.1627 -0.8893 0.3786 -0.5492 1.0479 -0.8952 1.1033 1.0240 0.1346 1.0342 0.2737 0.8847 -0.7359 -0.3071 1.3230 0.7093 1.2438 0.3389 1.6257 -0.8347 -1.1694 -0.6024 0.1884 1.5356 0.8450 0.8951 0.7988 -0.8949 -1.1414 1.4869 -0.8672 -0.9657 0.3612 -1.2057 0.2806 0.1639 0.8126 -0.1567 -0.1147 -1.1949 0.9463 -0.9204 0.4438 -1.0946 0.4759 0.4001 0.4336 -0.6649 1.0562 -0.5065 -0.8426 0.2228 -0.8797 -1.0193 -0.9104 0.5604 -0.9204 0.7612 -0.8920 1.1235 -0.7483 0.8207 0.8044 0.4406 0.9850 -0.7745 1.7264 1.1593 -1.0653 0.0147 -0.9058 -0.0003 -0.7811 0.9852 -0.9843 0.3700 0.5865 -1.0548 0.0390 0.1005 0.4861 -1.0073 -0.4343 1.1102 -1.2418 1.6112 -0.7280 -0.8412 0.1412 0.1577 0.5026 0.5709 0.1129 1.6043 -0.7427 0.9798 0.2298 -0.9450 -0.7877 -0.8469 -0.5793 -0.8781 -0.8580 1.1693 0.1734 0.8606 -0.9285 0.4952 -0.9584 1.4744 -1.0662 -0.7106 -0.8107 -0.7928 -0.9502 -0.6013 -1.0139 -0.2430 0.9124 -0.8521 0.3300 -0.9382 0.3654 0.1598 1.0349 -0.9748 -1.3271 0.9632 -1.2980 -1.1713 1.3004 0.7012 -0.8143 0.1335 -1.3262 -1.1964 1.2334 0.5680 -1.0735 1.1285 0.9949 -0.8690 1.0513 0.5341 -0.2885 0.6157 0.2651 -0.9769 0.9681 -0.8816 -1.0668 -1.3242 -0.0837 -0.4864 0.3553 -0.4431 -1.0586 -0.1908 0.1391 -1.1249 -1.0791 1.7722 -0.1184 1.0640 -1.0504 -0.3101 0.7960 0.6401 -0.9998 0.9862 0.7514 -0.8037 -0.3718 0.5317 -1.0923 1.6342 1.4413 -0.3755 0.5860 1.0614 -1.1575 0.1980 0.6177 0.6991 0.2520 -1.0492 2.2392 0.5275 0.8442 1.5895 -1.2408 -1.2512 0.7149 0.0711 1.9916 -0.9717 0.4067 1.0460 -1.2586 0.0064 0.7780 -1.1811 -0.4766 0.0503 -0.9802 0.7135 -1.1451 -1.3587 -1.3967 1.0053 1.6904 -1.1019 1.0845 -1.2101 0.8986 -1.2457 0.3589 0.5068 1.3352 0.4717 -0.9554 -0.2268 0.6151 1.0412 1.3767 0.3943 -1.0315 0.5791 -0.9208 0.1902 -0.3270 1.6615 -1.5717 0.4280 -1.0249 0.8630 -0.9926 0.8551 0.1010 -1.1419 1.3946 0.5634 1.4344 -0.8939 0.2402 -1.3170 0.9417 0.9006 -1.1792 -0.9384 0.1154 1.7021 -1.2437 -0.2476 -1.3185 -0.9826 -0.8343 -1.1563 -1.1295 -1.2162 0.5259 0.8223 -1.1429 0.0889 1.2150 -1.3682 -1.3468 0.3608 2.6257 0.3277 0.6034 1.3632 2.0537 0.5312 0.7622 -1.1587 1.2810 -0.3581 1.3187 1.1582 -0.8819 -1.1244 -1.0279 0.9969 -1.3974 3.2048 -1.5430 0.4532 -1.2635 0.5570 1.2302 -1.4390 0.3263 -1.3579 1.0103 -1.5301 0.7920 -1.1247 -1.4357 1.7299 1.8262 -0.2169 1.8494 0.1689 -1.2680 -1.2849 -1.3867 -1.0610 0.2479 -0.1607 0.5535 1.4016 0.7164 -1.2579 -1.3656 -1.4324 1.0230 1.7245 1.4973 1.4184 methionine 0.5344 -0.1464 0.3724 0.8605 -0.1738 0.9245 1.7034 1.1512 0.7990 0.8642 -0.5325 -1.7330 -1.3239 -0.1415 0.7175 -1.1439 -0.1275 0.3624 -0.7284 -0.3265 -0.7668 -0.8903 -0.5524 -0.2359 -0.5597 0.1048 0.4897 0.6677 0.2291 -0.2276 -5.4138 -0.3630 -0.3550 0.1851 -0.6728 0.1501 0.2783 0.8485 -0.6708 -0.3889 0.1186 -1.7464 0.9364 0.1985 -0.6943 1.4100 -0.4333 0.7544 -2.0015 -0.1148 0.2905 -0.9333 -1.6074 0.9888 -1.2510 0.5635 -0.7476 -1.4805 0.0539 -0.6094 -0.5693 0.1880 -1.5565 1.0566 0.4446 0.8980 1.7379 0.6653 -0.7138 -0.5351 0.2545 0.2793 -0.6594 -0.9729 0.9513 1.2381 -0.5599 -0.9397 0.7803 0.7905 0.8369 1.0860 1.1863 0.1961 0.6158 -0.8272 -0.8317 -0.7786 0.6935 -0.9366 -0.4905 -0.5690 -1.1953 0.3461 -0.5177 -0.3942 0.0439 -0.6433 0.0265 -0.3162 0.5070 1.6537 0.5397 0.5348 -0.9913 0.0390 0.6753 -0.7775 -0.3490 0.3963 0.2802 0.6789 -1.0002 0.0503 -0.1092 1.0474 -0.2514 0.1726 -1.2319 -0.1320 1.1690 -0.3379 0.2631 -2.1294 -0.3358 1.3897 0.0905 0.4119 0.6894 0.9985 1.3732 -1.1392 -0.1774 0.0677 -0.1160 1.9676 -1.4011 -1.4233 -0.6945 -1.0015 -0.2616 -1.5421 -0.6584 0.3245 -0.4952 -0.7102 -0.0578 -0.0711 -1.1873 -0.9045 -3.2305 -0.9943 -0.7857 -0.3687 0.0878 -3.4504 1.1384 0.5071 0.2351 -0.0374 1.7064 1.0334 1.6284 -0.8342 -0.8494 -0.2604 0.1988 1.0333 0.2977 0.3921 1.5946 -0.0950 0.7752 -0.5936 -1.2566 -1.3488 2.0423 -1.9167 -0.9523 -0.2030 1.9861 0.6922 0.2977 -0.3190 -0.1364 -0.1756 -0.9189 -0.7972 -0.7615 -0.1961 1.1038 -0.0943 -1.2887 -0.5534 1.2603 -0.5966 -0.1384 -0.2040 0.0935 -0.7856 0.5152 0.4298 2.1157 0.9138 1.9044 0.0207 -0.4799 -0.6100 -0.2564 -0.4586 0.2457 1.3918 -0.5334 -0.9009 0.9513 1.3125 -0.3305 1.6793 -0.6546 0.7024 -0.9611 0.9146 -1.1221 0.7016 0.2830 2.1737 -0.8171 1.2409 -0.3000 1.2308 0.2494 -1.0490 -0.4168 0.8056 1.1115 1.1918 1.0754 -0.6175 1.1383 0.6439 -0.8706 -1.2091 0.6304 2.3386 1.7013 0.7009 0.9565 -0.2350 0.1449 0.5716 0.9013 0.2416 -0.8108 1.6108 1.4664 -0.0245 0.2300 0.9757 -0.3322 -1.3962 0.2238 1.2600 1.2878 1.4598 0.6354 0.2510 0.8214 1.8555 -0.3450 0.7264 -0.2989 -0.0158 0.5724 -0.3406 0.4948 0.5960 -0.6502 -1.1517 -1.2312 0.7085 0.6445 -1.4217 0.2400 0.6768 -1.2451 0.6396 0.4550 0.2850 -0.1898 -0.2522 -0.3630 -0.2005 0.4787 -1.0846 0.7181 0.5356 -0.6160 -0.2191 0.7426 -0.7434 0.2323 1.5699 1.8009 -1.2326 0.2572 0.0232 0.1544 -0.3858 -1.2061 0.2423 0.6795 1.6017 0.9867 -0.0408 -1.4703 0.0610 -0.9910 0.4059 0.3587 0.7935 0.2425 1.1195 0.0297 -0.0947 0.7077 -0.1153 0.8193 0.2494 0.8222 -0.0222 0.0352 0.7845 -0.1068 0.6969 -0.8811 0.2898 1.9360 -0.4429 0.6066 -0.4356 0.4333 0.3566 0.3413 0.6137 -0.6746 0.4773 -6.7068 -0.5180 -0.2058 0.3533 -0.3757 -2.7101 0.2489 0.8855 1.1095 0.3943 -0.5252 0.2752 -0.1035 -0.5024 -1.5487 -0.0047 0.1525 0.7868 0.0884 0.4069 -0.1646 0.4944 -0.2646 -1.3016 0.2667 0.2105 -0.5947 0.4286 -1.2405 1.2379 -1.1475 0.9173 0.3251 0.6803 -1.3901 -1.7092 -0.0758 0.0195 1.0632 -0.8316 0.0114 -1.1158 -0.4759 -0.7153 -0.7195 1.7131 -1.1530 0.4976 0.0688 -0.0570 -0.4555 0.6176 -0.2510 0.0238 -0.2624 1.4230 0.2073 0.1297 -1.4554 0.5391 0.1707 -1.6268 -1.8335 -1.8672 methionine sulfone -1.7557 0.8092 -0.5795 -1.7417 0.9234 -1.8460 0.3703 0.3136 -1.7791 -1.0077 -3.1695 -0.2976 0.7061 -1.0573 0.8253 1.1091 0.6366 -1.5912 -0.3844 -0.2029 1.3107 0.7150 0.2798 -0.1330 0.0263 0.6657 0.1993 0.7260 0.9311 0.0225 0.3729 1.1230 0.8758 0.1637 -2.1137 -0.5861 -0.8682 -0.1137 -1.2663 -1.5939 0.2063 0.4162 -1.3223 -1.5672 -0.5232 -0.8370 -1.4959 -1.0214 0.3564 3.0446 -0.9403 -0.9527 0.2735 1.4786 0.5273 -0.6751 -0.0386 0.0365 -0.6825 -0.2447 0.3488 0.4825 0.5042 -0.2529 -0.4302 0.0896 -2.3789 0.4447 0.0529 0.0238 -0.8113 0.5077 0.0580 -0.6643 0.6275 -1.8899 0.8015 1.6323 -1.0035 -1.2845 1.4341 -0.4200 -1.0465 0.0512 -1.0970 0.0983 -0.4091 -0.6531 -0.4232 0.9484 -0.1255 -0.4393 0.4313 -0.0786 1.0787 -2.2609 -1.7516 -1.5190 0.4246 -0.5851 0.7638 0.2961 1.4718 0.5146 1.3507 -1.0789 -0.2494 0.5796 0.8368 -1.3534 0.2892 0.4216 0.9358 -1.7355 -0.0044 -0.7021 -0.1709 -0.0350 -1.6136 0.3007 0.7616 -1.3077 1.1075 1.7085 1.7193 -0.8149 -1.1607 -0.2034 -1.5426 -1.4216 -0.7659 0.1115 -0.9427 -0.4484 -0.2898 0.1229 -0.6420 1.2858 1.3361 0.8931 0.8909 1.9432 0.3984 1.0149 -0.1400 -0.2113 -0.4101 -0.3868 -1.5110 0.9813 -0.8298 0.5177 0.6828 0.7523 -2.1115 -1.6218 0.0339 -1.8492 -1.0906 0.2228 -1.1328 0.6043 0.6109 0.5441 0.6534 2.1712 -1.5861 -0.2085 0.4308 -0.4741 -0.1819 0.8565 0.8271 -1.1399 -0.3884 0.4131 -0.4219 0.8836 0.9946 0.4189 1.2829 0.4335 1.0286 1.3861 -0.3856 0.1966 0.5038 0.6646 -0.1893 -0.5008 -0.7081 -1.2364 0.7289 -0.4223 0.5554 -0.1592 -0.1125 0.6938 -0.5121 -0.2332 1.1938 -0.8581 -1.0958 1.8187 -0.1543 0.6494 0.1452 0.1302 -0.5575 -0.4136 -0.1953 -1.0980 1.8306 -0.2660 0.5881 -0.5431 -0.7067 -0.3293 0.2821 -0.4632 -0.4091 -0.0140 -1.0240 0.1755 1.1554 -1.5002 0.3707 0.0763 0.7238 1.0145 -0.8290 -0.2052 0.8362 -0.3846 -0.3684 -0.0296 -0.9742 0.4300 -0.1177 0.1549 -2.6901 -1.9230 -0.4407 2.1521 -0.0803 -0.2071 -0.7880 0.6899 -0.4822 -0.8970 -0.7637 0.3184 1.4362 0.6755 -0.2247 0.5685 -0.6150 -1.0739 0.8993 0.6715 -1.5323 0.0402 -0.3514 -1.3248 -0.6959 0.3196 -0.8727 -1.9536 -0.4229 0.3337 1.5238 -0.5819 -0.0480 0.1542 -0.4756 0.1048 0.3990 1.9719 0.8051 1.8860 -2.2253 1.0070 -0.4130 -0.7094 -1.1900 0.2622 0.3906 -0.3737 0.4632 -0.1707 1.3666 -0.7252 1.6254 -0.6821 0.3222 0.1006 0.1885 2.0871 1.9755 1.0691 -0.2646 -0.6221 -0.9610 0.3385 -0.3606 0.5080 -1.1379 -0.6284 -0.3121 -0.1140 -0.2909 0.3330 1.0131 -0.2564 0.7551 -0.4924 0.2921 0.7742 0.0715 -1.5535 0.8433 -0.3944 -0.1791 1.3380 1.5101 -0.9611 -0.5755 0.2758 0.0972 0.7622 -0.8428 0.4508 0.5548 -0.2013 -0.0451 1.5443 -1.9088 -0.0387 1.8871 -0.6363 -1.3428 0.7434 -0.4719 -0.9463 -1.0093 0.8090 0.9121 1.1232 1.0388 0.7133 1.9463 2.2699 -0.3623 0.4614 1.2626 -1.1364 0.0151 -0.0360 0.8497 0.0435 0.4590 0.8200 -0.1448 0.6468 0.2909 1.5139 -0.1500 -1.8244 -0.1656 0.2043 -1.5540 1.3396 0.6744 -0.7882 0.3679 -3.3332 -1.1049 -0.0083 -0.2724 1.5143 2.6939 3.3299 -0.9337 -0.3810 0.6769 -0.4073 0.6044 -0.7723 0.0098 -0.1718 -0.0659 0.5716 2.5665 0.4976 1.0098 0.2307 -0.7369 -0.7196 0.6573 0.6807 0.2873 -0.1740 -0.9746 1.4192 -1.5901 1.2228 -0.8941 2.1437 0.3567 0.9473 methionine sulfoxide 0.4101 -0.3502 -0.2443 0.4326 0.2461 0.7001 2.5504 2.4563 0.3294 2.3926 0.7804 -0.7761 -1.0566 0.2129 0.5619 -1.1625 -0.9056 -0.3228 -1.2492 -0.1713 -1.1535 -2.1163 -0.5896 -1.4256 -1.6549 -0.3234 -0.0787 0.0424 0.1383 1.2811 -1.4130 -0.8157 -0.2018 -0.7112 -0.8263 0.4388 -0.2630 0.0583 -1.0342 -0.0905 -0.4776 -1.9701 0.2597 0.2931 -1.8775 0.8146 -0.8693 0.3237 -1.6159 1.0390 -0.3165 0.6485 -2.1251 1.0456 -1.4414 -0.1171 -1.6806 -0.8253 -1.3114 -1.3094 -1.2036 0.8455 -1.0147 1.0974 0.0045 1.1107 0.4007 -0.6774 -1.2947 -0.4855 -0.4085 -1.1395 -1.3063 0.3572 -0.0242 -0.8540 -0.7615 0.9197 0.0940 0.4926 0.1506 1.5591 1.4808 0.5039 2.1800 -0.6258 -0.6303 -1.5582 0.1974 -0.1201 -0.1091 -0.4548 -0.9924 0.2166 -0.0442 -0.4863 0.2177 -0.2079 -1.1049 -1.4249 1.0692 1.3023 -0.4217 -0.4474 -0.5826 0.8736 -0.2595 -0.5550 -1.1457 0.7441 0.7132 -0.1106 0.2155 -0.3372 1.8801 1.0156 -0.6311 0.3706 -0.3858 -0.9842 3.9033 -0.0772 -1.3198 -1.3833 0.0688 1.3754 -0.1927 0.5134 -0.1294 0.8055 1.9895 -0.1637 1.0403 0.0903 1.4361 3.9037 -1.6758 -1.7992 -0.8441 -0.5452 1.1308 -2.0719 -0.1683 -0.0567 -0.7824 -0.2822 -0.0650 0.4561 -2.3515 -0.5710 0.4421 -1.2740 -0.3239 -2.1696 -1.2730 -1.1733 0.2335 0.1398 0.0374 0.2622 1.3308 0.0040 2.0001 -1.5501 -0.1227 0.4652 0.4466 1.8646 0.8586 -0.7426 0.8227 -0.7170 0.1846 0.6045 -0.0882 -0.5696 0.7496 -1.8116 -0.9862 -1.7254 1.8541 0.3481 -0.4675 -0.7421 0.0252 -0.5539 -0.5382 -2.0998 -0.0110 -0.1343 -0.0061 2.9879 -0.4294 0.3115 -0.0800 -0.7742 0.2175 0.5702 -0.1947 -1.7822 -0.0789 -0.5132 0.9968 0.0569 2.2294 -0.5211 -1.4252 -0.3526 0.4772 -0.6520 -0.0798 0.4794 -1.3742 0.0949 1.2572 0.8562 3.5293 1.4209 -1.0744 0.8524 -1.5358 -0.2932 -0.6682 2.3281 -0.9963 0.7640 -0.7535 0.9521 0.0904 0.5183 0.0325 -1.1300 -0.6707 0.0163 0.0675 0.5438 0.4574 -1.2485 1.3000 0.3034 -0.4966 -0.7152 1.6299 1.4089 1.1135 0.7246 -0.9337 0.7586 0.4460 0.1679 -0.1392 -0.0329 -0.0929 1.5867 -0.0466 0.1495 -1.3109 0.3514 0.1289 -0.7277 -1.1024 0.8013 1.2483 0.7276 0.1167 -0.2161 -0.3772 0.8181 -0.2252 -0.3351 -0.0690 1.2882 0.4778 0.7244 -0.1226 0.0463 -1.5147 -0.2079 -0.1559 -0.2914 0.8065 -0.2853 0.2546 -0.2107 -1.5338 1.7696 -0.7762 0.3509 -0.1767 2.1971 -0.9121 -0.5657 -0.3737 -0.6790 -0.2460 1.3438 0.7082 0.4947 0.5848 -1.1711 0.4551 1.3337 0.4161 0.7394 -0.2111 0.0311 2.4912 -1.3747 -0.7096 0.1807 -0.1125 0.6571 1.3981 -0.4195 -0.7074 0.1781 0.5148 1.2427 1.2209 1.2198 -0.7937 0.7407 -0.9338 -0.1473 0.9667 -0.5811 -0.2008 0.5222 0.9115 -0.8696 -0.9094 1.4452 -0.2845 1.4207 -1.2910 0.4451 1.0284 -1.2297 0.9373 0.8630 -0.0652 -0.9189 0.8092 0.0642 0.2466 0.6107 0.4387 -1.3814 -1.3777 0.2982 0.0759 0.1582 0.1536 0.2369 1.6420 1.1053 -0.8219 -0.1988 0.1316 0.6737 -0.6345 0.7778 0.2773 -0.0632 -0.3757 -0.3242 0.0984 -0.2222 0.8140 -0.7263 -0.6269 -0.9379 -1.0253 0.9285 -0.5565 1.2680 -0.8334 0.6480 -0.1503 0.8658 0.2903 -0.4410 0.5204 -0.3868 -0.5018 -1.1280 -0.1650 -0.9927 -0.9740 -0.8087 -2.0461 0.5395 1.7671 -0.1556 1.2239 -0.3838 -0.1105 -0.2450 -0.9138 -1.2795 0.0607 1.6424 1.5311 1.3966 -0.2280 0.1668 1.3831 -0.6974 -0.9895 0.3609 methyl-4-hydroxybenzoate sulfate 1.9157 0.5872 0.2862 1.8295 1.6455 1.5083 -0.2309 1.1402 -1.4764 -0.8172 1.2130 0.0901 0.7722 0.2612 0.7204 0.3277 -1.3230 -2.7421 -0.1456 0.2254 0.7216 0.1689 0.7967 0.2847 0.2613 -0.2256 1.5105 -0.1529 2.1339 -2.7487 0.1298 0.6301 -0.2369 0.4215 1.1884 -0.1873 0.5825 -0.6542 1.1272 -1.0207 0.9776 0.3828 -2.0160 -1.4021 0.2635 0.1036 -0.9044 0.5452 0.6404 0.2208 0.5716 0.4018 0.1151 1.1852 1.1779 -0.5645 -1.1870 0.0107 1.5830 -1.3856 -0.3164 -1.2642 -0.7118 0.4287 0.1249 -1.0781 0.6447 1.5696 -0.1172 0.0376 -1.9092 -0.0588 -0.4585 1.4054 0.8429 0.6307 0.9760 -1.9797 0.3663 -0.0080 0.7987 -0.2155 -0.4682 0.1884 0.4591 -0.7476 1.6871 -2.7035 -0.2813 -0.0075 0.4350 -1.0148 1.3986 1.1662 0.6794 1.7988 0.1877 1.2369 0.0582 -0.0542 -0.1107 1.2200 -0.0337 0.9765 1.4502 -0.2058 0.3659 0.2222 0.9328 -1.4570 -0.3249 -0.0503 -0.2725 -0.0650 -0.8668 0.1326 1.0016 -0.4377 -0.9493 2.0277 -0.7147 -0.1451 0.2037 0.5853 0.5950 -1.0929 0.6978 -0.7567 -0.4427 -0.0054 -0.0383 -1.6669 0.7888 0.5164 0.6570 1.0625 0.3387 -0.2608 -0.8976 -0.7829 -0.9923 -0.1114 -0.0447 -2.7707 -1.7450 -0.4913 1.5623 0.9104 -1.2314 0.1653 1.1073 0.5119 -0.0231 0.1900 -0.5015 -0.0573 0.1427 0.6356 1.5116 0.5405 0.4649 1.0798 -0.4954 -1.2424 1.3803 -0.1076 0.6603 -0.1149 -0.5987 0.9600 0.9512 0.6313 -0.3587 0.5291 -0.2850 -0.3568 -0.2833 0.6398 0.7278 2.2073 0.1625 -0.1380 -1.5267 -1.5178 -0.7758 1.1469 -1.1870 -1.1963 -1.4309 1.5682 0.4831 0.1806 0.1818 1.1222 0.6449 0.4271 -0.5257 -0.6454 -1.0622 -0.8900 0.9055 1.8016 1.4615 0.8787 0.2026 0.1592 -1.0373 -0.6414 0.4621 2.2715 0.7767 -1.1285 0.9921 0.2401 -1.2202 -1.2900 -1.1916 -1.8358 0.6505 0.1496 0.7053 -1.4666 -1.4332 1.0778 0.2135 -2.1695 0.4270 -2.1742 0.3753 0.6838 0.6398 0.6116 -1.7175 -1.3065 -0.2991 0.3000 1.9448 -0.5171 -0.4374 1.2597 -0.4313 -1.1903 -2.7859 -2.0385 0.6201 0.3756 0.1368 0.5811 0.6033 0.4349 -1.2608 0.7401 -0.4325 1.0770 -0.4343 0.5566 0.4023 -0.6664 0.8394 -0.5983 0.8125 0.8465 0.0988 -2.7458 -0.7103 0.8770 0.1808 -0.0671 0.1078 0.0288 0.6592 0.7864 -1.5161 -0.0215 1.1090 -1.5438 0.8778 -0.7984 1.1358 1.8427 -0.4373 -0.6614 1.0519 0.1531 1.5759 -0.0988 0.0351 0.1407 0.0968 1.0647 -0.1144 1.2584 0.1465 -0.5060 0.7356 -0.0454 0.6888 1.6957 -0.0217 -1.2423 1.3970 0.7165 1.3431 0.0830 0.3658 -0.9707 0.0839 0.5687 -0.4564 0.8994 -0.7424 -0.4536 -0.1084 -1.1481 1.1537 -2.1606 0.5095 -1.7797 -1.3938 1.2494 -0.0163 -0.4491 -0.3875 -2.9184 -0.2321 -1.1515 -1.5803 -1.6359 -0.1431 -1.3294 0.7419 0.9438 -1.2408 -0.3207 -0.6614 -0.8489 0.1636 -0.8069 -0.0542 0.1656 -0.0795 0.9277 0.8212 0.2078 0.5607 1.5805 0.8336 0.7565 -1.3104 -0.7224 -0.2419 1.2868 0.2490 0.9913 -0.6159 -0.4000 0.6987 0.0315 0.3066 -0.0089 0.0180 0.5922 0.6547 -0.3900 0.0209 -0.8783 0.9793 1.2067 -2.9273 -1.9708 -0.5258 0.7925 -0.4569 -2.7595 0.2836 -0.3899 -0.2808 -1.2669 -1.5504 1.0654 -1.4590 0.2668 -0.7324 0.0282 1.5359 0.0275 0.5907 0.4612 -1.7801 -1.8693 -0.1800 0.1125 -0.7041 -1.2082 0.2792 0.0748 -0.2943 -0.4395 0.0210 0.7662 -0.6824 -0.0693 1.0009 -0.5126 -1.0279 0.9194 -1.5327 0.0393 -1.4570 1.1309 methyl glucopyranoside (alpha + beta) -1.0500 0.0386 -1.3500 0.0856 0.1570 1.2500 -0.0739 0.5070 -1.3600 0.1180 -0.0907 1.7800 -1.2600 -0.0080 -0.9150 0.0137 0.0448 -1.2900 0.3590 0.8470 -0.0274 0.0110 0.0130 -0.1110 -0.0489 0.6260 -0.1720 2.5800 1.0300 0.1680 0.2910 -0.0297 -0.9640 1.1300 0.2310 0.4790 -0.3610 -1.0900 0.4270 -0.1560 -0.2380 0.5340 -1.0000 -0.4730 -1.1700 0.6610 -0.3030 -1.2900 1.2800 0.6040 0.7090 -1.4900 -0.9600 -1.3900 0.5080 -1.4500 0.7400 0.3180 -1.3500 -0.2450 1.1900 0.3020 1.7000 0.5800 -0.9490 -1.5000 -1.3300 -1.5700 -1.4700 0.3790 -1.3100 0.0519 -0.5630 -0.4880 -1.3100 -0.5640 0.2690 1.1400 -0.4240 0.0592 -0.1500 -0.1140 -1.3000 1.1000 -0.0038 0.4710 1.8800 -1.2400 -0.7900 0.7190 -0.2540 -0.0469 0.3740 -1.0100 -0.0997 1.5600 0.2600 -1.2600 -1.2500 0.2520 0.6090 1.4800 0.7990 -1.5200 1.3900 -0.6870 -1.3600 -0.9900 -1.6300 -1.2100 1.1500 -0.5140 1.7400 -1.3100 0.3290 0.4530 -0.2940 -0.4060 0.5220 2.0200 0.5940 -0.4280 0.1880 2.7000 0.4540 0.7240 -1.4400 -0.5050 -1.4000 0.4020 -1.4300 0.3880 2.3000 0.4580 0.3420 -0.3650 -0.8400 0.4100 -0.1420 0.4370 -1.1200 0.5220 -0.4860 1.6700 -0.3380 1.3900 0.5770 0.8700 0.4690 -1.1800 0.4940 -1.1300 -1.2200 -1.7100 0.4050 0.7810 -0.0005 -0.7530 -1.4200 -0.9410 -1.2800 1.2800 0.5320 -1.3100 0.9740 -0.6870 -0.4590 2.0000 1.3700 0.0979 -0.3500 -0.0539 1.8500 -0.0969 0.3860 -1.0600 0.4360 1.1300 1.1600 -1.1100 0.1470 -0.0994 1.6100 0.1170 -0.1540 0.8580 0.6350 -1.2400 -1.1300 -0.5380 -1.5700 -1.1500 0.5780 0.4820 -1.1600 0.4790 0.4300 0.2160 -0.2290 0.1650 1.0500 1.1000 -0.6670 -1.2900 -1.3700 -0.5720 -1.3700 0.3140 -1.2900 0.5970 -0.2810 0.7330 -0.6570 -0.7180 -0.1200 -0.6530 -0.1290 0.0639 2.6100 -1.0000 -1.3700 -0.6300 -0.0053 0.0805 1.8500 1.6700 1.6400 -1.5800 0.1530 1.1200 -1.3700 0.8300 1.6300 -1.4200 -0.3950 0.1910 -1.3700 -1.2500 1.9000 0.4530 1.2700 1.2400 -0.2800 2.1300 1.7300 -1.3300 -0.2610 -0.0385 0.9880 -0.7900 -0.4810 -0.3530 0.7890 0.0175 -1.4100 0.1920 0.6870 -0.4980 0.3300 0.4560 -1.4200 -0.4010 1.1200 -0.9950 -0.9640 1.4400 -0.4460 1.2400 -0.0615 1.7900 -1.4400 0.4620 -1.2000 0.1830 1.5000 -1.4000 -1.4000 1.8000 -0.0625 -0.4960 -0.2050 0.3800 -0.7690 -0.2090 1.6200 -0.3550 1.0100 1.6400 1.4300 0.3070 -1.0600 -0.0200 0.8390 -0.4690 -0.0027 0.4940 -0.4850 1.2000 1.4800 1.1900 -1.3200 0.6200 0.3040 -0.1890 -0.6520 2.0600 1.1700 -1.1400 -0.6930 -0.1130 -1.2900 -0.1450 -0.0000 0.6230 -1.5800 1.0400 -0.3410 0.4200 0.6560 -0.0820 -1.3400 0.0506 -0.1020 -1.5300 1.3100 0.0341 1.5800 -1.3500 0.2750 -1.5000 -1.2600 -0.3030 0.3180 0.0041 1.0900 0.7220 -0.5450 0.2140 1.1700 0.3800 -1.3400 1.1500 1.1100 2.4900 -0.4220 -1.2800 0.9870 -0.3750 -0.0343 -1.5300 -0.8500 -0.8430 -0.7400 -0.1960 -1.4400 1.4700 -0.4880 0.2100 -0.8390 -0.5620 -0.0498 0.6070 -0.2180 -0.0294 0.3890 1.5900 -0.7810 -1.6000 -0.1840 -0.3650 -1.2500 -0.5320 -1.3300 -1.3200 0.9950 -1.1800 1.6000 -0.1780 -0.1400 0.1400 0.0327 2.4000 1.2300 0.4000 -1.7200 -0.2570 0.5940 2.0800 0.2010 0.3670 0.5450 -0.1100 -0.9910 -1.4500 2.4100 0.1190 0.8980 -1.4300 0.0540 -0.1450 1.0300 -1.4600 0.7770 0.1510 -0.8970 -0.3470 0.7230 -1.4200 0.0256 2.2200 methylmalonate (MMA) 0.1354 0.4002 1.3051 -0.1117 0.9838 1.3811 -0.2487 0.9220 0.9603 1.2102 0.8522 0.3565 0.1555 -0.2165 1.0504 0.2727 0.7887 -0.3516 -0.7878 0.1146 -2.2043 -0.3005 0.2078 -0.2309 -0.8247 -2.5560 0.5095 0.2112 -0.8504 -0.5144 0.8456 0.3410 -1.7952 -3.1127 -1.1077 -0.8050 -0.3706 -0.2873 0.6938 -0.0879 -0.5451 0.1308 -0.2852 -0.5801 -2.3063 -0.4508 -0.7614 -0.2805 0.2669 0.8632 -0.1208 0.0899 0.0858 0.5407 -0.5268 -0.4797 0.4398 0.2119 -0.6989 -1.4668 -0.6234 -0.9461 1.5884 0.3029 0.3768 -0.0741 0.4366 -0.1398 1.2384 -0.1779 -0.3039 -0.0535 0.6264 -1.1505 1.3672 -0.0989 -0.7107 1.1668 -0.1193 -0.1309 0.1490 0.0416 0.0285 -1.0111 0.9629 -0.2478 0.0269 -0.4059 -0.1081 0.9655 -0.0496 1.2049 0.5391 0.3006 0.6450 -1.2116 1.0696 -0.0364 -2.3570 0.1115 -0.3946 0.1874 -0.3654 -0.6517 0.1100 -0.0407 1.0617 -0.5996 -0.9740 0.3272 0.0636 0.0136 -0.1279 -0.0443 -0.6208 -0.0580 0.7708 -0.7300 -0.2654 -0.6856 0.6506 -0.7869 0.5724 -0.3319 -0.6933 -0.2938 0.6340 0.5753 -0.6820 -0.3425 -0.4182 0.1919 0.0871 2.7406 0.0085 -0.2991 0.1300 -0.2511 -1.0732 0.0507 -2.4346 -0.5747 0.0695 -0.5300 1.0235 0.2765 -0.6297 0.6782 0.7837 -0.1036 -0.1301 1.7533 -0.1923 -0.0572 -0.5821 -0.6863 -0.2804 -1.2627 0.2605 1.1690 1.3157 -0.3088 -2.2649 -0.5283 0.3039 3.1916 0.2085 -0.0808 -0.8966 -0.8938 -0.0878 0.9958 0.0106 1.3708 -3.0973 0.4501 -2.1762 0.2288 0.7833 -0.5419 -0.2814 -0.1739 0.1529 -1.0040 1.2926 -0.6192 0.2233 -2.5804 0.6589 0.0375 0.2206 -2.4915 -0.4128 -0.2529 0.6995 0.3292 -0.9804 1.4415 1.1128 0.2794 0.5478 0.8413 -2.3190 -0.8998 0.8412 0.2250 -0.4910 -1.3694 0.5718 1.0110 -0.9517 -0.1773 0.8781 0.6549 -0.1790 -0.0088 0.2296 0.0977 0.8337 0.1318 -0.9714 0.8178 1.2170 0.1278 -0.2535 -0.5755 0.1651 -0.3693 0.4967 0.0458 -0.1551 0.9191 0.2510 0.3239 -0.0344 1.3424 -0.7414 -2.6476 0.2464 -0.2883 0.2536 -0.5371 0.5103 1.2904 -0.4270 -0.2288 -0.6557 0.1453 0.1221 0.1058 0.4194 0.9911 1.1226 0.5062 -0.2888 1.9821 1.4455 0.0807 0.0493 0.1099 0.3823 -0.8436 0.0099 0.2712 -0.4463 -1.0203 0.4164 -0.9305 -0.9384 -1.7269 -0.6451 0.1878 -0.6185 -0.5520 -1.3947 -2.7152 -1.2370 -0.1670 1.0869 0.4140 0.1229 0.4980 -0.1403 -0.6410 -1.7345 -0.2352 1.0379 1.6593 -0.5851 0.0690 -0.1574 -0.5140 0.7923 0.4189 1.2458 0.1124 0.0531 0.7606 1.0896 0.0834 -0.1917 -0.7140 -1.5115 -3.0251 0.3375 -0.1186 2.7578 0.3632 -0.3187 -0.7999 -1.7642 0.9262 0.0460 -0.2674 -0.3922 0.4835 -2.7302 -0.0151 -0.0309 -0.0276 0.6967 0.7733 -1.4938 1.4753 0.7750 -1.0591 -2.5990 0.1185 0.0817 2.5827 -0.3958 -2.4734 -0.9179 -2.5103 0.9446 0.7436 1.2558 0.8134 0.0094 0.1748 -0.5025 -0.4753 1.1802 0.1268 0.7027 -2.6380 0.2885 0.2498 0.2112 -0.8277 -0.3793 2.1821 -0.0640 1.0712 -0.5203 -0.3591 0.1352 0.8125 1.5806 -0.0248 1.5035 -0.1185 1.3028 -0.0296 0.5918 -0.2840 0.0326 -0.5802 1.6871 0.1131 -0.7757 0.3410 -0.7020 0.4369 -0.0223 0.5230 0.1108 0.7271 1.3168 -0.0820 4.4115 0.4613 0.8083 0.0603 -0.7826 -0.4258 -0.1353 -0.1127 -0.6781 -0.2647 -0.7499 0.3512 0.8272 -0.1464 0.6885 -1.0655 -0.4324 0.2427 -0.6385 0.7112 0.1226 1.0721 -0.9585 3.4121 1.6164 0.9788 -0.3109 -0.5870 4.3568 -0.4103 methylphosphate -1.0911 0.5877 -1.6294 -0.5390 -0.8340 0.3908 -0.1171 -0.4953 0.4714 0.3081 1.1515 -0.3987 -1.4664 -0.3429 -1.9184 -0.9206 -0.1872 1.6840 -0.1213 0.6798 0.7185 0.8297 0.2171 -0.8300 -1.5097 -1.5158 -0.1313 1.4306 0.8666 0.8595 -0.3138 -1.3077 -0.9431 0.1312 -1.1700 1.5475 0.5457 -0.3643 -0.2182 -1.8754 0.5155 -0.8229 0.2903 -0.2672 0.2099 -1.9031 0.7481 0.8326 -0.2817 -1.4985 -1.5178 -1.8829 0.0792 -1.7075 0.5789 0.3030 0.2364 0.8150 0.2107 0.0731 -1.3132 0.1969 -0.1107 0.2167 0.8723 -0.1125 -1.6030 -0.5017 0.7193 -0.0891 -0.3234 -0.5238 -0.2048 -1.8639 0.0254 -1.8249 0.1465 1.5469 0.5276 -0.5882 -0.1355 0.9317 0.4206 -0.0665 1.1789 -0.0008 0.8585 2.0715 0.5588 0.1290 0.7155 0.6582 1.1478 0.6686 0.9366 -0.4010 0.3653 0.1808 -0.6448 0.1127 -1.7999 -2.0317 0.1992 -0.0190 -1.3848 0.8003 -1.6503 -1.6339 0.0793 2.3157 0.8731 0.1416 0.7701 -1.5648 0.9959 -1.5454 0.7718 0.2190 -1.7230 -1.9475 0.8413 0.9369 -0.3573 0.0532 -1.9325 1.1873 -1.7930 -1.6464 -0.3213 0.2164 -1.7813 1.3866 0.3449 0.0871 0.0608 -1.0456 0.3370 0.5967 -0.0825 -0.8315 0.3511 -1.6680 0.8801 0.8227 -1.3517 0.6788 0.4842 0.2263 0.8920 0.6086 0.7115 0.0719 0.2127 0.9692 1.0393 0.5293 0.3733 -0.0437 0.3817 0.9323 0.9885 -1.9590 0.0217 -1.5584 0.3020 -1.8673 -0.4679 0.3265 -0.1469 -0.1737 -0.0547 -1.5966 -2.0488 -1.2291 0.3711 1.2043 0.3698 0.9116 -1.4670 0.1728 0.9824 0.4253 -1.6555 0.6642 -0.2970 0.9237 -0.1843 0.7845 -0.2274 -0.4802 -0.2903 -1.2785 0.5499 1.0338 0.0569 -1.7178 -0.0756 -1.9799 0.8346 1.5283 -1.7977 -1.2660 0.6106 0.3316 0.5120 0.7839 0.2928 -0.4818 -1.5309 0.7352 1.1362 0.2056 -1.4491 0.0572 0.3932 -1.6787 2.0705 0.9145 -2.0356 -0.2780 0.1077 -0.0006 0.7281 -0.7688 -2.1225 1.3210 0.1519 -0.4863 -1.7506 -1.5386 -0.0341 0.6166 0.8063 0.1118 -0.6334 -0.1944 1.1004 -0.2348 -0.2131 0.6493 -1.6759 1.1437 -1.6411 0.3972 1.0195 -1.5947 -0.3790 0.0954 0.2493 1.2503 1.2454 1.3374 -1.8659 -1.6597 -1.7418 0.1943 -1.7188 0.3441 0.1284 -1.0605 1.3599 0.8886 0.3415 0.0721 -1.7674 1.7350 0.6741 -1.9459 0.4744 0.0873 1.7827 1.3483 0.1485 1.4604 0.9459 -0.1187 -1.0434 0.1796 -0.5369 1.2435 -0.2864 -1.8789 0.9511 0.8376 0.5390 0.1004 -0.2608 1.1538 0.3799 0.2426 -0.6121 -0.3008 0.9787 0.7276 1.0617 -0.7854 0.1005 0.3460 0.2365 -0.1715 2.1333 0.8415 -1.6928 -1.8445 -0.0207 -0.1079 0.7559 0.6447 0.2261 0.4050 0.8404 0.6350 0.7809 -0.2373 0.8108 0.5029 0.4661 0.3544 -1.5032 0.5624 0.8347 0.8736 -2.3286 1.2750 -1.7412 -1.0791 0.6258 -0.1308 0.8808 0.3160 0.1587 -0.2142 -0.3732 -1.3243 0.7610 0.9359 0.7526 -0.2076 -0.1781 0.5969 -1.6176 -0.1947 0.1606 0.6070 -0.1303 0.8092 0.9108 -1.8807 0.9909 1.1536 -0.1517 -0.7268 2.1685 -0.8160 1.6574 0.4463 0.9089 0.6641 0.2758 0.1190 0.3163 0.5576 1.3153 -0.5608 1.5299 -1.9371 -0.4906 1.5938 0.8920 0.1697 0.8337 0.9498 0.1093 0.7156 0.8094 1.6685 0.0121 0.1398 1.1872 0.8987 0.4176 -2.1587 -0.6058 -0.4372 -2.2939 0.5359 0.2756 1.4710 -0.8189 0.0210 1.0729 -1.6194 -0.9926 1.0819 0.0414 -0.6142 1.2864 -0.0331 0.2767 0.7660 0.1743 1.1295 -1.5369 1.1726 -0.2574 0.2718 -0.6312 0.7909 0.4049 0.8705 methylsuccinate 0.6570 0.1797 -0.0290 0.7420 -0.8282 1.3647 0.9457 1.0899 -3.3929 0.1873 2.9258 0.0593 1.5360 1.0075 0.5699 0.7189 0.4375 0.4666 0.8283 -0.5026 1.6847 1.1368 -2.6952 -0.1622 0.0452 0.5261 -0.5756 1.0181 -1.0614 -3.3542 0.6203 0.2348 0.8379 1.0669 0.2710 -0.3841 0.0376 -2.8294 0.8803 -1.3432 0.2735 0.9116 1.0434 -0.5261 -0.2094 0.1179 -0.7630 0.5049 0.1425 0.9629 -0.6798 -1.0415 -0.4010 0.4778 0.0798 -0.3985 0.1190 -2.0559 0.9612 0.2813 -0.2906 0.9420 0.3377 1.8388 -0.0579 0.4280 -1.0477 -0.5625 1.2008 -1.3605 0.6183 0.1092 0.7400 -0.2912 1.3968 0.3535 1.1730 -0.9597 1.1137 0.7666 0.5723 0.7009 -3.2905 -0.0093 1.0091 0.0515 0.7564 -0.5181 0.4826 -2.7989 -0.3685 0.1026 1.4323 -0.0129 1.5251 0.3188 0.0422 -0.0007 1.0322 -0.0541 0.0950 -0.0553 -0.0950 0.5443 0.6922 0.2544 1.3265 0.8725 1.5832 0.5114 -0.4525 -0.6449 -0.8456 0.8986 1.2379 0.2391 -0.3592 0.0864 0.2142 -0.0428 -0.2219 -0.4880 -0.1188 0.6542 0.0568 -0.3346 0.0839 -0.1828 -0.6380 -1.2001 -0.6671 0.7601 0.2266 0.0817 0.7596 -0.5930 1.3242 -0.5045 1.1878 0.8378 -3.0032 0.0027 -1.0150 0.0851 0.3975 0.0671 -0.3421 0.8273 0.8068 -0.1191 -0.6974 -0.6092 -0.0800 1.6158 0.7936 1.2678 0.3539 -0.0633 1.2437 -0.2573 0.9559 0.1737 -1.0271 -0.4390 -0.2609 -0.1205 1.0135 -0.2431 -0.8492 1.0257 0.4847 -0.3114 -0.5972 -0.4409 -3.6689 0.3373 0.5196 1.0878 0.4236 1.2436 -0.5380 0.1060 0.3056 0.0901 0.8811 0.3292 1.1182 0.3223 0.1310 0.9389 -0.8621 0.8718 -1.2171 -0.7530 0.1198 -0.0401 -0.0295 -0.0788 -1.4827 -0.7310 0.2386 0.0741 0.9315 -0.1079 0.1859 0.5793 0.4417 0.0333 -0.3508 0.7340 -0.2447 -1.4006 0.6051 1.3294 -0.2522 0.6687 0.7580 0.3411 1.2609 -0.6757 -1.4206 0.0792 0.8456 -0.9132 0.0151 -1.1618 -0.2369 0.0202 -0.8010 0.1092 -0.3636 -3.0914 -0.3608 0.2106 -0.6794 0.6229 0.8297 -0.3159 -0.7800 0.6370 -0.1708 0.5037 -0.3376 -0.2477 -0.2382 -0.3865 0.6855 0.4703 0.1408 -0.5203 0.5347 -0.1142 0.1146 -0.4106 0.2416 0.1441 0.6930 -0.8059 0.2174 -0.0511 -0.0698 -0.6035 0.9445 -0.5930 0.3939 0.9224 0.7709 0.0163 -0.1698 0.1882 -3.5687 0.4408 0.5537 0.5525 0.5227 -0.5695 0.3315 -0.2187 -0.6871 -1.1334 -1.3106 -3.6972 0.1247 1.2083 0.6520 -0.3270 -0.3589 -0.9401 0.3452 0.8964 -0.9420 0.0905 -0.0048 2.4743 0.2445 -0.0165 -0.2246 0.3125 -0.4005 -1.2210 0.3796 -0.5945 -3.3308 -0.1371 -0.0379 0.4025 0.5703 1.0194 0.1350 0.9223 0.2474 -0.1729 0.3335 -0.4024 -2.0066 -0.6209 -0.1238 -0.0563 0.5682 -0.6018 0.0313 -0.3544 1.1018 0.7850 -0.0072 -0.4879 -0.2838 -0.1006 0.3861 -0.9009 0.8929 -0.9608 -0.9601 -3.1018 0.0284 -0.1923 1.4813 -0.3134 0.0654 0.6558 -0.2242 -1.9022 -3.7099 0.3121 -0.2895 -0.1709 0.2235 1.4746 1.7529 0.2819 1.2395 0.2737 2.3711 -1.7946 -0.1805 -0.2653 0.9376 0.2093 -0.1233 1.4860 0.6075 -0.5203 0.0754 -0.2183 -0.5849 0.2639 -0.6185 -0.1292 -0.4584 0.0046 0.4564 0.2358 0.4699 0.8747 -0.6906 2.2256 -4.1597 -0.4427 0.9834 -0.3123 -3.4434 -0.6343 0.6000 0.5592 0.4776 -0.1626 0.6917 -0.3351 0.3477 0.7780 -0.1375 0.0736 0.2983 0.0746 -0.2260 -0.9810 -0.1851 0.1414 1.0320 1.0037 -0.4647 -1.0220 -3.3078 -0.6214 -0.3716 0.2953 -0.8118 -1.2378 -0.2199 0.4921 myo-inositol 0.6100 0.0785 -0.5280 0.6190 -0.5220 -0.5140 0.9320 -0.5760 -0.6460 -0.3040 0.2110 0.5400 -0.8840 1.5400 0.0038 0.1690 -0.3760 -0.9610 1.0400 -0.3670 0.8870 -0.2780 0.7570 0.6630 -0.3340 0.8340 -0.6440 1.9700 0.8030 0.4640 1.6800 0.6470 -0.6560 -0.5350 0.7340 0.6100 1.3100 0.2430 -1.4900 0.1300 0.4110 0.7170 0.6000 -1.3500 -1.4800 -0.4380 0.4530 2.0500 -1.2300 -0.5490 -0.4740 -0.1490 -0.6620 0.5260 -0.7760 -0.4890 0.5900 -1.1100 -0.7490 -0.4120 0.2300 -0.5310 1.2200 1.7700 -0.8930 -0.6720 -1.1300 0.5200 0.1660 0.3420 0.7340 -0.4850 0.8240 1.7900 -1.2200 -0.6280 0.7410 -0.0981 -0.2190 1.2000 -0.7330 -0.6430 -0.2780 -1.8100 0.3330 0.3210 2.5900 -0.0563 -0.8700 0.7550 -1.0700 -1.1700 -0.8070 0.1320 0.9760 -0.2380 -0.8230 1.6000 0.6780 0.5850 1.0700 1.9900 0.5620 1.6300 0.9530 0.2110 1.3100 -0.9620 -2.7900 1.3000 1.1700 0.4870 -2.1300 -1.0300 0.9390 1.7300 0.5890 1.2100 0.8720 -1.0900 0.4770 0.6220 0.9550 0.5740 -1.0400 -0.0142 -0.7430 -0.0322 -0.6290 -0.8090 0.4130 0.6660 -0.3260 0.2580 0.9360 0.1620 -2.0900 -0.7900 0.6920 1.0900 -0.9730 0.8400 -0.6640 -0.0523 0.0676 0.3780 -0.6880 2.3600 0.3540 -3.0400 -0.1810 -1.8400 -1.3600 -0.7080 -2.2200 0.2720 -0.6940 0.3140 0.6000 -1.0200 -0.5900 0.6030 1.2700 -1.8000 0.1130 -1.1000 -0.6920 1.3100 1.3900 -1.5400 -0.6700 -0.8690 1.6400 -0.1680 -0.3460 -2.3700 -0.8470 -0.6120 -0.5160 -0.0619 0.9350 1.0700 -0.0375 0.5470 -0.0579 -0.3640 0.2950 -0.9640 -0.6690 0.4840 1.9400 0.6360 0.6160 -0.3450 -0.9600 0.4870 0.0731 0.7270 -1.1800 -2.9700 0.3680 -0.4190 0.2380 -2.9300 0.1990 0.3480 -0.1370 1.0300 -0.4460 0.1350 0.8030 0.5970 0.9550 -1.2000 -2.1500 1.9800 1.0800 1.6000 -1.0300 0.6930 -0.2290 0.3700 0.0047 0.0409 0.5380 0.5220 0.9960 -0.5170 0.4600 -0.1480 0.8820 0.1610 1.9000 -0.0211 0.7760 1.3300 1.1600 -1.5400 0.4030 0.3990 0.9100 0.1650 1.3700 0.3180 1.2600 0.2180 -0.7240 0.4930 2.0300 2.8800 -1.0400 -0.3830 0.5950 0.4070 -1.6700 0.5020 -1.6900 1.0100 -0.1490 0.4600 -0.7140 0.6340 1.3400 -0.6420 -0.2130 -0.6410 -1.6000 0.5900 1.2000 1.0600 -1.0000 0.5630 1.2600 -0.4370 2.1000 -0.0174 -0.8500 -0.0781 -0.7300 0.0273 -1.9400 0.6790 -0.0135 -0.1180 -2.0900 0.2520 -0.4200 -1.3200 1.0700 -0.1430 -1.3800 0.8770 0.7220 -0.6990 -1.7500 1.2000 -0.6880 1.6400 1.7700 0.2010 -0.4940 -0.5000 -0.2650 -0.7690 0.6410 -0.3560 1.2900 -1.0900 -1.2000 -0.4220 -0.5200 0.3650 -0.6430 0.1940 -0.5880 0.3280 -0.9290 0.1890 1.3900 0.5790 -1.2200 -0.7940 -1.0700 -0.7530 2.3500 -0.5660 0.4480 -0.0897 -0.5140 -0.1510 0.1160 0.9610 0.7650 0.0983 -0.3290 0.3800 -0.1880 0.6240 -0.2620 0.0778 -0.2100 1.1300 -0.5540 0.0679 0.1040 0.4150 -0.5760 -0.2750 -2.3700 -1.4300 -2.0100 -1.7800 -0.2470 -0.9120 0.8170 -0.5940 -1.1500 0.9170 0.8550 -0.8260 -1.0600 -0.3030 -1.4500 1.6100 -0.1940 0.6250 0.5390 -0.7760 -0.7260 0.5770 -0.7110 -1.1200 -0.1770 -2.2500 0.7090 0.5100 0.2740 -0.2030 -0.7620 0.7500 0.1160 1.2800 0.3550 2.4800 -2.2300 0.4080 -1.1000 -0.1590 -0.1550 -0.7660 -0.3830 1.4600 -2.2800 -0.4090 0.9990 -0.6040 -0.0552 0.3950 -1.8800 0.5610 -0.8930 -0.0144 1.1100 1.1600 -0.2240 0.3050 0.1300 -0.9210 0.0000 0.0843 myristate (14:0) -0.1188 0.6438 0.6145 2.2173 0.3741 1.1182 0.3471 0.3480 1.0623 -0.2665 0.9887 0.8563 1.1040 -1.1215 -0.7054 -0.9380 0.3472 0.7064 -1.4352 0.1806 -0.4958 -0.4924 -0.9048 -0.9851 0.5189 -0.8124 0.0065 -0.6287 -1.4757 0.0365 -1.1932 -0.8772 -0.5737 -0.4164 2.4166 1.3919 -0.4746 -1.2433 -1.6643 0.0017 -0.7836 -1.5384 -0.1337 0.6919 1.1191 1.1030 -0.5110 -1.6342 -0.9922 -0.4302 -0.6312 -0.2461 -1.2154 1.9524 -0.8036 -0.2194 -1.7072 1.8445 -0.6967 1.2024 -0.9440 0.2255 -0.3940 -0.3846 -0.1904 -1.0379 0.2798 0.5117 0.0421 -1.5252 1.3337 -0.9581 -0.4139 -0.6320 0.3232 0.3516 -1.5595 -1.4863 -0.4558 -1.5323 0.2967 0.5904 -0.3116 2.0473 1.3851 -1.3829 -1.2990 -0.0833 -0.3122 -1.4494 0.3874 -0.9790 -0.7688 -0.4419 0.0926 -1.4222 -0.3952 -0.2613 -0.7352 1.1677 -1.0858 0.2054 -0.9776 -1.1069 -0.6714 -0.2163 -0.3088 -0.1001 1.7816 -1.3228 -0.1683 -0.9523 -1.5058 1.3698 0.9580 -0.4717 -0.5768 -1.1789 0.7865 0.9820 -0.4875 1.5599 -1.3858 3.6368 0.0120 0.2288 -0.2482 -0.6325 0.3646 1.2282 1.3592 0.1759 -0.5048 -1.3254 -0.9045 0.4883 0.5533 -0.9347 0.1830 -1.8291 -0.2225 -0.5133 -0.1229 -1.2073 0.2321 -0.5639 1.6009 -0.0457 -1.4414 -0.2194 -0.4673 -0.8778 -0.7259 -0.5351 0.7683 -0.7866 1.7479 0.1313 0.0983 0.2081 -0.5863 -0.1766 -0.6624 1.0188 -0.2304 0.2040 0.0283 -1.4506 -0.6388 0.1474 -1.1487 -0.2947 1.0720 -0.3374 -0.2476 0.4412 0.7359 -1.0005 0.3886 -2.2323 -1.5150 -0.3206 -0.1998 0.1353 -1.5058 -0.2866 -1.2516 0.2660 -0.7099 -0.9917 0.6874 1.1341 -0.7104 -0.6121 0.1773 0.4993 0.9258 0.7355 1.4365 0.0433 -0.6418 -1.3247 0.0235 -0.9550 0.3898 0.6871 1.2016 -1.2005 0.9206 -1.7682 -1.7169 -1.1605 -0.9728 -1.3273 1.4164 -0.5765 -0.0977 0.7582 0.8068 1.2153 1.1835 -0.0723 0.4655 0.6427 -0.3636 -0.0331 1.6297 -0.4717 -0.8574 0.6383 -0.8541 -0.9673 -0.7331 -0.7801 -0.0619 -0.1966 -0.5484 0.6161 -0.8477 0.3203 1.2102 0.3503 0.5997 0.9106 -0.8950 -0.0731 0.6893 -0.3111 -0.9609 -0.0931 1.4675 1.2790 -0.6637 0.5961 -0.0666 -0.5923 -0.2152 1.1591 0.3334 -0.5024 -1.1991 -1.6949 0.1346 0.7282 1.0543 1.3816 0.0492 -0.1395 0.0464 -0.4593 0.2440 -1.3505 0.0997 0.4043 0.1234 -0.0376 2.7730 -0.3177 1.1136 0.2606 0.2903 -0.6093 -0.6075 -0.3458 1.0985 -1.7253 -0.3056 -0.9666 1.7078 -0.2476 -1.0047 0.4969 -1.3568 1.1752 0.3855 1.0640 0.6767 0.8433 1.7795 1.1364 -0.7555 -0.7955 -0.2529 0.3868 -1.5313 -1.7406 0.3894 -1.0884 2.0670 -0.3094 1.3503 -0.6925 1.5000 0.2376 0.1929 0.6027 0.9552 -0.7291 -1.2362 0.3038 -0.9436 -0.0673 0.5266 -0.6212 0.0815 1.5278 -0.5287 1.0609 0.1586 0.3065 -0.6921 -1.3912 1.7814 0.7100 -0.6857 0.3012 1.5852 -0.0726 -0.9474 -0.1324 0.7719 1.4570 0.5944 -0.0290 2.6899 0.0397 0.1637 -0.5454 0.6021 -1.0641 -0.6957 0.3677 0.5620 0.4256 0.7813 -0.9204 1.0475 -0.2522 2.9234 1.0088 0.3024 -0.2821 -0.7746 1.5723 0.5292 -1.5495 -0.3056 -0.6699 2.0571 -0.2521 -0.0286 -0.8574 0.2552 0.2616 -0.2150 2.0295 1.0276 -1.0306 -1.0328 -0.3665 0.9359 -1.8489 -0.8703 1.3047 -0.5579 1.0359 1.8514 1.0764 0.6606 2.5239 -0.1392 -1.7430 2.4145 -1.1710 -0.0381 2.2501 0.4002 -0.9163 -1.9952 -1.7598 0.0323 0.4335 0.9210 0.6751 1.3615 1.6670 1.3030 0.3002 1.5422 2.1237 myristoleate (14:1n5) 0.1874 0.6799 0.5877 2.0550 1.1197 1.4236 0.0232 0.1462 1.3958 -0.6730 1.3349 0.9096 0.9065 -0.5635 -0.5061 -0.4196 1.2929 1.4466 -0.3096 0.9313 -0.4432 -0.1433 -1.3393 -0.6489 0.8452 0.7173 1.0476 -0.7459 -1.9484 -0.6615 -0.5013 -1.0518 0.0264 -0.3189 1.3305 -0.3117 -0.1815 -1.1412 -1.5015 -0.0881 -0.7898 -1.5146 0.1184 1.3103 1.8782 0.7829 -0.4197 -1.5710 -1.4894 0.6210 -0.8346 0.2222 -0.3522 1.6590 -0.6631 0.1955 -2.3778 1.9830 -0.5668 1.2606 -1.1286 0.4687 -0.7736 -0.4651 -0.1553 -0.9752 1.2780 0.4225 -0.0437 -2.7801 1.1337 -1.0008 -0.1801 -0.0002 0.6710 0.6406 -1.4978 -0.7637 0.2196 -1.4661 0.7923 0.4714 -0.5162 2.3243 1.2679 -1.2622 -1.5519 0.8391 0.2722 -2.0094 0.8062 -1.3751 -1.3260 -0.5268 0.7312 -1.6507 -0.2599 -0.4090 -0.8346 0.4313 -1.0947 -0.8861 -1.3392 -0.8284 -0.5880 0.5365 0.2197 -0.2585 1.5993 -1.5669 -0.6465 -1.5492 -0.8874 1.0317 0.7546 -1.1145 -0.9652 -2.0419 0.2187 1.0691 -0.8049 1.1217 -1.2423 2.4872 -0.3215 0.5000 -0.4990 -0.4243 0.0942 0.6995 0.7931 -0.0727 -0.7604 -0.9346 -1.1182 0.2358 0.1512 -0.0068 -1.3087 -2.5575 0.7631 -1.0750 -0.0648 -0.7454 0.0577 0.8430 0.9055 0.2776 -0.8489 -1.2783 -0.7671 0.6818 -1.3708 -0.1094 0.0790 -0.7404 1.2718 -0.1579 -0.4406 1.0014 -1.0779 -0.1120 -0.5890 1.1952 -0.4881 -0.5496 -0.5898 -1.7011 -0.1679 -0.0488 -0.4896 0.8344 0.5766 -0.8761 0.6982 1.5291 0.9152 -1.0496 0.2421 -1.7539 -1.5653 -0.1449 -0.4219 0.6969 -2.0847 -0.2656 -1.5837 0.0763 -1.2050 -1.1131 -0.1417 -0.1321 -1.3015 -0.1268 0.5254 0.7404 0.3701 0.4417 1.4496 0.5945 -0.8655 -1.7632 -0.0322 -1.0653 0.6622 1.3988 1.1874 -2.1221 0.5574 -2.4984 -1.7498 -0.8241 -0.8681 -0.6525 0.9529 -1.1470 -0.9576 0.1870 0.9521 0.3325 1.0629 0.0873 1.0472 0.3215 0.2365 -0.0254 1.4166 -0.6637 -1.0330 0.9965 0.2023 -0.0921 0.0455 -0.6701 -0.2453 -0.0279 -0.7073 0.7039 -1.4035 0.4881 1.6096 0.5583 0.3292 0.6396 -0.8725 -0.2142 1.4521 -0.3490 -0.8424 0.1626 1.3796 1.1352 -0.7004 0.8587 0.0166 -0.6292 0.3080 0.7600 0.9066 -0.2651 -0.1823 -1.9014 0.1371 0.7678 0.8913 0.9195 0.1766 -0.9976 0.1578 -0.3238 0.0513 -1.4102 0.0067 1.1903 0.2320 -0.5886 2.4338 -0.3955 0.7979 1.5434 0.3490 -0.3447 -0.4871 -0.1135 1.3782 -1.8097 0.1544 -1.5395 1.3402 -0.4560 -0.3616 0.1463 -0.9428 1.0086 0.1251 0.8448 0.5891 -0.0510 1.1685 1.5219 0.3211 -1.3903 -0.7087 0.7471 -0.7897 -1.1997 -0.3637 -1.2619 1.7059 0.0969 1.3354 -0.8202 1.2898 0.3670 0.3573 0.3724 0.5133 -0.7279 -0.7009 0.1592 -0.3974 0.9434 0.2198 -0.0085 -0.8931 0.8480 0.1185 0.6569 0.4743 0.3735 -0.4471 -1.1851 1.8052 0.9314 -0.3407 -0.2730 1.1854 1.7910 -1.0647 -0.1077 0.1449 1.3551 0.5819 0.3985 1.5325 0.3066 -0.5359 -0.6938 0.7886 -1.2631 0.1585 1.2827 0.2074 0.4971 1.7984 -1.1731 1.5215 -0.0318 1.5620 0.3912 -0.3296 -0.1255 -0.4588 1.3824 0.8992 -0.4493 0.7955 -0.8468 1.0750 -0.2081 0.4727 -0.0683 0.4534 0.2316 0.0741 1.2290 0.4156 -0.0692 -1.7294 -0.8841 1.1467 -1.9279 -1.1071 1.3089 -1.1818 1.2576 1.0904 1.4468 0.9506 2.5754 -0.3443 -1.9584 0.9757 -0.4211 0.5606 2.0026 -0.3096 -0.8221 -2.5021 -1.8253 -0.4951 0.6009 0.8207 0.1402 0.8377 0.7932 1.7415 0.0203 1.0897 1.7583 myristoleoylcarnitine (C14:1)* 0.8519 0.1970 1.6236 2.1796 0.8685 1.2755 1.1492 -0.5863 2.4467 0.6872 1.6640 -0.1460 2.6752 0.0669 0.2759 -0.3189 2.4287 1.5359 0.6994 -0.0285 -0.1762 -0.9733 -1.2696 -2.3363 0.5881 0.3402 1.9526 0.6572 -1.3954 -0.8795 -0.5802 -1.1648 -0.0389 0.4194 0.7820 -0.2199 -0.8696 -0.7326 0.0715 0.8699 -0.8385 -0.5687 0.5715 0.6924 0.9917 0.8207 -0.9739 -0.3709 -1.5756 0.4530 -0.3279 -0.2818 0.1019 1.5354 -0.6381 2.9362 -0.8449 1.3617 -0.2181 2.0382 -1.8211 -0.3936 -0.5741 -1.2784 -1.8810 -0.1802 0.7785 0.3754 -0.5488 -0.5692 1.2408 -1.0283 0.4313 -1.2055 1.0782 -0.4010 -1.0303 -0.2039 -0.1244 -1.1729 0.5550 -0.8154 -0.6035 0.6822 -0.8882 -1.0256 -1.0664 2.1258 0.4231 -0.2792 0.9531 0.0182 -0.9328 -2.3427 0.2167 -0.3567 0.1076 -0.2358 -0.8722 -0.4567 -0.3086 -1.3230 -1.1721 0.1363 -0.2154 -0.9731 1.8911 0.3446 1.8847 -0.1412 -0.6477 -0.1405 0.2104 1.9298 0.3439 -1.6906 -1.8883 -1.1131 0.5163 0.9377 -0.5533 1.0539 0.4035 -1.2296 0.2498 -0.7766 0.9845 -0.2461 0.3538 -1.2888 -0.4298 -0.2302 -0.7935 -1.1832 -1.5394 -0.3903 -0.0375 -0.5316 -1.1246 -0.7567 2.1486 -1.1800 0.6780 0.2451 1.0997 0.7160 -0.0539 0.3528 1.1395 0.0374 -0.7318 2.0596 0.8012 1.1663 1.0401 -0.9470 1.8216 0.3740 -0.7097 0.9719 -0.4166 0.7101 -0.4281 1.6223 -0.3760 -1.2287 -1.2669 -1.4811 0.0502 0.2530 0.6213 -0.3452 0.1413 -1.1219 1.0472 2.9383 1.1516 -0.9905 0.5951 -0.0993 -0.9633 0.0604 -0.4713 -1.5719 -1.5102 0.8117 -0.2818 0.2947 -1.5949 -2.8801 -0.7034 0.2235 -0.6402 0.6667 -0.1668 0.5319 -0.4828 -0.6279 -0.0206 2.2447 -0.4632 -0.9778 -0.8992 -1.1855 -0.2459 0.8556 0.4723 -0.2096 -1.7404 -1.3923 0.1974 -0.9957 -0.7810 -0.1193 0.6185 -1.4576 0.4184 -0.7982 0.5669 -0.7697 2.1700 0.4042 -0.4975 -0.7953 -1.2206 -0.2447 0.0668 0.6325 -1.4019 -0.1932 -0.5545 -1.4115 0.4189 0.0772 0.4977 -0.5436 -1.8467 1.5658 -0.0010 -0.3627 0.8612 -0.5612 0.3746 1.0824 0.0854 0.7191 0.2536 0.0214 -0.5346 -0.4017 0.5078 -0.6248 -0.9165 0.9083 0.8914 -1.0623 0.0683 -0.3860 1.3807 0.5329 1.5178 -0.7196 -0.0146 0.2486 0.1858 1.1363 -0.4694 -0.4645 -0.2659 -0.2522 -0.2611 -1.4118 -0.8795 0.6981 -1.0778 -0.6745 1.4516 -0.5152 0.7751 1.0206 -0.1376 -0.4089 0.5173 -0.3267 2.6997 -1.7813 -0.0291 -0.4022 -1.0287 -1.3187 0.9071 -0.2715 -1.4453 0.4616 -0.5305 -0.7351 0.0731 0.1556 -0.3540 -0.1844 0.9197 -1.8888 0.5232 0.9873 0.2115 -0.9025 -0.4878 1.2014 1.0724 0.0680 0.6085 -1.0497 -0.6259 -0.7382 1.7844 -1.0016 -0.6982 -1.4249 -0.0686 -0.6752 0.4431 2.1784 -0.2923 0.9090 -0.6367 0.9976 0.3374 -0.6163 -0.0185 0.0504 -0.8653 -0.1398 1.0203 0.3134 0.5976 -0.8332 -0.9394 1.6954 -0.5663 -2.1855 0.2937 0.3103 -0.5706 -0.0522 -0.6447 -0.9701 -0.6465 0.2988 0.5183 -1.6899 1.2659 1.4129 0.2254 0.6053 1.6526 -0.5810 2.1772 0.1012 0.0606 -0.2519 -1.0320 -0.2239 0.1988 0.5041 1.0451 0.3387 -0.5720 -0.0596 0.2149 -0.2291 -0.0622 1.8022 1.0777 1.2934 0.7587 0.4890 1.1821 0.2068 -1.8210 0.0577 1.8534 -2.4304 -1.8895 0.7549 -1.3913 0.3180 -0.6113 0.2367 0.6406 1.9246 -0.1444 0.7746 0.7155 0.8040 0.4152 1.3792 -0.2687 -0.6547 -0.5053 -0.3898 0.4014 0.6140 -0.6355 -0.2123 1.1168 1.3197 1.4580 -1.1188 -0.4689 -0.8884 myristoylcarnitine (C14) 1.3476 0.2251 1.4474 2.0216 0.3674 1.5257 0.9229 0.4733 2.0008 1.0368 2.0158 0.4452 0.9148 -0.1840 1.2000 -1.0659 2.6173 0.8288 0.2151 0.2853 0.3332 -1.4618 -0.7325 -1.2860 1.0437 0.9179 0.1190 0.5074 -0.4691 -0.1985 -0.8756 -0.7559 0.4540 -0.4405 0.9981 1.4758 0.3188 -0.7558 -0.5700 0.3424 -0.3285 -0.5389 1.3335 0.1326 0.8662 0.8019 -0.1481 -0.4476 -0.5113 0.2804 -0.3401 -0.0596 -0.2138 2.2993 0.0403 2.1495 -0.5657 0.9334 0.0777 1.6760 -1.4450 -0.2868 -0.6311 0.0636 -0.1957 -1.2878 0.0254 0.0710 -0.1311 -0.8197 0.9786 -1.1685 0.4888 -0.5448 0.0157 -0.6620 -0.3378 -3.5496 -0.3930 -1.2374 0.3869 0.2224 -0.4148 0.9932 1.4438 -0.9116 -1.1630 1.4664 -0.6670 -0.7727 0.6310 1.1764 -1.2296 -0.3624 2.2978 0.2314 0.0401 -0.3213 -0.6778 0.2692 0.1361 -0.5040 -0.8205 0.1046 0.1660 0.7976 2.1048 0.4603 1.1656 -1.1875 0.6608 -0.9358 -0.2135 1.7047 1.0797 -0.7204 -0.9281 -1.1113 1.1942 0.3055 0.5496 0.9071 0.5209 -1.3243 -0.2938 0.9504 -0.2559 0.4572 0.6245 0.1469 0.2136 0.5474 -0.3746 -0.6418 -3.6754 0.2618 -0.2748 0.0572 -0.7534 -2.1061 1.1622 0.2017 0.7864 -0.0460 0.8606 0.3295 -0.5071 0.8358 0.2719 0.5854 -0.0725 0.3555 0.4425 0.5798 0.3138 -0.6968 2.0043 1.2343 -0.0571 0.4212 0.6559 0.5770 -0.5438 1.1684 -0.6333 -0.8795 0.1514 -0.9570 -1.2811 -0.0362 -0.9471 -0.5177 0.8009 0.3720 -0.3630 1.9384 0.5837 -0.5088 1.0190 -0.6868 -1.7689 0.1117 0.0735 -0.6572 -3.2080 1.1608 -0.1469 0.1213 -1.2143 -3.3622 -0.8654 2.4616 -1.4248 0.4280 0.3581 -0.7063 0.1653 0.2967 0.0168 1.6465 0.3000 -0.5194 1.0855 -1.2116 -0.0250 0.9557 0.3045 0.5045 -0.4455 -1.4835 0.4913 -1.2194 -1.3117 -0.2061 0.4188 0.1161 0.7180 0.0622 0.2339 -0.7353 0.7130 -3.8037 0.3303 0.0743 -0.5845 -0.3488 0.7276 -0.2148 -1.0325 -0.4813 -0.7070 -1.1653 -1.5491 -0.9092 -0.5016 -0.7535 -1.1966 1.1920 -0.2220 -0.2872 0.7443 -0.3831 0.7675 1.7779 -1.6677 0.1446 0.5357 1.0102 -0.1695 -0.1137 0.1759 -0.1926 0.2706 0.4135 0.1847 -0.4808 -0.1787 0.5176 0.5958 -0.5158 0.6543 -1.5264 -1.2504 -0.1521 -0.4812 0.6035 -0.0591 -0.5711 0.6974 -0.6802 -0.0842 -3.4417 -0.1707 0.5375 -0.3894 -0.4630 0.9588 -0.7643 0.1224 0.1340 0.2435 -1.0474 0.1617 -0.6016 1.7026 -1.4096 -1.1217 -1.3195 1.0209 -1.4101 0.2112 0.3820 -0.9590 0.7134 -0.5196 0.3405 1.8559 -0.1996 0.1831 -0.0382 1.2223 -0.7265 0.3163 0.6557 0.0318 -1.3724 0.4886 0.1551 0.8124 -0.4270 0.4137 -1.7546 0.2325 -0.1874 0.5435 -0.2867 0.8648 -1.1164 -0.4811 0.0253 -0.1352 1.9666 -0.7728 0.2326 -0.1755 0.6189 0.5178 0.1855 -0.0314 0.7311 -0.3149 -1.0326 0.7626 0.3917 -0.1088 -0.3018 2.0100 0.4832 -1.0629 -1.4808 0.1486 0.5042 0.8487 -0.7458 -0.2527 0.1826 -0.5881 0.8214 -0.8868 -3.9929 0.0231 0.5244 1.2019 -0.0181 2.0402 -0.3154 1.3819 -1.3077 0.0188 -0.5639 -0.6503 -0.7313 -0.2514 -0.3744 0.6618 -0.2740 -0.8773 -1.4120 0.9972 -0.7038 0.9773 0.5548 0.1925 1.3388 -0.1080 1.0119 0.5723 1.5156 -1.0006 0.2538 0.6068 -2.3804 -4.2685 0.1779 -2.1391 0.3455 0.1583 0.3538 0.1865 1.2150 -0.6811 0.0718 1.0674 -0.2852 0.0386 0.9225 -0.7897 -0.6376 -0.2200 -0.5043 0.0840 1.3444 0.0625 -0.0592 0.9160 1.0833 0.4643 -0.3632 -0.8269 0.8006 myristoyl dihydrosphingomyelin (d18:0/14:0)* -0.2108 -0.1490 -0.0312 -0.2876 1.5237 -1.2901 0.2226 -0.3959 -0.6516 -0.9831 0.0058 0.8904 -0.6546 -1.2069 0.1300 0.4835 0.7962 -1.0302 1.0158 2.2788 -0.3341 0.6186 0.5719 0.3261 1.7280 1.1936 0.5855 0.4491 0.1799 0.3684 1.4179 0.4115 0.6105 -2.5980 -0.9599 1.6365 1.5971 -0.2448 0.1485 0.5678 0.9697 1.6260 2.6520 -0.5444 1.3183 0.5678 0.9084 -1.0053 0.4059 -1.7983 -0.2421 0.6668 0.1467 -1.5412 3.2029 -0.1011 0.9772 0.0702 -0.6299 -0.4515 -0.4474 0.3170 -0.1847 -0.5655 -0.0744 -0.0713 -1.0942 0.4067 0.5551 0.4657 0.1959 0.6029 0.3140 0.2272 -1.0155 -1.1528 0.8819 0.8104 -0.2248 0.0261 1.5784 -0.8516 -0.3377 0.9240 0.1602 0.6874 -0.5451 -1.0448 -1.9694 1.0010 0.0589 -0.0826 0.1950 0.3868 0.4808 -0.7202 1.1951 1.7681 1.4067 1.4507 0.8475 0.7216 0.8002 0.0424 2.1936 1.0734 -1.8809 -0.4579 -0.6428 -0.2323 0.0964 -0.6920 2.2490 0.6107 -0.2625 -0.7661 -0.0580 -0.9334 -0.6981 0.7705 -0.5300 0.8480 0.7317 -2.0104 0.5451 0.7236 -0.5452 0.0015 0.1857 -1.5420 0.6001 0.1831 -0.5586 -1.0395 -1.7142 -0.8653 -0.0199 0.0976 1.4335 0.6569 -1.3234 0.7360 1.2697 -0.0772 -1.1208 0.7649 0.1680 -0.5757 -0.4991 1.2132 1.2592 -0.9195 0.3101 -0.1712 0.9783 0.4075 -0.6812 2.4065 -0.3998 -0.3953 2.0721 -0.9880 -1.4028 1.0009 -1.7610 0.2453 1.1415 -0.8123 -1.0077 -0.9867 -3.1597 0.4724 0.7152 0.8758 -0.0662 1.8329 -1.7448 1.8756 1.3883 -0.3570 -2.1159 -0.2446 1.2322 -0.1257 0.9736 -1.1071 -1.2133 1.0935 0.0154 1.0745 -1.8712 -1.5128 0.3302 -0.6411 -1.0434 -0.2900 0.9923 0.4691 0.7804 0.5057 0.5347 0.9161 0.6068 0.6107 1.0239 0.3082 1.1910 0.8604 -0.5818 -0.0657 1.1336 -0.2936 0.3272 1.1252 -0.2781 0.8745 -0.3647 0.2819 0.0353 -1.2399 -0.6923 -2.0583 -0.1751 -0.1800 0.8890 -1.5656 -0.2051 0.7453 1.2969 -0.5964 -0.2501 1.9834 -1.4248 -1.0626 -2.6171 -1.1959 0.1955 -2.1715 1.7787 -0.4359 -0.3831 0.6215 -0.6976 0.0736 -0.1416 -0.4733 -0.0927 0.3149 -0.3967 0.4907 -1.3936 0.9615 0.0810 -0.4045 -0.2675 -0.2387 -0.6498 -0.4894 2.1207 0.1288 -0.3161 -0.4830 -0.4644 0.1908 1.0686 1.0952 0.7289 -1.2215 0.7133 0.5328 0.7320 1.1995 -0.2698 1.3573 -1.2269 0.9332 0.2005 0.3562 1.8368 -0.3392 1.7032 0.3323 -0.8998 -1.1866 -0.2728 2.0410 -1.4072 0.2489 -0.5350 0.1866 -0.4245 0.1121 -0.3791 -0.7438 -0.4241 0.4545 0.0924 -1.3357 0.1372 0.6199 1.4209 0.0557 -0.1155 0.0284 1.6680 -2.0887 -0.1445 -1.8985 -0.0010 -0.2885 0.2466 -1.0093 0.3038 -0.6634 -0.1323 0.0368 0.7240 1.0656 -0.0398 -0.0615 0.0934 1.7804 0.7292 -0.8382 -0.1548 -0.2974 -2.7271 -0.2593 -0.4601 0.2360 0.1651 -2.2700 -0.0555 -0.9346 0.4071 -0.6097 -0.3325 0.0352 -2.1877 -0.8078 -1.2321 0.3014 0.6112 -0.3566 -1.2045 -1.3090 -0.8992 0.9511 -0.2314 0.2629 -0.8448 0.4127 0.1588 -0.3813 1.0718 0.7180 -0.4231 -1.3262 -1.1247 -0.3737 -1.8729 2.7103 0.9629 -1.6373 0.6612 -1.8096 -0.7340 -0.6978 0.4949 0.2142 0.4159 -1.4410 -0.1958 0.0560 -0.2470 0.1288 0.6671 1.6479 -0.6937 -1.3145 -2.3915 0.6915 -0.8845 -1.1279 -1.4483 -0.7021 -0.7473 0.7289 0.3840 -0.0486 -0.3537 -1.8368 0.8327 -0.5758 0.7284 0.2878 -1.2505 0.4856 0.8598 0.7909 0.2327 0.0306 0.5070 0.6629 0.0267 -1.4855 -1.8345 -0.0598 -0.1550 -0.0257 myristoyl-linoleoyl-glycerol (14:0/18:2) [1]* -0.2462 1.0808 0.0246 -1.6402 -1.8432 -0.4072 -0.7285 1.5049 -0.4842 -0.3104 1.2294 0.7973 -3.1397 -0.5303 0.3278 0.4487 0.5194 -0.1922 -1.3207 -0.3527 0.9921 0.2621 -0.3184 -0.6120 -0.0903 -1.0653 -1.5628 -0.2149 0.1600 0.2885 0.0004 0.7093 0.9661 -3.5551 -0.3387 1.2061 0.3571 -0.7312 -0.4755 -0.0343 -0.2965 -2.6068 -1.0263 0.1695 0.6093 -0.6190 0.8195 -0.1849 0.0484 -3.1689 0.5195 0.3913 -0.1997 1.1282 -0.7700 -0.1740 -0.2833 -0.6881 0.3552 0.5384 0.9341 0.0132 -0.8235 0.5462 1.1686 -0.3882 -0.2249 0.5502 1.0376 -0.9051 -3.2151 0.0026 -0.7300 1.1904 0.2838 1.2932 -0.6355 0.3168 0.5516 0.7416 -0.7221 0.4713 -0.7012 0.5259 1.9759 -0.7080 0.2255 -0.7718 0.3956 -0.6216 0.3747 0.0219 0.6553 0.6264 1.0942 0.0949 0.0824 0.1590 0.3467 0.3138 0.3535 -0.3732 -0.6959 0.3389 -0.8504 0.6801 0.0599 -0.9876 -1.3114 0.6372 0.4851 -0.6610 -0.3896 -0.0538 1.6078 0.6111 -0.0954 -0.5206 1.5873 -0.6051 0.3885 1.6211 -1.4716 0.8728 -0.2057 0.4804 -0.4938 -0.5445 -0.3172 1.0203 1.1675 1.1544 0.8545 0.2231 -0.5651 0.6240 0.9594 -0.7057 -0.6200 -2.6147 -2.9616 -0.6710 -0.2680 -3.2451 0.5129 -0.5556 -0.0459 0.4448 -0.0654 -0.6164 0.7504 -0.4657 0.3758 0.6766 1.4245 -0.1579 0.1511 0.9758 0.5322 -2.1695 0.3219 -0.6388 -0.2315 -0.0499 -0.1474 -0.1637 0.0127 -0.3694 0.0611 0.2281 -0.9990 0.0328 0.5079 -0.0773 -0.7018 -2.8166 -0.1106 1.0652 0.6373 -1.7875 -2.4961 -0.6731 -0.6026 1.1215 -0.3212 0.2575 -0.3172 0.2767 0.4184 0.1325 -0.1228 1.4138 -3.0743 0.1776 0.6260 -0.1503 0.4473 0.2226 0.7389 0.1698 -0.0422 -0.4540 1.2900 -0.9164 1.4634 0.1398 0.8486 -2.3174 1.6746 -0.3914 0.1979 0.2053 -1.0891 0.4178 0.2299 0.6816 1.2023 0.0941 0.6396 1.5087 1.0092 -0.7797 1.2955 0.4905 0.7289 -0.1692 1.2834 -0.8959 -0.5513 -0.1655 -1.1593 0.8374 -0.8059 -3.3369 -0.0452 0.9329 0.7736 -0.1427 -0.8821 0.9125 0.0103 1.8386 0.8572 -3.6208 0.5442 1.2110 0.5801 -0.0208 0.3009 1.1553 0.2027 0.5233 0.3781 -0.7354 -0.2101 0.4551 0.0100 0.3460 0.2601 -0.8537 -0.2031 -1.5692 -0.4090 0.0436 0.7736 -0.1239 0.2389 -0.1247 1.5606 0.2795 0.4604 -0.0257 1.2030 1.1967 0.8902 0.6926 0.0356 -0.7794 1.2573 -0.5219 0.3871 -0.7411 0.0017 -1.3148 -1.1623 0.2479 -1.5581 -1.3612 2.1119 -0.4346 0.3785 -0.5278 -0.2783 -0.5606 0.8208 0.0402 1.3546 -0.7798 1.9243 0.7057 0.1751 0.5911 -1.8080 -0.5215 -1.0500 0.8145 1.3847 -1.3630 0.8920 0.5538 0.5427 0.3977 1.3810 1.2647 -0.2336 0.2922 1.2659 -0.0103 -0.5641 0.3566 -0.2053 -1.3559 0.4177 -0.2789 -0.1904 -0.1526 -0.4458 1.5563 1.0704 1.2825 0.4388 -1.1488 -0.3437 -1.2946 -0.1205 0.6790 1.6653 0.0734 -0.3068 0.9986 0.6003 -1.1468 0.5609 0.5699 2.0200 0.4384 0.8287 -0.3148 -0.1837 0.5222 -1.7273 1.4018 0.3525 -0.1583 -0.8800 0.2447 -0.1729 -0.9502 1.6050 -0.4403 1.2877 0.7044 -1.3556 -0.3222 0.5888 -1.1737 0.6913 -0.3168 0.5795 -0.1136 0.7084 -1.1726 0.0958 -0.2915 -0.3844 1.7838 0.5890 -0.2278 -0.1092 -0.4062 -0.4524 0.2439 0.0587 -1.4144 -0.0018 1.1388 0.2762 0.4088 0.0905 0.1825 0.2809 -3.2045 1.9137 -3.3649 -1.0490 0.4002 1.0860 -0.1264 -0.6703 -1.7196 -1.5807 -0.1421 1.2011 0.9241 -0.4736 0.5103 -1.2239 0.6781 1.5736 1.2837 myristoyl-linoleoyl-glycerol (14:0/18:2) [2]* -1.3316 0.8595 -1.6188 -0.4684 -1.1629 -0.5251 0.2491 0.7673 -1.6189 -1.2950 1.2277 0.6117 -1.5290 0.0902 0.3619 0.4269 0.1066 -0.1891 -0.3306 0.3712 0.5941 -0.3416 -1.2746 -0.2782 -1.5401 -1.5458 -1.7103 -1.4643 -1.4144 -0.1570 0.5696 1.0255 0.8605 -1.8013 -0.4403 1.0193 0.5316 0.1045 -1.4783 -0.0344 0.4897 -1.1798 -0.0790 -1.7330 0.6042 -0.2025 0.5966 0.4836 -0.2663 -1.5481 0.5545 0.7416 0.5746 1.0864 -1.3110 -1.6952 -1.5748 -1.2857 0.7878 0.3078 0.9528 0.1679 -1.6963 0.6586 1.4049 -0.0502 0.5203 0.9974 0.5660 -1.4127 -1.5785 0.7532 -1.6211 1.5122 -0.0678 1.1789 -1.4268 0.6749 1.1081 1.0258 -0.5871 1.1062 0.1272 1.1253 1.9008 -0.1129 0.4695 -1.5090 0.8638 0.3373 0.0346 -1.5075 0.7441 0.1718 0.8958 -0.0841 -0.1796 0.7256 -1.4951 0.5958 0.4944 -0.8630 -0.4155 0.4849 -1.4884 0.5788 0.3784 -0.1522 -0.4211 0.2467 0.3113 -0.4811 -1.4239 0.4212 1.4992 0.9544 -1.4012 -0.4067 1.5966 -1.7846 0.2486 1.5628 -0.7138 0.8089 -1.7661 0.8340 -1.6821 0.4952 -1.6255 0.7598 1.3329 0.7774 0.8371 0.0002 -1.6174 0.3670 1.1685 0.5061 -0.1156 -1.1850 -1.4119 -0.6358 0.1015 -1.5982 0.6308 -0.1902 -0.1074 0.9647 0.3943 -1.4308 1.0049 -1.4060 -0.1762 0.3724 1.1628 -1.4188 -0.1767 1.0720 0.8149 -1.1896 -1.5319 -0.0562 -0.6661 0.2779 0.0011 0.0812 0.0271 -1.6496 0.3102 0.0949 -1.0442 -0.3138 0.9706 -0.4538 -1.7394 -1.3178 -0.2603 1.0923 1.2395 -1.3626 -1.5051 0.1299 -1.6201 1.0806 -1.4105 0.1192 0.4913 -0.2380 0.8678 0.5173 0.1692 1.2530 -1.4864 0.3146 0.9369 0.4091 0.1357 0.0790 0.5806 -0.1577 -0.1897 -1.3946 1.1789 -1.5078 1.3944 -1.3039 0.7627 -0.9903 1.5688 -0.6264 -1.5374 0.4607 -0.0170 0.0359 0.0590 1.0843 0.6058 0.5075 1.0736 1.2678 0.6363 -0.5662 0.9051 0.1877 0.8146 0.0579 0.6899 -1.8145 -0.4320 0.2950 -1.3294 0.6121 0.1315 -1.6588 0.3868 1.0052 0.9360 -0.1833 -1.7143 1.4505 0.0199 1.5640 1.2144 -1.8447 -1.6799 1.1765 0.6900 0.2149 0.5723 1.2217 0.7542 0.1122 0.8399 -1.6268 0.3508 0.5292 0.3795 0.6388 0.6718 -0.0739 -0.5430 -1.4599 -0.6500 -0.0774 0.9544 0.7231 0.1207 0.3176 1.1449 -0.3110 0.9544 -0.4405 1.2028 0.9022 0.9427 0.5558 -0.1376 -0.1958 1.2234 0.3660 0.1896 -1.7563 0.1068 -1.1694 -1.8513 0.4826 -1.6881 -1.5946 1.7283 -1.8046 0.7894 -0.4504 0.0894 0.1045 1.0645 0.7133 1.1013 -0.0697 1.4940 0.4513 0.8981 1.1255 -1.6096 -1.7332 -0.0916 0.8339 1.1620 -1.3884 1.1423 0.9812 0.8362 0.5545 1.1210 1.5035 -1.8436 0.1782 0.8562 0.4805 -1.5348 0.7834 0.2211 -1.7261 -0.1818 0.2010 0.0134 0.0085 -0.1491 1.4680 0.7357 0.8338 0.5238 -1.5209 0.0273 -1.4635 0.0479 0.1733 1.6797 0.5472 0.1902 1.5171 0.9839 -0.9281 0.6101 1.0057 1.7771 0.6659 0.8728 -0.5695 0.0488 -0.0455 -1.4297 1.4555 0.4169 0.3379 0.1200 0.4907 -0.6243 -1.6938 1.6708 0.3308 0.9549 1.3004 -1.6159 0.5371 -0.1588 -1.7530 1.2644 -0.4469 0.2345 0.5061 0.5098 -1.6967 0.1525 -0.0200 -0.6365 1.4467 0.5109 -1.8008 -0.4339 -1.7131 0.2748 0.6260 -0.4509 -0.1503 0.7047 1.1514 -0.0139 -1.6826 0.5341 0.1807 0.6497 -1.5723 1.4738 -1.6773 -1.7825 0.6131 0.9022 0.5719 -0.1313 -1.6897 -1.8925 -0.1657 0.6000 0.7583 -1.8496 0.6985 -1.6483 1.1339 1.3149 1.2559 N1-Methyl-2-pyridone-5-carboxamide -0.5238 -0.2706 1.5033 -0.6151 1.1441 0.7425 0.3401 -0.6126 0.0364 0.2867 0.1645 0.8197 1.8318 1.7084 -1.6080 0.0052 0.4281 -0.9749 1.2032 0.3045 0.3303 -0.1771 0.2137 0.0891 0.4889 0.9729 0.5619 1.3942 1.4298 -0.1809 -1.4655 1.0013 2.2472 0.0246 1.4927 -0.3370 0.8625 0.2694 -0.1780 1.7304 0.6451 1.3742 -1.7200 0.4680 0.2717 -0.1876 -0.0159 -0.5050 0.5625 1.9858 1.0464 -0.3261 0.7034 0.0244 0.0067 2.4076 0.5621 -1.2015 0.1767 0.6725 -2.9810 -0.0707 -0.4847 -1.0439 0.8073 -0.2181 -0.5334 -0.8932 -0.3709 -0.5321 0.4537 -0.3905 -0.1694 1.6831 -0.8840 -0.4986 2.1174 2.0619 -0.4654 1.2710 1.7625 -1.4073 0.1507 -0.2425 1.1301 -0.0854 1.9569 -0.6378 0.9482 1.8599 0.8348 0.1183 -0.8106 -0.4992 1.3932 0.2182 0.5331 -0.1811 0.7069 -1.0466 -0.0603 1.7462 -0.2188 -0.6824 0.8937 -0.8511 -0.0288 -0.4165 0.3923 1.3808 1.3195 -0.8980 -0.3430 -0.2534 -0.3662 -0.7080 -0.7008 1.5059 -1.3623 -0.2849 1.3718 -1.6539 0.1499 0.4792 -0.9234 -0.1931 -0.5862 -0.6990 -1.1615 -1.9148 1.5351 1.1548 0.8306 1.2535 1.7578 -0.2584 0.8763 -1.1117 -0.7601 0.8722 -0.7965 -1.0034 0.2771 0.6363 -0.2334 1.5558 -1.4785 0.4740 -1.4933 0.3823 0.1875 -0.3102 0.2952 0.1591 -1.4798 -0.1733 -0.7212 -0.0467 -0.3586 0.0625 -0.2871 -1.9630 -0.1831 0.1000 -0.2251 -0.5131 0.0141 -0.9649 -0.4332 -0.5300 1.4054 0.5720 0.3141 -0.0415 -0.3587 -0.8269 -1.1630 0.1270 -0.2080 1.0571 -0.4175 -0.7161 -0.6450 0.2644 -0.4039 0.7510 0.3454 -0.6982 -3.1256 0.8942 1.2220 0.0714 0.0898 0.3363 -1.1679 0.2475 -1.2313 -0.8685 -0.1662 -0.5591 -1.2389 0.3504 -0.2236 0.2574 -0.4585 0.0469 0.3133 0.1851 -0.2084 -0.6702 2.2661 0.0996 1.5728 -0.2457 1.7281 2.0077 -0.2720 -0.6454 -1.9142 -0.2813 -1.5169 -1.3307 -2.0494 -0.4217 0.4116 -0.3582 -0.4784 0.1717 1.9882 1.6612 0.9121 0.1109 -1.9525 0.8007 -0.0166 -1.1070 -0.3062 0.3606 -0.9299 -0.9953 -0.4157 -2.0460 -1.7676 -0.1464 -0.7232 -0.9342 -1.1835 0.4369 -1.0003 -0.7644 0.2987 1.0703 -0.1678 -0.4881 -0.7520 1.2849 -0.6948 0.7964 -2.3251 -0.7342 -0.6130 -0.5262 -1.7007 0.4534 -0.2323 -0.4744 -0.9309 -0.4280 -0.3286 -1.7074 0.0718 1.1782 -0.4248 0.6451 0.9979 0.7069 -0.7322 0.8841 1.6080 -3.2224 1.2190 0.7885 -0.5405 -0.7185 1.5143 -0.3870 0.9592 -0.0166 -1.1201 -0.5920 -0.0253 -0.0250 1.9397 0.8027 -0.0181 1.1421 1.6166 1.0566 1.1847 1.4205 -0.7859 -0.7272 -0.4850 0.9922 0.1019 0.9436 -1.7533 -0.6312 0.5779 0.4881 0.6333 -0.8313 -1.8007 -0.4660 -0.2735 -1.0067 -0.1635 0.6791 1.0053 -0.4170 0.6999 0.4050 0.5932 -0.3667 0.5882 1.2458 -0.4804 -0.4804 -0.6724 -1.2288 -1.1040 -0.3664 1.3777 -0.7708 -1.0093 -0.6302 0.0872 -1.0609 2.3341 -3.1768 -0.6652 1.6306 -0.3494 1.7323 -1.7335 -0.8425 -0.6475 -0.2369 0.2628 0.2429 1.7723 -0.6136 -1.4842 -1.4429 2.2152 -0.9191 -1.0320 0.6082 1.0740 0.3051 -0.8358 0.9872 0.0555 -0.1540 0.2629 -1.2173 0.2383 -1.4655 -1.9397 0.7225 -0.5591 0.5117 0.0139 -0.8878 0.1068 -0.5430 0.0672 0.1486 -0.3478 0.2717 0.7302 1.4631 1.0389 -0.0810 0.3292 0.3727 1.1421 0.1948 0.3770 0.6886 1.1990 -0.2652 -0.8314 1.0653 -0.0128 -1.0681 -0.5744 -0.3321 -0.0096 -0.5028 -2.4981 -0.9039 0.0276 0.6316 -0.2820 2.5229 -0.5713 -0.2428 -0.4338 0.3268 N1-methylinosine 0.3733 -0.5904 0.4740 -2.4620 0.6059 0.1882 -1.0395 1.5215 -0.1297 1.6736 0.6133 -1.9050 -0.2292 0.6687 -0.0169 -0.5180 0.1081 1.0804 -1.3808 -0.8955 -1.2096 -0.4013 0.6493 0.3430 0.0789 -0.0192 0.6936 -0.0042 0.8421 -0.1259 -0.2032 -0.6375 0.2412 -2.1005 -0.0390 -0.2973 0.4587 -0.2078 -0.7472 -0.4407 0.7327 -0.6753 -1.4965 0.9483 0.3284 -1.1378 -0.4110 0.2993 0.1156 0.2140 0.6464 -1.2049 -0.1165 2.3866 -0.6761 -0.0391 0.8711 -1.5610 0.0034 0.2451 0.0039 0.9128 -2.3661 0.4098 -1.8039 -0.9635 -0.0459 -0.0891 0.2799 1.5878 1.2600 -0.9046 0.7229 -0.6256 0.3704 -0.5166 -0.0210 -0.5785 -0.6559 -0.5762 -0.9215 -0.7208 -2.3921 -1.9468 2.2051 -0.9177 0.4242 0.7345 1.5927 -0.3513 0.7372 1.0294 0.2321 -0.7886 1.7179 0.6741 -1.3037 -0.2699 -0.6743 0.6106 0.7480 -0.0176 -0.8958 -0.3134 0.5194 1.6766 0.8097 -1.7885 -2.1194 1.5383 0.5946 0.3187 -2.1027 0.2408 0.6021 -0.1305 0.3746 0.0030 0.0837 -1.1901 1.2800 0.5632 1.0121 -1.7322 -1.9360 0.0096 -0.8012 -0.2635 -0.7854 -0.5816 -0.8817 0.8518 -0.0036 -0.1216 0.4009 -0.1033 -2.2514 -0.0490 0.8233 -0.1427 0.3955 0.5854 -0.8509 -0.4478 1.1600 -0.4834 0.1573 1.7290 -0.0733 -0.6057 -0.9564 0.7586 -0.6961 0.8171 -0.3819 0.9548 1.0574 -1.2567 -0.8812 -0.2533 0.3539 -0.5429 0.1912 -1.2607 0.7000 0.6146 -0.4081 -3.3449 -2.4118 0.3341 0.1883 -0.5062 -2.0693 0.7496 0.3581 0.2628 1.1058 0.1097 0.8794 -0.6102 0.9569 -0.9160 -1.5089 1.3505 0.0474 0.8424 -0.5725 0.1918 -0.0456 -0.6015 0.0620 1.2753 -0.0963 0.6364 0.1697 -0.3331 -0.9310 -0.8678 0.3722 0.4161 -0.3357 0.2639 1.1110 -1.1490 -0.2043 0.7014 -0.5057 0.7865 -0.2255 1.2136 0.6758 1.2333 -0.7119 0.0356 -0.7808 -0.3161 0.2608 -0.9444 -2.3652 0.0090 -0.9891 -0.1147 -0.1533 -0.4386 0.3136 -0.3138 -1.0088 -1.4393 0.8001 -0.2536 -0.4390 -0.3730 -0.8476 1.4201 -1.7850 0.5872 -0.0125 1.2291 -0.8785 1.1165 1.0436 -0.2911 0.7160 -2.7493 -1.5273 0.9110 -0.2131 0.0247 0.4341 -0.3118 -0.4380 0.8188 -0.7795 -0.4578 -2.0122 -0.1303 0.6110 -0.0414 0.4859 -1.9123 0.9726 -0.3374 -2.6434 -0.1377 -0.8546 -0.4731 0.0872 -1.1594 1.2776 -2.6069 -1.6493 1.0424 -0.2212 0.9134 0.1712 0.0029 0.2862 -1.4340 -0.9539 1.0532 -0.2106 -0.2708 0.0694 0.9188 -1.1880 -1.9869 0.4432 -0.0202 -0.5365 0.4005 0.3953 0.0115 -0.6375 0.3204 -1.2624 -0.7450 0.4559 1.3529 -1.9856 0.2735 -0.4456 0.1695 1.2529 0.2288 -0.2218 -2.1391 0.2784 1.0287 0.2138 -0.7009 1.4546 0.2147 -0.3234 -0.0909 1.7751 0.4353 0.2866 0.3392 0.8647 -0.1938 -0.2028 1.2754 -1.2981 0.1395 0.2226 0.4617 0.2438 0.7210 0.8237 0.8181 -0.0038 0.4838 1.5163 0.4442 0.3908 0.7467 1.1434 0.3482 -0.4340 -1.2882 -0.3986 1.0868 -0.2994 -1.0384 0.3601 1.3309 -0.0063 -0.0828 0.6499 -0.0709 0.4139 2.6259 1.9706 -1.2452 3.0738 -1.3702 0.5597 0.9628 -0.0712 0.1796 0.8225 -1.3010 0.0748 0.6927 1.7325 -0.1677 -0.2397 -0.1559 0.8942 -1.0192 1.1458 1.6664 1.0391 -1.2250 0.4679 3.7337 -2.2027 1.4777 0.1033 1.3323 0.7005 0.1275 0.3943 1.2764 -0.3378 1.5393 -0.2348 0.2082 -0.7373 1.2964 -0.3789 1.7705 1.8910 1.1269 -1.0701 -0.7512 0.2246 0.4629 -1.7338 1.2042 0.0022 1.7209 0.2828 1.2841 -0.1842 0.9534 0.6709 0.4470 0.6610 -0.4515 N1_N12-diacetylspermine -3.1926 -0.1697 -1.5654 -1.2105 0.5987 -1.2972 -0.4201 0.0930 -2.2151 2.9115 1.4878 -0.1617 1.2432 -2.1352 -0.9396 -0.6148 -0.2472 -1.0036 0.7868 -1.2317 0.2353 1.2643 -0.1925 0.0354 -0.5883 0.7570 0.2664 -0.7884 -0.7124 -0.7575 0.4760 -1.5902 -0.4314 -0.1468 -1.3210 3.1399 -0.3107 -0.2506 0.8525 -1.3081 -0.0967 1.0750 -1.3994 -0.7272 1.0240 -0.0985 0.8373 -0.1194 0.7334 -4.1519 -0.4661 -1.2166 -1.4991 0.8691 0.5351 1.1584 0.8110 -1.9935 0.1537 -1.1876 0.3258 -0.5179 -0.1199 0.2933 -2.5485 -0.1389 0.2902 0.2851 -0.1532 -0.3174 -0.8151 0.0096 -0.2769 0.7117 0.0589 -0.7301 0.0916 -0.0809 -2.1513 0.0291 1.0494 -0.6042 -0.1820 0.2076 3.1371 -0.1409 0.5948 -0.3379 -0.4782 0.8695 -0.2099 -0.6859 -0.0170 -1.1876 0.5337 -0.1800 -0.9440 -1.3497 0.1364 0.0942 0.7066 -0.6541 -0.1929 -0.4828 0.9774 -0.2239 1.4755 -1.3591 -0.3501 0.4350 -0.7051 -0.9270 -0.0251 0.5919 2.1593 0.4014 0.0973 -1.7390 0.5507 0.3930 2.0939 0.3123 0.9864 -0.7899 -0.8443 -2.2455 0.0488 0.1560 -0.4584 -0.2401 -0.8647 0.9928 -0.7287 -1.0524 -0.0541 0.7080 1.0259 -0.3552 1.0479 0.7324 0.4955 0.6264 -0.9550 -1.7429 -0.5717 0.8467 -0.6820 -0.3718 0.8596 0.5424 -0.3762 0.8435 -0.0305 -0.3286 0.1637 0.1483 -0.9766 -0.8269 -0.7441 -0.8234 0.4138 -0.0447 -1.0802 -0.4017 0.8114 0.7377 -0.3153 0.4410 -0.5725 0.0540 -2.0407 -1.3797 -0.1174 -0.6419 -0.8964 -0.4966 1.0488 -0.1390 1.3132 -1.0473 -0.6958 -0.7931 0.1752 -0.1448 -0.5623 0.5627 -0.5657 0.7143 -0.5351 -1.3285 0.2547 1.2635 0.6548 0.6936 -0.5157 0.5125 -1.1492 -0.5761 0.7763 -0.6916 0.2388 0.8287 -0.2194 0.0275 1.5606 0.7947 -0.6810 -0.1045 -0.6601 -1.2198 1.0229 0.3449 1.3621 0.9248 0.1798 -0.5111 2.8936 1.0392 -0.7366 0.1239 0.4308 0.4525 0.9927 0.9701 -0.1693 0.0098 0.3150 -0.6204 0.8861 0.7607 -1.0867 1.0863 0.4497 0.3942 0.3366 -1.3146 -0.5732 -1.6390 0.5183 0.0819 -0.6563 1.3221 1.2055 -4.6782 0.0962 2.0673 -0.6356 -0.1848 -0.1708 -0.4732 1.7132 0.1097 1.1042 0.5824 0.3477 0.1902 0.9157 0.3749 1.4686 0.5656 0.6588 -0.6168 0.4891 1.0162 1.1269 -0.6797 0.6783 -0.6316 0.3817 1.3933 0.0390 1.3258 0.9105 1.8485 -0.6015 0.4175 0.6008 0.3989 -0.2124 -0.3787 0.7131 0.6061 0.0232 0.1350 0.7214 -0.6503 1.1560 1.7358 -1.0218 1.3879 -0.9053 0.3968 0.1749 -0.0119 -2.8927 -0.9073 0.7683 0.5262 0.7741 1.0455 -1.4151 -0.2854 -0.5715 0.8793 -0.4016 0.7358 2.3882 0.8041 0.0048 -0.4371 -0.2733 -0.2255 0.3240 -0.4146 1.1509 0.6869 0.1828 0.2880 -0.7186 0.0932 1.3753 0.5093 -0.1228 1.0901 -0.0492 0.1104 0.1546 -0.4355 0.5956 0.2824 0.9648 -0.0925 1.2523 0.6967 1.1148 1.5829 0.1877 0.9635 0.6102 -0.1927 -0.7761 -2.1338 0.6497 -0.2213 -0.9682 0.1155 1.6181 0.7566 -0.1137 0.6237 0.1901 0.2252 0.3340 -0.3901 -0.2718 0.2062 0.3513 0.1958 -0.0260 1.2581 -0.7533 1.2451 0.5368 -0.7735 0.6961 -0.0870 0.7465 -0.9622 0.0377 0.6252 -1.4618 -0.7992 0.7286 -1.0268 1.6668 -4.1863 -0.6007 -0.7552 0.4613 0.1285 0.5550 -0.0112 -0.2781 0.0488 -1.7847 -0.0160 -0.4996 -0.7703 -0.3291 0.8283 -0.1791 1.4898 0.6755 -1.2940 -0.9481 0.9972 0.3059 -0.8874 0.1105 -1.7941 -0.4994 0.0914 -0.5282 -1.3935 -1.7374 2.2910 -1.6352 -0.1426 -0.2635 0.8908 N2-acetyl_N6-methyllysine 1.0901 0.2839 0.6852 0.4148 0.7283 -1.3021 0.7861 -1.3486 -1.2731 1.4599 0.1084 0.1895 1.1318 1.5268 -0.6144 -1.2903 1.0754 1.1620 1.2595 -0.5757 -1.0779 1.3950 0.9172 1.5877 1.9722 0.4794 -0.2685 1.0838 1.9150 -1.2334 -0.3093 0.6231 0.4990 -1.4527 0.4687 0.3298 0.5477 0.0961 -1.1301 -0.2370 -0.1147 2.0285 1.9889 0.6697 -1.0900 0.0814 -0.2135 0.5521 -1.2029 1.6866 1.2053 1.6304 0.9467 -1.3083 -0.9630 0.7134 -1.2312 -0.9478 -1.2655 -1.3216 -1.0866 1.7944 0.5923 -1.1390 -0.8921 -1.3925 -1.2377 -1.4597 1.8484 1.1277 -1.2313 -0.0709 1.8818 -0.2785 -1.2214 0.2744 0.6086 0.6677 1.3051 -1.2637 1.9808 -1.1617 -1.2200 0.5816 -0.5338 1.1270 -0.5609 0.0480 1.2774 2.1764 0.6441 1.8611 0.9649 -0.9337 -0.0705 -0.8777 0.1927 0.4388 0.8534 0.8254 -1.3535 0.4915 0.1715 -1.4165 -0.6593 0.4329 1.1000 -0.2362 -0.0778 1.1551 0.4908 0.7103 -0.0764 0.3870 0.3815 1.0646 0.6833 1.0790 -1.3176 0.6840 -1.1204 0.7972 -1.2510 0.3800 -1.4204 0.4037 0.7228 0.1277 -1.2964 0.1059 0.7505 -0.0062 -0.9841 0.2436 -0.2908 0.0137 0.0485 0.9563 -0.2276 1.5311 0.5507 -1.2780 0.9688 0.6375 -0.4436 -0.0591 0.0426 0.3374 1.0003 -1.0954 1.1913 0.5403 -1.1324 0.5191 0.3992 -1.0769 0.5242 1.2057 0.1822 0.6661 -1.1912 0.3991 0.0366 1.7998 -1.1735 1.1112 0.7309 -1.3077 -1.3651 -1.2170 0.6324 1.2296 -1.4832 0.7826 -1.3819 0.9010 0.8093 -1.0685 0.8707 0.2818 0.4915 0.6809 -1.2745 0.3649 0.6620 0.2932 0.4002 1.6057 -1.0600 -1.1337 -1.4624 -0.0269 0.6704 0.0401 1.2953 -1.3138 -1.1706 -0.6244 -0.0293 -0.4720 1.0781 0.1873 0.4636 -0.0852 -1.2658 0.4891 1.3816 -0.6507 0.0696 -0.5888 -1.1920 -1.2317 0.6321 0.1082 -1.3812 -1.2769 0.2865 0.7601 -1.4769 -0.6731 -1.2877 -1.3322 0.4409 -0.3672 -1.5192 -0.4213 -0.1473 -1.4721 -1.3214 0.7865 -1.2822 0.7078 -1.1914 1.2045 -1.4025 0.9479 -0.3396 0.1842 -0.3671 1.0402 -0.4817 -1.4383 1.3147 1.4836 -0.3153 -0.5630 0.5346 -1.4176 0.7359 -0.4582 0.5988 -1.3661 0.1148 0.4009 -0.6650 -1.1931 0.6565 0.0013 -1.2219 -0.2665 1.3564 1.0995 1.2072 0.9302 0.4327 -0.9805 -1.3567 -1.4220 0.5154 1.1451 -1.3494 -0.0136 -1.3903 -0.5228 -1.3312 0.0013 -1.2980 0.9079 0.5386 1.0798 -0.3253 0.8174 0.5823 0.4082 0.7503 0.8876 0.2801 0.7913 -1.3900 1.3656 0.2582 -0.6955 0.6570 -1.0404 -1.2277 1.3129 0.5002 -1.5865 1.0653 0.9976 -1.2411 0.2614 0.6993 -1.3805 -0.0218 0.2460 0.0258 1.6537 -1.3857 -1.4473 0.3075 -1.3842 -0.1847 -1.3838 0.4032 -1.2868 0.8165 -1.2704 -1.1918 0.4536 0.6229 0.6439 0.8261 -0.0069 0.1110 -0.4265 -1.2835 0.5014 0.0663 -1.3984 1.1806 0.2493 0.9657 0.6613 0.1749 -1.4965 -1.3414 0.9011 0.9141 0.5055 0.5121 0.1668 1.9924 -1.3915 -1.4013 1.2124 -1.1297 1.1693 1.7338 -1.4297 -1.0851 -0.7685 -1.3390 -0.3574 -1.3487 -0.8246 -1.1098 0.7244 0.3179 0.3997 0.1147 1.5297 1.0569 1.0508 0.0838 -1.4154 -0.5048 0.4386 -1.4570 0.9517 0.2498 1.8701 -1.2473 -1.2472 -1.5704 0.6721 1.6556 0.4132 0.5377 -1.3675 -1.2797 2.2226 0.1985 -0.8627 0.6127 -1.6015 0.8383 0.5116 -1.5444 0.7447 0.6512 0.8310 0.6966 -1.3423 0.7886 -1.4392 -1.5365 -1.3346 -0.5274 0.3536 0.7839 0.0402 -1.2176 1.0504 0.1619 -0.7051 -0.1501 -0.1298 -1.2882 -1.5333 N2-acetyl_N6_N6-dimethyllysine 0.2300 0.4048 0.3742 -0.6502 0.9651 -1.4925 -0.0865 -1.2328 -2.0423 1.4551 0.5389 -0.0299 0.9616 1.7484 -1.2568 -0.1003 0.7330 1.4721 0.9124 -0.6801 -0.4117 0.8283 -0.1284 1.1348 1.5397 0.0683 -0.7343 0.8250 1.7074 -0.9200 -1.5200 -0.2061 0.7982 -0.4831 0.5550 -0.0658 0.4117 0.0479 -0.9611 -1.6186 -0.9366 1.9814 1.2783 0.2121 -3.1005 -0.4931 0.7215 0.6608 -1.1281 1.4680 0.8309 1.3776 1.1828 -0.4901 -2.9295 0.5150 -1.1372 0.0718 -0.4115 -1.3401 -0.8792 1.6230 0.4090 0.4898 -1.0429 -1.2144 -0.2740 -1.1023 1.5998 0.6790 -1.2364 -1.7322 1.3853 -0.2242 -0.7108 -0.0691 -0.0033 1.1218 0.4726 -1.3746 1.3083 -0.1019 -0.4885 -0.1107 -0.6327 0.4623 -0.0369 -0.1645 1.1791 1.8599 0.8071 1.6776 1.3473 0.7652 -3.2493 0.0903 1.1653 -0.1159 0.4742 0.2425 -1.3485 0.6787 0.0349 -1.0584 0.1901 0.9227 1.2798 -0.0386 0.3408 1.1852 0.3846 0.8782 -0.1378 0.2001 -0.0039 0.5247 0.6077 1.0900 -0.5849 0.2314 -0.3111 0.9927 -1.3241 0.9235 -3.1548 0.3264 0.8680 -0.5842 -1.7031 0.2472 0.4428 -0.2739 -0.7566 -0.3054 -0.5534 -0.1602 -0.6857 1.0213 -0.4962 0.8919 1.2500 -1.3148 0.3727 0.5741 0.4161 -0.1050 -0.6636 0.3162 0.8934 -0.9456 0.6486 0.0903 -0.2303 1.0972 0.5877 -1.0538 -0.8653 1.5791 0.2070 0.7650 -0.0525 0.2577 0.5251 1.6958 -0.2378 0.6539 0.1542 -0.5769 -0.1535 -0.8251 0.2202 1.1899 -1.6298 0.7612 -0.5553 0.7857 1.4814 -0.4870 0.5932 -0.6153 0.3991 0.4700 -0.1979 0.0462 0.8545 0.9212 0.6640 1.5893 -0.7965 0.6894 -1.3543 -0.0993 0.5282 0.3168 0.9063 -1.5687 -1.7185 -0.9180 0.2383 0.2235 0.5079 0.5141 0.6571 -0.0552 0.5964 0.5989 1.1894 0.3065 -0.1957 -0.5590 -1.9770 -1.6220 0.6568 0.8538 -0.7715 -1.5863 0.3082 0.2773 -1.6183 -1.0712 -1.4005 -2.0255 0.6744 -0.4810 -1.8289 -0.7792 -0.9390 -0.3312 -1.4409 0.2719 -1.3528 0.7510 -1.5943 0.5241 -2.2439 0.4409 -0.4547 1.3750 -0.5072 0.9909 -0.8264 0.0851 0.9917 0.2874 -1.0236 -0.9413 0.0742 -1.1670 0.5076 0.0691 0.0690 -2.0424 0.4393 0.4523 -1.1591 -1.1213 0.3232 0.3591 -0.7124 0.1932 0.8685 1.2571 1.2719 0.9218 -0.0322 -0.5908 0.2805 -1.2634 0.0691 0.7791 -1.1457 -0.4581 -2.0069 0.0999 -1.2962 -0.1148 -0.2039 0.5302 0.8353 0.7983 -0.0484 0.7487 0.7405 0.7756 0.6791 0.3581 0.0318 0.8506 -0.4162 1.2212 0.1647 -1.5289 0.8956 -0.5765 -0.4014 1.6184 0.3132 -0.2046 0.7820 0.4487 -1.8657 0.5129 0.9412 -1.1321 -0.7998 -0.4385 -0.0741 1.5886 -1.5260 -0.3599 0.7967 -1.8657 0.1264 -0.5234 0.8193 -0.1176 0.5103 -0.7879 0.1145 0.1675 0.7876 1.0294 0.6934 0.4909 -0.1724 -1.2482 -1.1222 0.6254 -0.2659 -1.2674 0.8588 0.7140 1.6438 1.2247 -0.0718 -1.3577 -1.1231 0.9763 0.7113 0.6113 0.0208 0.5190 1.3831 -1.3122 -0.1583 1.5625 -0.5998 0.9994 1.7005 -0.6314 0.1629 -1.2928 -0.1047 0.0519 -0.3161 -1.7218 -1.5036 0.4192 0.6165 0.3022 -0.1585 1.4043 1.0667 0.7837 -0.1087 -0.5509 -0.4267 0.3566 -0.9743 0.8731 0.3666 1.9449 -0.3768 0.0991 -1.9166 0.9788 1.6123 -0.1656 0.5523 -1.1119 -0.5676 2.3883 0.5729 -0.5116 0.9688 -2.8744 0.5767 0.5488 -1.3587 0.3913 0.3111 0.7687 0.6102 -2.0595 0.7111 -2.1290 -3.7096 -1.4253 -0.1412 0.3635 0.8029 -0.4609 -0.0718 1.5917 0.1539 -1.0382 0.1770 0.2182 -1.4275 -0.7198 N-(2-furoyl)glycine -0.6012 -0.6750 0.5446 -1.4220 -1.1022 -1.0623 1.1382 1.1315 0.0895 -0.4229 -1.3721 -1.0087 -0.7603 1.1597 3.3683 -0.3237 0.3544 -0.5126 -0.0214 -0.7442 -0.5596 -0.1036 -1.1947 -0.0368 -0.3372 -0.1719 -1.2088 -1.4065 -1.3545 -1.5074 0.0377 0.2725 0.7861 -0.0840 0.2195 -0.1281 -0.0952 -0.2779 -0.3302 1.2603 -0.2070 -1.0986 0.6756 -0.2236 -1.3661 0.7536 -0.3630 -0.2560 -0.1803 1.0259 0.1322 -0.3648 0.0857 -0.8284 -0.5280 -1.6416 0.0571 0.7419 -0.2854 -1.5997 -0.1317 -0.2283 0.3080 -0.6185 0.8671 0.9638 -1.0450 -1.7567 -0.6643 -0.0125 -1.5108 -1.6179 -0.6819 0.5172 0.4612 0.4827 -0.1185 -1.4915 0.1726 1.8586 -0.7795 -1.4438 0.2557 -1.6623 -0.2613 0.7185 0.1505 -0.1897 -0.6491 -1.2480 -1.0561 -1.4436 0.5195 -0.1624 -0.5381 -1.4332 -0.4739 -0.7786 -0.5992 -0.1762 -0.0134 0.8714 -0.2788 0.3822 -0.6866 2.8117 -0.8747 0.2917 -1.8291 -0.0268 0.3693 -0.0008 -0.2802 -1.5085 0.4071 0.8820 -0.0831 1.9792 1.2527 -0.6423 0.1811 -1.4577 0.2753 -0.1080 0.8641 0.7627 -0.1969 0.7140 -0.4400 0.2371 1.5415 1.9339 -0.5215 0.7079 0.5900 -0.6186 1.1413 0.0048 0.0205 0.0626 -1.3188 -0.1612 -0.4406 -0.3507 -0.6044 -0.6277 -0.9377 -0.3108 -1.4168 -0.4073 0.1380 -1.3326 -1.4158 -0.0238 -0.3745 -0.3991 -1.4881 -1.3400 1.8129 -1.1385 -0.1647 1.3259 0.6049 -1.5048 -0.5054 0.3351 2.8052 0.1057 0.4427 -0.0760 0.2510 -1.5250 0.8633 -0.2694 -0.0557 -1.2610 -1.3223 -0.0960 -0.2745 -0.4647 2.0320 0.4995 -0.1026 -0.3471 0.2577 -0.7868 -0.2287 -0.1069 -0.3967 0.7154 -0.1745 0.8690 -0.3689 -1.3742 -0.0900 -0.5782 0.1352 0.4705 -1.5299 -1.2613 2.4366 -1.3405 -1.3849 0.9937 -0.3697 -1.2455 -0.6098 -0.9097 0.6763 0.1174 0.8145 0.4115 0.0193 2.3490 1.2816 -0.0965 1.1162 -0.0794 1.8302 -0.0317 0.0917 2.1659 -0.3570 0.3180 0.3745 -0.0209 -0.0692 0.2169 0.3508 0.0946 2.0815 0.6689 -0.6614 -0.3006 -1.6939 0.9369 -0.0707 -0.5326 0.1413 -0.1734 -0.3616 0.2940 -1.5488 -0.4157 0.3439 -0.2308 1.6213 1.5163 -0.0714 0.8359 0.2103 -0.1152 1.9739 -0.5861 1.0137 0.2373 -0.5701 1.5009 -0.9391 2.0875 -0.2476 1.3412 -0.4079 -0.8985 -0.7445 -1.2536 -1.6471 -0.0535 0.7683 -0.2733 0.5146 1.2251 0.8718 0.6407 -1.6202 0.0277 -1.5875 -0.7969 -0.0519 -1.3262 1.7165 0.1361 1.1439 2.7275 -1.7775 0.0710 -0.6409 0.3454 -0.4026 0.1378 1.3311 1.9047 -0.1126 -0.3686 0.3579 2.4789 0.0200 0.3070 0.9837 -0.1621 -0.1938 0.4451 -1.5744 0.6825 0.7223 2.4980 0.6100 -1.3344 -1.6630 -0.7496 -1.1967 0.8533 0.2853 0.0900 0.9030 0.0477 0.5736 0.3983 1.2533 1.5194 -0.1415 -1.0059 -0.5366 2.3761 0.2605 -1.2357 0.1221 -0.0845 -1.5999 -0.0402 -0.2476 0.3218 -0.8231 -0.1377 -0.0894 0.5237 1.9916 -0.8488 0.1741 -0.1022 1.1815 0.7956 0.6232 -0.1446 0.2409 -0.0465 0.5345 -0.1957 -1.6298 1.8993 -1.3601 -0.7664 -0.3009 -0.7383 -1.6303 -0.2861 -1.7440 0.6328 0.9470 2.0212 0.4816 -0.8907 -0.2861 -0.5969 0.8336 -0.2033 0.2158 1.7711 0.0676 1.8844 -0.4059 0.9288 0.8285 -1.5217 1.9677 0.3565 1.4127 -0.1371 2.9279 -0.4055 -1.5565 1.1947 2.5938 -0.4861 0.2174 -0.4930 2.5660 -0.3666 2.3670 -0.9154 0.9892 -0.6111 0.1991 0.0910 -0.2927 0.5228 -1.2446 0.5323 -0.2747 -0.5384 -0.3441 -1.1313 -0.8218 0.3262 0.5073 -0.9687 -1.5941 0.4046 1.1922 0.6148 N2_N2-dimethylguanosine -0.0934 -0.9339 -0.2834 -1.3608 0.5642 0.0473 -1.7707 0.1442 -0.3993 2.3239 0.9307 -0.5385 0.2854 -0.8488 0.3695 -1.7347 -0.2788 0.5997 -0.6143 -0.5508 0.3558 1.1265 0.4853 0.8849 0.5216 -0.0618 0.1185 0.2728 0.5685 -1.0328 0.0012 -0.3023 0.9332 -0.6856 0.5379 1.3785 0.2492 0.7333 -0.1690 -1.1035 0.8959 0.4010 -1.7250 0.5271 1.8511 -1.2610 -0.8226 -0.0729 0.3776 0.1173 1.3833 0.1126 0.1420 1.2822 -0.6773 0.1628 1.1868 -0.1515 0.7578 -0.0930 0.0208 0.6984 -3.0888 0.4170 -2.8297 -1.6641 -0.5815 0.8150 -0.0911 0.5301 1.0901 0.0797 0.3149 -1.7962 1.1625 -0.3884 0.5643 -0.2582 -0.7890 -0.3018 -0.9233 0.2880 -1.7730 -0.3458 1.0045 -1.5025 0.2879 1.3809 1.0263 -0.1253 0.7511 0.8429 0.3611 -0.5173 1.3316 0.7629 -0.3902 0.0985 0.1793 1.3190 0.4032 -1.3985 -0.8604 0.2435 0.3031 1.3855 0.6848 -1.2401 -1.5706 1.1876 -1.7462 0.4980 -1.0679 0.2870 0.4976 -0.9039 0.7200 0.4204 0.3617 -1.1440 1.4523 1.1292 1.1134 -0.2637 -1.8171 -0.8001 -0.8537 -0.1850 -0.2904 -2.1164 -0.9915 0.6274 -0.1332 -0.5729 -0.5014 -0.4390 -1.7532 0.5271 1.2136 0.1992 0.5318 -0.6397 1.3696 -1.1351 0.1679 0.1330 -0.6158 0.8863 -0.0564 0.0798 -0.0817 0.9079 -0.0058 0.9548 -0.3778 0.0895 0.5810 0.5365 -0.3698 -1.1895 -0.1439 -0.5795 0.4111 -1.1356 0.4759 0.5443 -0.7496 0.1531 -3.3939 0.2494 -0.2581 -1.3543 -2.5239 -0.9907 -0.6297 0.9837 1.5769 -0.4845 0.9567 -0.5583 0.7751 -0.9721 -1.6417 1.5377 0.5351 1.8168 -0.4245 0.6787 -1.0957 -0.8642 -0.3141 0.4223 0.1619 0.8963 0.4504 -0.9459 -1.8064 -1.8263 0.6827 0.4495 -0.3569 0.6295 1.6426 -1.2686 0.4376 1.4437 -0.1966 1.3878 0.1570 0.8149 0.4365 -0.4550 0.8140 -0.3025 -0.4459 0.9530 0.5147 -0.8732 -2.4256 -2.3495 -0.8347 0.1598 0.2742 -1.3776 0.1518 -1.2129 -0.3038 -1.6155 1.1001 1.2761 0.0150 -0.3752 -0.3069 1.6245 -1.7790 -0.1263 -0.8288 1.8464 -1.4450 0.5875 0.5501 -0.6660 1.7015 -1.6469 -1.4721 -0.0380 0.0149 -1.2846 -0.2407 -0.1299 0.8098 0.5061 -0.6962 -0.5767 -0.8912 0.3183 0.3453 0.2672 0.0274 -1.6038 1.3718 -0.4140 -0.6392 -0.2321 -1.1604 0.5826 -0.1850 -1.5460 -0.1979 -0.0605 -0.3179 0.8692 -0.3446 0.3772 0.3450 -0.3078 0.2540 -0.2992 -0.9879 1.4864 -0.4562 -0.9215 0.1761 0.3310 -0.0523 -2.6604 0.7522 0.0073 0.1099 -0.3992 0.2153 0.4980 -0.2925 -0.6535 -2.0458 -1.5149 0.0956 2.0301 0.5594 0.4007 -1.2716 -0.8493 0.9009 -0.8415 0.0027 -1.5198 0.7836 2.0937 -0.2447 -0.3398 1.5397 0.4563 -1.2141 0.4492 1.8585 -0.2008 0.9057 -0.0583 1.6712 0.5855 -0.0549 1.1503 -0.3446 -0.6185 0.6558 0.4018 0.9759 -0.0718 1.0271 -0.0187 0.1979 0.0786 2.6829 -1.1004 0.5025 -0.0697 1.8602 0.3619 -0.4545 -2.3219 -1.0110 0.3310 -0.8328 -0.7147 -1.0709 0.2520 -0.2012 0.4894 2.1291 -0.4665 0.7060 4.0774 0.7022 -1.5771 2.0321 -1.0469 0.7175 0.0964 -0.2314 -0.4475 -0.1875 -0.7764 -0.1096 0.8644 1.2698 0.1710 0.1157 -0.7500 -0.2048 -1.0153 0.4570 1.4749 0.5342 -0.1576 0.4674 1.4519 -1.1098 1.5578 0.9138 1.3213 0.4481 0.1408 0.4958 1.3888 0.0310 0.6854 -0.7046 0.6210 -1.9342 0.6540 -0.1047 2.0251 2.6381 0.6019 -0.2476 -1.1540 -1.0636 0.0977 -0.8632 -0.2688 -0.9466 1.3906 -1.1961 0.0293 -0.2496 1.1299 0.1599 0.3453 -0.1795 0.3450 N4-acetylcytidine -0.0204 0.0054 0.5598 -2.2882 0.8112 0.8602 -0.8241 0.8410 0.4185 1.4371 -0.5044 0.4942 -1.4031 1.6438 0.9072 1.0233 0.3011 1.2872 -0.3433 -0.0496 1.1071 0.0378 -1.3017 0.9436 -0.3433 -0.1494 1.3582 0.3058 1.1694 0.1751 -0.7373 0.7248 -1.8748 0.3064 0.1794 0.8522 1.2684 -1.0563 -0.0042 -0.0334 0.5746 -0.9306 -1.2041 0.7462 -0.1087 -0.3666 0.1141 -1.0363 0.6029 -0.1381 0.8012 -0.5049 0.3638 1.0686 0.5928 -0.1178 0.2442 0.3261 0.2578 0.6277 -0.5196 0.8750 0.3548 -0.7688 -0.6232 -0.2815 -2.4534 -2.8225 0.2809 0.6245 0.4998 -0.7751 -0.8955 -2.7091 0.0321 1.1129 -0.4238 0.7861 -1.0922 -0.5310 0.0364 -1.3993 -0.5743 -0.5228 0.7707 0.4995 -1.7550 1.4851 -0.0687 -0.2573 0.9572 0.9900 0.4181 0.9342 0.9033 0.5996 -0.8870 -0.2988 -0.1190 0.7070 -0.4169 0.5097 -0.1165 -0.1743 -0.1501 0.4949 -0.4193 -0.9476 -0.7251 2.4599 0.7261 0.1604 0.1456 -1.4031 -2.4430 -0.9996 0.2910 -0.1009 0.2907 -0.9031 1.2124 0.6560 -0.1132 0.1528 0.3522 -1.5591 -0.5355 -1.1765 1.3953 0.9033 -1.1642 1.0863 -2.0286 -0.5168 0.3741 0.0028 -0.7622 -0.1215 0.7650 -0.6814 -0.2495 0.6153 -1.1395 0.0854 -0.2824 0.7193 0.3666 -2.5104 -0.6016 -0.1465 -2.1281 1.2062 0.1878 1.0906 0.6199 0.1752 1.2022 -0.0185 1.2119 0.3798 2.1003 -0.4229 -0.8812 -0.6216 0.7079 0.5913 0.1485 0.2208 -0.6728 1.4871 0.7648 -0.8377 -0.6717 0.4773 0.2687 0.6871 0.2026 -0.3700 -0.4974 -0.0461 1.0444 -1.1920 -0.8126 1.3080 0.3096 0.9612 -0.3486 -0.9504 0.4383 -2.2789 -0.7840 0.4820 0.3988 0.2098 -0.1876 -2.5766 -0.2567 -2.7951 0.5583 0.4340 0.1472 1.0160 1.0834 -0.1558 0.7076 -0.6132 -2.5142 -1.4754 -0.3777 -0.6130 0.9403 -0.2054 -0.9770 0.2808 -0.1144 -0.4835 1.2773 -1.6138 -2.8490 1.2602 0.9382 0.3718 -0.1339 0.9687 0.7133 0.3585 0.7622 0.4868 0.2253 -0.4189 0.1332 -2.2486 -0.2176 -0.0168 -0.2641 -1.2971 -2.5289 0.0139 0.3010 1.3656 0.3572 0.3389 0.5176 0.6295 1.0770 0.7220 -0.0960 0.5025 -0.3418 -0.9926 -0.5875 0.5701 -0.1918 -2.5194 -2.5806 -1.0265 1.1081 -0.4446 0.3610 -2.7159 1.3560 -0.5883 0.8364 -0.0763 0.5481 -0.9376 0.2372 -1.4282 0.4393 0.4368 -0.5469 0.7053 -1.0291 0.2379 -2.6081 -0.0113 0.0747 -0.1108 -1.1296 0.6010 0.3434 -0.0495 -0.4253 1.0277 0.7414 -2.4222 0.1140 0.5825 0.8522 1.0026 0.0263 0.0766 0.9024 0.6546 -0.7482 -1.5684 0.2520 0.2118 1.2443 1.4102 -0.1119 -0.4932 0.5732 0.7999 -0.5418 0.0688 0.7605 0.1772 0.1849 -2.8002 1.1478 0.0718 0.1700 0.3833 1.3779 0.4805 -0.4982 -1.3724 -0.0154 -0.0497 -2.4681 0.7621 0.6358 0.2689 -0.2303 1.1373 -0.6766 -0.5334 1.1852 1.4318 0.1999 0.8652 1.1071 -0.1861 0.6109 1.2166 0.1793 0.7594 -0.0218 -0.9625 -2.4741 1.1416 0.5979 -0.8747 -0.5859 0.4189 0.8768 -0.1063 -0.1811 0.8369 -0.1718 0.8638 1.4346 -1.3439 1.9986 0.7334 1.1361 -1.0182 -0.3932 0.4841 0.8123 -0.1700 -0.2911 0.3920 1.0430 0.5243 -1.4534 -0.4257 0.4848 -1.5083 0.5685 -0.1214 -0.1689 -2.4653 0.7635 -2.2889 -0.0385 -1.3404 1.3156 1.5256 -0.8537 -0.9460 1.2217 -1.7635 -0.2107 0.9181 0.2105 0.6445 -0.9124 1.0894 -2.2072 1.3062 1.4222 1.2192 -0.1428 0.3709 0.7388 -1.1313 -0.5051 1.3674 0.5396 0.7092 0.3743 1.3381 -1.3387 1.5760 1.1386 0.4877 0.9935 1.0776 N6-acetyllysine -0.2450 -0.2157 -0.1443 0.3520 1.8119 1.8467 1.7784 -0.6174 -0.4249 -0.2762 0.7678 0.8116 0.5146 1.0367 -0.0733 0.6036 0.3002 0.8135 -0.2410 -0.3380 -0.4219 0.8199 -2.1722 0.6567 -0.3821 -0.5710 -0.0061 1.2646 -0.9038 -1.4921 -0.2198 -0.0613 2.4317 -0.3389 1.2042 -0.0389 -0.4431 -0.9472 -0.1516 -0.1486 -0.2045 1.3991 0.1945 0.0241 0.9047 0.6702 -1.6685 -0.9560 -0.8882 1.3062 -1.2142 -1.9051 -0.3674 -0.8435 -1.1542 0.2575 -0.3765 0.4861 -0.1204 -2.7406 -0.0830 1.8814 -0.8790 1.7673 0.2743 0.7446 1.7157 0.7891 -0.2368 -1.2792 -0.6827 0.1273 -0.8959 0.2348 -0.6073 0.3284 0.3702 1.0357 0.1348 0.9610 0.4457 0.1960 1.2245 -0.7595 1.4503 -1.1674 0.2515 0.2499 -0.8801 -0.2893 -0.9992 -0.6430 -1.0321 -1.4539 1.2358 -1.1177 -0.8016 -1.7666 0.0436 -1.0931 -0.5363 0.3001 1.1299 1.0151 -0.0420 -0.3248 -0.7844 -0.6140 -3.0287 0.6798 -0.6109 2.4410 0.7367 0.2950 -0.7260 1.0506 0.8346 0.1852 0.1111 0.1491 1.2624 -1.2332 -0.4683 -1.4373 0.4440 -0.3093 0.2803 0.7636 -0.3647 -1.1692 -0.3485 -1.9410 0.9630 -1.9027 0.6742 1.3298 -2.0187 -0.5018 -0.5023 -0.5995 0.2284 -1.8864 -0.7837 0.0744 -1.4501 -1.2063 0.1864 -0.7383 -1.6719 1.5954 0.6742 -0.1972 1.1774 -2.2238 -0.3862 -0.1433 1.0481 0.1859 -0.0702 0.2091 2.3235 -0.1598 1.7588 -2.3415 -1.2484 -0.5778 0.8494 -0.6692 0.0650 -0.4553 -0.4712 -0.7560 -1.8382 -1.7200 -0.6671 2.0290 1.1284 -1.0150 0.9481 0.4150 1.3719 -0.2043 -0.5333 -0.2754 1.5206 -0.6412 0.1225 0.3433 -1.5062 0.3303 -1.1116 -0.7575 -0.1766 2.1013 1.0166 -0.0111 -1.1979 -0.0061 1.0486 0.2149 -0.7330 0.6788 1.6135 1.0626 0.0957 1.8815 -0.7941 0.6058 -0.0302 0.1428 0.1000 1.5278 -0.4356 0.6900 1.6865 1.0043 -1.5674 -0.1035 -1.3743 -0.2788 -0.9570 -1.1645 0.3335 -0.3505 0.2203 0.3909 -0.5746 1.4103 0.9479 -0.9246 -1.3028 -0.6797 -0.5917 0.9961 -0.5072 0.0765 -0.1689 0.1500 -0.2239 -0.4198 0.6567 -0.5323 -1.3001 0.4592 1.4394 0.1893 -0.4303 0.0307 1.2032 -0.0399 0.4055 0.1839 -0.1156 1.2812 0.4713 0.7284 -2.3459 0.9624 -0.4016 -0.2447 -0.1567 0.9748 0.6977 -1.1828 0.7189 1.0025 -0.8935 0.0088 0.4800 -0.8982 0.1222 1.1102 0.3501 1.6980 0.8447 1.7527 1.0155 0.0400 -1.3876 1.7730 1.4938 0.7625 -0.3870 1.7049 -1.1812 1.2433 0.7407 1.1043 -0.7594 0.2726 1.5110 0.4066 0.3033 -0.4429 -1.2336 0.5989 -0.0313 0.1205 0.0293 -1.3304 1.3945 1.9454 -1.2120 0.8373 0.8920 -0.2732 -0.5506 1.2087 0.0235 0.7779 -0.9040 0.2747 2.2742 -0.8729 -1.4230 0.0025 0.1744 0.3789 0.4348 0.2971 0.5164 1.3674 -0.4760 0.1164 -0.7752 -0.1618 -0.4960 0.2889 -0.1432 -0.2037 -0.4575 0.4211 0.2531 -0.9697 -0.9894 0.9101 1.1853 0.0018 0.9682 -2.1653 1.0462 -1.8380 0.8936 0.1052 -1.0294 -0.4496 -0.8364 -0.0536 1.2263 -0.9264 -0.0016 2.0179 -0.0127 1.4700 0.2666 0.0802 -1.5489 0.7759 1.0887 -0.7023 0.7878 -0.1427 0.6553 0.3792 -0.1812 0.0637 -0.8009 1.1889 -1.5734 -1.6819 -0.0794 0.9186 -0.1148 1.5361 -0.9194 0.9339 -1.8432 0.6971 -0.4737 0.4664 0.7920 -0.7929 -1.1334 -0.7560 -0.9952 -1.3662 0.1492 -0.1996 -0.8149 -0.4708 -1.2654 1.3750 1.9456 -0.1128 -1.2006 -0.7379 -0.7703 0.6835 -1.8797 0.0684 -1.7894 1.8966 -2.0465 -0.2053 -0.6063 0.7590 -0.4231 1.1994 -0.5459 -1.8331 N6-carbamoylthreonyladenosine 1.1797 1.2750 0.7355 -0.3192 1.0092 0.9069 -1.5925 1.0594 -1.2765 -0.4395 1.0044 0.8202 1.3177 0.6448 -1.6202 -0.5456 -0.1926 0.8045 -1.0688 -0.7083 -0.8180 0.9209 -0.4311 0.4295 -1.0928 -1.1005 1.2549 0.7083 -0.8103 -1.1580 -1.5625 -0.8324 -0.3635 -1.7094 0.1951 -1.1867 -1.0465 1.1975 -0.9208 0.3152 0.4836 -0.2071 -1.1684 0.7994 -0.8346 0.6123 0.3487 0.9863 1.2296 -1.0772 0.8032 0.4202 -0.9964 -1.3465 -0.5124 -1.4803 -1.1798 -0.4994 -1.2603 -1.3744 -0.8405 0.2320 -0.1433 1.1395 -1.0902 -1.6037 0.6415 0.5644 -1.5263 1.1391 -1.1708 0.2475 -1.2777 -1.5476 0.1390 -1.4992 -0.8416 1.0920 0.0832 0.4831 -0.0094 -1.0189 -1.1438 0.5289 1.1790 0.5570 0.8756 1.3321 0.8973 0.9486 0.7533 -1.0161 0.8706 -0.4755 1.3919 0.6380 -1.1036 0.8427 0.1235 -1.4064 -1.4662 -0.1879 -0.8753 -0.5669 -0.9306 0.9024 0.8448 -0.3511 1.3737 1.5215 0.4503 0.5874 -0.8179 0.5202 1.1300 0.4721 0.2165 -1.0255 -1.3662 0.6257 0.8588 0.7358 -1.2479 -1.2823 -1.6377 -1.3148 -1.4588 -1.2686 -0.0613 0.0426 0.4226 1.6326 -0.5629 -1.4544 0.2370 -0.6437 -1.0862 0.7388 -1.2200 -0.2181 1.1882 -1.2972 -1.0468 -1.2189 -0.8873 -1.2989 -1.1410 1.2263 0.2088 -0.8669 -0.0488 -0.7542 -0.9554 1.1244 -1.2682 0.7443 -1.1220 -0.7765 -0.2405 0.7317 -1.0887 0.7665 -0.8387 -0.1837 1.1493 -1.5545 -0.1982 0.3822 -1.4734 0.3207 1.0705 0.2348 -1.7874 1.4608 0.3048 1.2880 -0.7338 -0.7553 0.7038 -0.7071 -0.3163 -1.7525 -1.2805 1.1783 -0.8065 1.3657 0.6077 -1.0080 1.1667 0.3915 0.7536 -0.7926 0.8004 1.1537 0.9959 0.3704 -1.0198 -1.6991 1.0834 -0.5919 -0.3160 -0.7800 -0.8795 -1.1108 -1.2891 -0.5574 -1.2911 0.2320 1.3474 -1.1494 0.9479 0.4614 0.6418 -0.5558 -0.4630 1.1629 0.8209 0.3900 0.9256 -1.5117 0.2186 -0.3267 0.3487 0.4035 0.1814 -0.0519 0.0018 -1.7721 0.6792 -1.1293 -1.2980 -0.8844 0.1774 -1.4156 0.3902 1.0673 0.1998 -1.0198 -0.1757 1.4900 0.6905 1.4334 1.0583 0.8412 -1.4552 0.6103 -1.2988 -1.6294 0.2572 -1.3856 0.9794 0.7426 0.6454 0.2227 0.1442 -1.0913 0.1223 0.2914 0.5655 0.3003 0.2420 -0.9265 -1.5930 0.5284 -1.4253 1.3850 -1.4946 -0.0053 -1.1017 1.0086 0.4096 -1.0455 0.5898 1.1946 -1.4312 -1.3568 -0.4276 0.3958 -1.5597 -0.7464 -1.6336 0.1925 -1.6527 0.8042 0.3747 0.9856 1.0840 0.9527 -1.5319 0.6714 1.3256 0.2354 -1.4109 0.8633 -1.1662 0.4131 0.4462 1.5026 1.6947 0.2338 1.0958 1.0994 0.3520 -1.5231 -0.0233 -0.0644 0.6405 -0.7658 0.8449 0.5803 -1.1232 0.5270 -1.3647 0.3298 1.5515 0.2071 -1.1587 -1.2728 -1.0846 1.0300 -1.2362 1.2420 1.1405 1.1289 1.0050 0.4679 0.1465 1.0835 -0.6237 0.9032 -1.0376 -1.0523 2.0255 1.0605 -1.3327 -0.1049 1.8552 0.8908 -0.2197 -0.8646 -1.2323 0.8772 0.5278 -1.5527 -1.5417 -1.1013 -0.9369 1.1858 1.4547 -0.0850 -0.8196 1.7451 0.5094 0.1850 1.9725 -0.2638 1.0266 0.4439 -0.0973 1.0415 1.3147 0.5373 0.4902 0.7025 1.4177 0.5156 0.7069 -0.2818 -1.7082 0.8074 0.1809 1.1298 1.5597 1.0006 0.4822 1.9785 -0.0362 0.6648 1.4202 -1.5081 1.6724 1.3952 0.8710 0.3212 1.5520 0.8848 0.0994 -1.4226 0.6817 1.0754 -0.8375 1.3200 1.8847 0.8770 -0.3051 0.3032 0.0808 -1.4470 1.0739 0.9592 0.6126 0.6965 0.3797 1.0671 -1.7946 1.0324 0.9040 0.8249 -1.2893 1.0332 N6-carboxymethyllysine -0.8158 -0.1528 1.7280 1.0094 -0.6918 0.9552 -1.1823 0.6324 -0.3329 0.6671 1.5903 -0.0073 1.2118 0.9322 -1.1904 0.5070 0.4622 -1.0113 -0.9945 -0.8705 0.8952 -1.3245 -0.2575 -0.2216 1.0982 1.5506 -1.1576 0.0839 -0.9022 -0.1602 0.5261 -0.9120 1.3230 -0.1952 -0.1296 -0.0753 -0.7538 1.6901 -0.1380 -1.1687 -0.8390 0.7779 -1.0310 -1.1711 0.5187 1.4227 1.1136 0.8853 0.0934 1.1607 -1.0073 -1.1831 -0.9722 0.6843 -0.8008 -1.1411 -0.0703 -0.1076 -1.0643 -1.1089 -0.9123 0.0530 -1.1325 -0.9532 1.1038 -1.1800 1.5366 0.8111 -0.0904 -0.8971 -1.0336 -1.1203 0.6107 1.5356 -1.0285 -1.1487 -0.9132 -1.0175 1.4871 -1.0632 -1.0591 1.3917 1.8539 -1.1592 0.6686 -1.1175 1.1480 -0.9757 -1.1726 -0.8155 0.3651 0.6225 -0.3651 -0.7814 -0.2169 -0.9690 -1.0109 -0.9917 -0.9740 -1.1130 -1.1389 0.2528 0.8649 -1.1977 -0.9503 0.2571 0.3630 1.7496 -1.3005 -0.9470 0.3818 0.7138 -0.9063 0.7456 1.2751 0.9450 -0.8942 0.3118 1.5452 1.0674 -0.9370 0.6589 -1.0557 0.8661 0.1899 -1.0865 1.0741 1.7777 -1.0977 -1.1992 1.3308 1.4366 -0.8188 -1.1316 0.2978 0.4023 -1.0019 1.1306 0.1692 -0.6953 0.8080 -1.0762 1.3622 -0.5465 0.9152 -1.0802 -1.0195 1.5280 -0.9559 -0.1499 1.4789 -0.8856 -0.7128 0.2425 -0.2469 -0.9020 -1.0135 1.2447 0.0815 0.0844 0.9615 -1.2066 1.7469 -1.0294 -0.9795 -1.1664 -1.1332 -0.2642 -1.1453 1.0390 1.1897 0.8123 -1.2520 0.0363 0.6669 -0.8238 -0.8759 0.8753 -0.9835 -0.8636 -0.9837 -1.2369 1.4725 -1.0598 0.9575 -0.0920 -1.0533 1.1486 -0.8852 -0.9511 1.2242 1.1955 0.8563 0.0847 -0.9030 -1.1029 0.9004 0.9956 -1.0477 -0.8249 -0.5897 -0.3366 1.2191 -1.0022 1.0649 0.8154 1.3652 1.2616 -1.0159 -1.0182 0.1609 0.9100 0.7389 1.5229 -1.1671 0.7989 0.7870 1.3584 -0.2847 -1.1548 -1.0809 -0.0070 0.6431 -0.1941 1.1453 0.0789 0.5898 0.3814 -1.1139 -1.0197 -0.1290 -0.2251 0.5292 -1.1159 0.9430 2.0675 0.8511 1.1704 -1.1651 -0.2652 1.3068 1.1184 0.3349 -1.2686 -0.0871 0.2121 0.6246 -0.4066 -1.1826 -1.1111 1.3472 1.2390 0.7562 -1.0746 0.8614 1.2282 -1.1000 2.3197 -1.0244 1.3402 -0.5536 1.0717 0.0037 0.2535 -0.1442 -0.8190 -0.5515 -1.2021 -0.0195 -1.1310 -1.1347 -0.9867 -1.1691 1.6148 1.6073 1.1630 -0.3012 1.2506 1.0407 -0.8780 0.3534 1.1613 -0.7551 -1.1752 -1.2570 1.4866 -1.1357 1.6451 0.9370 -0.4854 0.7221 -0.2696 -0.1270 -1.1984 1.1464 0.9276 0.6708 1.1981 0.2085 -0.0244 1.0982 1.4699 -1.0828 -1.1607 1.3832 -1.2333 -1.1340 -0.8848 -1.1624 0.7331 -1.0158 -0.3859 1.5108 0.4217 0.1338 0.3409 1.0211 -1.0686 1.1956 -1.1442 0.7336 0.7535 -1.3845 -1.2081 0.7801 -1.2881 0.6103 0.4449 -1.1061 -1.1823 -0.6490 0.6216 1.1586 0.7728 -1.0894 -1.2636 1.1753 1.3389 1.3700 0.7761 1.3618 0.4389 1.6113 1.5091 -1.1732 0.7089 1.5124 -1.1733 -1.1322 -1.2070 -0.9081 -0.6407 0.4907 1.8723 -0.1883 -1.2580 -0.3704 0.5755 1.0626 0.3849 0.3663 1.4806 -0.0463 1.1073 0.1040 0.9130 1.4615 -1.2593 0.2858 0.9667 -0.9776 0.9561 -1.0467 1.3815 -1.3282 2.3139 -0.6970 1.4458 -0.1398 -1.1524 -1.0729 1.6933 -1.3237 0.7287 -1.3629 -0.2890 1.4355 -1.1231 0.7704 -0.1019 -0.9136 -0.2692 -0.7694 -1.1350 0.4198 -0.1540 -1.2969 1.0304 -1.3436 -1.1521 -1.2934 -1.1471 -0.1211 -1.1918 0.9405 0.1349 -1.1015 -0.0271 0.2472 0.4229 N6-methyladenosine -0.1161 0.2121 -2.7727 -0.8861 0.9769 -2.8505 -0.3895 -2.9499 -0.8592 -2.0633 -2.4516 0.8599 0.3783 0.1063 -0.5784 1.0280 -3.0546 0.4839 0.2518 0.6800 0.8120 1.0425 -0.4606 0.8843 0.9447 0.1704 -0.6574 0.2137 0.5996 -2.7020 -3.0175 0.4292 0.8271 -0.1275 -0.3339 0.0357 -2.5764 0.6028 0.9868 -1.0708 0.5363 1.4740 0.2380 -0.8816 0.9875 -0.6009 0.7831 0.3606 1.1533 0.5990 0.5205 0.2581 1.3373 -2.8637 0.6695 0.2569 1.1346 0.7952 0.8065 -1.2900 0.9450 -0.3301 0.3681 -0.8107 -0.5693 -0.1857 0.4754 0.8184 0.3929 0.0471 -0.4948 0.7548 0.4589 0.2047 1.0469 -2.9761 1.0764 0.0487 0.3099 0.4364 -0.0620 -1.0186 0.0561 0.3931 -1.4071 0.5820 0.9448 -0.0416 0.6227 0.7977 -0.0712 -0.0537 0.9844 0.2429 -1.0751 -0.7325 -0.1172 0.5564 0.7187 -0.4459 0.4326 0.2066 0.7717 0.8434 0.9645 0.5971 -0.1765 0.7313 0.6537 0.6313 -1.4964 0.5924 0.5064 -0.1769 -0.1726 0.5021 0.7540 -0.0626 -0.7395 -0.3331 -0.0956 -2.5919 0.2811 0.5370 -3.1029 -0.8118 0.2564 0.4892 -2.8207 -0.5875 -0.3668 -2.4586 0.2373 -0.4506 -0.1817 0.2300 0.4050 1.2298 0.9757 1.2955 -0.6334 0.8146 0.8373 -0.5995 1.0182 0.4400 0.1659 -2.7787 0.5451 0.8887 1.1453 0.3216 0.7336 1.5305 0.1092 -2.3519 -2.6299 0.4950 -0.3030 -0.8998 -0.1653 1.1313 0.9618 0.5823 0.8160 0.0259 -0.7796 0.9117 -0.4108 -2.6536 -3.0199 -0.1694 -0.0591 -0.1527 -0.1658 0.4075 0.7554 0.8428 1.1665 0.5863 0.2044 0.1461 0.3969 0.4623 0.4044 0.8566 0.3588 1.2558 0.4747 0.4784 -0.1221 0.1501 0.3992 0.6727 0.2517 0.4012 0.7942 -0.1904 0.7883 0.4506 -0.0544 0.5591 0.3869 0.5477 0.7074 0.8478 0.6041 1.3274 1.1359 0.6546 0.5359 0.4345 1.1971 -2.8038 0.4516 0.4763 -1.5361 -0.1070 -0.2037 -0.0783 -2.8178 0.5963 0.0460 -0.1941 0.1852 0.3004 -0.7397 -0.9271 0.9044 0.6919 -0.0467 0.6600 0.8954 -0.1381 -0.2066 -0.1314 -0.0650 0.8112 -0.9132 -0.3400 -2.8144 -3.1520 0.1273 -0.0576 0.2641 -0.6534 -0.5099 0.1181 -0.6955 -0.2292 1.3451 0.1511 0.6575 0.1418 0.3706 0.6828 0.0904 0.6710 0.4544 0.7520 0.5700 0.4408 -0.4165 -0.6676 0.0886 0.9179 0.7400 -0.5621 0.2163 0.1503 1.3586 -0.0495 0.6976 -2.9280 0.2753 1.0185 -0.7713 0.7909 0.7867 1.0917 -0.5821 0.0062 -0.6201 1.1752 -0.1339 0.4259 0.8434 0.2879 -0.8170 0.1821 0.7752 0.5514 0.3434 0.5886 0.4563 -0.0722 -0.3576 0.4923 0.1928 -1.7074 0.9022 0.5861 -0.3050 0.0820 0.2253 0.3138 -2.3291 0.8401 -0.1858 -0.0264 -0.6443 0.3837 -2.8805 -0.1492 0.1464 0.4839 0.8455 0.3265 0.4112 0.3588 1.0404 -0.8794 0.9481 0.8909 0.3144 -0.9129 0.4244 -0.1216 -0.7594 1.3481 0.0800 0.7465 -0.9466 0.8407 0.6341 0.1603 -0.5126 0.2758 -0.1194 0.1886 0.0020 -0.9352 -0.5722 0.2582 -0.5232 0.6656 -2.4665 1.5108 1.2850 0.4005 1.3722 -1.6698 -0.2140 -0.3043 -1.2284 0.0634 -3.2042 0.9063 -0.1987 -0.5046 0.1317 0.6925 0.4939 0.6096 0.1539 0.0128 0.3935 -0.0068 -0.9943 0.0013 -0.5264 1.4223 0.4408 0.1650 -0.3946 -2.5296 0.7607 -0.7717 -3.0759 0.3803 0.7212 0.2442 0.5411 0.0610 -0.0501 0.1188 -0.3126 0.2450 0.4385 -0.4757 0.3127 0.5061 -2.0267 0.3810 0.4771 -0.2658 0.2989 0.2303 1.2166 0.1115 0.0003 -0.4610 -0.0501 -1.9116 -0.3468 -0.6290 0.1493 0.5036 0.6215 -0.1890 N6-methyllysine -0.2527 -0.6268 -0.2523 -0.7231 -0.1269 -0.5073 0.3240 -0.3190 -0.9510 0.3854 -0.8648 -0.3329 -0.5560 1.9356 -0.0177 0.2705 2.0518 -0.9658 -0.0019 -0.1586 -0.7392 0.1347 -0.1443 1.6629 2.1742 -0.2777 0.5032 1.9921 0.8936 -0.3181 -0.4536 1.4820 -0.0169 -0.2271 -0.3947 -0.5863 -0.3995 0.7419 -1.4002 0.0634 -0.0261 1.8724 1.7156 -0.3479 -0.7468 0.0575 -2.3505 0.0221 -0.4656 2.2034 -0.5286 0.8564 1.9243 -0.5998 -1.3047 1.6580 0.2505 -1.6840 -0.9377 -1.3298 -0.2886 2.3786 1.3193 -0.0533 0.1069 -0.8305 -0.2157 -0.3308 1.7618 1.8475 -0.4588 0.6143 2.1880 -0.1366 -0.4461 -0.7569 -1.1213 0.5705 2.2435 -0.6353 1.8033 -1.2145 0.2015 1.9195 0.0138 1.9268 -0.3887 -0.9521 0.5088 2.0815 1.6639 1.7751 0.0307 -1.2235 -0.0119 -0.6745 -1.1211 -1.1302 1.8846 1.5352 -0.1987 1.5693 0.7619 0.1029 0.1658 -0.2713 -0.1430 -1.2234 -0.3729 -0.2761 2.3835 -1.2110 -0.4401 -0.5673 -0.7139 -0.2794 -0.7449 0.3364 -0.9572 0.0369 0.7809 -0.3876 -0.4139 -0.9810 -0.7603 -0.2954 1.4119 0.9473 -0.7351 -0.8289 1.9542 -0.2413 -0.1739 -0.2121 0.2345 0.4687 0.1382 1.9659 0.0497 2.4133 0.0134 0.1221 0.0664 1.7379 -1.2176 -1.1761 -1.2210 -0.3158 1.9161 -0.4592 1.8660 -1.0871 -1.4498 -0.5374 -0.7828 -0.4772 -0.5765 -0.2732 -1.0766 -0.2370 0.1537 1.7588 -0.4365 1.6130 -0.5559 2.5015 -0.0647 -0.0277 -0.1519 -0.8370 -0.2541 0.7479 0.0935 1.7251 -1.4848 -0.3362 0.2984 -0.0952 -0.1188 -0.9757 -0.2690 1.8598 -1.7253 -0.2075 0.1463 -0.9605 -1.1866 0.6434 -0.7684 -1.4576 -0.3263 0.0746 2.4951 -0.0480 2.5904 -0.9900 -0.8156 -0.3357 -0.5576 0.4231 0.1057 -1.0782 0.2418 1.0431 -0.9662 0.0776 1.6597 -0.5632 -1.1519 -0.8182 0.1900 -0.2709 1.5908 -0.2374 0.3857 -0.2729 -0.2661 1.5403 -0.5915 0.7095 -1.0627 -0.1560 -0.0747 -1.1330 -0.1633 -0.1993 0.4456 -0.0380 -0.0419 -0.9064 -1.2742 -0.1612 -0.1156 2.2975 -0.4166 -0.2628 -1.1236 -0.8932 -0.5509 -0.2165 -0.3072 -1.1174 0.3099 1.2043 0.2415 -0.1024 -0.2751 -0.5096 0.1397 -0.5525 -0.0278 -1.0208 0.1454 1.1993 0.1697 -0.5717 -0.9921 -1.2224 -0.0381 0.5814 0.0844 -0.0775 0.3880 -0.4802 -0.1009 -0.5653 -1.4426 -1.6483 -0.4907 -0.2322 -0.1717 -0.4999 -0.7450 0.2616 -0.2080 -0.4396 -0.1271 1.6535 1.3664 -0.3044 -1.1834 1.9815 -0.7401 -0.0734 -1.4734 -0.0228 -1.4638 -0.1798 -0.1524 1.7135 -0.1724 -1.3722 1.9506 -0.7712 -0.4470 1.2532 1.3441 -0.5228 0.2806 2.0025 -0.8361 -0.1166 -1.3506 -0.5012 0.5007 -0.0460 -0.6767 0.8119 -0.5978 0.5336 -0.1138 -0.6621 0.8766 -0.6993 1.0170 -0.4100 1.5820 -0.4929 -0.3508 -0.8507 -0.1151 -0.4157 -1.5010 -0.7964 -0.5599 -0.0915 -0.0991 0.0166 -1.0469 -0.5730 1.5111 -1.1656 -0.3294 -0.1634 -0.5839 -0.1323 -1.2575 -0.4296 2.4120 -1.0658 1.9429 -1.7116 1.3291 -0.2454 -0.6398 0.3479 -0.3784 2.6985 1.8945 -0.8296 -1.3103 0.0494 -0.2163 -0.6049 -0.4594 -0.2541 -0.3547 0.0747 1.2105 1.3720 -0.5486 1.3541 -0.1305 1.9090 -0.5458 -0.3900 -0.4494 -0.5301 -0.3765 1.9022 -0.5180 1.8108 -1.1728 -0.8917 -0.9280 -0.2090 1.6888 -0.3897 -0.9740 -0.6805 0.3808 1.9089 -0.5969 0.2247 0.1230 -1.2445 1.5326 -0.3744 -0.7472 -0.3343 -0.7157 -0.3396 -0.3218 -0.9761 -0.1973 -0.9322 0.0656 0.0735 -1.7207 -0.8252 1.6035 0.2372 -1.5542 1.7844 -0.6755 -0.7746 -0.7255 0.2234 -0.2540 -0.5204 N6_N6-dimethyllysine 0.3756 0.0546 -0.1566 -1.3878 0.2301 1.1059 0.3160 0.9708 -1.4424 0.6135 0.7513 0.0459 -0.1475 1.3273 0.1806 -0.0374 1.0194 -1.4520 -0.3784 -0.2081 -1.0869 0.1984 -0.5041 1.5208 1.4274 0.2065 0.3605 1.2719 0.9373 -0.1439 -1.1634 0.8649 0.2699 -0.9914 -0.0293 0.4928 0.0878 0.3342 -1.0733 0.0672 0.1988 1.1889 0.9445 -0.4890 -0.4081 0.2121 -2.2476 0.2440 -0.2137 1.7659 -0.1366 0.7318 1.2008 -0.1486 -2.1661 1.3294 0.2548 -2.0000 -2.4515 -1.0202 -0.2152 1.6721 1.0378 0.9374 -0.5910 -2.3915 0.9175 0.0132 1.2277 1.3284 -0.2532 0.3572 1.1882 -0.0221 -0.4304 -1.2476 -2.1637 0.5741 1.5059 -0.9948 1.2078 -0.3811 0.1572 1.4211 0.4627 1.1181 -0.1942 -2.3472 0.6068 1.2597 1.3954 1.1231 -0.2982 -0.8508 0.2536 -0.4489 -0.8180 -2.4662 1.2387 1.3438 -0.0817 1.8247 0.3398 0.0199 0.0924 0.1011 0.5382 -1.5506 0.0717 -0.4158 1.3612 0.3265 -2.2071 -0.1303 0.3829 -0.2676 -2.1011 0.7269 -0.1566 -0.2063 0.7713 -0.0479 -0.1806 -0.2100 -2.6327 -1.0596 1.3945 0.7271 -0.2848 -0.2036 1.2519 -0.0739 -0.1694 -2.4872 0.4740 0.7698 0.0291 1.1094 0.2582 1.0735 0.1027 -0.0681 -0.5184 1.4872 -0.2150 -0.3573 -2.3066 0.1668 0.9657 -0.6308 1.2858 -2.2436 -2.1779 -2.9852 -0.2712 -0.8375 -0.7461 0.4937 0.0368 -1.7611 1.0896 1.2950 1.1722 0.7978 -0.1052 1.4917 0.1853 1.2712 0.1901 -2.2825 -1.1717 0.9094 -0.3047 1.1155 -0.6653 0.2519 0.5168 -0.1115 0.0059 -2.0290 0.0070 0.9855 -0.6552 0.1890 0.4259 0.4763 0.4207 0.9459 -0.7723 -2.2706 -0.0028 0.4228 1.4411 1.0737 1.4314 -0.3032 -0.8690 -0.3025 -0.2868 0.2846 0.1834 -2.0791 0.4714 0.5847 -1.2448 0.3883 1.0209 0.1790 -0.4411 -1.5809 0.3246 -0.7689 1.1228 -0.4591 0.3217 -0.0717 0.5189 1.1270 -0.2822 0.6911 -2.5698 0.0449 -0.0884 -0.3272 0.0550 -0.1784 0.0928 0.4016 0.2368 -0.9218 -2.4894 0.0555 -0.1413 1.9684 -0.1920 -0.3871 0.2086 -1.1930 -0.3059 0.3439 0.2100 -0.4962 0.7947 0.4761 0.2662 0.2796 -2.5058 -0.2988 0.3322 -0.8215 -0.1246 -0.5721 0.2030 1.0031 -0.0742 -0.3927 -2.4819 -0.2111 0.1754 -0.0036 0.2722 0.0171 0.6446 -0.3082 -0.2269 -0.0017 -2.4842 -1.9452 0.0255 0.0047 0.0587 0.4564 0.2140 0.2969 0.1695 -0.3354 0.1934 1.0743 0.9307 0.0999 -0.1670 1.4520 -2.5481 0.5273 -1.3227 -0.7926 0.0249 0.3826 0.7163 1.3328 0.0710 -0.6746 1.9278 -0.8088 -2.4194 1.4409 0.9583 -0.8163 0.4164 0.9921 0.7326 0.7170 -0.4958 -2.6927 0.5735 -0.6191 0.0457 0.9703 -0.3598 0.7467 0.1608 -0.1243 0.5046 -2.5482 0.3788 -0.0855 1.1912 -0.1459 -0.1668 -0.2318 -0.3757 0.6066 -0.3128 -0.7663 -0.2586 0.4757 0.2068 -0.0624 -0.4724 -0.3464 1.2787 -0.3912 -0.2380 -2.4279 -0.2511 -0.0563 0.2308 -0.6184 1.7047 -0.6315 1.4635 -0.6992 1.0828 -0.2526 -0.3636 -0.0570 -0.7607 1.6891 1.4960 -0.5665 -2.2487 0.4800 -0.0941 0.3557 0.5474 0.1672 -0.0757 0.2030 1.2019 1.2106 0.1370 1.1368 0.3910 1.7497 -0.0546 -0.0551 0.2426 -0.0815 0.1497 0.7944 0.0848 1.4484 -0.7144 1.0425 -0.5012 0.9424 1.2797 0.2974 0.5457 0.1358 0.5886 1.8703 -0.3555 0.3330 0.5445 -0.8213 1.0067 -0.5175 -0.5827 0.2632 -2.2285 0.3357 0.0880 -1.3541 -0.0466 -0.4294 0.1189 -0.0655 -0.9290 -2.3336 1.1898 1.4976 -1.6898 1.4877 -0.4680 0.0621 -0.2241 0.3811 -0.1419 -0.1146 N6_N6_N6-trimethyllysine 0.4199 0.8572 0.1406 -0.7248 0.7469 1.0242 0.0538 0.3203 -0.0264 -0.1191 0.9857 -0.2232 0.5725 -0.1582 -1.1725 -0.6742 -0.7679 -0.5719 0.2149 -1.1897 -1.3868 2.2276 -0.3932 0.3064 -0.1484 0.3477 2.2408 -0.2203 1.5815 -0.7321 -1.9629 -0.4340 -0.8246 0.1746 -0.3753 2.2011 0.0225 1.7142 1.5113 -0.4238 0.4622 -1.1853 -0.3783 -0.3637 -0.0909 -0.8296 -1.1541 0.7470 -0.5076 -0.1153 0.3128 -0.2881 -0.8411 -0.5801 -0.3674 0.0005 1.8457 -0.6478 0.3709 -1.9201 -0.9860 1.3682 0.5019 0.6668 1.3487 -0.3777 0.7313 -0.1514 -0.6813 -0.1740 0.1352 0.6167 -0.0303 -0.9050 0.1161 -0.8824 -0.0982 -1.1812 1.2616 -0.6236 -0.2700 0.5482 0.6455 -0.3548 1.1690 -0.6840 0.2536 -1.1293 0.5743 -0.7175 0.0079 -1.0850 -1.3964 0.4492 -0.0394 0.8819 -1.1114 0.8675 1.0447 0.1914 0.4400 1.0480 -0.3648 0.1579 -0.6584 0.6415 0.6698 -0.7108 0.7878 0.3113 -0.9451 0.3024 -1.3053 -0.3566 1.4244 -1.2862 0.0641 0.9683 0.5700 0.3801 0.2582 -0.5918 0.1791 -0.4718 -1.4445 -1.6690 -1.1365 0.1304 -0.1998 -0.3772 -0.3107 -0.0971 0.9485 -1.7660 -0.4733 1.7616 -1.2394 1.0538 -0.4384 -0.9619 0.1276 -0.4144 -1.7761 0.6016 0.6428 0.9608 -1.1361 0.5561 0.3993 -0.6402 -0.4341 -0.8025 -0.1477 -0.1480 -0.9396 -1.0126 1.3510 2.4653 -0.1955 -0.8084 1.2311 -0.0818 2.0521 -1.6459 -1.1793 -0.7413 -1.3639 2.8840 0.2218 -0.4372 1.1649 0.0263 -1.8729 -0.4749 -1.4124 1.0928 1.3178 -0.7722 -1.0685 -0.7644 -0.5030 -1.6782 -0.7368 0.0340 0.8672 0.7750 0.2400 0.0205 -1.0107 0.4852 1.8054 0.4162 -0.5726 1.4064 1.3601 -0.6069 -0.7684 -0.3220 0.1587 -0.5323 -1.3218 0.8930 0.9576 -0.8532 0.4505 -0.8115 -0.4189 -0.5186 -0.8378 0.9585 -0.4684 1.6605 -0.0050 -0.7730 1.2085 0.3690 1.0112 0.2878 -0.6931 0.4138 -1.3122 -0.1553 -1.2490 1.0156 0.0285 0.3746 -1.1014 1.5995 -0.4835 1.5522 0.3248 -0.9499 -0.4731 2.5696 -1.1754 0.0373 1.3141 0.5163 0.3754 0.2457 0.0631 1.9004 1.6947 -0.0385 1.0211 0.7571 -0.5800 -1.0522 1.0467 -1.5104 -0.2830 -0.9079 -0.1773 0.0266 -0.9044 -0.5051 -0.3770 -0.7622 -0.9278 0.0235 0.9252 -1.2124 1.9374 2.3711 -1.4670 0.0747 0.7561 -0.4816 0.2608 -0.6737 -1.2960 -0.3819 -0.0936 -0.5708 1.2444 -0.5008 -0.8481 0.0922 -1.0056 0.6373 -0.0068 -0.8216 -1.4023 1.4221 2.2920 0.2605 -0.2966 -0.1158 0.7107 -0.3699 -0.0125 -0.5364 0.6400 -0.6379 -1.2180 -0.7625 -0.6106 -0.9279 0.2985 -1.6521 -0.3852 -0.3334 3.6740 -1.1973 -0.2451 -0.4526 -0.3479 -0.4880 -0.6747 0.6979 -0.3980 2.9413 -0.4227 -1.6716 -1.7169 -0.8093 -0.3476 -1.2427 0.2309 0.2241 -0.4798 -0.0934 2.9477 -0.1482 -0.0478 -0.3049 -1.2603 -0.7101 -0.1748 -1.2983 0.8551 -0.9283 -0.2299 0.6666 -0.4863 -0.1878 -0.3719 -0.5546 0.6666 -0.8506 0.4266 1.3378 -0.2040 -0.0896 -1.4198 0.1966 -0.7963 0.0610 1.5594 -0.6377 -0.9765 1.9417 -0.7161 1.4781 0.8474 0.8766 -0.5211 -0.0053 -0.8056 -0.1058 -0.1912 -1.2323 -0.0995 2.1008 0.0926 -0.5503 0.7048 0.3174 -1.2431 -0.2861 1.2175 1.1795 -1.2841 2.5998 -0.5120 3.7531 -0.6717 0.1940 1.5628 -0.2511 -0.4611 0.9263 -1.6087 1.7695 1.2687 0.1480 1.2552 -1.4411 -0.9147 0.9644 -1.6590 1.4386 -0.1709 -0.3695 -1.5598 0.2959 0.6041 -0.1995 0.4966 1.9307 -0.5821 1.2299 -0.3393 1.6874 -1.8623 1.0978 1.1216 -0.8285 -0.4302 0.1485 N(8)-acetylspermidine -1.4498 0.5167 -1.8096 -1.6190 -1.2263 -1.8556 0.8345 -1.9083 -0.2445 -1.4076 -1.6512 -0.3048 -1.6961 -1.7967 0.4445 0.6537 -1.9640 -1.6964 0.7857 0.0497 0.5063 1.3160 0.7803 1.1042 0.5571 1.2289 0.8158 0.3867 0.8363 -0.2832 0.1756 0.2100 0.5391 1.1180 0.5841 -1.7577 0.0792 0.9115 0.6219 0.4232 0.2979 1.2013 0.1052 0.1016 0.7653 0.0654 0.3159 0.5571 0.4433 -1.7208 0.3987 -0.2841 -1.6692 -1.8626 0.5073 0.9649 1.1032 1.1048 0.8046 -0.1982 0.6665 -0.1762 0.1674 -1.6427 -0.6020 0.3705 0.7770 0.6109 0.0121 0.1951 -0.3198 0.4833 0.3599 0.7674 1.5151 0.1558 1.0009 -0.1108 0.6620 0.9839 0.2220 -0.1742 0.0757 0.6512 -1.6615 0.1948 1.0026 -1.6676 -1.9320 0.9185 0.3235 -1.6642 0.7834 0.3602 -1.7371 1.0896 0.0850 -0.0159 0.6856 0.5199 0.6543 0.2160 0.2484 1.0645 0.8899 0.1428 -1.8222 1.1070 1.1124 0.1227 -0.2105 0.5955 1.4192 -1.7655 -1.7673 0.8066 0.4619 -1.6695 -1.8768 -0.1495 -1.6195 -1.7055 1.0066 1.0213 0.4239 0.4307 0.0963 -1.8043 0.5546 -0.1713 -0.1277 -1.6370 0.1122 0.6147 0.0726 0.5512 0.0813 0.8725 0.4043 0.1296 -0.0441 0.8025 0.8200 0.2288 0.4732 -0.0919 0.5389 -1.7975 0.5771 1.0073 0.4237 0.7803 0.9565 0.8606 0.5244 1.0343 -0.2170 0.8051 0.2706 0.1816 -1.6928 0.4197 0.7977 -1.7591 0.2755 0.7196 -0.0494 0.4133 -0.0234 0.8563 0.7512 -0.2462 -0.5254 -0.3774 -0.9162 1.4361 0.6856 1.4771 0.1922 0.1181 -0.3542 0.0379 0.2610 0.0272 0.6071 -2.0050 0.7744 0.4156 0.3609 0.3074 0.1323 -1.5935 1.2515 0.6947 0.9944 -1.8696 -0.3054 0.1589 0.4483 0.2400 0.5837 0.9636 0.4115 1.0725 1.1361 1.0452 0.0367 0.3765 0.9381 0.6650 0.8600 1.0494 0.6850 1.1173 -1.9267 0.7328 -2.0518 -1.9905 -2.0638 -1.9327 -0.3800 0.0334 0.1691 -2.0249 0.2629 -2.0058 -0.1447 -0.5750 0.1372 0.2891 0.0572 0.5852 0.8063 -1.8486 0.4108 -0.1002 0.3064 -0.1724 0.7156 0.6887 0.7617 1.1515 -1.7907 -2.0855 1.3874 -1.7866 0.8361 -0.1627 -1.9823 -0.0519 -1.8506 0.2097 0.4252 -0.0069 -0.4940 0.5185 0.8105 0.2358 -1.7492 0.3807 -1.8485 -0.1651 0.2156 -2.0527 -0.0616 0.4822 0.7952 0.1058 -1.7324 0.8618 0.2619 0.8806 0.5592 0.9780 0.2132 0.9691 0.5427 0.7152 -1.0790 -1.5003 0.3882 0.3674 0.4613 0.9335 -2.1039 0.3799 0.7628 1.1559 -1.9765 0.8020 -2.0016 0.5277 0.4570 0.2861 -0.3753 -0.0709 -1.8947 -2.1775 0.2555 -0.0462 -1.7835 0.5277 0.2996 0.6772 0.1068 1.0253 -1.9137 0.9123 0.5762 0.3037 0.2470 0.3970 0.7958 0.8517 0.5565 0.2816 0.5652 -0.1373 0.7624 -0.0449 0.6323 -1.9440 1.4141 0.5766 -0.2423 -0.4831 1.2492 -0.0408 -0.3042 0.6315 0.5614 0.6016 0.5758 0.4111 0.8882 0.4892 -1.9125 -1.8863 -1.9866 -0.3597 0.7677 0.1283 0.6238 -0.1315 -0.3856 0.6199 0.6782 1.0792 1.8849 -0.2451 1.4099 0.9671 -1.8957 0.4443 -1.9111 0.2850 0.2966 0.6012 -0.3275 0.1678 0.5356 0.3426 0.5790 -0.1798 0.7641 -1.9664 0.7820 0.2021 -0.0524 -0.0211 -1.6619 0.2805 0.8371 -1.7908 -2.1760 -1.3657 -0.0822 -2.0427 -1.9904 0.9949 0.2698 0.4007 0.3822 0.1588 1.2456 0.1247 0.2771 0.4888 -0.0655 -2.1321 0.8064 0.9867 0.5317 0.9588 0.0955 0.2842 -2.1435 0.6964 1.2370 0.9818 0.5013 -1.9062 -0.1257 0.2934 -0.1359 -2.2022 -0.5369 0.5707 0.3603 -2.1771 N-acetyl-1-methylhistidine* 0.9766 1.3295 1.3868 0.1705 1.3399 -1.6488 0.1826 -0.6274 -1.6176 1.4223 0.8875 0.6019 1.8271 0.9031 -0.8117 -1.6432 -0.7299 1.2325 1.6540 -0.2652 -0.1392 1.2261 0.4810 0.5492 1.4343 1.3453 -0.0903 -0.5230 1.1579 -1.5659 -1.7526 -0.3132 0.5204 -1.8306 0.4445 0.0417 -0.0060 0.6590 -0.2909 -1.7522 -0.0822 1.0971 -0.2819 0.2530 -0.0750 -0.3010 0.8742 0.5392 -0.0683 0.5486 1.2376 0.1517 0.2459 0.3833 -1.2465 -1.7146 0.3077 0.4111 0.1489 -1.6712 -0.8367 0.6634 -1.7034 -0.2501 -0.0056 -1.4263 -0.6935 -0.0897 0.1923 -0.3743 -0.2315 -1.6856 0.1801 -0.6498 -0.4544 0.9826 1.1791 0.6717 -0.2800 -0.5697 0.5646 0.4287 0.1498 -1.7399 -0.2203 -0.6307 -0.1102 0.0876 1.3867 1.2604 0.2736 -0.0954 0.6363 0.4336 0.6877 -0.0178 0.9144 0.4847 -0.0399 -0.7848 -1.7122 0.2190 -0.7332 -0.8696 0.8194 0.5011 1.1204 -0.2410 0.7056 1.6309 -1.7593 1.6558 -1.3914 1.1044 -1.5674 0.1096 1.1141 0.8651 -0.2711 1.0286 -0.6746 1.0875 -0.8064 1.3680 -1.7936 -0.1254 -0.8140 -1.6144 -1.6538 0.6599 -1.0080 0.0383 -0.4069 -0.2053 -0.0724 -1.0649 -1.5231 -1.2315 -0.2212 -1.1010 0.5174 -0.4172 0.3223 -1.5905 0.3663 0.6407 0.2289 0.2911 -0.6688 -1.4108 -0.8455 1.3689 0.9442 -0.1028 0.6364 -0.4693 1.5077 1.3765 -0.0618 0.8533 -1.5225 -1.0776 0.5762 0.9436 -0.5397 -0.4761 -1.7039 -1.6610 0.0171 0.1406 1.2131 -1.5830 -1.0041 -1.3559 0.5355 0.6141 0.8773 0.1353 0.9677 0.7349 0.5148 -1.8465 0.6162 0.7508 1.0096 0.6989 1.1311 1.1117 -1.3626 0.1105 -0.8763 -1.3891 -1.4657 0.2708 -0.3878 -0.3814 -1.4941 -0.5157 0.5342 -1.2791 1.1896 1.3342 0.0884 -1.5219 0.5441 -0.1062 0.5363 -0.8779 0.7359 0.2456 -1.5211 0.3332 -0.5108 0.2402 -0.7709 -1.6276 -0.0511 -1.1383 -0.9373 -1.7339 -1.6324 -1.6877 -1.3820 0.9710 -1.3273 -0.7766 -1.7517 -0.3768 -0.2469 1.5449 -1.6283 0.7789 -1.5228 -0.7055 -0.3629 1.4873 -0.2149 0.8934 -0.4527 1.3308 -0.0298 0.0778 0.7807 1.5763 -0.5172 -1.5850 0.5199 -1.7899 0.7469 -0.3372 0.0149 -1.7268 0.5331 -1.6235 0.1616 0.2435 1.7682 0.8109 -0.6457 -1.7630 1.3788 1.5177 0.9292 1.1457 0.0313 -0.1804 0.0891 -1.7985 0.6897 0.3040 -1.7065 -0.9367 -0.1616 -0.1200 0.0607 0.2779 -0.8789 -1.6561 -0.4248 1.6461 0.4886 -1.7657 0.3897 0.8477 1.5134 0.7094 1.2124 0.5231 -0.6799 -0.2009 0.9226 0.6051 -0.0620 -0.1184 -0.0971 0.5344 -0.4120 0.1675 1.7582 -1.7283 -1.5749 0.5663 1.6781 0.2952 -1.5989 0.6671 -0.6055 1.5183 -1.7453 0.4463 0.5032 -0.0244 -1.0497 0.6876 0.5194 -1.6312 0.1904 -0.3102 0.4648 0.1021 0.5796 0.8987 1.5740 0.6424 0.4362 -0.2658 -1.6347 0.7917 0.8449 -1.7710 -1.4979 0.5401 1.7361 1.0604 0.9196 -0.2572 -0.1434 1.7801 -0.3113 1.3427 -1.5932 1.8610 1.1172 -0.4644 0.3594 1.6712 -0.9866 -1.7590 1.2752 -0.4980 0.7500 0.0805 -0.1234 0.6984 0.2408 -0.3278 -0.8924 1.3471 -0.1580 0.0921 0.2008 0.3482 0.8135 0.2010 1.0979 -1.0328 -0.1034 0.5866 -1.8333 -0.0276 0.5408 1.4713 0.1838 0.8176 -0.2519 1.0067 0.2234 0.2753 1.6181 -0.2573 0.7430 2.1752 0.9719 -0.3695 0.5365 -1.2171 -0.2854 1.0729 -0.7151 1.4890 0.4837 1.3918 1.0872 -0.3954 0.9318 -0.2445 -1.9297 -1.6952 0.3017 1.7253 -1.9254 0.1219 -1.5485 1.0977 0.2288 1.1538 0.1037 0.4892 -1.6307 0.0546 N-acetyl-2-aminooctanoate* 0.2217 1.0852 1.4085 1.1214 0.3512 -0.4405 0.9800 0.0453 -1.1911 1.2140 1.4920 0.3294 1.2417 0.4254 -0.2597 0.2212 -0.0732 -0.1456 0.4978 -0.4215 1.2274 0.7544 0.6596 0.6785 0.2973 1.0397 1.3532 0.7191 -1.8565 -0.3426 0.4208 0.6183 -0.2496 -0.3873 0.0447 0.1313 1.4421 0.7163 -1.9278 -0.2285 -1.7318 0.7143 0.2089 -0.8209 -1.8715 0.2447 -0.0196 0.5105 0.5428 2.0035 1.5333 0.3357 0.9222 0.2499 -1.6551 0.0219 0.6747 -1.6490 -1.0926 -0.1960 1.4181 1.3603 -0.8310 -0.2586 -2.0441 -0.4564 0.7423 0.6882 1.1054 0.2582 -0.5643 1.4610 -0.3620 -2.3445 0.0689 0.5517 1.0345 -2.0655 -1.8577 -0.7342 -0.6850 1.2576 -0.5392 -0.6242 -1.9383 -0.0458 -0.0965 0.9856 1.3136 1.1519 0.8715 1.0284 -0.3302 0.2993 0.2440 -0.8758 -0.4839 0.4300 0.6944 0.6634 0.3831 -1.0348 -0.0666 -0.0589 0.5529 -1.9550 1.1531 0.0821 0.2784 0.2471 0.0975 1.3065 0.8592 -1.1459 0.4191 -2.0753 0.4888 -0.7280 -0.4428 0.2486 0.5794 0.2074 0.5172 -0.1434 0.1953 0.1010 0.7264 -0.0012 1.2340 0.4929 0.3445 1.2412 -1.6887 0.4530 0.3674 0.4472 0.8340 0.0612 0.8413 1.3867 0.1563 0.8377 0.2158 0.0193 -0.5346 1.0150 0.2393 0.0825 0.5486 -0.0249 0.4692 0.3170 1.0988 -0.0471 0.8588 -0.2411 0.2792 0.4683 0.1894 1.5648 -2.0420 -1.4539 0.6206 0.3928 1.2478 0.6448 1.2403 -0.5916 -0.1441 0.5430 1.0207 -0.3504 -0.6518 -1.7987 0.5785 -0.3186 0.5108 0.4799 0.7316 1.2305 1.9548 0.4047 0.8871 -0.2854 1.8636 2.2267 0.6738 0.0835 0.5487 -0.9697 -0.7189 -0.0189 1.3837 0.4226 -0.2917 -0.7866 -1.9939 -0.9328 -0.6266 -1.7106 0.8310 -0.1091 0.1172 0.7142 0.0531 0.5070 0.6766 0.0240 -0.0701 0.1641 -0.5826 -0.4369 1.4928 0.2361 -0.8093 -2.1927 0.6008 0.2473 -1.2828 -0.7435 -2.1799 -2.2608 -1.8403 -0.1406 -0.7845 -0.1023 -0.7335 0.8950 -0.5374 0.9012 -1.0456 0.9772 -0.0404 0.5620 -0.1870 1.6476 0.0818 -0.5749 0.7427 0.5646 -0.4464 -0.1834 0.5235 1.5026 -0.0969 -0.6922 -0.3582 -0.4500 0.4465 -0.2891 -2.2279 0.7297 -0.0125 -0.5656 -0.8109 -0.3530 0.6937 0.3165 0.5584 -0.1162 -0.5432 0.6272 0.4633 -0.6485 0.1582 -1.6974 0.5880 -0.7010 -0.8258 0.7799 -1.0963 -0.6737 -2.3445 -2.2779 0.2945 0.9207 -0.7974 0.0987 0.4266 1.2187 0.4137 0.0689 -2.4189 0.7484 -0.5563 -1.1677 2.2253 0.4060 0.1687 0.5319 -0.6465 -0.9305 0.2650 -0.3643 -2.0924 0.0059 -0.1769 -1.3804 0.8460 0.2889 -0.1122 0.5805 0.8901 0.2926 0.6575 -1.0502 -1.4855 0.9869 -2.3248 -0.5548 0.2379 -0.0098 -2.2231 -0.1522 0.0958 -1.1391 -2.0855 -0.9845 -0.1793 0.2269 1.1116 -0.2871 0.8547 -0.1812 0.3892 0.3784 -0.4352 0.2573 -0.0389 -1.9442 -2.0077 2.1588 0.2370 -0.0493 0.2562 -0.2778 -2.2571 0.3202 -0.0957 -1.8872 -0.8360 0.9828 0.1071 0.6929 -1.2322 1.0583 0.0578 0.6826 0.6457 0.3238 1.2402 -1.3755 0.0179 1.0930 -2.2790 0.3406 -0.5601 4.6310 -0.7180 0.5452 0.1710 -0.3350 0.8722 -0.6649 0.1627 0.2087 -0.6878 1.1055 -0.1917 0.1339 0.4730 0.6338 0.0385 -0.0327 -0.2398 0.5134 -0.4472 -0.6497 -0.0983 0.5473 -2.1622 0.5983 0.0782 -0.2257 0.8980 -2.6748 -0.5565 -0.2331 -0.4517 0.3206 0.4994 -0.2328 1.6343 -0.6124 1.2518 -0.9535 -2.5880 -0.1329 1.2124 1.7486 -0.0217 1.1409 -0.6755 -2.3869 0.0692 -0.0379 -0.2439 -0.3529 -2.1720 -2.5473 N-acetyl-3-methylhistidine* 0.5671 0.3383 0.8033 -0.5292 1.5541 -1.5823 -0.0121 -1.6433 0.0261 0.4770 1.0551 -0.3697 1.2111 1.0054 -1.7278 0.1662 -0.4725 -0.2411 0.8544 0.3519 -1.3143 -0.3623 -1.1180 0.9104 0.6760 1.3620 -1.6809 0.6128 -1.3106 -0.2015 -1.6973 -1.3233 0.0520 -1.7757 1.6706 -0.7063 -0.2144 0.9900 0.0754 -0.1288 -1.2171 1.3242 -1.4960 -1.6989 -1.3245 0.4105 -0.0386 1.0134 0.4493 -1.4515 -1.4622 -0.1113 1.2939 0.9484 -1.1603 -0.2258 1.2508 -1.1505 -1.5437 -1.6053 -0.0233 1.0716 0.2877 -1.3814 0.1924 0.1137 -0.2118 -1.7947 -0.5309 0.3581 0.0307 -1.6276 -1.5532 0.0669 -0.2704 0.1327 0.9661 -0.4547 0.0432 0.3193 -1.5413 0.6975 1.6121 -1.6808 0.8139 0.7943 -1.3260 -1.4150 0.2155 1.3044 0.8143 -1.4177 0.2500 0.0675 0.8215 -1.4051 1.3483 0.9442 0.8759 -0.1803 0.1599 -0.5669 -1.3420 -1.7394 1.4184 -1.3925 -1.5522 0.1211 1.3433 0.0641 -0.4362 0.6025 -0.4967 -0.1920 -1.4970 -1.4806 -1.2998 0.5490 0.5509 0.8545 -0.1489 0.9463 -1.5344 1.3304 -1.7379 0.3021 0.4969 -0.6058 -1.5975 -0.0418 0.6698 1.3882 -0.3736 0.4776 1.0062 0.7082 -1.4537 0.6837 -0.0922 -1.0081 0.7857 0.4398 0.2128 -0.1816 -1.3550 0.5940 -1.0433 -0.3057 -1.3854 0.8029 0.1943 1.3864 1.1202 0.4185 0.8355 -0.6752 -1.4714 0.5324 -0.2729 -1.0509 -1.4543 -1.7533 0.3823 0.9108 -1.4168 0.8257 0.3501 1.2792 -0.1715 0.9446 0.9420 0.4141 -1.8154 -0.2236 1.4097 -0.2148 -1.2718 0.1492 -0.2298 1.1933 0.5383 -1.7955 -0.1096 -1.5384 1.3464 0.8982 -0.6668 0.4766 -1.2830 0.6236 1.3590 0.0207 -1.3937 -1.3339 -0.2062 0.0663 -1.4211 -0.7611 0.5436 -0.7463 -0.5307 -1.2939 -1.3471 -0.1643 0.2308 -0.3422 -0.0333 -0.7751 0.6300 1.1491 0.0483 1.0629 0.4243 0.9394 0.9131 -0.3726 -0.5190 0.3463 -0.3551 0.7466 -0.2465 -0.0463 -1.3030 1.4287 -0.2181 1.0853 -1.6896 1.6106 0.6963 0.5133 -0.4753 0.7076 -1.4545 -1.6212 -0.2289 0.6945 0.6900 0.6455 1.0160 0.0268 -0.1149 0.3322 -0.9758 1.8433 1.0835 -0.0547 0.6997 0.2046 0.3751 -0.6015 -1.5997 -0.1567 0.3727 -1.5576 -0.7338 1.2494 1.0172 -1.2475 0.3235 -0.0718 -0.0276 0.9341 1.9322 2.2648 -0.3458 0.0009 -1.6627 -0.1808 -1.4641 -1.6393 -0.7514 -0.8678 0.1274 -0.8546 -0.2426 1.6606 0.0618 -0.4613 0.4730 0.9093 0.8307 -0.0398 -1.7439 0.2503 1.7419 0.2792 0.5275 0.0963 -0.8963 1.2805 0.0986 0.8905 0.8029 -0.1608 -0.2699 1.0953 0.4368 0.7648 -0.1759 -1.6677 -1.5035 -1.6693 1.8480 0.2395 -0.5747 0.4105 -0.2155 1.2603 0.0142 -0.5108 -0.3947 0.9781 0.8220 0.0360 -1.8176 1.1257 -1.4940 -0.7381 -0.1463 0.1221 -0.0991 1.0029 2.1511 0.6836 -0.8725 -1.1841 -0.0135 0.3640 0.6847 -1.7172 -0.8665 -0.7360 1.8955 -0.1829 0.7351 0.4793 1.0042 0.3858 1.5146 -1.3450 -1.5283 1.0660 -1.7297 0.7062 -1.6948 0.4087 -0.2108 -0.4285 1.5455 -0.8574 0.1960 0.3555 0.9356 0.7285 0.7578 -0.8312 -1.7789 1.7090 -0.2135 1.1153 0.7159 -0.5746 -0.0687 1.5561 0.6631 0.4523 0.7759 0.5886 -1.7766 0.7476 0.5681 0.8652 0.7049 0.3609 0.7028 0.0695 0.4479 0.5253 1.8853 0.1706 1.2062 2.5106 0.8496 0.3746 0.5701 -1.9515 0.8604 0.5929 -1.8833 2.2790 0.7470 1.1901 0.7598 -0.8453 0.1887 0.7284 -0.1338 -1.6375 0.0792 0.8269 0.4596 -1.6648 -1.4771 1.2857 0.9539 0.5487 0.3753 0.9676 -0.6414 0.1784 N-acetylalanine 1.2800 2.1269 1.0452 -0.5679 0.8358 1.8513 -1.8861 1.7566 0.8945 3.4619 2.3941 -0.6050 -0.6604 0.9283 -0.1423 -0.2375 0.0178 1.2953 0.3792 0.0851 0.3086 -0.5961 0.4903 0.0168 -0.2409 0.8610 0.5306 1.1670 0.9343 -0.4019 0.4858 0.4945 0.3477 -1.3029 -1.1973 0.3719 1.0473 1.6352 -0.4181 -2.2910 0.6662 0.0706 -1.0346 -0.3245 -0.4730 -0.9394 -0.0881 0.4093 -0.5867 1.4850 -0.1463 0.2581 0.2352 2.0978 -1.2002 0.2805 0.0402 -0.9715 0.8303 -1.2569 -0.6223 0.6268 -1.3477 1.5262 -1.7936 -1.0132 0.8799 0.3014 -0.5079 0.4774 0.5362 0.0903 -0.3655 -1.3747 0.7140 -0.3111 0.6949 -2.3413 -0.4438 0.1697 -1.1687 1.3512 -1.0812 -0.2267 0.7257 -0.8436 0.8393 -0.3065 -0.3834 -0.2751 -0.4717 -0.3199 -0.3671 0.5556 1.1481 0.6475 0.3562 1.0778 -0.5931 0.4008 0.5309 1.1189 -0.8738 0.7838 0.6545 0.3451 1.8671 1.1930 -0.0409 1.1868 0.4745 -0.0715 -2.6161 1.1411 2.1824 0.0854 0.4022 0.6742 0.0510 -1.1487 0.7734 0.1229 0.8952 -0.7229 -1.6352 0.5335 -0.2517 -0.2978 -1.0499 -1.4319 -0.8432 1.3689 0.3081 -0.5958 0.0069 0.3038 -0.6782 -0.0113 0.6822 -0.5114 1.2596 0.6563 -0.6016 -0.2498 3.5159 -0.5630 -1.5767 2.5013 -1.1468 -1.4870 -0.7762 -0.6026 -1.5399 0.6582 -0.9719 -1.0957 0.8763 0.1960 0.7691 -1.1378 1.3215 0.1117 1.2375 -1.2240 0.9926 -1.2861 -1.7682 0.4888 -0.5520 -0.0885 0.6646 0.3090 -0.3653 0.7210 -0.2791 -0.6466 1.4137 -0.0452 -0.2557 0.2819 1.8406 0.2741 -0.9134 1.4243 0.1597 0.2977 0.0128 0.4026 1.4321 -0.6697 0.8768 1.1464 0.3626 0.3512 -0.8242 -0.3145 -1.0238 -1.0515 -0.2058 1.4092 1.0354 0.8427 2.2151 -1.1874 0.9463 1.9775 -0.1326 0.7810 -0.1761 0.1874 1.0567 -0.9909 0.5674 -1.3437 -1.2244 0.3305 0.2313 0.4214 0.4817 0.4007 -1.4639 0.5758 -0.9895 0.1147 -0.6633 -0.9451 -0.4641 -0.8974 -0.2689 -0.4617 0.1841 -1.3983 -1.0422 1.0997 -1.5499 2.2670 -0.1540 0.1376 -1.0059 0.4366 0.5610 -0.8445 1.3833 -0.7034 -1.7572 -0.0933 -0.7897 -0.1113 -0.2102 1.1126 -0.0475 -0.1235 -0.0688 0.3536 0.6495 -0.6270 -0.9509 0.3964 -0.5550 -0.9601 0.7335 0.1627 0.2606 0.0634 -0.3706 -1.0591 -1.0398 -0.8985 -0.4264 -1.1117 -1.0882 0.2215 0.8101 -0.5710 1.2469 -0.4411 -1.7379 -1.3124 -1.5387 1.4549 -2.3041 -1.2145 -1.1593 0.4917 -1.8792 -1.5213 0.2599 -0.5682 -0.3808 -1.3123 -0.5124 -0.6919 0.0437 0.4219 -0.5041 -0.9134 0.4614 0.2358 -0.0296 -1.7176 1.5386 -0.0006 1.2374 -0.6494 -0.0605 -1.5267 1.3164 0.0074 -0.7654 -0.3592 -0.5533 0.4793 -1.6258 -0.1885 -1.2448 -0.7994 -0.7794 -0.9737 1.1610 0.6456 -0.7349 1.2979 0.5062 -0.3897 -0.3925 -0.3332 0.0561 0.0190 -0.5138 -0.4450 0.4361 1.7801 0.5424 1.0863 -0.6689 -0.3436 1.6232 0.9895 -0.8874 -0.3111 -1.2420 1.0542 -0.7406 -1.0879 -0.1027 2.1548 -0.6207 -0.0966 0.8568 -0.4949 -0.7830 1.2520 0.9847 -1.1238 2.1232 -1.1897 -0.9173 1.2804 -0.1919 -0.0881 -0.1946 0.9239 0.7724 0.5711 -0.0787 1.3729 -0.6396 -1.0291 -0.3266 0.2020 0.2490 0.3726 -1.2475 -0.2197 -1.0552 2.0645 -1.0647 1.1521 0.6002 0.7457 0.0308 0.2098 -0.0493 1.4668 0.8570 -0.0667 -1.3953 -1.1755 -1.8807 -1.1848 -1.3342 1.8085 0.9175 -0.2984 -1.3703 -1.6613 -0.4533 -0.5028 -0.7182 0.7552 -0.5512 2.9211 1.2921 0.5263 -0.4259 1.0211 0.5376 -1.2619 -0.2815 -1.6321 N-acetylalliin 0.6444 0.3171 -1.6390 -0.1190 0.9092 0.1532 -0.7039 -0.0915 -1.6485 0.4746 -1.4995 0.5007 0.6030 0.8934 1.8573 -0.7801 -1.7523 1.2413 -1.5761 -1.4535 -1.4894 0.9471 -0.1154 -0.5097 1.7484 0.6921 0.2872 -1.5288 -1.4869 -0.4059 1.4028 0.6965 1.5070 -0.3624 -0.2525 0.3865 1.9265 0.8945 0.8160 -0.5823 -0.3123 1.2073 1.2355 -0.0810 -1.4960 1.1658 0.0264 0.8911 -0.1410 -1.5808 -1.5883 0.3255 0.3023 0.3198 0.1614 0.1680 0.7034 -1.3798 0.5230 0.5414 -1.4971 1.0225 0.3075 0.7594 0.9631 0.7513 0.7903 0.0283 0.6095 -0.9895 -1.6124 -0.4504 2.0369 0.4316 -0.3989 0.2673 1.9436 0.2863 0.2615 -0.1946 1.2474 -0.1530 -0.5946 -1.7344 -1.5338 0.1311 -1.4970 -0.3403 1.4009 -0.2941 -0.1786 1.0921 -0.0282 -0.2678 0.3635 1.6104 -0.8535 -0.0485 0.2964 1.0717 0.2066 0.6435 1.7266 -0.8225 0.2923 -0.2664 1.0358 1.4746 0.5925 1.2063 0.0703 1.5050 0.8120 -1.6103 -0.4855 -1.6006 0.2198 -0.4602 0.0913 1.3879 -1.5183 -1.5694 0.3708 -0.4187 0.0102 0.5207 -1.0937 1.4870 0.1478 0.4907 -0.3373 -0.0364 -0.1588 0.5789 0.3571 1.1462 -0.8090 0.4915 0.5837 1.0418 -0.8007 -1.6550 0.7628 1.1712 -0.0848 2.0748 -0.4378 0.8980 0.3797 1.1865 -1.4561 1.0426 -1.5364 0.4277 -0.3077 -0.8126 -0.1059 0.6846 -1.6959 -0.1873 -1.5830 -1.7833 1.4431 -0.2235 -1.5574 -0.5876 0.2210 -0.0351 1.0599 -1.1294 -0.0986 -1.6238 -1.8244 0.9535 1.4662 0.8888 -0.0146 0.1741 0.2680 -1.4506 0.8388 -1.8114 -1.6498 -1.6393 0.2656 0.9236 -1.6310 0.9317 0.2790 0.8216 0.3641 0.5732 0.5484 0.3419 -1.4877 -1.6783 -0.4439 0.6762 -0.1707 -1.4118 1.7054 0.1494 1.3707 -0.1128 -0.4606 0.4914 0.7859 0.4144 1.2838 0.8675 -1.5806 -0.0210 0.0898 1.1229 -0.6516 -0.3143 -0.2218 0.8130 -0.9458 -0.2833 -1.1482 -1.6976 -1.4815 0.6179 -0.1090 0.7506 -0.2925 -0.0112 -1.6916 0.2298 0.1637 0.6653 0.8262 -0.0769 0.9058 -1.7700 0.7797 1.4363 0.4986 -0.0805 -1.6591 -1.7784 -0.6819 0.3523 0.2956 -0.1981 -0.6207 0.1384 0.9920 0.3105 -1.6802 -1.7243 2.3246 -0.5620 -1.4578 -0.7321 1.0633 0.2686 -1.6028 0.7788 0.5082 -0.6987 0.1686 0.6368 -0.7648 -1.4056 0.4371 -1.7780 0.0337 0.2801 -0.5653 1.2519 0.4118 -1.7058 -1.7008 1.3809 -0.5768 -0.5916 0.6530 1.0708 0.4073 1.5517 -0.5979 1.6331 -0.1622 0.8661 0.3675 -1.6424 -0.1724 1.2951 -0.0661 -0.2888 -0.2231 0.0387 0.3983 -1.8762 -0.6854 0.5146 -1.8074 0.0330 -1.6155 0.6921 0.0788 -0.6760 -0.5135 -0.9306 0.9283 1.4437 -1.7343 -1.7951 -0.2319 -1.7478 -0.6746 -1.7438 0.0998 -1.6563 0.5169 -1.6470 0.8028 0.3069 0.4057 -0.2378 1.4717 -0.7545 1.1219 0.8817 -1.6634 0.4001 -0.1655 -0.6102 -0.9790 -0.7077 1.7210 0.2971 1.5878 -0.5359 -0.8147 0.4727 -0.0038 -1.5092 -0.3234 0.5686 -1.7670 -0.1167 1.2486 1.1352 -1.5309 -0.9776 0.7085 -0.5735 0.5850 0.0470 0.6614 1.9468 -1.7084 0.2912 -0.0994 1.5860 -0.9301 0.6323 0.9574 0.8571 1.7220 1.0501 1.4588 -1.7738 0.0027 0.9095 0.6994 0.6991 0.1956 1.5190 0.0649 1.5167 0.0932 0.9266 -1.0253 1.2060 0.5803 0.7863 0.8643 0.9543 0.2596 1.0093 0.0142 -1.9150 -0.5781 -0.3712 0.1974 0.2092 -1.4969 0.6253 -0.0973 0.6080 0.4776 -1.7835 0.6654 -0.4000 0.0053 0.5912 0.1399 -1.7238 0.9279 0.0991 0.5768 0.2037 0.0890 0.5354 -0.4875 -0.7374 N-acetylarginine -0.0989 1.0594 1.2528 0.5126 1.4488 -2.2504 1.2288 -1.1723 -0.5818 -0.8698 -0.5062 -0.4672 1.4899 0.8038 -0.4611 -1.2966 -0.2282 1.5451 1.6973 -0.1005 -0.9933 1.8791 0.3390 0.0941 0.6491 0.9141 -1.2196 0.1914 1.0823 -1.4325 -1.0169 -1.0858 0.8887 -0.7550 -0.0346 0.4322 0.9910 1.7677 -0.2240 -1.2259 -0.7904 1.0361 1.1020 0.4059 -0.2284 -0.2531 0.4299 -0.2556 -1.4074 2.5233 2.3972 0.0138 -0.6851 0.2249 -1.1308 -0.7630 -0.4753 0.0334 -0.2538 -1.7630 -0.7259 1.2746 -1.1128 -1.5128 0.0949 -0.5546 -0.3996 -0.4333 -0.2343 -1.0509 -0.6675 -0.8991 -0.3774 -0.0755 0.0981 0.9380 1.7125 0.6637 -0.3833 0.8966 1.5575 0.0969 0.3907 -2.0202 -0.0868 -0.3643 -0.2803 -0.2187 1.1710 1.2388 -1.0922 0.2025 1.5818 0.8516 0.0923 -0.8227 1.1844 0.7860 -0.2258 -0.7074 0.1003 -0.3308 -0.5963 -0.5171 0.0259 0.4866 0.2435 0.8114 -0.7411 1.6817 -1.8949 0.8381 -0.0304 0.2185 0.6487 0.5277 1.6335 1.0484 -0.1184 1.5397 -0.8225 0.9015 -1.4146 0.5165 -0.9902 0.5097 -0.7136 -1.5925 -1.1939 1.0480 -0.7991 -0.1636 -0.2936 0.3761 0.5230 -0.0816 -0.3966 -0.8501 -0.0822 -0.6553 -0.3766 -0.9015 0.7907 -0.5021 0.0341 1.2680 -0.0128 0.8778 -1.2352 -0.4105 -0.0550 -0.0196 1.0983 0.0902 0.2383 -0.9667 0.9237 1.8305 0.7055 0.5526 -1.7178 -1.1046 1.4704 -0.0002 -1.3070 -0.4903 0.2412 -0.9427 0.4815 -0.9104 1.5840 0.0785 -0.6593 -1.4563 0.0283 1.2837 0.8967 -0.2383 0.9174 0.3790 0.9749 -0.4531 0.8484 0.1354 0.6537 -0.5718 1.1250 0.8177 -1.6816 1.1408 -0.2522 -0.8847 -1.4343 -1.9214 -0.5511 -0.6497 -0.8610 -0.4727 0.1675 -0.3666 0.7087 0.9550 -0.1825 -0.7576 0.9990 0.7390 0.5023 -0.3258 -0.1454 0.5286 -0.8936 0.3823 -0.0229 0.6438 -0.4597 -2.1914 0.7414 -0.2444 -2.0929 -0.9097 -0.8601 -1.7021 0.0923 -0.8587 -2.0816 0.5864 -0.6654 -0.2652 -0.3935 2.4120 -0.8948 1.0710 -0.4382 -0.7003 -0.6119 1.8778 0.7133 0.9529 0.2577 2.0699 0.1406 -0.1496 1.4233 2.1695 0.2656 -0.5574 1.3415 -0.6314 0.3609 -0.3497 -0.2291 -1.3608 -0.6257 0.6635 -0.6959 -0.1611 2.2773 2.7211 -1.6991 -1.5842 0.9132 0.9221 1.6132 2.9498 -0.1825 -0.6858 0.7893 -0.1356 0.6575 1.0294 -0.2825 0.0247 -0.2028 0.7047 0.0032 0.5141 -0.5139 -0.5907 -0.1834 0.5226 1.4420 -0.8206 0.7311 0.8511 1.9340 1.2415 1.0564 0.6954 -0.5098 0.3368 0.2230 -0.3106 -0.2749 0.0216 0.4404 0.1196 -0.3899 0.1098 1.2363 -0.7624 -1.6575 -0.2213 1.6690 -0.4973 -0.9753 0.0968 -0.0134 0.5004 -0.7292 -0.4809 -0.6648 -0.0422 -0.1529 -0.5965 -0.3120 -0.5909 -0.3088 -0.0457 -0.4303 0.8945 0.9851 0.1482 4.0749 0.1095 0.0833 -1.4590 -0.5294 0.2593 0.4187 -0.9288 -0.5949 -0.0087 1.7737 1.8178 0.0283 -0.8899 -0.5394 0.1943 -0.2363 1.2506 -1.1246 2.6017 0.6861 -0.8199 0.3512 1.1421 -1.3413 -0.7385 0.5343 -0.4763 -0.3232 -1.2262 -0.5541 0.2244 -0.3616 -0.9553 -1.6781 -0.0345 -0.7663 -1.4782 -0.1308 0.5946 0.8920 0.0947 0.1436 -1.4351 -0.4112 0.7310 -2.2710 -1.3289 -1.2094 1.5639 -0.9312 -2.2361 -0.4881 -1.4526 -0.7290 0.7577 0.7412 -0.2994 -0.1480 1.8374 -0.3567 -0.1278 0.8642 -1.6562 -0.6445 0.2815 -1.5040 0.6926 0.2241 0.7128 1.2494 -0.0968 0.7491 -0.7223 -3.0324 -1.3716 0.8893 0.2796 -1.1284 -2.2363 -0.6585 1.0675 0.0087 0.4548 -0.8392 -0.2898 -1.5067 -0.3617 N-acetylasparagine 0.6890 1.6101 -0.8592 0.3779 0.6923 -1.6076 0.5889 -2.1280 -0.5527 0.1981 -0.4977 0.0170 0.1000 0.0775 -1.6138 0.5657 -1.3726 0.8855 0.1651 0.1030 2.6100 0.5789 0.8728 0.1746 0.6515 -1.6005 -0.7134 0.0412 0.4746 -0.6115 -0.8562 0.3678 1.5180 0.3929 -0.1520 -0.0426 0.0552 -0.0468 -0.7975 -0.4753 -0.0751 -0.2831 0.5735 -0.1674 -1.3662 0.6994 2.2007 1.5630 -0.5471 -1.4408 1.8430 0.4938 -1.0415 -1.2117 -2.1091 -2.2001 0.6309 -0.5418 -0.3822 -1.2864 2.0044 0.1425 -0.1650 -0.4705 0.2181 -0.4874 0.9062 0.6244 0.5802 -0.2433 -1.1540 -0.0509 0.2510 0.2994 -0.2515 -0.1225 2.0305 0.7855 -0.3158 -0.0412 0.6814 0.1104 0.4204 -0.8757 -1.3344 0.3128 0.7984 -0.2861 0.6663 0.5139 -1.0168 0.2077 0.0878 1.3215 -0.7920 0.2724 0.4865 0.8081 -0.0768 -0.3783 -0.2154 0.1019 0.2386 -0.3676 1.5423 0.3257 -0.9988 1.8439 -0.6067 1.4592 -0.7965 1.2181 1.3954 -0.6889 -0.2982 1.6709 0.9756 0.1440 -0.8733 0.6266 -0.0590 -0.9873 -1.3747 -0.5889 0.4813 -0.1953 0.8665 1.2759 -0.1974 0.9036 0.5442 -2.8546 -0.6320 1.7043 -0.8403 -0.4998 -0.0593 -0.3213 -0.1835 0.0188 -0.7579 -0.6984 1.0019 -1.1347 0.7994 0.7060 0.6807 -0.9757 1.1103 1.1048 1.0924 -0.6003 -0.0817 -0.7285 0.2146 0.2971 -0.4485 0.8242 0.9180 1.5241 -1.5806 1.0899 1.7290 0.6314 0.5017 -1.3472 1.1341 0.8295 0.6295 -0.2356 -0.9219 -0.6121 -0.6768 -0.4114 0.6173 1.1794 0.5412 -0.4902 0.8947 0.6826 0.9427 0.2054 2.4074 -1.5129 0.7800 0.3760 1.4806 0.7565 1.0251 0.5932 -0.7562 -1.9347 -1.0698 1.5757 0.0171 -0.7160 1.6919 0.3058 0.1593 0.3268 0.8827 1.2329 -0.4512 -0.0428 1.4164 0.4751 -0.4826 0.5171 0.6628 1.2809 0.2396 -0.0636 -1.0121 -0.8925 0.0761 -0.8686 -0.2830 -1.2267 -1.4731 -0.8421 -1.4386 -1.1813 -0.1984 0.9348 0.2048 0.9051 -0.7601 0.2110 -0.8451 2.0833 -0.5001 1.1844 0.1463 -1.4414 -0.9221 0.8722 0.4913 0.3220 1.6672 1.2086 -2.3592 -2.1119 0.4277 0.6577 -0.1122 -1.3028 -1.1273 -2.4438 0.4304 -0.5568 -0.8426 -0.7059 -0.3364 0.0092 -0.5597 0.0565 0.6016 0.9797 -1.0657 -1.1573 1.6394 1.1357 1.0457 2.1513 1.0455 -0.1732 -0.1377 0.4061 0.4275 1.0205 0.0927 -0.4263 0.3194 -2.3795 -1.1775 2.9921 -0.5871 -0.0658 -0.0699 1.5009 0.6560 -1.5381 0.1713 -0.2945 -0.3712 1.0630 0.8034 0.1611 -1.5706 1.6942 -0.7699 0.2492 -0.5261 -0.7765 -0.7286 -0.3464 -0.8167 -1.0262 0.2094 -0.3583 -0.2753 0.1094 2.3047 0.0545 -0.3711 -0.5803 0.2483 0.0637 -0.8360 -1.3039 -0.1195 0.2927 -0.7663 -0.8136 -0.1631 0.1067 -0.7613 1.1309 -0.7121 0.4570 -0.5184 -0.0541 0.2892 -0.0975 0.6299 -1.2409 -0.3882 0.5053 1.8853 -0.5354 0.5587 0.3689 -0.4917 0.4975 -0.4195 -0.5131 -0.7392 1.1307 -0.3917 1.3452 -0.3842 0.4686 0.6740 -0.8710 -0.2534 0.5936 -3.3241 -1.4720 0.0120 1.4835 2.1691 -3.1505 -0.0955 0.8966 -0.8069 -0.4029 -0.7587 0.9780 -0.3466 -1.1298 -0.4571 1.4684 1.9945 -0.5861 0.0077 0.1638 0.0660 0.6091 -0.9509 -0.9071 -0.0188 -0.9293 1.0469 0.2604 0.0652 -0.1575 0.1903 -1.4013 0.8002 -1.9117 -0.8174 0.6994 -0.1769 -2.0842 -0.0027 0.0575 -0.7918 1.4782 -0.1963 -0.4950 1.4346 1.0545 -3.7040 -1.4427 0.5098 0.8562 -1.8281 -0.7547 -0.7612 0.7208 -0.0972 0.5009 0.9329 -1.1049 0.2510 -1.3574 -0.9476 0.7199 -0.9697 -1.5010 N-acetylaspartate (NAA) 1.1469 -0.0904 -0.5559 0.4462 -0.8611 0.7259 -1.4107 0.8881 1.2178 -0.2280 0.4759 -0.8536 -0.1350 0.5906 0.2774 -0.7213 -1.1709 0.5519 -0.1497 -0.1720 1.1380 -0.2415 -0.0115 -0.7717 0.0252 0.8798 -0.4337 0.5462 -0.3863 -0.3297 0.1277 -0.3402 1.0013 -0.4353 0.3010 -0.1773 0.2426 0.9104 1.1792 -0.6691 0.3737 1.3156 -0.4233 -0.6177 -1.1131 -1.0821 -0.1453 0.2092 0.3697 1.4319 -0.1946 0.7706 -0.2605 -0.6261 -0.3590 -1.4310 0.0608 0.0278 0.3847 -0.7473 -0.1709 -1.5698 -0.8719 2.3970 -0.8360 -0.9773 1.1448 -0.9849 0.4351 -0.5763 -0.5943 0.6569 1.0169 -0.2603 1.2650 1.1035 -0.5581 -0.6504 0.1536 0.1529 -1.4589 1.6619 -0.4847 -1.8622 0.2289 -1.2042 0.6270 -0.1217 0.3450 -0.0626 -0.8458 0.3654 0.7621 -0.3204 1.8072 0.1577 -0.2042 0.8746 0.4260 -0.4642 0.3641 -0.2626 -1.4790 0.4679 1.4384 -0.1815 0.6107 -0.5845 -0.7003 1.6096 0.2315 -0.7545 -0.5962 -0.0366 0.1726 0.9418 -0.1321 -0.1119 -1.1289 -0.3450 1.0536 -2.2908 -0.1563 -0.1847 -1.2671 0.3952 0.2531 0.4307 -1.0557 -2.4575 -1.1573 0.0542 0.6728 -0.4998 -1.0761 -0.1388 -0.1467 0.2983 1.4553 -0.3995 -0.0081 0.6531 0.2076 -1.2656 1.4816 -0.1403 -0.1623 0.6966 0.5274 -1.6406 -0.8228 -0.2924 -0.5585 -0.0638 -0.2347 0.6978 -0.3514 0.1815 3.1143 -1.8862 0.7567 0.5810 0.5028 -0.8646 1.5388 -1.8961 -0.6754 0.7852 -2.5002 -0.1139 -0.8034 0.2891 -1.7280 -0.1419 -0.6441 -0.1563 1.9631 1.1721 -1.0306 0.6345 0.7587 -0.1408 -0.5134 0.6711 1.1913 -0.0039 1.5207 0.5781 0.0568 0.3171 0.0936 -0.5213 -0.0674 0.4267 0.2039 0.7819 -1.2308 -1.7756 -0.7241 -0.0187 -0.3896 -0.8367 0.6801 -0.5304 0.5062 -0.2783 -1.9363 1.5309 -0.9149 -0.3610 -0.1654 -0.1794 -0.7502 0.0978 -0.0904 0.7593 -0.0460 -0.1296 -0.3204 -0.2440 -0.1191 -1.2578 -0.4445 0.2753 -0.8917 -1.3164 -0.2257 -0.6555 -0.2918 0.0619 -0.1618 -0.9986 -0.7091 0.9657 0.1268 0.3777 1.3613 -0.6614 -0.6035 1.7383 -0.0655 0.7701 0.3238 -0.1686 -1.0679 1.1687 -0.0822 0.1264 -0.1564 0.5081 -0.1776 0.0350 0.6860 0.5082 -0.8133 -0.9313 0.1701 0.2516 -1.3056 -0.4022 0.1543 -0.6630 0.3078 0.8884 0.0989 0.1536 -0.1711 0.4926 -0.9962 -0.2643 -0.3386 0.4660 1.7124 -0.0502 0.6334 0.5160 -0.4933 -0.5739 -0.5290 -1.1985 -0.3179 -0.4585 0.7483 -0.5606 -0.0210 -0.7583 -0.4673 0.4224 0.7017 -2.3836 0.1080 0.3313 0.4289 3.6401 1.7928 -0.4105 -1.0489 -0.4456 -2.1395 -0.3478 1.5757 -0.9431 -0.2552 0.8341 0.7248 -0.4142 0.4182 1.1472 0.0783 -0.1558 -0.4767 1.0749 -0.4162 -0.5329 -0.9234 0.0607 0.1086 0.3752 1.3230 -0.4384 -1.4031 0.1557 0.4077 0.0785 0.5001 -0.4272 0.6966 0.6739 2.0564 -0.8825 0.0977 1.2265 -0.4488 0.7291 -1.3103 -0.2354 4.0890 1.0703 -1.3937 -0.5402 -1.1751 -2.0506 0.1016 -0.8047 1.1910 2.2627 -0.0843 1.9434 -0.6717 -0.3815 -0.8972 6.6316 -0.1735 -0.4429 2.0295 -0.4455 0.5773 -0.4496 -0.3100 1.5222 1.1756 -1.6149 1.3983 -1.1462 0.1146 0.6804 0.1445 -1.0936 -0.5846 -0.3019 0.2734 -0.1304 -0.6091 1.1632 -1.1310 1.2096 -0.4149 -0.5189 0.7436 -0.2496 0.5479 -0.1069 0.0578 0.4676 0.1887 -1.2292 0.2471 -0.1138 -0.5551 -0.4758 0.0929 0.9986 5.9076 -0.4727 -0.2807 -1.4166 -0.0398 0.1484 -0.1511 -0.3032 -1.0446 1.0790 -0.1528 0.4903 -0.0003 -1.0918 -1.6724 -1.4796 -0.5497 0.1286 N-acetyl-aspartyl-glutamate (NAAG) -0.9581 0.4690 -1.3925 0.8939 1.4992 1.2556 1.1338 -1.5203 1.4261 1.3908 -1.1379 0.2751 0.6471 0.2973 1.1264 1.0354 0.5518 0.7660 0.7772 0.2253 -1.1216 0.2672 -0.8816 1.3272 1.1452 -0.1447 0.9087 -0.2864 -1.1170 1.0622 1.3594 0.8743 -0.8368 -1.6817 0.2169 -1.3540 0.6547 1.1230 0.7137 0.7025 1.3038 0.6636 -1.3420 0.0384 -1.1333 0.7551 0.9112 0.6003 0.9209 -1.2868 0.7288 0.7111 0.9408 -1.4556 1.3466 -1.5369 0.2239 -0.9223 -1.3999 -1.4735 0.2608 -1.5497 1.0596 -0.0521 1.0300 0.4334 0.7847 -1.7063 0.6822 0.9113 0.8677 0.3190 -1.4112 1.6718 0.1241 -0.6106 -1.1365 -1.3164 0.5887 0.6919 0.8381 0.9134 0.1382 0.6133 -1.2012 0.7204 0.5876 1.3276 0.8784 1.2910 0.9494 1.1926 -0.3488 1.2319 -1.2727 0.0994 0.1217 -0.2678 0.6236 0.4642 0.1124 1.1503 2.0192 -1.6389 0.5795 -1.2150 -1.4093 0.3099 -1.3975 1.1824 -0.6762 -0.1700 0.5700 0.8631 0.9553 1.2974 0.5603 0.8831 -1.4683 -1.6490 -0.0343 -1.2660 0.0834 0.3698 -1.6361 -0.1115 0.3573 0.1713 0.8770 0.0884 -1.5148 -1.1635 0.7998 -0.4968 1.2149 0.5613 0.2725 0.7911 0.3689 0.9840 0.3068 1.0004 -1.2652 0.3437 -1.1689 1.5155 -1.3239 -1.4144 -1.2067 1.1517 -0.3096 -1.0837 1.4437 -0.8647 -1.4034 1.5720 0.3743 -1.0958 -1.4969 0.5923 -1.2916 0.6085 1.3248 -1.3351 0.8679 -1.5828 -0.0049 0.4635 -1.5362 0.5792 -1.5883 0.7000 -1.7301 1.3550 -1.5620 -0.9806 1.3674 1.0903 -1.2599 -1.0513 -0.0115 0.2321 -1.4127 0.8699 0.8492 0.0604 -0.0637 -0.4062 -0.5828 0.0612 0.0566 0.9945 -1.2177 1.3563 -1.1185 0.3198 0.9447 -1.6742 -1.3739 0.7432 0.6290 -1.0971 0.0412 -1.3014 0.8291 0.3136 -1.4184 -0.4653 -1.3126 0.8476 1.0413 -1.3570 -1.6650 -1.4331 0.8606 0.4860 0.2949 0.3499 0.0113 0.4085 1.1146 1.1197 0.5659 1.2339 -0.0797 0.1389 1.2508 0.8689 0.4768 -1.3189 0.7417 -1.1659 0.1869 0.8147 -0.5795 0.3774 0.3824 -1.2518 1.0527 -1.2118 -1.4295 -1.6455 0.6620 0.0854 -0.0944 -1.3645 -1.4245 -0.4625 -0.1302 0.1366 0.8027 -1.5479 -0.0825 -1.4164 0.1917 -1.2934 0.7748 1.2233 0.2164 0.4535 -0.0536 1.2155 1.5693 0.2172 -1.5027 -0.9689 -0.2225 0.2780 1.0381 -1.5157 -0.1145 2.3293 -1.5808 -1.5146 0.2560 0.3076 0.7655 -0.3350 -1.5902 0.7097 1.4778 0.2799 0.3419 -1.6045 -0.0915 0.2460 -0.0820 0.8171 -0.4100 0.8502 0.3360 -0.2286 1.1892 -1.6303 -1.3412 0.4390 0.4699 0.4731 0.8945 0.3752 -0.4679 -0.7774 -0.1311 0.4492 -0.0789 0.2452 1.1357 -1.0882 1.4794 -0.6033 -1.3142 -0.5131 -1.4670 0.4626 -1.7320 0.7222 -1.3382 0.4277 1.0530 -1.5365 -1.3826 0.1934 1.0149 0.0428 -1.4806 0.1122 0.0736 -1.3973 -0.0349 1.1170 0.5171 -1.2693 0.3373 0.4191 0.6569 0.6464 -1.5009 0.4013 0.0311 0.5843 -0.1104 0.9486 1.0313 0.8945 -1.5809 0.9193 -1.1967 1.9807 -0.2456 0.4510 -1.1242 1.0589 0.2951 0.1962 -1.5188 0.8673 0.2439 0.3036 0.1069 -1.6754 0.6724 0.4560 0.8891 0.8285 1.3783 -1.6387 1.6529 0.4439 -0.3830 -1.7041 1.0630 -1.5334 -1.3664 -1.3591 0.9360 -1.1658 -1.9212 -1.6491 -1.5976 0.3785 0.4894 1.0875 0.5471 0.5870 0.1362 -0.0957 -1.8905 1.0762 -0.4173 1.2623 0.8726 0.7288 -0.8782 -1.5301 -1.6428 -0.1110 -0.3350 0.0561 -1.8860 1.1942 -0.4090 0.6620 0.6603 0.6981 0.3701 0.6461 -1.4674 0.4751 0.9353 0.2862 N-acetyl-beta-alanine -0.2600 0.7459 -0.2101 0.3012 0.9511 0.2559 -1.6306 -0.4386 -0.0104 0.6009 -0.2374 -0.1636 0.1708 -0.4188 0.7658 0.2735 -0.2509 0.6318 0.4863 1.1730 0.7978 0.4660 0.7369 0.9459 -0.1003 0.6267 0.3052 0.2524 0.5425 -0.5129 0.1864 0.2846 0.5711 -5.2681 -0.1758 0.0035 0.2433 0.7478 0.5888 -0.2679 0.6825 1.2160 0.5952 -0.3010 0.1678 -0.9677 0.5451 0.6175 0.4757 0.3678 0.0541 -0.2632 0.2328 -0.4480 0.8192 -0.2718 0.7574 1.2246 0.4361 0.0705 0.4039 -0.4017 -0.1720 0.4870 0.1415 -0.0007 -1.3294 0.0315 0.0107 0.3659 0.3569 -0.3063 0.3693 -0.5817 0.1853 0.3166 0.0724 0.3705 0.9292 -0.2450 -0.4074 0.8507 -1.2832 -5.1036 0.3398 -0.2445 1.0681 0.7055 -0.2689 0.1227 -0.5896 0.5156 0.7503 0.5995 0.6063 0.0717 0.5418 -0.1048 0.7321 0.3828 0.2546 0.5433 1.1722 0.1592 0.7711 0.4697 -0.4839 0.0932 -0.4469 0.9657 0.3745 0.4977 -4.4699 0.4511 0.5028 0.2359 0.7381 -0.2320 -0.2638 0.8671 0.8907 -0.2291 0.5135 -0.1383 0.2551 -0.3157 0.9548 0.1489 -0.2188 0.2449 -5.0299 0.8051 -0.6065 0.0881 0.9316 -0.2086 0.4701 0.6654 0.6761 0.6406 0.1650 0.3594 0.3749 0.0611 0.0431 -0.2126 0.2654 0.2524 0.3889 0.1915 1.0780 0.1780 0.9563 0.3987 0.5062 0.4365 -4.7409 0.0106 -0.7287 -0.3248 0.3917 0.8005 0.3777 0.5859 0.7060 -5.1269 0.4864 0.4548 0.1088 0.4528 0.0948 0.4054 -0.4993 0.6617 0.1713 0.9801 0.4469 0.9980 0.2203 0.7908 -0.3210 -1.3901 -0.5928 0.7912 0.5325 0.0894 0.2489 0.1345 0.2250 -0.3030 0.1745 0.2479 0.5930 0.3491 0.0409 0.2035 -0.7701 0.1249 0.3850 0.3172 -0.2810 0.7770 0.6663 0.3242 -0.3317 0.8329 0.5602 0.3257 -1.0108 0.0077 0.8022 0.9833 0.3643 0.3300 0.7957 -0.2004 0.5601 -5.2218 0.2069 0.1217 -0.1860 -0.5373 0.7650 -0.9336 -0.8012 -0.4922 0.3156 -0.0658 -0.0156 0.6012 -0.1369 0.9674 0.6745 0.2767 0.0120 -5.1962 -0.1857 0.1607 -0.5211 0.0301 0.0408 0.3672 0.8939 -0.1653 -0.0253 0.2573 0.6914 -0.1883 -1.3166 -1.0746 0.1176 -0.3538 -0.1294 -1.3368 0.2681 0.6662 -0.0844 0.9054 0.9034 0.4123 0.3511 1.0474 -0.1696 -0.3312 0.0067 -0.0302 0.3417 -0.1790 -0.3261 0.5023 -1.0551 0.4233 -0.5108 0.4282 0.4218 0.1592 0.8160 0.4504 -0.1063 0.5438 -0.3016 -0.4900 -0.2836 0.1901 -0.3447 -0.2335 0.2008 0.4231 -0.4612 -0.1580 0.5840 0.5659 1.1977 0.8374 -0.0978 0.2421 -0.4000 -0.9417 -0.4007 0.3867 0.1453 0.1387 -0.7266 0.4036 0.3433 0.5308 0.0637 0.6247 0.1461 0.5865 0.6979 -0.1265 0.2105 0.2969 0.3077 -0.2016 0.4516 0.7948 0.3839 0.0178 -0.4509 -0.4067 0.3410 0.4113 0.0783 -0.4929 0.1704 0.0942 0.5948 -0.2925 0.7817 -0.0605 0.9690 0.5956 0.6459 -0.2011 -0.3252 -0.0151 0.6047 0.0361 0.0601 0.4157 0.1690 -0.8145 0.1514 0.4462 0.3834 0.8094 -0.4182 0.0314 -0.4160 -3.8113 -0.6711 -0.6562 -0.3935 -5.3459 0.3953 0.0215 -0.1398 -0.7292 0.1437 0.1124 0.2500 0.1933 0.1696 -0.5082 -0.2783 -0.0305 -0.3788 0.2415 -4.6493 0.3659 0.3577 -0.7281 -0.2676 -2.6028 -0.2010 -0.1173 0.3753 -5.0874 0.7816 -0.8944 -0.3277 -0.8486 -0.4357 -1.0137 -0.1061 0.1590 -0.5405 -0.1396 0.2706 0.1081 0.3267 -0.0446 0.1574 0.0150 -0.0222 0.4056 0.4000 0.2535 -0.6287 0.2311 -0.4663 -0.0104 0.2990 0.2234 0.2978 0.6863 -0.2383 -0.3984 N-acetylcarnosine 0.8592 1.1303 0.3053 0.2246 -0.8851 0.2698 -0.5350 -0.0151 -0.4911 0.6145 -0.0965 -0.4075 -0.1003 1.9959 -0.6375 1.8340 0.2909 1.2205 0.8591 -1.1769 0.2088 0.9341 -0.1479 1.6986 0.6515 1.6973 0.9353 0.8660 0.4891 -0.7303 1.1629 -0.0239 -0.5013 1.4443 -0.4818 0.6333 0.1407 2.6242 -0.8083 -0.0664 1.4724 1.0803 -2.2551 1.4632 0.0435 -0.6117 1.8109 1.5343 0.3603 -0.5386 1.7528 1.3087 0.9272 1.3682 0.2241 0.3426 1.2854 -2.6722 0.6458 -0.5196 1.0909 0.7181 -1.3673 0.8909 -1.1040 1.2552 -1.8815 0.2160 -0.5088 0.2427 -0.3655 -0.8398 -0.3885 0.2036 0.3784 0.0228 1.2135 -0.3990 -0.4340 -0.0699 -0.3113 0.2910 -0.8126 0.3654 0.5478 0.2201 0.9851 1.4488 -1.0006 -2.4369 0.6467 0.4526 1.6498 -0.4737 -1.0164 1.5996 -0.3305 0.9796 -0.1990 1.1284 -0.5270 -1.4335 -1.0871 0.7978 -0.7096 -0.7432 -0.5278 0.7367 0.4684 0.4771 0.9310 -0.3760 -0.2588 -0.0491 -0.6879 0.2676 0.7447 0.8324 -1.4613 -1.0256 1.3071 -0.2253 -1.2065 -0.8855 0.2609 0.5626 0.8768 -0.2445 0.2150 -0.2098 -1.1473 0.2678 0.0497 -0.6889 -1.3479 0.6260 -0.0726 -0.2134 0.6219 1.0788 -0.1900 -0.2066 0.0957 0.1368 0.2225 -0.0732 0.0101 0.7002 -0.6947 -0.0461 0.5629 1.3644 1.0638 1.3946 0.0155 0.4099 -3.6727 -0.0533 0.4965 0.3298 -0.2913 0.7955 2.3151 -1.1756 -1.1218 -0.1723 -1.1198 0.2859 -2.1623 1.6944 1.3165 -1.9811 0.0890 0.4582 0.4043 -1.4019 -0.1044 -0.5228 0.1083 1.2225 -0.2252 -0.8633 -0.0207 -0.5159 2.3597 -0.0994 -0.4784 0.3106 0.2987 -0.3695 1.0569 2.2406 0.0191 0.7431 1.1570 -0.9915 0.6377 -1.1412 -0.5954 -1.2640 0.1424 2.0127 -1.0490 -1.9670 0.6274 -2.5506 0.4794 -1.1434 -1.0314 1.8582 0.4276 -0.6609 0.2013 0.0433 0.2765 0.4965 -0.0664 0.1910 0.0329 -0.1750 0.2813 -0.3217 -0.1442 -0.2893 -0.3514 0.1867 -1.4245 -0.4488 0.4863 -1.9709 0.8042 0.3105 -0.8313 0.0314 -0.5505 -1.3018 -0.4311 2.1824 0.7917 0.0540 0.6151 -0.2427 -0.3738 0.9534 0.4237 -0.8472 0.0231 -1.1214 -0.7235 -0.1355 -0.7049 -0.5216 -1.3889 0.1211 -0.1687 0.1526 0.0445 -0.8503 -1.0463 -0.3401 -0.2117 0.8292 -0.3099 0.3084 -0.5426 -1.6572 0.3298 -0.8681 -0.3591 -0.5383 -0.7253 0.0522 0.2691 1.2481 -0.1530 0.7560 0.2390 -0.5236 -0.9957 -0.7660 -0.2076 0.1466 -0.4108 2.6962 1.0750 -0.5190 -1.2367 0.1008 -1.4082 0.0509 -0.1243 0.7117 0.2795 -1.8514 -1.0079 -1.9534 -1.2898 1.1848 -0.3860 -1.0401 -3.0984 -1.1219 2.2870 0.7616 0.2589 0.0051 -0.3743 1.6369 -0.5957 -0.4045 0.0370 -0.5735 -1.6123 1.0058 1.0188 -0.6891 -1.0189 0.1889 0.0419 0.5552 -0.3970 -1.2086 2.0470 -0.4651 0.5157 -0.3766 2.1723 0.6356 -0.4229 -1.2489 0.2674 1.6219 0.5695 0.3429 1.4360 0.2347 -0.1743 0.8760 -0.0618 -0.9966 0.0178 0.6621 -0.1598 -0.8348 -1.4014 1.1269 0.7556 1.3967 -0.6371 0.3340 2.0711 1.8517 0.0633 0.2780 -0.3335 -1.3352 0.2220 0.4247 -0.5814 0.3303 0.1175 -3.5338 -1.5964 -1.4027 1.5060 1.1247 0.3148 -1.0321 -0.8746 -0.6800 -1.2332 -0.0442 -1.4320 -1.1650 -0.8429 -0.1538 0.1106 -1.1312 -0.4287 0.2285 -0.2733 1.0549 1.1591 0.7987 1.7357 0.0915 -1.2700 -1.6965 -1.2811 0.1598 -0.5917 1.4315 1.8513 0.8851 0.2041 -1.3757 -0.3678 -0.8841 -1.2239 0.2081 0.9725 -0.4210 1.0330 0.0079 -0.1225 0.1098 -2.0232 0.0849 -1.2433 -1.4303 N-acetylcitrulline 0.9094 0.9978 0.8795 0.3865 0.8391 0.3832 0.1284 0.5123 -0.0642 1.4803 0.9364 0.4786 1.2474 0.7294 -0.6221 -1.7340 0.1181 1.1006 0.6727 -0.1701 -1.4976 0.7971 0.5110 -1.6284 0.5208 0.6349 -0.5752 -1.5516 1.1358 -1.6852 -1.8411 -1.5143 0.9836 -1.0338 0.2242 0.2744 0.6317 0.6138 -1.5642 -1.8373 -1.4204 0.6350 0.2272 0.5026 -0.2248 -0.2293 0.9104 0.0755 -0.1507 0.6507 0.9359 0.5389 -0.2434 -0.0148 -1.3768 -1.8093 -0.8629 0.8059 -1.7134 -1.7839 -1.5068 1.2120 -0.3270 1.1614 0.3041 -0.0732 0.3968 -0.4261 0.1232 -1.4928 -0.3086 -1.7755 -0.0219 -0.1904 -0.2760 1.2538 0.9739 0.8770 -1.4981 -1.7104 -1.6864 0.2670 -1.6640 -1.8387 0.4201 -1.7910 0.1581 0.5016 0.6718 1.0031 -0.0839 0.5250 0.9107 0.7761 0.0821 -0.5316 0.6624 1.0338 0.8397 -1.7671 -0.1149 -0.0921 -1.5127 -0.2221 -0.0757 0.7245 0.9898 0.9081 -0.0005 1.0702 -1.8535 2.1733 0.4347 0.5993 0.8857 0.5144 -0.0909 1.2165 0.1062 1.0564 -1.5534 1.2041 -0.7031 1.0333 -0.1934 -0.0338 -0.0253 -0.5036 -0.3194 0.8817 0.0110 0.9387 0.2881 0.3624 1.0151 0.2563 -0.0731 -1.3638 -0.0412 -1.2364 0.3408 -1.7253 0.3336 -1.6989 0.8303 1.0857 0.8503 0.9642 -1.5774 -0.1136 -1.4638 0.2666 0.7376 -0.7685 0.2592 -1.4996 1.0254 1.3355 0.9916 0.7446 0.9343 -1.8853 1.8295 0.3103 -0.1339 -0.2955 0.7301 -0.0024 0.4853 -1.6528 1.3712 0.2965 -1.9593 -0.7169 -0.1450 0.7590 1.3339 -0.5216 0.5378 0.3807 1.0870 -0.1522 0.9081 0.5008 0.8782 1.4246 1.7124 0.4748 -1.4849 0.4867 -0.2586 0.5419 -1.5753 0.4750 0.1787 -1.2601 -0.7953 -0.4872 0.6546 -0.4070 0.8703 1.0558 -0.0564 -0.7007 1.0274 0.6914 0.8218 -1.0199 0.5156 0.3249 -0.2572 -1.6701 -0.7777 0.6679 0.2995 -1.7184 0.5358 0.3149 -1.9528 -0.4557 -1.7433 -1.4587 0.6933 1.2461 -1.9973 0.0929 -1.8610 -0.1689 -1.7740 1.4086 -0.2398 1.0113 -1.6270 -1.2079 -1.8646 1.3176 0.8949 0.5951 0.3498 1.6068 0.4649 -1.9189 0.9168 0.8318 -0.0319 0.2474 1.0131 0.4052 0.6897 0.5418 -0.3484 -0.5154 0.2354 -0.0081 -1.7645 0.5569 1.1140 1.3487 -1.6684 -1.8666 0.7162 1.1859 1.4540 1.2963 0.3181 -1.3906 0.9597 0.2322 1.1864 0.3571 -0.7429 0.3939 -1.8597 0.4977 -0.0033 0.6608 -1.7446 -1.7535 0.1564 0.7124 1.0460 -0.3903 0.8051 -1.8355 1.0180 0.9269 0.8768 0.7001 -0.0130 0.6528 0.4026 0.0927 -0.2276 0.2155 0.1683 0.6281 -0.8424 -0.6099 1.8150 -1.8306 0.5122 0.2312 0.9734 -0.7398 0.0561 1.0315 0.6608 0.3776 -1.8596 0.2192 0.4896 -1.1343 0.0772 0.2484 -0.0138 -0.3928 -0.7309 0.1240 -0.1097 0.7466 0.3150 0.9569 1.4950 0.1053 0.9403 0.2391 -1.7270 0.7602 0.1050 -1.8571 -0.6167 -0.2042 1.3680 1.3841 0.7145 -0.1907 -1.8080 0.9766 0.2150 0.3179 -1.6945 1.8908 0.4461 -1.8599 -0.0488 1.5085 -1.5582 -1.8508 0.5437 -0.6214 0.1966 -1.1424 -0.3634 1.0439 0.3366 -0.4392 -1.9453 0.1955 -0.1281 -1.9388 0.5145 0.6733 1.4652 -0.3056 0.2770 -0.8264 -0.1777 -0.3428 -0.5509 -1.9580 0.1432 0.9812 -1.6966 1.8612 -2.0559 1.2238 0.6613 0.8715 1.6452 -0.4275 -1.7363 0.9185 -0.0418 0.0695 0.6551 -0.6344 -0.1483 0.6950 -1.3946 0.8883 0.0228 0.6258 0.5690 0.0640 0.5503 -0.1299 -2.0218 -1.7852 0.3769 0.5209 -0.6563 0.9100 0.3650 0.3293 0.4549 -0.0043 0.1273 -0.1810 -1.7475 -0.3111 N-acetylglucosamine/N-acetylgalactosamine 1.0196 -0.6115 -0.1918 0.1991 -0.4242 0.9020 -0.8194 0.7451 0.4241 1.1472 0.4740 -0.2133 -1.1669 0.5062 -0.0222 -0.4060 0.8556 0.4117 -0.0493 -4.8041 -3.3794 -1.2794 0.2951 0.1878 -0.4738 -0.6724 0.0213 0.7740 0.8381 0.2827 0.1466 0.4727 -0.3397 -0.5630 -0.3018 0.1315 0.2341 0.8089 -0.8014 0.1595 0.4878 -0.3310 0.0242 0.5132 -0.4014 0.2007 0.4043 -0.2460 -0.0701 -0.3234 0.3324 0.2508 -0.0386 1.1848 0.1239 0.3468 -0.1733 -0.0805 0.0695 -0.0993 0.1337 0.2707 -0.7474 -2.9107 -1.0819 -0.1426 0.5006 0.0155 0.3687 0.8658 0.5231 -0.1979 0.0264 0.2109 0.5706 0.6689 0.0371 -0.4379 0.4918 0.2077 -0.6705 0.8275 -0.1518 0.1042 -2.1568 0.3041 0.6117 0.9663 0.7324 0.3703 -0.1757 0.3735 -0.1377 0.6110 0.2598 0.5472 0.4876 0.5702 0.1025 -0.2418 0.1891 -0.2609 0.0190 0.9279 -0.2753 0.9715 0.4695 -0.6191 -0.7498 1.6422 0.4995 0.9825 -0.6330 0.6101 0.1018 0.4659 -0.0713 0.5480 0.3908 -0.6438 0.7660 -0.0235 0.2459 0.1189 -0.6492 0.6136 -0.1807 -0.0589 -0.0636 -0.0344 0.2059 -1.1972 0.7798 0.3417 0.3193 0.5205 -0.7217 -0.0311 0.3565 0.0456 1.1866 -0.5006 0.2711 0.5594 0.1187 -0.5162 0.0036 0.5048 -0.5684 -0.6218 -0.4100 -0.3869 -1.4500 -0.4134 -0.1435 -0.2475 0.5408 -5.4126 0.7773 -0.1696 1.1700 0.0589 -0.0039 -0.5209 0.7806 0.0546 -0.1527 0.4209 -0.0978 0.2969 0.1409 -0.4220 -0.1189 0.4711 -6.1507 0.1043 0.6285 -0.0446 0.3156 0.3136 0.8281 0.1747 0.0862 0.7741 0.0808 0.5818 0.4188 -0.3603 0.8436 -0.3228 0.9220 0.4495 0.1558 0.1319 0.0027 -0.1063 0.5121 -0.2036 -0.0304 0.1349 0.4047 0.4655 1.0988 -0.4759 0.6900 0.4503 -0.4247 0.7414 1.0514 -0.0537 0.9549 -0.2540 -0.1561 -0.7343 -0.9777 0.6208 -0.5063 -0.3934 -0.0667 0.7443 0.1942 0.5360 -0.3237 0.8001 -0.5184 -0.2181 0.0782 -0.2505 0.1380 0.2511 0.8835 -0.2157 -5.6788 0.3504 -0.4916 0.0384 0.5307 0.1911 -0.5726 0.5888 0.2309 -0.1449 0.8047 -0.8974 0.3518 0.0114 -0.2718 0.1188 0.3441 1.0416 0.2829 0.6140 -0.3637 0.6924 -0.0327 -0.0706 -0.4564 0.1504 0.3821 -0.2448 1.2244 1.0663 -6.1037 0.4298 0.1764 -5.2651 -0.3591 0.2544 0.5359 0.0647 0.4934 0.2891 0.8052 -1.2469 0.1318 0.3290 -0.0149 -5.9045 -0.6182 0.6453 -0.6037 -0.3785 0.3442 0.0232 -0.9063 -0.2225 0.2268 -0.3593 0.0479 -0.4435 0.0966 0.1977 -0.0307 -0.0609 0.1079 0.7919 0.7827 -0.2100 -0.2235 0.6266 1.0178 0.2514 0.4695 -0.1793 0.2589 -0.7750 0.2985 -5.3739 0.0686 -0.3927 0.2226 0.5030 -0.0889 0.1070 -0.2613 0.4475 0.1703 0.2043 0.3558 0.8335 -0.3161 1.1305 -0.4695 -0.4449 0.6395 0.4621 0.3591 0.4815 0.3009 0.6208 0.4921 1.2347 0.0727 0.6806 -0.2108 0.3033 1.0496 -0.0956 -0.0863 0.7717 0.2322 0.0435 -0.0671 -0.2405 0.2647 0.8789 -0.1102 -0.6708 -0.1204 0.7247 -0.0312 -2.3161 1.0431 0.2708 1.6150 0.0303 1.3292 0.4634 -0.0944 0.7196 -0.0736 -0.0412 -0.1856 -0.1441 -0.1016 0.3241 0.4605 -0.0849 0.1097 0.3762 1.0858 0.0944 0.5430 0.7568 0.2940 1.6391 0.0358 0.2054 0.9280 0.4740 0.0663 -0.7450 0.3517 0.1601 -0.6706 -0.3744 -0.4001 -0.2559 -0.9855 -0.4059 0.0907 0.5172 -2.6531 0.4801 -0.6314 -0.3602 0.1297 0.1650 -0.7035 -0.2718 0.3613 1.7154 0.2849 -0.0796 0.0860 -0.7359 1.3107 -0.2304 0.3504 -1.8710 N-acetylglutamate 1.3788 0.6535 0.6688 -0.8527 -0.5724 0.2563 -1.2659 0.2878 0.1750 0.1835 1.5102 -0.4360 0.2465 0.9885 1.1204 0.2575 -0.6830 0.2409 -0.3106 0.2318 1.6196 1.6457 0.0463 -0.7575 -0.9648 0.6199 -0.5530 0.7148 -1.6692 -0.4664 0.6648 -1.2536 1.4452 -0.9114 -0.3769 -0.2281 0.2541 -1.3218 0.9007 -1.4939 -0.4398 2.5101 0.4773 -0.9515 -1.8672 -0.2347 0.0941 -0.0494 -0.5583 1.7997 -0.1519 -0.3972 -0.0611 0.3616 -0.5834 -1.2621 -0.9482 -0.9982 1.3903 -0.3716 -0.8703 -1.3584 0.5832 0.6226 -0.0122 -0.4009 -0.6503 0.0458 1.6371 -0.1734 -0.7830 0.2530 1.4312 0.1958 1.6262 1.9085 -0.4691 -0.6516 0.0993 0.5828 0.2436 1.1304 0.8160 -1.0181 1.0148 -1.3414 0.4108 0.7437 -0.0517 -0.8399 -0.6597 0.2741 1.3492 0.7832 1.0516 0.2962 -1.2262 0.8749 0.7577 0.5167 0.7297 0.2520 -1.6816 1.9228 1.8762 0.2031 1.2430 -0.1698 0.0536 0.5009 -0.5186 -1.4168 -0.0951 0.0653 1.1476 0.4647 0.7437 0.3902 0.4683 0.4526 1.7146 -1.5376 -1.4773 0.7337 0.1903 1.0070 0.9529 0.5828 -1.4268 -0.1065 -0.0034 1.8311 -0.1281 -0.2392 -1.1910 -0.2209 1.1514 1.2026 1.5631 0.2220 0.6034 0.5561 -0.0470 -0.8046 1.8494 -0.4060 -0.6851 1.6635 1.5428 -1.4652 -0.5039 -0.4855 -1.0611 0.9159 0.5468 0.2789 -0.6614 -0.0493 2.1242 -0.6559 0.2527 0.3819 -0.0145 -0.3429 1.1163 -1.8259 -1.0257 0.3381 -0.8278 0.9404 -0.7646 -0.2943 0.0788 -0.2818 -1.6521 -2.0801 0.9086 2.0167 0.5208 2.1382 0.7295 0.2945 0.7824 0.8000 0.6308 -0.6037 0.3119 0.8312 0.3039 0.9318 -0.5790 0.0351 -0.1982 -0.7566 -0.1292 -0.5555 -2.2802 -0.5313 -0.9193 0.3143 0.8297 -2.0534 -0.2211 0.2726 0.1513 0.1424 -0.2165 -0.6989 -0.1079 -0.3738 -0.0790 0.3487 -0.0029 0.8050 -1.2019 0.1589 1.3442 0.6132 -1.1015 0.1742 -1.4136 -1.4874 0.6895 -0.4304 -1.4348 0.0816 -0.5241 0.4272 -0.4479 0.8342 -0.5111 -1.3415 -0.5749 0.3334 1.4456 1.5216 0.6621 -0.7386 -0.6747 1.5534 -0.9455 1.8209 -0.3668 -0.6283 -0.9567 -0.9959 0.7711 0.0168 0.3602 0.2274 0.4162 -0.5177 0.7157 1.4856 0.2121 0.2375 -0.5742 -0.6072 -0.7862 -0.7538 0.4574 -1.1135 0.8191 0.7793 0.9479 -0.5066 -0.3857 0.7077 -0.8170 -0.0400 -0.4337 0.6855 2.7392 0.8711 0.0786 0.1622 -1.2873 0.0017 -2.0868 -1.6615 -0.6638 -0.4094 0.4090 -1.8754 -0.4794 -0.5032 -1.0717 -0.9061 1.2363 -1.6485 0.4401 -0.8092 -0.2301 3.6412 2.2538 0.8247 0.0223 -0.0011 -0.7037 -0.6529 2.1187 0.0040 -0.3922 0.4010 -0.6690 0.3890 1.2837 0.6024 -1.3885 -0.0938 -1.7467 0.6357 -0.1306 -1.0503 -1.5360 -0.9467 0.4083 -0.8954 0.9952 -1.2119 -0.9381 0.6826 0.1128 0.1494 -1.7409 -2.3001 0.7465 0.8708 1.8119 -0.1914 0.4696 1.0348 -0.4346 0.9633 -1.2656 0.3957 1.4296 0.3936 -2.7473 0.3457 -0.4300 -1.5805 0.8862 -0.4587 1.9180 1.4310 -0.4756 1.3497 -0.1313 -0.3394 -1.4905 -1.3029 0.7184 -0.5426 0.3468 -0.5515 -0.8430 0.2548 1.2244 1.6710 1.3647 0.3290 0.2609 -1.3432 -1.2072 -1.0551 -0.5348 -0.8036 0.2448 -0.1644 -1.3355 -0.8823 -1.5421 -0.9748 -0.5557 0.6538 -1.2921 1.0715 0.0361 -0.0868 -0.7886 0.3177 0.4470 -0.1125 0.4511 -1.2261 0.3737 -1.2025 0.2037 -0.2359 -0.3529 -1.7783 1.6900 -2.2349 1.1098 -2.5061 -0.3805 0.8593 1.3778 0.1830 -1.1471 -0.6328 -1.3977 -0.8958 0.9799 0.5349 -1.2521 -2.0460 0.5141 1.8729 N-acetylglutamine -0.2524 0.8938 0.9140 -0.4465 0.7269 1.1115 -0.4534 0.3070 -0.2173 1.7373 0.9576 -4.1974 1.4845 0.2921 0.2290 -0.1116 0.5800 0.4527 -0.7411 0.3620 0.3514 0.9775 0.5503 -0.4900 0.0225 0.5230 0.0117 0.3258 -1.8058 -3.8991 -0.2792 -0.5750 1.1840 0.0564 -1.0946 0.2360 1.5576 -3.3158 0.5913 -1.6792 0.0075 2.1148 0.1872 0.1755 -0.4218 -0.0517 -0.1281 -0.9284 0.2823 2.3075 0.1543 -0.3257 -0.0644 0.7677 -0.5442 -1.1768 -0.3331 0.8118 0.4310 -1.2871 -0.1285 -0.5932 0.2132 0.2316 -0.4645 0.2593 0.1421 -0.1030 -0.0524 -1.0431 -0.7141 -0.0711 -0.3272 -1.1497 1.8529 1.4527 0.2630 0.8075 -0.3940 0.2411 0.9019 -0.2898 -3.8408 -1.3138 0.4947 -4.1182 -0.2198 0.4550 0.5747 -3.2652 -0.3159 1.3580 1.8802 0.1814 1.5087 -0.7893 -0.2993 -0.1687 -0.1348 -0.5486 -1.3877 -0.5625 -0.3122 -0.7216 0.9175 -0.2395 0.9850 1.0235 -0.1977 0.3479 -1.1386 -0.8097 0.5110 0.5037 1.5539 0.8545 1.4103 1.8989 -0.3832 0.9462 -3.6080 -0.4640 -0.4083 1.2967 -0.2042 0.7392 1.5709 0.0934 -0.5780 -0.3224 -2.0936 1.7289 -0.9058 0.4746 -1.3851 0.1261 0.7118 0.8251 0.8587 -0.0249 1.0705 0.6538 0.2249 -1.1904 1.0349 -0.6167 0.1404 0.3214 0.5249 -0.1241 0.2128 0.0646 -1.6984 0.9910 -0.0485 0.1573 -1.0453 -0.0841 1.9111 0.1636 1.1168 -0.4434 0.3600 0.5837 1.7775 -1.8013 -0.0269 -0.5849 -0.7683 -0.4103 -0.0468 0.6175 -0.2307 -0.0148 -0.3805 0.4008 1.1907 0.9802 0.3421 0.5765 1.0502 -0.0316 0.0424 0.9289 0.5357 -0.3096 0.5821 1.2730 -0.8070 0.4660 0.0370 0.1284 0.6991 -0.6143 -1.0010 -0.1154 -1.2052 0.0725 -0.0269 0.3302 0.9701 -1.8438 0.2032 0.6488 0.8124 0.1138 0.0463 -2.4595 -1.0883 -0.7944 -0.4274 0.4677 -0.5562 0.3695 -0.6680 -0.5264 1.0277 0.8475 -0.3126 -0.1209 -0.1153 -0.6553 0.4646 0.8138 -0.3241 0.5372 0.6441 -0.1179 -0.2570 0.8106 -1.4607 0.2612 0.3781 1.2297 0.0891 1.0657 -0.4483 0.6913 0.4689 1.4198 -1.0546 0.4229 0.3852 0.9552 -0.3685 0.3653 0.9045 -0.5209 0.0539 -1.2106 0.2475 -0.2520 1.1517 1.5223 0.0073 -0.6763 0.4626 0.3950 -0.2592 -0.5488 0.2325 -0.1013 1.1206 0.6916 0.7078 0.6957 0.8449 -0.1089 -0.4600 0.8674 0.0187 0.9667 0.5959 0.8817 0.0319 -0.2856 -1.2046 0.5521 -0.8313 0.0947 0.2376 -0.4233 -0.3910 -1.1527 -0.1209 0.2123 0.3465 -0.4108 -0.6141 -0.3276 0.3587 -1.4746 0.6754 2.3846 1.1273 -0.8247 0.6107 -0.0681 1.8140 0.0543 0.6080 -0.3407 0.2726 -0.5372 -0.3908 0.6516 1.1394 1.1068 -1.2102 -0.7403 -0.4178 -0.0741 -0.6729 -1.0658 -0.6075 0.4460 0.7443 -1.0353 0.2380 -0.4244 -0.4496 1.3395 0.6882 0.6896 -0.9112 -2.1528 -0.0384 0.6034 1.1015 0.5526 -0.1129 1.6384 0.6318 0.9724 0.1682 -0.0658 1.3776 0.9608 -1.2519 0.3887 -3.1625 0.2686 0.0872 -1.1194 0.4764 1.1168 0.3798 0.8561 0.3899 -0.5839 -0.1064 -2.6987 1.2070 -0.1773 -0.0075 -0.3458 -1.3013 -0.1894 0.6135 1.0278 0.8858 1.3643 0.9279 -0.7115 -0.1641 -1.1228 -0.9784 -0.3019 0.2387 0.3345 -1.0692 -0.7615 -0.1227 0.0641 -1.1993 0.0395 -0.2669 -0.3515 0.7694 -0.6733 0.0447 1.1081 0.3828 -0.6211 0.4912 -1.1346 0.4768 -0.4888 0.4163 -0.5483 0.6521 -0.5219 -1.2500 -3.1270 0.6207 -0.5469 -4.6072 -0.9665 0.0559 0.6291 -0.9081 -0.0044 -1.5390 -0.4520 -0.2522 0.9361 -0.1446 -0.8801 -0.0263 0.3460 N-acetylglycine 0.5788 0.2231 -0.4594 2.9723 0.8225 0.0716 -1.5826 -1.0531 -0.4062 -0.0987 -0.5547 -0.0535 2.3687 -0.7883 0.2981 -0.6031 2.1887 0.0917 -0.8446 1.2914 0.1656 -0.4772 0.3404 -0.5031 0.3030 -1.4992 0.6934 -0.3607 0.5180 -1.0389 0.6555 -0.0263 0.7117 0.6581 0.3872 -0.7000 -0.9167 -0.8494 -0.2254 -0.9767 0.8874 0.4511 0.1414 0.3804 0.6899 1.0066 -0.3018 -0.8078 0.2425 -1.1438 -0.4341 -1.0176 0.4256 -0.3367 0.5129 -0.4992 0.2476 2.4948 -0.5958 -0.2158 -1.2367 -0.4005 0.1934 -0.5942 -1.9362 0.5394 -0.7213 -0.2880 -0.8895 -0.9184 0.8477 0.2722 0.0988 -0.7104 1.0841 -0.4071 -0.0173 -0.1098 -0.2335 -1.2006 0.0913 0.3253 -1.9770 0.2342 -0.8374 -1.4343 -1.3705 -0.1294 0.0024 0.5673 -0.8550 -0.9456 0.2389 0.5012 -0.7734 -1.2136 0.4720 -1.1005 0.3086 0.7834 0.3023 -0.7242 1.1180 -0.2586 -0.3654 0.5617 0.7191 1.2028 0.7287 -0.0326 -0.8693 -1.1788 0.9416 1.3912 -0.5608 0.2945 0.0674 1.1463 -0.8466 -0.4439 0.1979 -0.4927 0.4210 -1.2946 -1.5353 -0.1985 0.4230 1.1566 -0.2946 0.2068 -0.7869 -0.5730 -0.2009 -0.9097 -0.4014 -1.1228 0.6425 -0.1448 1.6291 1.2744 1.0128 0.8334 -0.4707 1.7230 0.6346 0.5489 0.6451 -2.0324 -0.8188 0.9217 -0.3249 0.2468 -0.3121 -1.4533 0.7563 0.1584 1.6733 -0.0322 -0.1487 -0.3060 0.9378 0.7414 -0.8721 1.5197 0.6159 0.9502 -0.4278 0.3999 -1.8911 -0.2847 0.2574 0.5639 -0.7084 0.2911 -0.7730 3.6629 1.2606 -0.5371 0.8286 1.3640 -0.0808 0.5430 0.6599 0.5936 2.0426 -1.2210 0.3679 0.0223 0.6158 -1.0363 -1.0267 -1.6730 0.5546 0.3558 1.9541 0.2672 0.8318 -0.3029 -0.1088 0.7956 0.2902 -1.0678 0.6854 0.3406 -0.3111 3.0214 -0.2981 0.0878 2.1882 0.3765 0.5422 -0.5153 0.1670 -0.5593 -1.2372 -0.8477 -1.4692 -0.0122 1.4387 0.6820 0.2970 0.5905 1.3808 -1.2229 1.6631 1.0073 -0.2301 0.0136 -0.4195 0.0802 -0.5174 -0.2234 0.1125 0.5819 -1.7304 -0.4090 -0.5575 -0.4834 0.5098 1.1702 -0.0418 0.0467 -0.4032 0.1546 0.1515 0.3965 -1.2247 -0.9230 -0.0298 -0.9035 1.5460 0.6569 1.4809 0.3337 2.0666 -0.2677 -0.3434 0.1947 0.5839 -0.1187 -0.2207 0.5409 -0.1974 1.2828 -0.1237 2.3054 -0.0087 -1.6154 -0.1476 0.6491 1.2247 -0.3813 0.1482 -1.7462 -0.4317 0.0477 2.2931 0.2521 -0.5248 2.9373 -1.5009 -0.5616 -0.7466 -0.0360 -0.9006 1.6645 0.5899 0.8939 -0.5373 -1.0743 -0.1592 -0.7067 2.5120 -2.1560 0.6636 -0.2330 -1.1057 -1.2816 -1.4849 1.5767 0.9778 0.1810 0.2921 0.7560 1.4749 -0.8674 -1.0875 -0.0914 0.7283 -1.5653 1.6575 -0.9593 -0.7868 -1.5022 2.1305 -0.5703 0.6283 0.3665 -0.4825 -1.3647 -0.4701 1.1653 -0.7675 -1.6411 0.1780 0.0079 1.1388 2.0539 0.8658 2.0642 0.1498 1.2741 -0.7012 0.2002 -0.8676 -1.3977 -0.6071 1.8662 -1.0666 0.2314 -0.1186 -1.7488 -0.2475 -0.5338 -2.1232 -0.2841 0.6358 0.5040 -0.4030 0.2647 1.9278 -2.5038 0.7341 -0.4060 -0.6563 -1.3144 -1.1608 -0.0100 -1.5601 -0.4348 0.6183 0.1376 1.6209 -1.2342 0.8471 1.2530 -0.0650 -1.0876 -0.4188 -0.6947 0.0960 -0.9126 2.5226 -0.0695 0.0433 -1.1194 -0.8137 -1.6177 -1.1065 -0.2913 1.6116 -1.3396 0.2124 -0.4333 -0.4105 -1.2169 -0.3723 -0.6210 -0.7062 -0.1410 0.5279 1.4033 -3.1591 -1.0081 1.3347 0.5536 -1.6743 -0.7728 -1.4928 0.4003 -0.2972 0.8039 -0.7294 -0.5774 -1.0973 0.8312 0.0985 0.8402 0.1945 -1.0038 N-acetylhistidine -1.6011 -0.0591 0.7018 -0.3397 0.2653 0.4688 -0.9693 0.4661 -0.5573 0.3517 0.3271 -0.3484 -0.4327 -3.6694 0.3715 0.1931 0.5737 0.2004 -0.2615 -0.1105 -0.2044 0.9654 -3.0683 -0.1262 0.1596 -3.5496 -0.3658 0.3444 0.3758 0.1910 0.2082 -3.3490 1.0404 -2.1706 0.2950 0.7190 0.2705 -0.4143 0.1715 -0.2392 0.4643 -2.9007 -0.2272 -0.9603 0.0598 0.0885 -0.4098 0.1412 0.2695 0.5791 0.3080 0.1050 0.2777 0.0155 0.5679 -1.0549 0.6704 0.7556 -0.3789 0.0484 -0.0377 0.3284 -0.3574 0.4120 -0.2232 -0.8641 -0.8082 0.2892 0.1046 0.1873 0.6096 0.2726 -0.8057 -3.9082 1.1641 0.9337 0.6912 0.9582 -0.1606 0.1914 0.6661 -0.2371 -0.1691 -0.4089 0.6642 -3.7885 0.3824 -0.4423 0.0631 0.8451 -0.5980 0.8303 0.3562 0.7319 0.8051 -1.6476 0.6846 -0.5692 0.1894 0.3547 -3.8263 -0.5788 -3.3439 -0.7230 0.4780 0.2205 -0.2866 -0.8677 -1.7742 0.0711 -0.1678 -0.1051 0.7683 -3.6150 0.2224 0.0571 0.1425 1.1979 0.0995 -0.1989 0.1853 -0.0037 -0.1540 0.5935 -1.4240 0.3749 0.3403 -0.4428 -0.0998 0.3118 -0.1741 0.3534 0.0472 0.2448 0.3858 -0.5909 -0.1574 0.2115 0.3714 0.3080 -0.0517 -0.0830 0.0054 -0.7864 -0.0628 -0.0971 -0.2031 0.0820 0.3210 0.7121 0.5391 -0.2516 -0.3754 0.6664 -0.0871 0.0118 0.1203 0.0988 0.5567 -0.5412 0.9286 -0.7070 -0.2206 0.8155 -0.1313 0.1320 0.0573 0.1020 -1.7183 -0.2109 0.0254 -0.1094 0.1095 0.4080 0.7893 -0.1125 1.1458 0.1116 1.0001 0.2672 0.0525 -4.0089 0.2895 0.6213 1.1258 0.5116 0.7307 0.4789 -0.0276 -0.3942 -0.8035 -0.0748 -0.1209 0.1295 0.3414 0.3792 -0.2317 0.2035 0.3245 0.6296 0.7897 -0.2471 -3.3786 0.1755 1.0930 1.3919 -0.1916 -2.5662 0.2302 0.5762 0.1383 0.7221 -0.9075 0.2233 0.3051 -0.5146 -0.3966 0.3386 -0.0239 -0.1059 0.1674 0.3666 0.4892 0.3215 -0.1339 0.4585 0.5091 0.1535 0.2524 0.7649 -1.4435 0.5244 1.1213 0.2695 -0.3561 0.4220 -0.9520 0.4457 -0.0173 1.1467 0.3141 0.1473 0.6878 -0.0956 0.7862 0.2186 -3.6998 0.6197 0.5424 -0.1868 0.0343 0.4343 -0.0662 0.2507 0.2313 -3.5309 0.5836 0.6089 0.3600 -0.3518 0.8666 0.6668 0.9581 0.1723 0.6542 -0.7836 -3.2841 -1.5332 0.7039 -0.3850 0.2116 -0.4698 0.5112 0.1588 -0.7287 1.0488 0.4146 0.7881 0.2798 -0.0464 0.3852 -0.3833 0.8812 0.5091 -0.2040 0.7480 0.6320 0.7069 0.3463 0.7547 0.7643 -0.2933 0.5337 -0.4769 0.6193 0.1338 0.7917 0.2033 0.8051 0.8368 0.4771 0.2875 0.3514 1.2240 0.8583 -0.0490 0.7637 -0.0236 1.2565 0.2358 0.2611 0.3092 1.0096 -0.2474 -0.4891 0.7848 -0.5768 0.8013 -3.5308 0.4518 0.6944 0.4724 0.7396 1.0673 0.5060 -0.3442 0.0534 0.4703 0.8709 0.8938 0.1626 -1.2302 0.7914 -0.4377 0.5863 0.7162 1.0110 1.3123 0.6965 0.9357 -0.8290 0.6688 -0.2027 0.1446 -3.9364 1.3557 0.7093 0.4509 -0.0562 0.8025 -3.3439 1.2512 0.9636 -0.2759 0.2083 -1.9608 0.9091 0.5089 0.3589 0.1463 -0.0700 1.2502 0.5773 -0.6419 0.5554 0.6456 0.8511 -0.1631 -0.2540 0.5866 0.4327 0.5491 -0.3414 -0.0425 0.7430 0.5068 0.5061 0.4069 1.5448 -3.8463 0.6995 -0.3472 -0.2069 -0.0858 0.1376 0.0702 0.2433 -0.0458 -4.1767 0.3929 0.0716 0.8793 1.2439 -0.9308 0.6400 0.3821 0.1503 -0.3119 0.0514 0.5043 -0.0052 0.3973 -0.7365 0.9465 0.1877 0.6993 -0.5339 0.1634 0.1518 0.2301 N-acetylisoleucine 1.1898 -1.4924 1.9289 -0.7728 -0.2349 1.5694 -1.2199 1.8324 -0.9917 2.0733 2.1266 0.6153 -0.8168 -0.9880 -1.2410 -0.5694 1.1833 -0.8818 0.2732 -0.5806 0.5988 -1.5034 -0.3811 -0.8795 -0.8596 -0.8648 -1.1766 -0.7450 -0.6571 -0.9036 0.0856 0.7230 -0.3353 -1.3035 -1.3787 1.9588 -0.8257 -0.5404 0.7436 -1.2031 -0.5223 -0.2198 0.4602 0.2535 -0.6733 1.0259 -0.9162 1.1143 -0.8687 -0.8462 1.2158 -1.1986 0.4319 2.0190 -0.4393 0.2175 -0.9225 -0.4328 -0.9803 0.4350 0.4234 0.3903 2.2056 1.5668 -0.8600 -1.2320 -0.9497 1.1297 -1.1747 -0.6432 0.2343 -1.1037 -0.9923 0.9821 -0.9142 1.2165 -0.6797 -0.8830 1.1853 -0.9795 0.8934 0.9697 -0.8955 0.9144 1.8103 -1.0811 -0.6733 -0.7990 0.0768 -0.4712 0.4247 1.3877 0.9117 -0.4168 0.9432 -0.7848 -0.8657 -0.0277 0.7741 -1.0878 0.3970 0.2495 1.1687 -1.2596 0.3384 -0.7634 -0.9873 -0.9752 -1.4429 -0.7451 -1.2038 -1.1670 -0.6617 1.1400 1.8052 0.5219 -0.6439 -0.8111 2.1614 1.6487 0.7869 0.8218 -0.9741 -0.9895 -1.2526 0.9581 0.5767 0.8236 -1.0671 -1.2583 1.1000 -0.7007 0.6241 -1.1213 -0.9832 1.3147 -0.8550 0.5875 0.8112 -0.2277 1.3525 0.9108 -0.8275 -0.9497 -0.7081 -1.0067 -0.8957 0.7079 -0.7555 -0.6989 0.9835 0.4493 0.5769 0.5804 0.7516 0.6348 1.0226 -0.6327 -1.0949 -0.2998 1.0886 -1.2813 -0.6770 0.8612 -0.7935 0.7108 -1.1209 0.8833 1.4473 1.6624 0.7958 -0.9394 -0.0953 0.7845 -1.1604 0.9733 0.9857 1.4631 -0.8215 -0.5839 1.3217 -0.0376 -0.0340 -0.9755 -0.6547 0.5909 0.3801 -0.7962 -0.6122 0.2344 -1.3511 2.0119 -0.7715 0.1725 -0.6590 -1.0499 -0.8056 0.6094 -0.2137 0.7279 0.4460 -0.6363 -0.7062 0.7375 -1.0044 1.3529 1.2309 0.0958 1.1773 0.6778 -0.8494 -0.9346 -0.3172 0.8950 -1.1967 -1.0205 1.2583 -1.2694 -1.3476 0.8622 -1.0066 -1.0941 0.5718 0.5221 0.8413 1.3523 1.2848 1.5018 1.1205 1.5491 0.5362 -0.7076 -0.8580 -1.0946 0.7190 0.9618 0.3597 -0.8037 0.8562 -0.7625 -0.0604 0.6486 1.1303 1.6462 0.9905 1.7104 0.5738 0.4312 1.0624 0.6526 -1.0586 0.7653 0.9341 -0.9976 -1.0774 -0.8592 0.4733 -1.0425 1.2449 -1.1994 -1.0956 1.1640 -1.2209 0.9571 0.9934 -0.4850 -1.1507 0.5587 0.5546 -1.1119 0.6110 -0.0629 -1.1846 1.3583 0.6901 -1.0507 -1.0515 -1.0541 0.2713 -0.6120 0.9903 -1.1988 0.9964 -1.2254 0.6998 0.3020 -1.1296 -0.9850 -1.1724 0.8008 0.8498 -1.2720 0.9391 1.1884 -0.9121 0.4394 0.8899 0.5321 1.6463 -1.1514 1.3486 -0.2328 -1.0357 -1.1678 -0.9737 0.9488 1.4573 0.5859 0.3376 -1.2993 -0.8812 0.4053 1.4005 -1.1938 -1.3587 0.0344 -0.9046 0.2071 -0.8539 -1.1333 -0.9655 1.7337 -1.6157 0.8414 -1.0781 0.9040 -1.0288 1.0453 0.8004 -1.2287 0.1940 -0.8307 -0.9471 -0.6826 0.7283 0.0252 2.4093 1.1245 -1.2875 1.1307 1.1750 0.3116 0.3386 -1.1895 0.0644 0.5257 0.8998 0.5313 -0.1308 -1.2722 -0.6621 -0.1372 1.0868 1.0537 0.8946 0.4248 -0.3379 -1.1627 1.5345 -1.2906 0.8246 -1.0899 1.2813 0.7615 0.5193 -0.3631 -1.2815 0.9520 -1.3012 -1.3243 -0.8067 1.1477 0.3767 -0.9276 -1.5175 1.8840 -0.1176 0.8950 1.7906 0.6928 -0.9874 1.7295 -1.5115 0.2454 -1.5895 0.1293 -1.5432 -1.0966 0.6472 0.4393 -0.6756 1.0833 1.4447 0.6392 -1.2566 -1.2703 -1.4478 -1.1172 -0.1798 -1.1770 0.4325 1.2506 0.1448 0.4016 1.0508 -0.0728 0.7302 -1.0890 0.7076 -1.4036 N-acetyl-isoputreanine* -1.2454 1.4304 -1.6645 0.2357 -0.3381 0.5465 -1.2408 1.8763 -1.2960 1.2173 -0.2728 -0.3018 -0.0730 0.1322 -0.9876 -0.6295 -0.5489 -0.3475 -0.8921 -0.1243 -2.1389 -0.7830 -0.3509 0.3586 0.0567 0.5881 -2.0950 -0.2094 -1.0152 -0.0132 -0.2242 -0.4313 -0.4088 0.7911 -0.6621 3.0184 0.5065 -0.1588 -0.4789 -1.0893 0.4776 -0.6856 -0.7022 -0.1494 -0.5521 -0.2122 -0.3089 -0.3615 0.0392 1.0704 0.4135 -1.0102 0.2616 1.3048 -0.9646 1.1167 0.1107 0.6227 -0.4039 -0.3627 -0.4981 -0.7054 -2.0297 0.5929 -1.5218 -1.4222 -1.1924 -0.3004 -0.5119 0.3351 -0.2924 -1.7917 1.3450 -1.5481 -1.0322 -0.3673 -0.0515 0.9823 -0.1711 0.6586 -0.4216 -0.7153 -0.7296 0.2853 0.5624 -0.0245 1.3245 1.4290 -0.5034 0.5888 0.6538 -1.0613 0.9887 -1.1121 -0.7658 -0.2472 1.6947 -0.2064 -1.8457 0.2723 0.7305 -1.0496 0.0737 -1.1282 0.9122 -1.7833 1.0223 -1.1760 -0.1075 0.1882 -0.4918 0.3625 -1.5634 0.4208 0.4716 0.5795 -0.0435 0.7319 1.6237 0.2165 -0.1821 -0.0126 0.1175 -1.0252 -1.3924 -1.9464 -0.7046 -0.7251 -1.8190 -0.2371 -2.3383 0.2117 -0.5034 0.0874 -0.3801 -0.7866 -0.1260 0.0222 0.8163 0.2803 0.2187 -0.1171 3.1804 -0.6147 1.5584 -1.3364 -0.6968 1.0138 2.4781 -0.1176 0.2350 0.2906 0.7346 -0.4751 -0.5809 -0.7143 -0.5697 0.2134 -0.9155 -1.0554 -0.0293 1.3476 -0.2975 -0.4216 2.2205 1.1540 -1.3022 -2.0930 -1.1289 -0.5000 0.0346 -0.4093 -1.9434 -0.5199 0.0074 0.6846 1.0162 0.5233 -0.9077 -0.9441 0.5157 -2.0976 -0.1814 0.2765 0.6551 0.2145 0.3616 0.9765 -0.8361 -0.2392 -0.2909 -0.5315 -0.6395 -0.9164 1.0346 0.2614 0.0763 -1.1724 0.4082 -0.2853 -1.2691 0.9997 0.7192 -1.1440 2.3411 1.3521 0.8819 -0.4009 0.5886 0.2628 1.8486 1.5841 -0.8854 -0.7882 -1.5948 -1.3183 -1.3424 -1.2999 0.4521 -1.8737 -0.3597 -0.1224 0.0585 -1.1225 -0.4221 0.1943 -0.4493 -1.1821 0.0657 -0.0965 -0.3203 -0.3735 0.2423 -0.4436 -1.0220 -0.1760 0.3447 -0.7628 -0.8331 0.8203 0.1793 -0.0787 2.1796 -0.2630 -1.0883 -0.2365 -0.4666 -2.2274 -0.5721 -0.0569 -0.1267 0.5373 -0.5759 -0.0988 0.5636 -0.1421 0.4584 -0.6054 -1.1511 0.1713 2.4365 0.6280 -0.0607 0.1251 -1.9990 0.2651 -0.1249 -0.5245 -0.8647 -0.5709 -0.9276 -0.3294 1.0418 -0.3460 -0.1353 -0.6590 -0.4129 0.1889 -1.0444 1.7081 -0.9035 -0.8046 0.6991 -0.0698 -1.0139 -3.0713 2.1849 -0.4146 -0.7139 -0.1511 1.3269 0.1417 -0.8063 0.0359 0.6513 -0.5929 -0.1444 1.6500 -0.5754 -0.8092 -1.3039 -0.4803 0.9012 -0.4054 1.7741 -0.7631 0.4214 2.2604 0.0246 2.2140 -0.8994 0.1374 -1.4571 -0.8169 1.5786 0.7480 -0.2751 1.0642 0.5198 0.3260 0.5263 0.6320 0.5800 1.0068 0.1750 0.8530 1.7173 0.3876 1.3335 -0.9366 0.4291 0.5444 1.4616 0.0934 -0.0812 -0.4579 0.2211 0.5971 0.5831 0.5142 -0.9902 0.1073 -0.0278 -0.0133 0.5655 0.7072 0.4841 0.7207 0.8086 0.3618 0.8419 2.2054 0.3944 -0.6945 -0.1913 -0.2167 0.8599 0.8183 0.6465 0.9327 0.0307 0.6132 -0.0979 1.0536 2.2217 1.7572 0.3585 -0.1756 -0.4714 -0.0952 1.3053 0.5184 -0.7848 0.4782 0.5100 5.9441 -0.4738 0.4436 1.8069 -0.0311 1.2495 0.1310 0.0970 1.3344 0.2733 0.0983 -0.1579 0.0446 0.4184 0.0207 -0.7297 2.9074 1.9403 -0.8778 0.0284 -0.4110 -0.2238 -0.6497 1.2042 0.6029 0.3736 1.6809 -0.8692 0.6714 -0.4576 0.6745 -0.4002 0.8283 -0.4361 -0.1546 N-acetylleucine -0.5640 0.3974 2.2143 0.2530 -0.7903 2.3449 -0.3267 2.3654 0.1734 2.4959 2.8810 -0.2028 -0.1511 -0.9953 -0.2676 -1.2876 1.4883 -0.0325 -1.2697 -0.2653 -0.1383 -0.2170 -2.1236 -1.3269 -1.2860 0.3312 -0.6567 1.1170 0.4550 -1.1673 -0.5023 -3.2916 0.3726 -0.0977 -0.5593 2.5402 0.6373 -0.7516 -0.4813 -1.2139 0.3086 -0.1290 -0.8634 -0.0773 -0.5711 0.5512 0.7859 -1.5003 0.3731 0.0401 0.6270 -0.6768 0.9967 1.6607 -0.8620 -0.0530 -0.9773 0.4706 -0.2226 -1.4465 -0.4891 0.3966 -0.2939 1.8604 -3.4810 0.0787 -0.3395 0.0487 -0.9346 -1.1195 -0.5894 -1.2823 -0.6232 0.8597 0.4887 0.5946 -1.7595 -0.3603 -0.9627 1.3518 0.5162 1.6327 1.0222 -2.0321 1.8706 -1.5558 -0.5225 0.0938 0.8420 -3.0441 -1.1345 0.9052 -0.1888 -2.8343 2.1322 -1.4121 -0.7658 0.3477 -0.8857 -0.8002 0.0886 -0.6872 -0.0008 -0.3902 -0.3203 1.8407 2.1711 0.5155 -1.8265 -0.2851 -0.2203 0.5068 0.1882 0.4666 1.4227 0.7965 0.2747 0.7471 1.6560 -0.5727 1.0821 -0.1183 -1.0238 -0.4365 0.2262 1.1797 -0.5820 0.1094 -0.8221 0.7704 0.6294 0.5130 -1.2589 -0.2948 0.9156 -0.2702 -1.0626 0.1429 0.2972 -0.9799 0.7898 -0.5079 0.3892 -0.5138 0.8939 -0.1406 -0.1845 0.3569 -1.0809 -1.0600 -1.9144 1.1024 -0.5522 -1.3043 -0.7276 0.2120 0.5089 0.4301 0.1800 -2.6143 0.7412 -1.9972 0.9041 -0.6160 0.4989 -0.7320 1.1003 -0.4305 -0.0624 0.5257 0.1413 -0.3747 -0.3614 0.9684 -0.5512 0.4974 -0.2170 -0.0474 -0.9411 0.5181 0.0772 -0.2882 -0.1878 -0.1181 -0.5846 -0.5524 0.3782 -0.3251 -0.8338 -0.4094 -0.3465 2.1868 -1.7672 1.0025 -0.7535 -0.5128 0.8705 -0.6178 -0.6735 -0.5279 0.5362 -0.4512 1.0529 -0.3837 0.6192 0.4240 -0.1536 0.7561 -0.1976 -0.7010 -0.3043 0.4288 -0.7389 0.3732 -0.6435 -0.8978 1.8893 1.3057 -1.2736 0.2478 -0.1314 -0.0908 -0.2821 1.2383 0.3081 0.9650 1.6986 0.1004 -0.4120 1.3186 0.1157 -0.2983 -3.5251 -0.7123 0.2128 1.2968 -0.2123 -0.0562 0.4212 0.5166 -0.4825 -0.3846 0.4864 1.7017 0.9040 1.4322 -0.4204 -0.2594 0.2738 0.3675 0.7404 -0.6044 -0.3715 -0.0017 0.2322 0.3847 0.1733 0.6044 -0.6052 0.1323 -0.0346 0.2483 0.3318 1.2168 0.0844 -0.3647 0.2433 -0.4336 1.4421 0.1705 -0.4390 0.5518 -0.0923 0.8445 0.3873 1.3399 -0.5872 -1.2493 -0.6305 -0.5854 -0.8889 -1.9616 0.0932 0.1268 -0.4453 -0.0705 -0.2537 -0.1940 0.2192 -0.9485 -0.2188 -0.1957 1.0062 -0.2663 0.4555 0.0848 1.9410 0.4650 1.3948 -0.3553 1.4567 1.8684 -0.4309 -0.5025 0.2457 0.0463 1.0225 -0.4573 -4.1478 -0.7349 -0.0451 0.2466 0.9368 0.4071 -0.2614 0.1456 -0.3798 -0.8224 0.3695 0.6271 -0.5514 2.5470 0.0137 0.4395 0.2493 -0.9668 -1.8018 0.3874 0.8374 0.3752 -1.2011 -0.3063 -0.4057 0.3178 -0.6413 -0.2002 3.4305 0.2288 -0.3097 1.5688 -0.3123 0.3424 0.1424 -0.1726 -0.7573 0.3374 0.0698 -0.7942 0.0812 1.0056 -0.1649 -0.1387 1.8691 1.0451 0.8652 -0.3689 0.3363 -0.5309 0.3390 -0.3860 1.1951 -0.2721 1.2007 -0.2045 1.2417 -0.2623 -1.9243 0.0530 -0.1748 -0.9497 -0.3940 -0.0338 -0.7052 1.1122 -1.0447 3.3178 -0.6812 0.7590 2.1251 -0.5427 -0.4115 -0.0114 0.7610 0.0015 -0.4580 -0.8694 -0.3251 -0.1822 -0.3504 0.4287 -0.2958 -0.0018 -0.1758 -1.1059 0.2413 -1.0415 -1.1764 -0.0420 -2.0883 -0.2158 0.1081 1.1341 0.1608 -0.2025 -0.1374 1.2489 1.4703 -0.3478 -0.2681 1.4349 N-acetylmethionine 1.4285 -0.0485 1.7209 1.2854 -1.4517 2.2192 -0.9616 1.5311 1.9793 0.6776 -0.6781 0.4420 -1.5474 -0.5270 1.0970 0.0022 1.1089 0.8066 0.5795 0.7515 0.4231 -1.4085 1.2808 0.5965 0.0045 1.1968 0.8932 1.6283 1.7581 0.8737 0.1385 0.6500 -2.6174 -0.8995 0.2486 0.8809 0.9179 1.8130 -0.5059 0.0249 1.4261 -1.3848 0.5055 0.5307 -0.7693 0.2301 0.6175 1.4795 -0.6025 -0.1916 0.7684 0.6875 -0.3625 1.2598 -0.1216 1.2861 0.0086 -1.7395 -0.6270 0.6641 -0.6569 0.3543 -1.9920 1.5231 -1.5796 -1.0916 1.2833 0.0856 0.4994 1.1827 1.3189 0.0922 0.8384 -0.0425 -0.3627 -0.3059 -0.0155 -2.3557 0.3314 0.0750 -2.1419 0.4638 0.2244 0.6524 0.2413 0.6648 0.5886 -2.9783 0.7154 0.8194 0.4363 0.3417 -1.5953 0.6193 1.5387 0.2300 0.3353 1.2672 -0.2584 0.1353 0.4096 1.0722 -0.2984 0.7486 -0.1669 1.2027 0.5513 -0.4712 -0.3133 1.3005 0.7946 0.6853 -1.8968 0.8565 0.4055 0.6469 -0.1139 0.8627 -0.2245 -0.2803 1.4085 0.5242 0.4414 -0.1480 -1.6022 1.1872 -0.0890 0.2841 -0.0213 -0.3940 1.1440 0.5229 1.1819 -0.1065 1.2207 -0.2982 -1.6970 -0.5061 0.1995 -0.5350 0.6870 -0.7968 -0.6063 0.7067 1.8820 -0.0990 -0.9906 1.0113 -1.6567 -2.0250 -1.7359 -1.5981 -1.7288 -0.9795 -1.1418 -0.5318 1.4351 0.8576 0.7532 -1.5872 1.6775 -1.7067 0.7717 -0.9197 0.5486 0.1534 -0.1326 0.8045 0.9943 0.6816 1.0030 0.5233 0.2978 1.5721 -0.1210 -0.9739 0.9430 -0.8648 -0.3837 0.2109 1.4715 1.1763 -0.0754 1.3119 -0.1018 -2.4373 0.1109 -0.9901 0.7990 -0.3355 1.0906 0.0299 -1.9999 1.4307 -1.1521 0.3249 0.2076 -0.2697 -0.0689 0.0169 0.9579 0.5844 1.1391 -1.9550 1.1980 0.5845 -1.3769 0.9087 -0.1937 -1.0439 0.8758 -1.2988 -0.4006 -2.0966 -1.7535 0.8785 -0.5136 -0.0195 0.3587 0.9100 0.2047 0.4168 -0.1731 0.9677 0.1398 -0.7571 0.6983 0.3851 0.1111 0.3232 1.4162 -0.3193 -1.9349 0.9100 0.2053 0.6312 0.3644 -0.4401 -1.5227 0.3726 0.8695 -0.0754 0.7961 -1.7203 -0.2930 0.5305 0.2337 -0.0062 0.2552 1.5667 -0.1212 0.4347 -0.5339 0.5631 0.7067 -0.1622 -1.0001 1.0949 -0.5939 -0.8793 0.8473 1.0923 0.2524 0.5991 0.6056 -2.3492 -0.5565 0.1334 0.5568 0.0449 -1.0135 -0.0063 0.8067 -2.6214 1.1509 0.1740 -0.4732 -1.5569 -1.4546 -0.0981 -1.0031 0.1576 0.2763 -1.1682 -2.0200 -0.2947 -0.3161 -0.7932 -2.2192 -1.6481 -1.4192 0.1093 -0.6885 -1.2551 -0.8677 0.3332 0.8750 -1.3693 -1.0364 0.4844 0.9828 0.4225 0.7155 -0.8613 0.5754 -1.7729 -0.0911 -2.0257 0.4873 0.4755 0.3259 0.0615 -0.5862 0.4849 -0.6613 0.0263 -0.1285 -0.0712 0.9194 1.5013 -1.1577 1.0409 -1.5161 -2.2696 0.2191 0.8660 0.2914 0.7397 0.2079 0.1006 0.6926 1.3124 0.0467 1.0442 -1.5121 -0.1945 1.2336 -0.8620 0.4178 0.3927 -0.3141 1.1867 0.7996 -0.4875 0.4318 0.2835 -1.0086 -1.7987 -1.1426 -0.7309 -1.8860 -0.1452 1.3027 -0.3727 1.3245 0.4408 0.3488 0.1622 -0.2277 0.2419 -1.6970 -0.0818 -0.9799 0.0050 -0.5600 1.4359 -0.3644 -0.1135 0.2954 0.1047 1.1886 -1.1292 -0.7989 1.0586 0.2937 -1.7694 -2.4430 0.9111 1.3157 -0.1060 -0.5588 -1.3658 -0.0970 0.8947 -0.2580 -0.3198 -0.3742 -0.4839 -1.9938 -0.3388 -0.8795 0.0360 -0.9478 -0.7310 -0.8899 -1.0303 0.1336 0.2164 -0.5161 -1.5735 -0.1295 1.6800 -0.2880 0.4382 0.5743 0.3990 1.0095 -2.5592 -0.3814 0.3864 N-acetylmethionine sulfoxide 1.8137 -0.3761 0.8928 0.8651 -1.0431 1.7816 -0.1912 1.9169 0.8695 1.9738 1.3796 0.2722 -1.7591 -0.1013 0.2230 -0.2772 0.4533 0.3257 -0.2961 0.3253 -0.0176 -1.6296 0.4602 -0.5441 -0.9095 0.2642 0.2427 0.6572 0.9393 1.4091 -0.3666 0.1223 -2.0206 -1.5483 1.4756 0.8571 0.1958 0.9551 -0.9889 0.5558 0.2728 -1.9411 0.1756 0.4305 -1.2646 0.2316 0.3826 0.7651 -0.7379 -0.3036 0.3614 1.0592 -0.7692 1.1320 -2.1149 0.4111 -0.4218 -1.7282 -1.0647 0.1163 -0.6413 0.1101 -1.6347 1.6194 -0.8893 -0.9504 3.0058 -0.3794 -0.0467 0.7105 0.4471 -0.7119 -0.0790 0.3955 -0.9570 -0.4590 -0.3787 -1.5094 0.3173 0.0185 -1.2625 1.1392 0.2848 0.6903 1.2616 0.3927 0.0470 -0.9792 0.6456 0.8211 0.2206 0.2790 -1.4628 0.0067 0.9027 -0.1282 0.2441 0.7026 -0.8772 -0.6230 0.5081 0.7042 -1.0591 -0.2480 -0.4068 0.5709 0.3509 -0.7695 0.6984 1.1046 1.1629 2.1727 -1.3584 0.5653 1.3280 0.1005 -0.7161 0.0944 -0.2372 -1.0068 2.0303 0.5338 -0.6658 -0.3274 -1.2319 0.5837 -0.3169 1.1869 -0.3246 0.1722 1.4051 0.5950 1.0181 -0.0345 0.9525 1.1692 -1.4914 -1.0740 -0.2845 -0.9787 1.0934 -1.1295 -0.3139 0.0634 0.6858 -0.4064 0.9321 0.6875 -1.8339 -1.5961 -0.5260 -1.5114 -1.0367 -1.6462 -1.5559 0.2396 0.7250 0.3530 0.7808 -1.2208 2.4380 0.3754 2.5012 -1.0439 1.2651 -0.4845 0.2294 1.1819 0.5388 0.4556 0.3196 0.2790 -0.2370 1.6260 0.3245 -0.8478 0.3320 -0.6328 -0.4817 -0.5782 0.6076 0.2362 0.3508 0.5117 -0.2814 1.1481 2.5523 -0.3074 1.1281 -0.7058 0.2992 2.2621 -0.1788 2.7653 -2.2745 -0.1271 0.4354 -0.4252 -0.0932 -0.5310 0.2090 -0.2689 0.8674 -1.9103 1.2026 -0.0652 -1.7906 0.1098 0.0071 -0.8257 0.9375 -1.9164 -1.0902 -1.6707 -0.0898 0.5409 2.0184 -0.0959 -0.5697 0.6481 -0.5008 -0.4021 -0.2334 1.4482 -0.5446 -0.4170 0.0483 0.0180 -0.0447 -0.1867 0.3455 -0.9654 -1.0774 0.5122 0.1216 0.3013 1.3471 -0.5285 -0.7940 -0.3853 1.1788 -0.0594 1.5387 -1.5461 -0.5169 0.8098 -0.5583 0.5941 0.0477 0.5448 -0.5520 0.1322 -0.5913 0.6353 0.0111 -0.7963 -1.3872 0.8439 -0.1626 -0.4979 0.1262 0.5107 0.0148 0.5086 -0.0673 -2.1422 -0.7197 0.1404 0.0512 -0.1552 -0.6301 0.4274 0.0852 -2.6332 0.3620 0.3019 -0.5088 -1.5239 -1.1582 -0.4177 -1.1158 -0.1493 -0.2205 -1.1037 -1.7690 0.1505 1.7097 0.8732 -0.5911 -0.9396 -0.9601 0.0484 -1.3228 -1.0231 -0.8872 0.6463 0.6801 -1.3326 -0.5617 -0.0230 2.3778 2.5155 1.2181 0.0639 1.3656 -1.3791 1.6470 -2.2449 -0.0211 -0.5257 -0.4393 -0.4348 0.0322 -0.2922 -0.6624 0.1371 -0.4399 0.1009 0.0080 1.0445 -1.2994 1.1113 -0.8504 -2.7574 0.0234 1.7647 0.0167 0.5051 0.3565 -0.3401 0.4518 0.9880 -0.1985 0.7633 -1.7205 -0.0436 0.7162 -1.1794 -0.2118 0.6352 -0.3186 0.4141 0.1958 -0.1191 0.0600 0.5477 -1.2025 -2.0971 -1.4369 -0.2735 -1.0204 -1.8578 0.7222 1.8584 1.5455 0.6428 -0.0340 -0.2359 -0.0122 0.2752 -0.5428 -0.0536 -0.1559 -0.0937 -0.8679 0.3818 -0.2788 -0.5715 0.7585 0.0158 0.9598 -1.5828 -0.6491 3.2795 0.4131 1.8472 -0.5792 0.6745 1.9208 -0.1131 0.1522 -1.0041 -0.4538 0.0157 -1.1001 -0.5290 -0.6478 -0.2822 -1.7470 -0.5286 -1.2110 0.4018 0.3303 -1.2324 -0.0002 -0.7660 0.1301 -0.4501 -0.3837 -1.5489 0.6399 3.2598 1.6404 0.2777 0.2024 0.2607 1.4607 -0.5776 0.1470 1.0319 N-acetylneuraminate 0.8492 -1.0349 0.5070 -0.1367 -1.7326 -0.1901 -0.6031 0.3289 0.1159 1.7850 1.7364 -0.4952 -2.1231 0.0692 0.8882 0.1723 0.8726 0.2012 -0.4809 1.4528 -0.1979 -2.1041 -0.2289 -0.0437 -0.0588 -0.2515 0.4380 1.7389 1.2226 0.0185 0.6805 0.5640 -0.9847 -0.7422 0.8270 0.2255 4.4530 2.1969 -0.9635 -0.0706 1.3229 -1.4564 0.3770 -0.3639 -0.6148 0.6290 1.5333 1.0192 -0.4551 1.6688 1.3826 0.3317 -0.7551 1.7789 0.2407 0.5125 -0.1481 -1.5557 1.0753 0.1493 -0.0406 -0.3059 -2.1554 0.3528 -1.8580 -0.2429 0.3999 -0.3748 0.2860 1.1596 0.6877 -1.0183 0.1530 -0.2990 0.0472 1.3802 -0.2317 -1.1352 0.2745 -0.0840 -1.1255 0.6205 0.3689 -0.7508 -0.0783 -0.4117 1.4963 0.6570 -0.0904 -0.1841 -0.0764 -0.6950 -0.9997 1.8781 -0.0173 2.9640 0.8297 1.5503 -0.7531 -0.7685 0.0970 0.5549 -0.6564 -0.0117 0.4969 0.2693 -0.0161 -1.6713 -1.4044 0.8454 0.5511 0.5697 -1.1755 0.4939 -0.3730 -0.4645 -0.4570 0.6931 -0.4275 -1.4001 0.8343 1.2663 -0.1073 -0.0400 -0.6608 4.4007 -0.3200 0.2731 0.6923 -0.8809 0.0713 0.8447 0.6020 -0.9411 0.7449 0.7732 -0.5712 -0.5571 -0.5971 -0.5443 0.8543 -0.6144 0.4007 0.8228 0.1236 -0.4566 -0.5024 0.6610 -1.3210 -1.2073 -1.6499 -0.9575 -2.0540 1.2089 -1.4214 -0.9437 1.1531 2.7390 2.6502 -0.8131 1.4398 0.1146 -0.0118 -1.2503 -0.3452 -0.9205 -0.3087 0.2224 0.6320 0.6492 0.9491 -0.9309 0.2949 0.2429 -0.6846 -0.5551 0.0775 -0.7225 0.5213 0.4840 2.9840 0.6150 -1.1013 0.4912 -0.7593 -0.1443 -0.9020 -1.1161 0.0373 -0.3243 0.9230 -0.0355 0.2115 -0.0734 -0.8206 -0.2048 0.7556 -0.9058 -0.3106 -0.4858 -0.2633 0.2687 1.3432 -1.9056 0.7215 0.0312 -1.5335 0.7077 0.0932 -0.9472 0.4832 -1.2478 -0.9713 -2.1108 -1.5077 0.2752 1.2365 -1.6533 -0.2984 1.6312 -0.3283 0.5537 1.0305 0.2647 0.2470 -1.0785 1.0449 -0.3133 0.4340 0.8374 1.0243 -1.0392 -1.5851 0.1970 -0.1164 1.6491 -0.0602 -1.2554 -0.9569 0.0741 0.6383 0.7113 0.5313 -2.2969 -0.0092 0.6758 -1.1046 -0.1177 0.5272 0.5810 0.4529 0.3174 -0.9680 1.9004 -0.2189 -0.8665 -0.8389 0.1256 0.4418 -0.6492 1.9092 0.6121 -0.1573 -0.4980 -0.3154 -1.8811 -0.5728 0.1158 1.0523 0.8695 -0.4421 0.0671 -0.2791 -0.9800 -0.2598 -0.3002 -1.2129 -1.8245 -0.8108 0.3707 -0.4977 -0.3514 1.1559 -0.7047 -1.7084 -0.7044 -0.2388 0.0717 0.6656 -1.3682 -0.5183 0.0482 -0.1125 -0.6524 -0.2664 0.8173 0.9850 -1.5206 0.1048 0.1400 1.0159 0.0478 0.6150 -1.4483 0.2510 -1.1913 -0.8072 -1.4617 -0.7075 -0.5410 0.3035 -0.0774 -0.1770 -0.2747 -0.2628 2.5102 0.2625 -0.1769 -0.1438 1.4015 -0.1614 0.4810 -1.4224 -1.4667 -0.3221 -0.4673 -0.5262 -0.0875 -0.0922 -0.2625 0.0666 3.8946 0.7387 1.2975 -1.3255 1.8030 0.9180 -1.2365 -0.0781 0.1629 -1.0398 0.7762 0.1229 -1.1037 -0.0919 1.1290 -0.0363 -2.0923 -1.5207 0.8856 -1.0665 -0.3226 0.5966 -0.0888 2.3427 0.8378 1.3240 0.9214 0.1055 0.3125 0.3077 -0.1335 -0.3057 0.5034 -0.7159 1.8042 -0.7289 -0.7442 -0.5979 -0.0131 -0.0049 -1.3027 -0.3069 -1.1758 -0.1535 -0.7004 -0.5210 1.5003 0.8434 1.1345 -0.2327 -0.9866 0.9651 0.4183 -0.3693 -0.1819 0.1343 -0.8824 -1.6258 -0.2489 0.6564 1.4827 -0.1213 -0.2655 -1.0547 -0.5271 -0.5805 -0.5023 -0.9705 -0.8762 0.6561 1.0076 0.0863 1.2926 -0.5233 0.6592 1.0713 -1.5477 0.3045 -0.7693 N-acetylphenylalanine 0.1540 -0.3428 2.0697 0.4265 0.6164 1.8930 0.3795 2.3641 0.6548 2.9392 3.7874 -0.5174 0.1077 -0.3102 0.3792 -0.7128 1.2999 -0.3146 -0.6607 -0.5311 0.3359 0.1690 -2.0106 -0.5683 -0.3769 0.0349 -0.4610 0.9848 -0.3295 -1.5225 -0.7896 -1.3599 0.7992 -1.4045 -0.6970 3.2466 0.2568 -0.5672 -0.4280 -0.7669 -0.9048 -0.6004 -0.8981 -0.5793 -0.7464 -0.3843 1.3882 0.1918 -0.4871 0.5530 -1.3430 0.0130 0.0940 2.2686 -1.8156 -1.8102 -0.8679 -0.8223 0.5882 -2.0689 -0.1122 -0.5331 -0.8828 2.0088 0.9240 -1.5229 0.0728 0.2915 -0.2043 -0.7807 -1.9733 -1.6886 -1.0632 -0.3323 0.4288 1.2214 -0.5956 0.0742 0.1217 -0.2110 0.1192 1.7783 -0.3973 -1.0544 1.8752 -2.1070 0.0115 0.5662 0.7401 -0.9852 -0.4024 0.6502 -0.6856 -0.3834 1.2173 -1.3403 -1.5807 -1.3457 -0.6611 -0.9124 -1.7369 -0.4868 0.1472 0.9946 0.0752 1.3032 1.6795 -0.2303 -1.4640 1.0643 -1.5309 0.1614 0.1971 1.0571 1.5579 0.3636 0.3437 1.7488 2.5238 0.2297 0.1438 -0.2420 -0.4914 0.5902 0.6651 1.1097 0.3758 -0.4397 -0.6481 -0.6243 0.2764 1.7758 -1.4485 -0.4777 0.4111 -0.2124 -0.9709 0.2836 -1.3714 -0.9068 0.6390 -0.8620 0.8029 -0.4621 -0.3926 -0.7066 0.4491 1.0744 -0.2193 -0.4409 -0.4364 0.2650 0.1334 -0.7658 -0.9776 -0.8591 1.2958 0.2198 0.3086 -1.1129 0.3514 -0.6604 0.9318 -1.2272 0.5181 -0.8720 0.3456 -0.1672 -1.0105 -0.8310 0.9692 -0.4031 -0.5615 -0.9213 0.1097 -1.1917 0.0330 -0.8606 -0.7457 0.5717 0.1466 0.1929 -0.1153 -0.3566 0.3078 -1.6703 0.1957 -0.7434 -1.6730 -0.0168 -0.1581 3.5883 -2.3480 0.4362 -0.3511 -0.7914 -0.3054 -0.5339 -0.6229 -0.8467 0.7229 -0.2791 0.6191 -0.5145 1.8468 0.0877 0.2755 0.5078 0.1325 0.1110 -0.6923 0.4755 -0.8516 1.1083 -0.7475 -1.0544 1.8752 0.9727 -0.9611 -0.6053 -0.5132 -0.4725 0.3801 1.5279 -0.6822 -0.2798 1.2416 -0.3171 -1.8926 1.0944 -0.7850 0.1523 -0.3089 -1.3277 0.2403 1.8238 -0.9976 0.0903 -1.0890 0.7813 -0.1342 0.8641 1.3162 0.1844 -0.1359 0.5944 0.0730 0.2091 0.4501 -0.2034 0.9685 -0.5222 0.1799 -0.1247 -0.3769 0.6406 -0.3792 0.4203 -1.1203 -0.9183 0.9486 0.7132 0.5744 0.6105 -0.0001 -0.9884 -0.9372 0.0914 0.6680 -0.7964 -0.1525 -0.2059 -0.4357 0.8366 0.4263 1.6890 -1.4089 0.0050 -0.8013 0.6072 -0.6829 -0.9189 0.5294 1.4959 -0.4234 0.0463 0.0852 -0.7607 -0.1146 0.1348 0.7827 -1.2032 -0.4531 -0.3288 0.3275 -0.1543 2.3002 0.4619 2.1303 -0.8081 0.4450 0.7238 -0.1352 -1.4854 -0.5649 0.4385 1.6967 1.0573 -1.7542 0.0014 -0.7062 0.3526 0.2138 0.5933 1.2506 0.2491 -0.6752 -1.1042 0.4053 0.6184 0.7481 2.7915 0.1512 -0.0399 -0.7984 -1.4404 -1.1685 -0.2760 0.0448 -0.0372 -1.1040 0.1651 0.7906 0.6160 0.9336 -0.4044 3.9582 0.7019 -0.6944 0.3172 -0.3871 1.5046 -0.3426 -0.1694 0.3403 0.9333 -0.2060 -0.8446 0.5496 -0.4324 -0.0365 0.1442 1.0395 0.2405 1.1674 -0.8767 -1.2290 -0.0852 0.7293 -0.0268 -0.5035 -0.4524 0.3232 0.2248 0.1574 -1.1424 -0.7084 0.3755 -0.2784 0.4965 -0.4750 0.6068 -1.0793 0.3435 -0.6742 4.6649 -0.1410 1.4567 1.5232 -1.2721 -1.0573 1.3143 -1.0605 0.5257 0.2845 -1.3466 -0.7042 0.2748 -0.0173 0.5292 -0.9074 -0.6262 1.1629 -0.1020 0.3494 -0.6728 -1.6295 -0.7916 -0.5255 0.1736 -1.3186 1.5154 0.1261 -0.2750 -0.0077 1.2667 -0.5238 0.8112 -0.6973 1.2203 N-acetylproline -0.1585 -1.0581 1.1021 0.0811 -0.3677 1.7140 0.5471 2.9138 0.3698 2.4335 2.1306 0.3851 -0.3723 -0.0941 0.5293 0.2773 0.7382 -0.1372 -1.2423 -0.2894 0.4999 -0.5812 -0.2954 -1.2309 -1.2472 -0.0564 -5.2014 0.4154 -0.6749 -0.0873 -0.3578 -0.0523 0.5528 0.5151 -0.5290 3.0098 0.1981 -1.8180 -0.8627 -5.8217 -1.0835 -2.6153 -0.1826 -0.4748 -1.1806 0.0737 0.7412 -0.2230 -0.9046 -0.0556 -2.1582 -5.9000 -0.8671 1.3199 -0.3620 -1.3175 -0.3431 -0.5746 -0.5389 -0.9080 -0.0570 -0.2299 0.0222 2.0706 -0.4417 -0.2973 0.9684 0.2113 -0.1029 -0.2853 -0.8124 -1.3086 -0.6450 0.9543 0.0831 0.2756 -0.3331 -0.1123 1.2731 0.8279 -0.2610 0.9678 0.4372 -0.6503 1.1799 -0.4161 -0.0143 -0.8010 -0.4679 -1.0017 -0.5526 0.8161 -0.1182 0.0418 0.6676 -0.1341 -0.3529 -0.7056 0.0100 -0.0740 -0.0334 0.4606 -0.0681 0.4314 0.5766 0.2721 1.0757 0.2675 -1.3091 -5.3066 -0.5017 0.0511 1.0053 -0.5143 1.3616 0.5382 0.3883 0.2666 1.4625 -0.1488 0.3986 0.3325 -0.5031 -0.1008 0.1190 0.8919 0.2751 0.3286 0.1186 1.4125 0.5392 0.6179 -0.3072 0.1774 0.5967 0.7676 -1.2216 0.2948 -0.6251 -0.9411 -0.2445 -0.3996 -0.2105 0.1949 -0.2515 -0.7465 -0.6859 0.4258 -0.4970 -0.6177 -3.3924 -1.7035 -0.4201 -0.5070 -0.5523 -0.3411 -0.4882 0.5369 0.5562 -0.0649 0.0448 -0.0974 0.7717 -1.7476 0.3516 -0.1049 0.4145 0.4477 -0.1825 0.0158 -0.0141 -0.2481 1.5452 -1.1522 0.6643 -0.1895 -0.8050 -0.4522 -0.9944 -0.9349 0.1495 0.3238 0.3191 -0.6890 -0.3302 -0.7487 0.0121 -0.2150 -0.3722 0.5876 0.4742 0.3052 -0.9623 -0.2818 -0.4509 -0.4571 0.9175 0.7750 -0.3803 -1.0690 -0.2918 0.2501 0.0439 0.2872 1.4219 -0.2282 -0.5915 0.0855 -0.0779 -0.3814 0.0902 0.7354 -0.4045 0.4204 0.1783 -0.1049 0.6449 1.2557 -0.3152 -0.0643 -0.1959 0.7398 -0.1622 0.6621 0.1395 0.3741 1.1099 0.4385 0.7798 0.7862 0.2018 0.4236 -0.2982 -0.8701 0.3120 1.4198 -0.6788 -1.2707 0.4731 -0.2238 -0.7965 0.1728 0.5952 0.4747 0.1163 1.1198 -1.3933 0.6229 0.8935 -0.5302 0.2241 -0.0533 1.2616 0.3124 -0.4822 0.4073 0.0466 -0.4798 -0.4721 -0.2690 0.3043 -0.4847 -0.7911 1.1546 0.1663 -0.2236 -0.3938 0.1784 0.3653 0.0823 -0.4257 0.3422 2.3104 0.2963 0.2159 1.7252 -0.9937 -0.0183 -0.3733 0.1629 -1.1407 -0.7490 -0.5355 0.5631 -0.8241 0.4001 -0.3290 -0.3371 1.2634 0.9883 1.0949 -0.6814 0.5624 0.2072 0.1390 -0.4022 1.9152 0.6956 0.8463 0.3680 0.4573 0.6015 -0.4049 -0.6222 0.0320 -0.0895 1.5508 -0.7058 -1.1977 -0.2052 -0.7839 1.1011 0.8356 -0.3318 0.2046 0.9992 -0.1667 0.4856 0.0098 1.1680 -0.1161 2.2223 -0.7827 0.0710 -0.4388 -0.9023 0.2240 0.5698 -0.0792 0.5181 -0.1040 0.1792 -0.4978 -0.1608 -0.4287 1.1044 2.2402 -0.4938 -0.1764 1.6239 -0.4860 0.3508 0.4292 -0.3911 0.8925 -1.0637 -5.3089 -0.7426 0.2231 0.9588 -0.1390 -0.1061 1.4089 0.4295 0.3767 -0.1741 -0.5484 0.2038 1.3224 -0.2762 1.9539 0.2913 0.2898 1.0165 0.0093 0.9031 0.3873 -0.3203 0.1487 0.3936 0.2196 -0.0829 -1.2023 0.3635 -0.1030 2.2031 -0.4709 0.8617 2.1053 -0.1304 -0.0043 0.8227 -0.3008 0.2150 -0.5886 0.0496 -0.0993 0.3440 0.3618 -0.3712 0.4131 -0.3674 -0.5581 -0.0986 0.3006 0.0247 -0.8730 -0.1468 -0.8093 -0.3776 0.0921 2.3061 0.2259 0.1734 -0.0820 0.4286 -1.0821 0.4602 0.0250 1.0485 N-acetylputrescine -0.5533 1.0200 -1.4609 -1.3309 0.5111 -1.9314 -1.0188 -1.0646 -1.6392 -0.3733 -0.5571 -0.3230 -1.1960 0.5374 -1.7696 -0.5010 -0.2064 -1.2026 2.2406 0.7890 1.4493 0.7022 -0.7571 1.7406 -0.0829 0.7494 -0.9848 -0.2515 -0.0413 -0.5763 1.0069 0.3505 -0.1179 0.2938 -1.1877 -0.3596 1.0409 1.4482 0.4411 -1.0063 -0.2758 1.0095 -1.8809 -0.8976 -0.2356 -1.5468 -2.3085 0.6363 1.2943 -0.2932 0.3301 -1.2953 -0.8435 -0.2643 1.1991 0.1114 0.5649 -0.2191 -0.1322 1.0556 0.4126 -1.0661 0.4035 -0.0719 -1.0788 -0.6834 -0.7114 0.1110 -1.6571 -1.2325 -1.7032 -0.7010 -0.3489 1.1239 0.5228 -0.3559 0.4169 1.3144 -0.6519 0.7607 0.8398 -1.2695 0.2589 -1.1505 0.3212 -1.2530 0.9544 -0.8986 0.0258 1.8392 -1.1481 -0.5050 -0.3428 0.9547 1.1264 -0.5742 1.1203 -0.1046 1.0770 -0.4425 1.6638 -0.0651 -0.3687 -0.1652 0.7223 -0.6408 -1.7714 0.8155 -0.9803 -0.7316 -1.4017 0.5049 0.4113 -0.4763 -0.3911 0.3437 2.1606 0.1376 -0.1866 0.4352 -0.2904 -0.0277 0.7239 -1.8315 -0.2362 0.1465 0.7770 0.8433 -1.4366 -1.7068 -0.6217 0.6885 0.5054 0.3570 -1.2625 0.2701 -0.0747 0.2310 2.0674 -0.4335 -0.9678 0.2464 1.5945 -0.7075 0.8924 -0.3665 -1.3971 1.9182 0.0206 -0.1864 0.5535 0.1511 0.0512 1.2442 -0.2118 2.3692 0.6140 1.2987 -0.9096 -0.5936 -0.8200 -1.2859 -1.7832 -0.5267 -0.6642 0.4957 -0.4039 -0.2416 -0.4216 -0.7715 1.8888 -0.4853 0.4462 -0.5022 1.3400 -0.3273 1.2948 2.6215 0.5243 -1.3223 -0.5234 0.5135 -0.4653 -0.7305 0.1996 0.9125 -0.9470 0.3496 -0.4355 0.6072 -0.9312 0.1778 -0.7680 -0.1486 1.3547 0.3313 -0.2472 0.8774 -0.5487 -0.7427 -0.5441 -0.9325 0.3534 -1.2160 -0.3636 0.5511 0.5043 1.0379 0.5656 -0.2443 -0.3635 1.5516 2.1492 0.8574 0.5620 -0.4079 -1.2501 0.7108 -1.7625 -0.9210 -0.6607 0.5598 0.0487 -0.5927 0.8080 0.0272 0.9325 -1.0618 -0.4094 2.6922 -0.9586 0.1112 1.9696 -0.7208 -1.2818 0.1424 1.5465 0.4212 -1.1887 0.6573 -1.1026 0.9880 0.7377 -1.3271 1.0041 -0.0894 0.4755 0.4752 -0.7916 0.8375 0.7842 -1.1943 0.9428 -1.8369 -0.7960 -0.5682 2.0255 -0.1843 1.4176 -0.0495 -0.1076 -0.4871 -1.5612 -1.9087 -2.2544 -0.0883 -0.5374 -1.1756 0.1051 0.6125 0.4492 0.6299 0.1961 0.6056 -1.2526 0.1573 -1.1552 0.2063 -0.3012 3.3213 0.0188 -0.7258 -0.2800 0.1171 -1.6429 -0.5180 -0.0214 0.7436 0.8110 0.7333 0.5374 0.0362 1.0317 -0.7063 -0.2333 -1.0380 1.1385 1.2916 2.6757 0.8723 0.1760 0.5823 -1.7859 0.6793 -1.0042 -0.0768 -0.3901 -0.2889 0.3168 -0.6035 -0.2462 1.8726 -0.8865 -1.8122 0.5089 -0.1473 0.3806 -0.2647 0.0913 1.0392 -0.1193 -0.8357 0.7461 1.5016 0.1059 -0.6008 1.1855 2.2974 0.0826 -0.0631 -1.2445 -0.5456 1.8041 -0.2599 -0.8213 1.4230 -0.3410 -0.4428 -1.0726 0.2523 0.2385 -0.0923 1.0248 -1.5150 -0.6197 1.4079 -0.8135 -0.0458 0.1018 -0.5393 -0.8044 2.0644 -0.7992 0.8304 1.0763 -0.5956 -0.0095 -0.5252 0.8105 0.0920 0.2886 0.5159 0.1017 1.8763 -1.0387 0.1353 0.5561 -0.5476 -1.2332 0.5354 0.7401 1.1778 -1.1535 -2.3645 1.3555 -0.3507 -0.8680 -1.2284 1.9810 0.6083 1.1478 0.3254 0.5656 0.2754 -0.4770 0.8405 -1.8857 -0.6173 0.9525 -1.1368 0.7996 0.9697 1.4463 -1.0808 -0.1373 0.7607 -0.4643 -0.1662 1.1851 0.1976 -0.2011 -1.3656 -2.5600 2.0006 -0.2601 1.4536 -2.1945 1.2460 0.8765 0.3352 N-acetylserine 0.1234 2.3326 0.8204 1.3350 0.5787 3.3014 0.2537 3.0288 0.3859 4.0473 3.1977 -0.6202 -0.7127 0.9168 0.4038 -0.8132 -0.0783 -0.0924 -1.1753 -0.5626 -1.2925 -0.3341 -0.1446 0.2353 -0.1881 1.7836 0.0288 0.3774 0.2797 0.1526 -1.1667 -0.2937 -0.7489 -0.7519 -0.5321 0.9928 0.1356 1.4103 -0.8316 -2.1487 0.1102 0.3331 -0.6619 -0.3782 -1.1038 -0.1602 0.2722 0.1165 -0.5925 1.9225 -0.1976 -0.2977 -0.5824 1.9607 -1.5170 0.3839 -0.0594 -1.2583 0.4980 -1.5735 -0.6742 0.7968 -0.5882 2.4315 -0.9228 -0.4149 1.0459 0.0877 -1.0324 0.2415 0.6842 -0.5504 0.2473 -0.8588 0.5200 -0.4016 -0.0975 -1.5668 -0.4290 -0.5908 -1.0446 2.2372 -1.2075 -0.5232 0.9890 -0.3420 1.2216 -0.3028 -0.8012 -0.0472 -0.6837 -0.1923 -0.6793 0.8305 0.8297 -0.2091 -0.0765 0.0136 -1.4676 -0.3625 0.1369 1.3558 0.2613 0.1866 1.0511 -0.1026 2.2376 0.9143 -0.0040 0.1308 0.0207 0.3042 -1.4247 0.1345 0.7890 0.1088 0.3419 0.5662 0.3115 -1.2921 1.4123 -0.2632 1.0373 -0.8453 -1.6735 0.9158 -0.5489 -0.1323 -1.2961 -1.6673 -0.3121 1.3414 -0.0189 -0.5321 -0.0445 0.2895 -0.8246 -0.6195 0.3498 -0.2285 0.3535 1.1065 0.3991 -0.0290 3.0249 -0.6862 -0.5665 1.1217 -0.3687 -0.8186 -0.2117 -0.3773 -1.6177 -0.0952 -0.6095 -1.1167 0.1558 -0.4025 0.2403 -0.8483 1.1134 0.3774 1.5088 -1.3490 0.9882 -0.7714 -2.3512 0.8829 -0.8907 -0.9030 -0.3939 0.1117 -0.2602 0.7881 -0.9267 0.8363 1.3764 0.3857 0.2692 -0.8630 1.0609 -0.4327 -0.4372 0.7088 0.3200 -0.1578 1.6125 -1.0424 1.4079 -0.8251 0.4603 1.1515 0.4787 0.4720 -0.6866 -0.4948 -0.7419 -1.8243 -0.5954 2.6631 -0.0958 0.1520 0.0782 -0.5580 1.3452 1.5702 -1.1790 0.7614 0.5618 0.3902 1.5275 -1.4482 -0.7661 -0.8024 -0.1359 0.1158 0.9854 0.3673 -0.0724 0.2505 -1.8829 0.0122 -1.4389 0.6062 -0.7539 0.0433 -0.2847 -0.4283 -0.2465 -0.1614 -0.2436 -0.6958 -0.5446 1.1441 -1.4575 0.1232 -0.6240 -0.1596 0.0963 0.5093 0.5839 -0.0116 1.1024 0.5081 -0.5089 0.4060 -1.4181 -0.0807 -0.2724 0.8382 -0.4317 -1.5626 -0.1491 0.0322 -0.5733 -0.3761 -1.7498 0.6086 -0.7876 -0.9141 0.1750 0.2599 0.0187 0.2717 -0.4665 0.2113 -0.7986 -0.6957 -0.8439 -0.4885 -1.1015 0.2688 0.7099 -1.0482 1.3051 -0.5804 -1.0571 -0.7769 -1.1848 1.0995 -1.2322 -0.9355 -1.2877 -0.3544 0.0347 -0.0424 0.9879 -0.4284 -1.4811 -0.5067 -0.5668 -0.0831 0.9720 0.0225 0.0744 -0.8475 0.1551 0.6132 0.4839 -0.6879 0.7713 -0.3125 0.8479 -1.9053 0.6084 0.0872 1.5872 0.3086 -0.8457 -0.3929 -1.0006 0.0409 -0.9624 -0.9972 -0.7200 -0.2425 -0.8569 -0.3160 1.5112 0.7008 0.1132 1.7558 1.3526 -0.8088 0.3513 -0.4485 0.1418 -0.3096 -0.3628 0.0939 -0.5491 0.9241 0.4462 1.0286 -0.9514 0.0199 1.7088 1.7052 -0.6775 -0.4972 -1.4475 0.2815 -0.7748 -1.4121 -1.2593 0.5727 -0.1488 0.5682 0.2573 -0.9895 -0.3978 1.0906 -0.2709 -0.2170 2.2720 -0.3809 -1.4451 0.4430 -0.2054 -0.1049 0.1333 0.9694 0.9047 0.3000 -0.4279 0.9545 -0.5590 -1.1852 -0.6825 -0.5584 -0.3109 0.4794 -0.8060 1.1483 -0.3123 6.2552 -0.6654 0.8723 0.8236 0.0842 -0.4704 1.1439 0.5744 -0.3011 0.4006 0.1858 -1.5966 -0.5047 -2.2078 -1.4685 -0.8580 1.6981 0.1067 -0.1558 -0.3025 -1.1360 -0.7443 -1.0613 0.1202 0.2959 -0.3468 2.8158 0.9281 0.6233 -0.8235 1.2683 0.1777 0.2168 -0.2073 1.7551 N-acetyltaurine 0.3693 0.4718 1.5091 0.5478 -0.5799 2.0785 -0.4352 1.2413 0.7140 1.6818 2.2987 -3.1856 -0.1854 -2.9853 0.6157 0.3452 1.1372 0.4954 -0.3969 -0.1586 0.2453 -0.2229 0.3707 -0.1146 -0.5260 0.3163 0.2124 0.6150 -0.6630 -2.9813 0.0775 -0.4425 -0.1909 -0.4065 0.7257 0.7701 0.9591 -2.5429 0.4733 -0.7694 0.2711 0.5475 0.7150 -0.2789 0.3904 -0.1773 -0.0159 -0.1251 0.0649 1.4706 -0.5475 0.0158 -0.3483 1.1899 0.0400 0.0026 -0.0817 -0.1681 1.0702 -0.4545 -0.4098 0.1672 -0.3442 1.7644 -0.2858 -0.3105 0.8275 0.3262 -0.5040 -0.4497 -0.3787 -0.1259 -0.3471 -0.0062 1.3334 0.9836 0.0186 -0.5011 0.0254 -0.0942 -0.9076 -2.7889 -2.9205 -0.3053 1.1169 -3.1213 0.6730 1.0240 -3.1453 -2.5277 -0.2911 0.5846 0.2784 0.6948 1.5287 -0.0118 -0.1946 0.4491 0.3797 -0.7499 -0.0381 0.0514 -0.6334 0.2500 0.6998 0.9360 1.4970 -1.7816 0.2528 0.5696 -0.0040 -0.1143 -0.9051 1.0362 0.3206 0.1526 0.9674 0.6276 0.4302 1.0767 -2.7659 -0.4114 0.2165 0.3794 -0.1179 0.6601 0.4621 -0.3354 -0.9503 -0.5076 -0.0955 1.4584 -0.6653 0.3389 0.2437 0.2849 0.2733 0.1344 0.5006 0.0412 0.8899 -0.6401 0.3206 -0.1974 0.1628 0.4238 -0.1171 0.7223 0.2115 -1.7183 0.1908 -0.7280 -0.3306 -0.1040 -0.1305 -0.0610 0.2461 -0.3166 0.9711 -0.9437 1.7768 0.5741 0.3913 -0.1464 0.9143 -0.4020 -0.3219 0.2275 -0.2029 0.4127 0.0475 0.1496 -0.0913 1.4230 0.1202 -0.2884 1.0103 0.4661 -0.7826 0.6260 0.7612 0.0447 -0.5305 0.5626 0.4587 0.0102 1.0423 0.2072 0.0761 0.0976 0.2165 1.4574 0.1698 0.9291 -1.0108 0.1042 -0.9578 -0.4423 -0.2795 -0.4809 0.4983 -0.5234 0.5948 -0.3911 0.3758 -0.2271 0.2206 0.4138 -0.4153 0.2902 0.3270 -2.8937 0.6665 -0.5701 -0.6621 0.0308 1.4025 0.5218 0.2975 0.6105 0.2279 -0.1148 0.0566 0.6552 -0.1158 -3.2397 0.7644 0.6255 -0.0108 0.2813 0.5782 0.0599 -0.2565 0.6993 0.1650 1.2105 -0.3392 0.1769 -1.2878 0.5448 0.0728 0.8873 0.3628 -0.5152 -0.4415 0.8372 0.5436 0.4558 0.7199 0.7146 0.6874 0.7493 0.9115 1.1995 0.0079 -0.0320 0.0710 0.5999 -0.2911 -0.3820 0.7179 -0.6526 0.4642 0.7305 0.3766 -0.6708 0.2114 0.1710 -0.2080 -0.0937 -3.1466 0.7727 0.7989 0.4141 0.5317 -0.3329 -0.4377 -0.6229 -0.3655 -0.0219 -0.3479 -0.0251 0.5060 -3.0965 -0.9853 0.2744 0.0776 -2.9281 0.4637 -0.7326 -0.0760 -3.2128 0.2231 1.9168 0.3094 0.1103 0.7210 -0.3217 -0.1885 -0.0686 0.9934 0.4236 -2.9302 0.2448 -0.0811 -0.2852 1.6938 0.5887 0.0482 0.1372 -0.6717 0.3206 0.0044 -0.4881 -0.7378 0.3883 -0.0758 -0.7307 0.7423 0.2817 -0.6222 1.5822 -0.3399 0.2537 -0.2685 -0.2396 -0.2522 0.2507 0.0587 0.4556 0.1731 0.7435 -0.1984 0.7921 -0.1804 0.1509 2.1663 0.0586 -0.6278 -0.0482 -0.9248 0.8796 -3.2599 0.0084 0.8541 1.1660 -0.1880 0.3889 -0.5445 -0.1699 -1.2896 -1.5596 1.3992 0.2984 1.1883 0.5126 -3.3723 0.5894 0.9578 1.0883 0.1515 -3.1609 0.2526 -0.5335 -3.1130 0.1327 -0.2561 0.0353 0.4560 0.5769 -0.1084 -0.0032 -0.7635 0.7799 -3.4811 1.7975 -0.1693 0.6250 1.5681 0.1657 -3.0512 0.2447 0.0326 0.7450 0.8455 0.3832 0.3015 -0.6174 -0.1605 -3.4328 0.4272 0.0178 -0.9725 -0.0278 -0.3335 -0.3307 -3.4512 0.5571 0.0291 -0.5264 -0.3079 1.5469 0.1273 0.4654 0.5819 1.6273 0.1580 0.0302 0.8028 -0.3685 N-acetyltheanine -0.7992 0.3893 -0.6096 0.6054 1.5677 -1.0704 0.6635 -0.8898 0.0051 -0.1867 -0.0946 -3.3212 1.7883 -0.4810 0.7786 0.0242 0.3938 1.2648 -0.8023 0.1170 -0.4525 -2.1094 -0.5140 -0.3384 -0.1335 0.1506 0.0761 0.3538 -0.9436 -2.1475 -0.0835 -0.8797 1.3839 -0.4713 1.2210 -0.2804 -0.8565 -0.6353 0.2129 -0.5549 -0.2815 -0.2799 0.8602 -0.4737 0.3710 -0.3685 -0.1077 -0.2385 -0.9540 1.2922 -1.4591 -1.0222 0.8979 -1.1014 -0.3080 -0.3782 -2.0694 1.1597 -0.0205 0.5107 -0.5942 0.6316 -1.1617 -0.7261 1.4879 0.1014 -0.2763 0.6966 -0.6648 -0.1317 1.0140 -0.9487 -1.0668 -0.3654 1.6020 -0.5671 -0.7372 0.2228 0.6374 0.0555 1.5880 -0.4395 1.6405 0.0857 -0.6990 -1.7549 -1.1026 1.9122 1.0142 -0.7402 -0.3877 -0.7541 0.4278 -0.1838 -1.8267 -1.3513 -0.0056 -0.6550 -0.1871 -0.7471 -0.8249 -1.0285 0.0920 0.7371 -0.5137 -0.0248 -0.0443 0.4794 0.5078 -1.5109 -1.9245 -0.0583 -0.1269 1.4478 -0.3811 -0.3582 0.2361 0.0782 -0.9138 0.1595 -0.0829 1.1056 -0.6417 -1.3849 0.5147 -1.0336 0.3045 0.6483 0.8026 -0.0887 0.1527 -0.7880 0.1113 -0.4655 0.1416 1.3406 -0.3884 0.9012 -0.1636 0.1153 1.7710 -0.1661 1.1643 1.2791 0.0486 -0.0150 1.3006 -0.6183 0.1673 -0.6210 -0.1048 1.0758 -0.0442 -0.6977 -1.0531 -1.1996 -0.0088 -0.4920 -0.8930 1.1993 -0.4534 -0.8746 -0.8732 1.0009 -0.6260 0.5259 0.8380 -1.7687 -0.1510 -0.7567 1.4347 -0.2438 -0.7410 -1.4248 -0.7992 1.9206 1.9040 -0.4819 -0.9148 0.1895 0.3463 0.4419 -2.0722 -0.2824 0.0194 -1.1831 -1.1295 -0.2971 -1.5783 0.3009 -0.2112 -0.9311 -1.1133 -0.7148 1.4885 0.1722 -0.0896 1.0951 0.5644 1.9808 -0.5091 -0.9485 -0.3914 1.5443 0.1889 1.9032 1.3146 0.5192 0.1874 -0.2661 -0.3154 1.6005 -0.5530 1.4406 1.0996 0.2063 -0.4679 -0.7098 -0.3950 -0.0983 1.5721 1.1566 -0.1540 0.6866 0.1926 2.1813 -2.3436 0.6771 0.2575 0.5624 -0.4921 -0.1136 1.1983 0.7214 1.3000 -0.5455 -0.3190 0.3452 -0.7068 0.4736 -1.5300 -0.9025 -1.4313 0.9388 -1.2034 -0.2969 0.3805 0.8203 -1.2873 -0.4768 1.6614 -0.0331 0.4848 0.9175 -0.1920 0.6177 0.1289 0.1280 2.3376 0.1388 0.2292 0.0726 0.0222 0.6867 0.3887 0.7689 0.1131 -0.1503 -0.1592 -2.5049 0.8187 0.9743 0.1347 1.4969 0.6556 0.5858 1.3091 -0.1184 -0.3584 0.1069 0.4734 -1.1457 0.8080 1.3109 0.3166 -0.5954 -0.0556 -0.3092 -1.6555 0.7282 0.6438 -0.7504 0.8722 0.2966 0.9199 0.1317 -0.7557 0.6868 0.5430 0.2402 -0.0384 0.2736 -1.5330 -1.1054 0.7282 -1.9867 -1.4097 0.7680 0.3480 -0.3911 2.1317 0.7443 1.3146 -0.4360 1.9996 0.4855 0.6535 0.6580 0.6719 -0.0280 0.5427 0.6317 0.6750 1.1918 -1.1680 -0.1213 -0.4934 0.2774 0.0376 1.7473 -0.3279 0.5690 0.1595 1.7690 -0.0262 0.1658 -2.2675 0.8189 -0.7725 0.3645 0.5777 -0.8802 1.2278 0.9910 -0.0448 0.2840 1.0051 -0.9094 0.9656 -0.2952 2.1212 1.8348 -1.8501 0.9423 -0.1212 -2.2636 1.5553 0.8129 -0.5931 0.2851 0.4188 -0.0604 1.0841 -0.2243 2.0531 -1.5090 -0.3595 0.0059 -0.9177 -0.3731 -0.5154 1.1245 1.5264 0.0519 0.1627 -1.5630 -2.7368 -1.4887 -4.9677 0.7659 1.7142 0.1396 -0.9886 0.0881 -0.8772 0.0955 0.3480 -0.2147 1.2365 1.4296 -0.8553 -0.3521 0.3053 0.1409 -1.0213 0.7200 0.1585 0.1042 -1.3840 -0.5106 -2.4629 -0.7517 -0.8842 0.1545 -0.1831 0.0862 2.2151 0.5739 0.3007 -3.1924 N-acetylthreonine 0.2803 1.6695 0.2777 -1.7014 1.4787 2.0754 -0.7636 1.6730 0.8273 2.7677 1.7868 1.5344 -1.6567 -0.5553 0.0695 0.7992 0.0077 1.2657 -1.1527 -1.1907 0.0303 0.8984 -0.1434 1.1617 0.2892 0.4492 0.9930 1.5611 0.1823 0.7215 -0.7025 -0.1081 -1.0472 -0.7408 -0.0293 1.6564 0.9455 0.2064 0.1405 -0.4509 1.1428 -0.0085 -0.5402 -0.1389 -0.6643 -1.8224 0.5011 -0.2387 0.9447 0.3985 0.9522 -0.4642 0.4498 0.5730 0.0566 -0.0936 1.5025 -0.6401 -0.3234 -1.8321 -0.8786 1.3018 -0.2621 0.5273 -1.7487 0.3933 -0.0540 -0.3314 0.6591 0.9848 -0.1610 -1.7922 -0.1052 -0.7922 0.5035 -0.1095 0.3039 0.2432 -0.6434 -0.8361 0.4245 -0.8260 -1.2211 -0.5256 1.0077 -0.8287 0.1793 0.1564 -0.4633 0.0041 0.9078 1.1046 0.5002 1.2888 1.9810 0.4639 -1.3763 -0.6105 -1.5092 1.0612 -0.5814 -0.0249 -0.5138 -1.2063 0.3710 -0.0372 0.6865 -0.9483 -1.4026 1.6819 0.6794 -0.2799 0.3392 -1.3542 0.3335 -0.3684 0.8769 -0.1391 -1.0137 -0.7717 1.9845 0.3207 -0.9160 0.0719 0.6086 -0.7995 -1.8041 -1.3266 0.0692 0.3580 -1.2583 1.7132 -0.1100 -0.4617 0.6383 0.6388 -1.2578 -1.5475 0.4767 -1.1078 -1.4239 0.9030 -1.7224 0.3242 1.5334 -0.4697 0.0540 0.8407 -0.9868 0.7512 -0.4079 -0.2918 0.0810 0.7999 -0.5843 0.9382 0.0664 -1.0651 0.1980 1.1032 1.4244 -0.6607 0.4085 -1.6915 1.1590 -0.5502 -0.9522 2.1339 -0.5808 0.2011 0.0355 -0.6412 -0.8459 1.5733 0.0733 0.5921 -0.4172 0.5989 0.4667 -0.0983 1.3044 -0.6221 -1.6616 1.1573 0.0172 0.5163 0.3802 -0.0394 0.4049 -0.6526 -0.8103 0.4770 1.8002 1.5163 -1.7528 -1.2260 -0.1442 -3.0062 0.1338 1.0844 0.6361 1.4723 -1.0419 0.6647 0.1373 1.1187 -0.2617 0.0696 -1.4822 1.2570 2.1138 -1.9171 -0.8895 -0.7257 0.6589 -0.9528 1.4811 -0.7218 -2.2085 -0.3676 -0.6621 0.1869 -0.0324 1.2380 -1.7198 1.4206 1.3204 0.3934 0.9460 -0.5718 0.5506 -0.3964 -0.8636 -0.0922 -2.5826 0.4509 -1.0883 -0.1764 0.3307 0.9072 1.1286 0.2379 0.2507 0.4179 0.6480 1.0611 -0.8561 0.7519 -0.4662 0.0757 -1.9886 0.6280 -0.1474 -0.7217 -1.3359 -0.5987 -0.2247 -0.2522 -1.5561 -0.7080 0.1902 -1.1152 2.0007 0.4065 -0.4285 -1.1483 -0.5090 -1.5174 0.2424 1.2491 -0.3444 1.7194 -0.4959 0.5820 -0.4116 -0.0333 -0.9288 -0.4295 -1.4367 -0.3444 0.0339 0.2738 -0.0041 1.7929 0.0870 -0.2330 -1.3225 1.2474 0.8289 0.5203 -1.1422 0.2665 0.7111 0.3097 -2.0186 -1.7627 1.3646 -0.3613 2.4390 -0.3827 -0.5836 -1.3416 1.2698 -1.9130 -0.6727 0.6278 1.2335 -1.3377 -1.1133 -0.9802 -0.1226 -1.9713 0.2230 -0.6779 -0.7057 -0.4011 -2.4009 -0.8404 -0.5506 -0.1048 -0.5282 0.9448 1.0210 -1.3897 -0.8484 1.2438 -1.1586 -0.7070 -0.2657 0.0122 0.4421 -0.5674 1.3764 0.0427 1.1479 0.0255 1.0098 -0.4010 1.3041 -0.5834 -1.6661 1.2586 0.7018 -1.5901 -1.0651 0.2099 0.7551 0.3961 0.7228 -0.1306 -1.4705 0.7679 -0.1267 -1.1353 1.3828 -0.0624 -0.3090 -0.0182 -0.7638 0.3746 0.8915 0.6013 0.2703 -0.9296 0.3733 0.1502 0.0237 -0.8811 -0.2106 -1.2728 0.3349 -1.0566 -1.4363 0.0651 0.6222 2.1030 1.3181 -0.8287 1.3975 0.9729 -0.6226 1.1692 -0.1753 -0.3383 -0.2862 1.0071 0.1300 0.6385 -2.1009 0.3994 -0.3489 2.1296 0.7167 0.9874 0.3604 -0.9921 0.5639 -1.6093 -1.7039 1.4689 -0.0137 2.8095 0.9426 0.6287 -0.8711 0.2228 -0.0709 -0.4472 0.7257 0.7963 N-acetyltryptophan 1.6061 -1.7575 2.0480 -0.9150 0.3752 2.1774 -1.4386 1.8852 0.9052 2.0001 2.1299 -0.2689 0.1720 0.2960 0.8616 -0.6367 0.6928 -1.0420 -0.4525 -0.6956 0.6698 0.1940 -0.4626 -1.0386 1.1413 1.2834 -0.1553 -0.8835 0.9344 0.4040 0.8361 0.4004 -0.4055 -1.5370 -0.1635 1.8560 0.7771 1.2800 0.3406 -1.4159 -0.6260 -0.2742 0.0593 0.6447 -0.8016 -1.4444 0.5591 1.1759 0.7547 0.6221 -1.0278 0.0944 1.1744 1.8731 -0.5309 -1.3443 0.6361 -0.5198 0.4810 -0.3841 -0.8065 -0.0999 0.6956 1.2587 2.0323 -1.4478 0.3674 1.3460 -1.3829 0.2185 -1.0843 -0.5989 -1.1741 0.5696 1.1440 0.9997 0.0668 -1.0468 0.7449 -1.1581 0.7676 2.2020 -1.0616 0.1663 1.7541 -1.2792 0.6378 -0.9487 -1.4237 0.3058 1.0435 0.8416 -0.9655 -0.4997 1.1819 0.0930 -1.0278 -0.9801 -0.9528 -0.2497 0.5812 -1.5852 0.9344 -0.1655 1.0841 0.7551 0.5024 -0.5205 -1.7036 -0.8845 -0.0502 -1.3738 0.6992 0.1345 1.1557 -1.0576 1.1513 1.7187 1.4934 1.3516 -0.8540 -0.9775 0.2819 0.6289 0.6330 -0.1510 -1.3262 -1.1665 0.5317 -1.4822 0.2796 0.8111 -0.5734 -1.3225 0.8787 1.1544 -1.0131 0.5499 -1.1256 -0.2835 -0.7011 1.4367 -0.9799 0.3680 0.5690 0.3961 1.0118 -0.0887 1.0401 0.7955 -0.7037 0.3688 1.0254 0.1558 -1.1660 0.6261 2.0214 -0.7527 -1.2913 -0.3615 0.7784 -1.5066 -0.8050 0.7210 -0.9462 -0.0896 -1.3231 0.0340 0.2088 -0.1405 0.8140 0.5792 -1.6025 0.0650 -0.2984 -0.5992 -0.7169 3.2443 -0.9729 1.0274 0.7768 1.0546 0.1020 1.3190 -0.7779 -1.4990 -1.1290 -0.9476 -0.7319 -0.8932 -1.5872 2.2237 1.0040 1.6620 0.2321 -1.2432 -0.9574 -0.5087 -1.1263 -0.5976 -1.3316 -0.7556 -0.8393 -1.0334 -1.1835 -0.5685 0.4152 0.0949 -1.0411 1.0450 0.2602 0.2523 0.2735 0.2661 -1.4094 -1.2029 0.7846 1.2114 -1.5881 -1.3708 -0.1670 -1.2927 0.6378 1.8804 0.5178 -0.0628 0.9977 1.0772 -1.2800 -1.0494 -1.1911 -0.8437 0.7102 0.3591 1.1443 1.2153 0.3188 -0.9575 -0.1666 0.0088 -1.1983 0.6234 1.1201 1.8819 0.6914 1.1234 0.9542 0.4580 0.8465 0.1166 -1.2508 0.0306 0.0701 -1.1808 0.1629 -1.0173 0.0093 0.7736 -1.0599 0.7032 1.1427 0.3184 0.2730 0.5389 -1.2981 -0.5816 -0.1676 0.4216 0.2959 -1.3140 -1.3212 -0.4004 -0.4479 0.9009 0.5116 0.8081 -1.2400 0.0481 0.4335 0.6399 0.2265 -0.1289 0.6065 1.0540 0.7997 0.6134 -1.3322 -1.1619 -0.6174 -0.0456 0.2759 0.1423 -0.0960 -0.1205 -1.0804 -0.2219 1.4286 0.1654 1.4300 0.3131 0.8903 0.8526 -1.2187 -1.3805 0.1515 1.4399 0.5472 1.1438 -1.3775 1.0066 -1.0443 0.4553 -1.2473 1.9050 1.2701 0.5640 -1.0742 0.0393 1.1470 -1.3405 1.2644 1.1359 0.5196 -1.5035 -1.2704 -0.2338 -1.2131 -1.1545 -1.2636 -0.4366 -0.9722 -0.9846 0.1402 -0.8165 0.9712 -0.1134 1.7666 0.5452 -0.2689 -0.8272 -1.1359 1.5703 -1.4608 -1.4054 0.8007 -1.0259 0.8469 0.4143 0.8979 -0.5455 -0.7891 0.6711 0.8681 -0.7610 -0.0006 -0.5046 -0.2260 -1.3686 0.5596 -0.2236 -0.5832 -1.2910 0.5409 0.3466 -0.0884 -1.4826 -0.3643 0.4804 -0.3336 0.5610 -0.1901 0.9397 -1.1131 0.2920 -1.7851 2.6271 -0.4297 0.6703 1.7722 -1.3678 -1.1709 1.2970 -1.7771 0.7400 0.6339 -1.8185 0.2886 0.5900 0.1630 0.3330 -0.8041 -1.1391 1.7974 0.2989 0.4961 0.1904 -1.7057 -1.3163 0.4412 0.7179 -1.6908 -1.3586 0.5445 -1.4536 -0.2147 0.9426 -1.2512 0.4763 -1.1840 1.0504 N-acetylvaline 0.7651 0.9802 1.7284 -0.0294 0.6276 2.7766 -0.8050 2.7087 0.6521 3.4243 3.6904 -0.0246 0.1953 -0.8296 0.5380 -0.8325 0.8060 -0.3107 -0.6299 -0.1478 -1.3228 -0.4201 0.0670 0.1114 0.0932 -0.2101 0.1359 0.3518 0.3467 -0.0414 -1.4530 0.3331 0.2758 -1.3650 -0.9795 2.4032 1.4310 0.7833 1.5306 -1.5963 0.5196 0.6458 -0.8606 -0.7786 0.1600 0.2552 -0.0821 -0.0825 -0.5039 0.2554 -0.5183 0.0245 0.1989 2.6091 -0.6362 -1.5607 0.0115 0.3017 0.1401 -1.4184 0.3823 0.2541 -1.1815 2.0223 -0.9293 -2.6560 -0.1486 0.2719 -1.3160 0.1158 0.6820 -0.4220 -0.0256 1.1175 0.5651 0.9515 0.3067 -0.8097 0.4050 0.1464 -0.3874 0.8303 0.6484 0.4899 1.5930 -0.4672 0.7232 0.1781 0.1283 -0.2037 -0.9556 1.1538 -0.7341 0.6880 1.6873 0.2717 0.4536 -0.5612 -1.0904 -0.2287 -0.0111 -0.5238 0.8973 -0.9530 -0.0545 -0.3147 1.5078 0.8915 -1.2407 -0.3218 -1.1136 -1.6341 0.5720 0.3951 1.6474 0.4631 0.5761 0.2053 1.7181 -0.1111 0.7788 -0.7370 0.1618 -0.6458 -0.5155 0.9326 -0.9898 -1.4639 -1.9295 -1.3353 -0.9209 2.8615 -1.8002 0.0891 0.1839 0.2917 -0.0529 0.2118 -0.0982 0.5812 1.3967 0.4762 0.0609 -0.5492 1.8312 -0.6591 0.1839 0.6701 -0.3701 -1.5959 -0.8132 -0.8727 0.0766 -0.2033 -0.0180 -0.2762 -0.2941 -0.3492 0.2791 0.0757 0.1847 -0.9006 -0.6287 0.6889 0.3321 -0.2749 -0.3667 -0.7980 2.1715 -0.5114 0.0413 -0.9911 -1.3340 -0.0680 -0.6394 0.2313 0.1731 0.6798 -0.4592 0.6392 0.5610 -0.3530 -0.4182 0.7463 -0.5536 -0.3023 0.6658 -0.1261 1.1914 0.2363 -1.0816 2.5099 1.0766 0.6905 -1.3890 -0.6841 -0.6761 -0.6911 0.0647 1.4450 -0.7138 -0.6898 0.6946 -0.0830 -0.3693 0.9344 -0.7001 2.3766 -0.5566 -0.2721 0.2124 0.6240 -0.1360 0.1905 -0.2641 -0.5516 1.4073 0.1653 -0.6230 0.9510 -0.3917 -1.1738 1.1951 -0.6836 1.0949 -0.4657 1.0024 1.9640 -0.4995 0.4086 -0.9698 0.2541 0.3667 0.3983 0.2002 1.2066 -0.6038 -0.2185 -0.3478 -0.5532 0.6357 -0.1176 1.5068 1.2866 -1.3973 0.7128 -0.8401 -0.5924 0.4820 -0.9584 0.2134 -1.0338 -0.2335 -0.0285 -0.3095 -0.0825 -1.1821 -0.8759 -0.0316 0.1575 0.0757 -0.8695 -0.0228 -0.5168 -0.3002 -0.1013 -1.6527 -0.9427 0.0250 -1.6607 0.2619 -0.7801 0.0038 0.2950 -0.1429 1.5860 -0.8196 -1.9710 1.0098 0.3617 -1.0193 -0.5371 -0.1709 -0.2578 1.2876 0.4482 -0.3601 -0.3809 -0.2965 -1.2826 -1.7330 -1.1224 0.6396 -1.0106 -0.9261 -0.6493 1.1215 -0.3188 0.7741 0.7058 1.3719 -0.1609 -0.5314 -1.8797 -0.6301 0.9917 0.5250 -1.2065 -1.3296 0.2874 -1.2211 -0.4010 -0.6366 -0.3540 -2.3069 -1.1781 0.2118 0.6043 0.6124 0.0406 1.4865 2.0094 0.1352 -0.3174 -0.7287 -0.6736 0.1213 0.5665 -1.6782 -0.4113 -1.0402 0.0068 -0.1802 0.7027 -1.4208 0.0113 3.4886 0.9482 -0.4396 0.3510 -0.6688 -0.7014 -0.6919 -0.7814 -1.3697 0.2536 -0.3887 -0.9004 -0.0295 -1.5629 0.1264 2.4544 0.9290 0.4126 0.7118 -0.9659 -0.0647 0.5147 0.3720 -0.4275 -0.4734 1.1106 1.1275 -0.5081 -0.1215 -0.2716 -1.0322 -0.4585 -0.0472 -0.0184 1.1004 -0.8676 -0.3007 0.6155 -1.0167 5.9305 -1.4630 0.4816 2.1778 -0.3609 -0.2558 0.2714 -0.7246 -0.6581 -0.4260 -0.1705 -1.9755 -0.6424 -0.9696 -0.6809 -0.2154 0.6702 1.7599 0.3020 0.4723 -1.3108 -0.5950 -0.4044 -1.4536 -0.6318 -0.6020 1.3110 0.5734 0.2341 -1.5279 1.2722 -0.6892 0.4691 -0.4574 0.9233 N-alpha-acetylornithine 0.2787 -4.7944 2.5787 -0.0479 -0.7117 1.8308 0.1489 1.7048 0.4793 2.3875 2.3800 0.7022 -0.8885 0.4163 -0.1269 -0.4330 1.2877 -1.2875 -0.5769 0.2424 0.9458 -1.8946 -0.0726 -1.1726 0.3904 -0.1649 -0.3929 1.0714 1.1173 -0.0324 -1.0431 -0.7554 1.1278 -0.4142 -0.1519 2.6373 0.5825 -0.8044 0.1080 -1.3538 -0.4765 -0.4947 -0.5033 -0.5984 -1.2335 0.7446 0.8991 0.7798 -0.6675 0.1377 -1.0125 -0.6839 -1.6303 0.9653 -1.0704 -0.2837 -0.1561 -0.9319 -0.7223 -1.6790 0.6248 0.2283 0.3450 1.7898 0.0597 -0.9568 1.4365 0.6025 -1.0761 0.0642 -1.3074 -1.6073 -0.2357 0.6884 -0.1456 0.3176 -0.6272 -0.3015 0.3678 0.6232 -1.3068 1.0992 0.9335 0.1864 1.2561 0.1391 0.6458 -0.7534 0.1000 -0.2960 -0.8498 1.2540 -1.1155 -0.5839 1.3810 -0.3230 -0.5385 -0.5623 -0.6178 -0.4032 -0.4402 0.5038 0.3319 0.3987 -0.0131 1.1403 1.0235 -2.5053 -4.7630 0.9097 1.3886 0.0030 -0.0155 0.5354 0.8644 0.9106 -1.0238 0.1956 2.5619 -0.3604 0.6925 -0.3767 -0.9517 -0.4436 0.5812 1.1390 -0.0187 0.8980 -0.6431 0.1159 0.1308 0.3325 -0.1391 -0.0332 1.2551 0.1040 -0.2726 0.1180 -0.9706 -0.6720 0.3815 -1.3804 -0.1373 -1.2232 0.8973 0.1638 -0.6589 0.9729 -0.2688 -0.1082 -0.0940 -1.7481 -0.6626 -4.9114 -1.0081 0.0451 -0.2809 0.3760 0.6039 0.0492 0.8875 0.0982 1.3482 -1.2634 0.5243 -0.7492 0.4827 0.8179 1.4096 0.2201 -0.5395 -0.1820 0.3419 0.4315 0.1323 -0.9879 -0.9046 -0.4384 0.5199 -0.8407 0.2857 0.3604 0.4101 -0.4605 -1.1942 -0.2036 0.3598 0.1240 0.3887 0.2176 0.5234 0.6436 -0.7887 0.8827 -0.5049 0.2338 0.9471 0.1134 -0.2475 -0.3988 -1.0084 -0.2000 1.1190 -0.6736 1.1422 0.2853 -0.2477 0.4856 -0.1651 -0.0726 0.4573 0.2483 -0.9358 -0.2473 0.9048 0.1095 1.0183 0.4860 -0.4814 0.1345 -0.1770 -0.1375 -0.8092 0.6441 0.5887 0.9726 1.6805 0.3389 -0.3201 0.9619 -0.3666 0.1163 -0.0724 -1.2063 0.9923 0.9084 0.2404 -0.2748 0.3181 -0.2323 0.3214 -1.1872 1.1166 -0.8282 0.6308 1.0710 -1.3321 -0.7242 0.6890 0.0131 0.9234 0.0134 0.0726 0.1888 0.7198 0.6290 -0.8382 -0.2584 -0.8087 -0.8962 0.0457 0.0853 0.0987 0.9840 -0.0753 -0.7746 -1.1551 1.0042 -0.0231 -0.5121 0.5200 -0.6053 0.1217 -0.0297 0.1089 2.0056 -1.1643 -0.4400 0.4359 0.3197 -1.0876 -0.4456 -0.0909 -0.2118 -1.8574 0.5287 -0.0562 -0.8128 0.2343 0.1977 -0.5816 -0.5364 0.0325 -0.6140 -0.2053 -0.4761 1.7840 0.2622 0.4233 0.5765 0.4791 1.5180 -0.5068 -0.3857 -0.1109 -1.2857 0.4944 -1.1923 -0.4313 0.3603 -0.3741 0.2651 1.4606 -0.4766 -0.5991 0.5356 0.0524 0.3063 0.4073 1.0923 -0.4000 2.5564 -2.7306 -0.6380 0.2398 -0.3750 0.0010 0.1131 0.7406 -0.0420 -0.0604 -0.1486 -0.7104 -0.0674 -1.1367 0.3827 3.2152 -0.1235 0.0739 1.3458 0.2625 0.5613 -2.4241 0.0172 0.2876 -0.7119 -0.5557 -3.7559 -0.6654 0.4852 -0.0800 -0.1225 2.4571 1.8598 1.3876 0.5950 -1.2130 -0.0742 0.7750 0.1931 -0.1147 -0.9873 0.4406 0.5066 -0.5620 0.3660 -0.0175 -0.4011 0.1612 0.1227 0.0874 -1.5161 -0.1495 1.2491 -0.7398 2.1717 -0.1966 1.5215 1.9801 -1.4217 -0.2352 0.0763 -0.2849 0.0325 -1.0520 -0.1641 0.0648 1.4031 -0.0174 -1.8954 0.0141 -0.7364 -0.8904 -0.6061 -0.5263 0.5755 -0.5810 0.0933 -4.1793 -1.3125 1.0343 2.0442 0.8851 0.0198 0.7498 0.8757 -0.0926 -0.4333 0.4636 1.2801 N-behenoyl-sphingadienine (d18:2/22:0)* -0.1482 0.7619 0.0331 -0.6948 1.4169 -0.4558 -0.5667 -0.6668 0.6708 0.7583 -0.5303 -1.7187 -0.0121 -2.5747 -0.1163 0.7228 -0.4717 1.1390 -0.4151 -0.0179 1.5194 -0.0462 -0.5372 1.1046 -0.9362 -0.3113 0.1377 2.0108 0.7162 1.5531 -0.2565 0.5663 -0.2843 2.6844 -0.5456 0.3746 0.5581 -0.0260 0.7330 -0.9531 2.0950 0.0853 -0.9867 -0.0907 0.2815 -1.5211 1.4534 -0.1989 -1.2601 -0.5621 0.0405 -0.0254 -0.4990 -0.7661 1.1568 1.7042 1.1855 0.7994 0.2444 0.2644 0.4960 -0.0199 0.5970 -1.6305 0.5362 -0.1816 -1.1206 -0.5392 1.7482 0.8373 0.8408 0.0364 1.0250 0.5022 -0.0048 1.0135 -1.2516 1.0942 0.8597 1.4091 -0.8653 -0.1754 -1.0509 0.6481 1.1884 -1.1711 -0.7212 1.9809 0.3369 1.3357 0.0598 0.4804 -0.3496 0.2800 2.0657 -0.8558 -0.8484 0.2484 1.1812 1.7786 0.4226 -2.8643 -0.2619 0.3868 0.5858 0.6443 -0.4122 -0.5415 -0.5438 0.7202 -1.3016 -1.2211 -1.4165 1.0037 -1.1436 -0.2455 0.0260 -2.4578 0.2823 -0.2487 -0.3605 2.5670 0.5097 -1.3230 0.8555 0.5273 0.0404 0.0666 -0.7993 0.0093 -0.7745 0.2910 0.8691 0.5349 0.6838 0.1275 1.6036 0.9353 -0.9766 -0.0824 -1.6126 1.1037 -0.5084 1.6345 -0.2616 0.6349 0.8167 0.0741 1.4787 0.8809 -0.2867 2.7787 1.4999 1.1992 2.0725 -0.2095 0.9650 0.1953 0.9208 0.1916 1.3482 -0.7841 -0.5758 0.7266 -0.5122 1.9025 -1.3190 0.4266 -2.6742 0.7260 1.2564 -1.0792 -0.8448 -0.9922 -0.6003 -1.9385 -0.5874 1.0078 0.5769 0.9457 -4.0923 -0.9933 -1.1048 1.6337 -0.0999 -0.6642 0.6034 0.7759 -1.4276 -0.8891 -2.7514 -0.9507 -0.7624 -0.0422 1.0161 -0.4886 0.9832 -0.7246 0.6704 1.7571 -0.1177 -0.1599 -0.6584 0.2159 -0.5622 1.0351 0.7752 -0.2486 -0.2368 0.1051 0.7036 0.3496 1.4231 0.8476 -0.5195 0.4898 -0.3295 -0.1037 -0.7848 0.4880 0.5738 -1.0245 0.4228 0.0878 -0.0840 -0.1037 -0.9380 -0.7022 -1.2610 -0.5152 1.6784 -1.4790 -0.8069 0.8828 -0.2428 0.1362 -0.5746 -0.8947 -1.5541 1.5654 -0.1460 -0.1990 -0.1662 0.5624 0.2774 0.2059 -0.8288 1.9066 -1.3322 -0.7505 -0.8423 -0.8673 0.6387 -2.6656 0.4731 -0.1416 -0.8478 -1.8278 1.4567 0.1522 -0.4715 -0.7317 -0.7465 -1.1640 0.1811 0.1071 0.5268 -0.1642 1.3717 0.9672 -1.0730 0.1874 -0.6331 1.1527 -0.8840 -0.1781 -0.5150 -0.2851 0.2676 -0.9506 0.3136 -1.3824 1.7709 -1.0233 0.0735 0.1994 -1.0035 -1.1713 0.8036 -0.4335 -0.2766 -1.5394 -0.3197 -1.6819 0.0224 -1.2877 1.3666 -1.3173 1.7037 0.0504 -0.2286 1.4281 -1.6451 0.1222 -0.5747 1.2135 0.1418 0.0706 -0.4901 0.3224 -0.2749 0.2450 0.0583 0.7699 1.7647 -1.1480 0.3399 -2.1885 -1.2506 -1.1746 0.4603 0.0342 0.5795 -1.3021 0.4454 0.0735 -0.1898 0.4151 -0.1960 2.5532 0.3909 1.3555 -0.2054 -0.4666 -0.0950 1.1770 0.0356 -0.8101 -1.8041 0.1326 -0.2736 -1.5304 0.6819 -0.7258 -0.6501 -1.3517 0.4558 -1.0399 0.4446 0.2693 0.3654 2.5784 0.4840 -0.3895 -0.0699 -0.5065 -0.1360 -0.6288 -1.1340 0.1946 0.2015 -0.9630 -0.5751 -0.1166 0.7289 -0.8255 -1.3926 -0.1711 1.5486 -0.1373 1.0798 -1.6206 1.2354 0.0378 -0.7668 -0.3186 0.0391 0.4101 1.4754 1.2582 -0.2461 -0.0557 0.2075 -1.3809 0.8790 0.1606 -0.2687 0.9488 -0.4562 -0.5023 1.0893 -0.4306 -1.4047 0.4551 -1.7833 0.3736 -0.3605 0.8370 -1.7911 -0.5176 -0.6117 0.6817 0.7808 -0.1586 -1.2541 0.8866 -0.4786 1.2123 0.2798 -0.2227 N-carbamoylaspartate -0.6272 -1.4742 -0.5054 0.0612 -1.3555 -1.5121 -2.2286 0.1793 0.7867 0.5759 -0.6364 1.0024 -0.9454 0.0622 -0.1183 0.0134 -0.1642 0.5091 1.1568 -0.0518 -0.9781 -2.4839 0.6777 0.5234 -0.0912 -1.9233 0.2282 0.0013 0.7658 1.2833 0.0012 0.1033 -1.4481 -0.8023 -0.1966 2.6544 0.8125 -1.6323 -0.8127 0.4809 0.8791 -0.6619 0.1974 0.5567 0.2018 -0.4947 -0.4660 0.1622 0.1614 -0.1875 -0.4945 0.1918 0.5496 0.6981 -0.3014 1.1807 0.3505 -1.5366 -2.0215 0.4794 -0.3233 -0.4266 -1.3396 -0.7867 -1.8985 -0.5212 -1.9744 1.1971 0.6490 -0.2141 1.0784 1.0337 1.7813 0.3282 -0.0941 -0.1408 -1.1190 -0.5404 0.1603 -0.7308 -1.9929 0.7046 -0.1392 0.6906 2.4586 -0.4293 0.6169 -0.0687 1.6030 0.3468 0.1921 -0.2642 -1.4537 0.1037 0.0104 0.9812 -0.1738 -0.8223 -0.0895 1.4722 0.4327 -0.0045 -1.7571 1.2874 -0.5661 1.5210 1.5888 -2.0150 -0.1230 0.9742 -2.2110 -0.2800 -0.1959 0.6437 2.6144 1.1649 -0.6160 1.8712 2.7978 0.1242 2.2111 0.0157 0.7834 -0.3240 -0.7687 -0.3018 -0.9754 0.0969 0.6271 -0.3542 0.3592 1.9063 1.3705 0.2848 0.8281 0.8880 -1.9104 0.7093 0.1356 0.2175 1.8984 -0.5310 -0.3559 0.7014 1.0887 0.4335 0.1225 0.4465 -1.0270 -1.7587 -0.2477 -1.7109 -1.2693 -2.5528 -1.2752 -0.2633 0.4175 0.5877 -0.0247 -1.4004 -0.4387 0.6619 0.0548 0.1461 0.2795 1.2256 -0.2972 0.9091 0.0008 -1.9437 -0.5188 0.8367 -0.5399 0.1046 -0.1288 0.8987 0.3652 -0.0492 -0.6750 -0.2361 0.8472 0.6178 -0.2924 0.7598 0.8699 1.8296 -0.3610 -0.5314 -0.5750 -0.4807 0.6831 1.3250 0.5007 0.1289 0.4428 1.6613 0.1364 0.3073 0.3420 -0.3844 0.8616 -0.1954 0.8863 -0.4444 1.2109 0.9064 -0.6027 0.8148 0.7123 -0.4400 1.2377 -1.9666 -0.1057 -2.0484 -1.3079 1.1099 1.9846 2.4241 -0.3229 0.4179 1.3201 0.2100 -0.4501 0.4104 -0.9696 -0.1472 0.7700 0.0970 0.7104 -0.2220 0.8563 -0.9407 -1.9070 1.2166 -0.7679 0.0268 0.0696 0.1281 -1.1996 1.1522 -0.4887 -2.2912 3.4411 -0.1007 -0.0504 1.2762 -0.3191 -0.3862 1.5315 0.4687 0.1914 0.6515 -0.5766 1.7828 -0.5155 0.2346 -0.1132 0.0813 0.7814 -0.8535 -0.7011 0.0815 0.2910 2.1078 0.0459 -1.1432 0.1691 0.1438 1.8552 -0.6897 0.7515 0.2880 0.6092 -0.9979 0.8075 0.2166 -0.7219 -0.5465 -0.0137 1.5885 0.0986 0.1836 -0.1135 -2.1947 -1.3417 -0.5375 -2.1422 -2.0058 1.3489 -2.3203 0.2708 -0.2166 0.7033 -0.5695 0.8092 0.2985 1.2965 -1.3025 -1.2672 1.3879 0.0432 0.0409 -0.4226 -0.1638 0.9030 -0.6245 1.7342 0.0862 0.9909 0.9196 1.3350 0.1097 -0.2882 0.0178 -1.1763 0.8099 0.5851 -0.0533 0.5358 -0.4660 -0.5800 0.2422 -2.5997 -1.2594 -0.1539 0.6463 1.5749 0.8111 -0.4354 -0.2005 -0.0003 0.3668 -1.3830 0.5876 -1.3175 0.0749 1.1746 0.7301 0.0734 0.4727 1.0083 -1.4629 -0.2608 -0.1278 0.5336 0.0069 -0.5029 -2.2084 -2.1424 0.1297 -1.0929 -1.2595 0.4276 -0.2575 0.1492 -0.3311 -0.9992 -0.0582 0.5633 0.0632 0.2752 -1.1411 0.0250 -0.9351 -0.3251 0.8195 0.5945 -0.1093 0.5957 -0.6097 0.9861 -1.5292 -0.4402 0.3496 -0.3929 -1.8598 -0.3868 0.4574 -0.4784 -0.4230 0.6218 -2.4579 -0.1044 0.9293 -0.7842 -0.3027 -0.6049 0.4612 -0.9923 -0.1090 -1.7556 0.9836 -1.5085 -0.1458 -0.4270 -0.6537 0.3190 0.3931 -0.1584 -1.5849 0.1173 0.5054 -0.8754 -0.6906 0.4541 1.4392 0.2631 0.3837 0.1579 1.9516 N-delta-acetylornithine -0.9420 0.2721 -0.2494 -1.6078 0.4805 0.7993 0.6495 0.8511 -1.3066 -0.5012 -0.4947 2.7999 -1.6922 -0.9084 1.2138 1.1952 -0.2936 -1.9703 -1.9356 0.1545 0.0452 0.5238 -1.1499 0.0737 -0.4348 -0.5126 1.1852 1.2659 0.1619 1.5373 0.6315 1.4854 1.2265 0.9311 -0.5553 -0.4661 0.0445 -0.0957 -0.3448 -0.2498 0.2970 -0.4865 -0.8212 0.7378 -0.6676 -0.0176 -1.6509 -0.8835 1.2651 1.1149 -1.5396 -2.1173 -0.9277 0.6630 -0.0476 -0.4199 1.6193 -0.8505 0.0519 -0.1168 0.7665 1.2551 1.1543 -0.0105 -0.3604 1.2323 0.2542 -0.8490 -1.1432 0.2423 0.2054 -0.5647 0.6085 0.3525 -0.5102 -0.2475 -0.3625 1.0064 -0.4198 -0.4020 -0.5905 -1.2073 -0.1941 -0.0468 0.0854 2.5428 1.0396 -1.7861 -1.9266 0.1214 -0.1568 -0.5856 0.0335 -0.6954 0.6471 0.1605 -0.9256 -1.7679 0.0764 0.0388 1.2282 0.7017 1.3556 -0.3542 1.1305 -0.5184 -0.9599 -0.1799 -0.2338 -1.0678 2.6245 -0.8971 1.3967 -2.7742 0.4046 -0.8987 -0.4389 -1.0915 2.5710 -0.8369 1.0126 -2.1193 -0.8067 0.4226 3.5534 -0.2931 -0.8666 1.2629 -0.2985 1.9664 -0.2234 0.1878 0.6794 -0.5003 1.2658 0.9646 -0.3719 0.7496 0.4961 0.8724 -0.4311 1.8888 -1.0823 1.1406 -0.8441 0.4255 -0.0463 -1.1324 -1.2046 0.2919 0.2653 -1.3613 -0.3888 -1.4517 -0.9312 -0.0079 0.2206 -2.2752 -1.8020 -0.9461 0.0057 -0.1530 0.4012 -1.0045 1.4573 -0.1221 -0.6207 1.7262 1.5725 -0.0746 -0.0041 -0.9835 1.0870 0.9941 -0.6566 -0.6535 -2.7455 0.9458 0.9285 -1.1792 0.3735 0.0001 -0.1383 0.8032 0.0457 -1.4143 -0.5282 -1.2702 -1.7134 -1.0119 -0.1546 -0.4117 2.1632 -0.5086 -0.6708 -0.1788 0.9033 1.0138 0.2653 -0.4720 0.3928 -0.7746 -0.9692 0.3295 -0.9648 -0.1811 -0.1772 -0.6093 -1.6853 -0.3345 -0.2126 -0.5639 0.1047 -0.3830 0.2415 -0.2654 1.0689 0.2795 -0.2196 0.2940 -1.0864 -0.4602 0.2495 0.3317 1.9245 0.4971 2.0681 1.6382 0.6444 -0.1245 -0.0955 0.0969 2.5356 -0.2184 2.6321 -0.6058 -0.8298 -0.7065 1.0075 -0.5043 -0.7002 -0.9932 -0.4385 1.2389 0.7038 -0.3900 -1.1496 0.0354 0.8048 -0.1694 -1.8972 -0.5512 -0.2303 -0.1484 -1.3539 1.1091 -2.4405 -0.3037 -1.1119 1.3594 -1.7100 -0.0563 0.0955 -0.7959 -1.4179 -0.0260 -1.1615 -0.8927 0.8776 0.3974 -0.0274 -0.3757 0.2767 0.0397 0.6092 -0.7879 1.6641 1.3445 0.7378 -0.5418 0.9802 1.5148 -0.3286 -0.2675 -0.9837 -0.5247 -0.9849 0.4723 1.9681 0.7515 -0.7360 -0.7503 1.2267 0.3526 -0.4466 -0.0678 0.8875 0.6647 1.3856 1.1236 -0.3648 -0.7043 -1.5603 -0.1368 -0.3577 0.4129 0.6481 -0.8438 -0.1669 0.3188 -1.2400 -0.0289 0.8693 -0.5517 0.3381 1.0372 -0.0670 1.2993 1.9582 -0.0992 -2.1255 -1.4389 -0.2399 -1.6735 0.3201 -0.1942 -0.0955 -0.3405 -0.9847 -0.4572 1.0150 0.2757 1.0598 -1.0231 0.0626 1.1236 0.1132 0.2342 2.2756 -0.6629 -0.0076 0.1143 0.6371 1.4540 0.9343 -1.0829 0.1155 -0.0045 -1.3044 -0.0279 -0.7923 0.6179 -0.1251 0.2758 -0.4337 1.4579 0.4331 -1.1150 0.9636 0.7009 0.5010 -0.2423 -0.9308 0.2678 -0.4067 1.6073 0.1195 0.1814 0.4655 0.3558 -0.9417 -0.6619 -1.3061 -1.1969 0.7602 0.3576 -0.0768 -0.9745 -0.3339 1.9732 1.7875 0.9957 0.3462 -0.5932 -0.6835 0.8024 0.2491 -0.3258 0.2434 -0.6040 -1.2060 0.0344 -0.5071 -0.1560 0.4765 0.2948 0.6394 -0.4901 -1.3220 -0.2583 -0.1505 0.0746 1.0305 1.8325 -1.3924 -0.1768 -0.4991 1.0459 1.2452 3.1602 nervonoylcarnitine (C24:1)* -1.0102 -0.4310 0.8455 0.9599 0.1470 0.3708 0.8065 -1.7157 -0.5933 -0.9342 0.1469 0.4737 0.8987 -1.5585 0.2213 -0.0591 0.3579 1.1381 1.1434 0.6015 0.3014 -0.1872 0.5990 -0.4486 0.8172 1.2672 -0.0712 -1.2791 -1.1833 1.1508 -1.7747 0.9072 -0.8250 0.7651 0.9279 -1.4957 0.6857 0.5187 -0.1235 0.3634 0.1912 1.3139 1.5504 -0.1340 0.8558 1.0847 -0.1309 0.8363 0.4166 2.0291 -0.1650 -1.8481 0.3821 0.9178 0.6983 1.3376 1.3525 0.0567 0.4379 0.4979 0.2285 -0.2697 0.4799 -1.3117 0.5672 -1.7870 -0.3438 0.3054 0.9656 -1.1766 -1.4882 0.9550 1.7393 0.6449 -1.4637 -1.7385 0.7050 -1.4513 0.3281 0.7896 0.1554 -0.1148 -0.3107 0.5089 -1.3254 0.5718 1.6559 0.5677 -0.0596 0.6436 0.4886 0.0850 -0.4031 -0.9073 0.0007 0.5239 0.5831 0.5646 0.9926 -0.1495 1.6775 -0.2992 0.1323 0.4177 1.3856 -1.3342 1.3454 1.0424 0.2636 -1.2869 0.0889 0.0560 0.7529 2.1079 0.5941 -1.4496 0.0710 -1.3643 -1.6586 1.0915 1.1229 0.6973 -1.5177 -1.6297 0.0838 1.5628 -1.6958 0.1866 -1.6006 -0.4318 1.2617 0.9448 0.9365 -1.6963 -1.5627 -0.0946 1.2894 0.3962 -1.5188 1.2421 -1.1560 0.3961 1.1437 0.0084 1.0301 -0.0925 -1.4438 0.8498 1.2914 0.5956 0.9225 0.3865 -1.2908 0.7324 -0.3555 0.8648 -1.4330 1.6768 -1.6633 -0.1034 0.3314 0.8585 -1.2103 1.8239 -0.7875 -0.0895 -1.7047 -1.6313 -1.7524 0.4924 -1.7769 -1.5129 0.7997 -0.0636 1.6500 0.7517 -1.1277 0.9017 1.2583 0.3412 -0.4319 0.4014 -1.5700 -1.5361 -1.1773 1.2516 0.6614 1.0719 0.1761 -1.2974 0.4507 -0.0556 1.3282 -1.2481 0.4540 -0.0121 -1.3725 1.2077 -0.4460 0.0044 -1.6930 0.9051 -0.2934 0.3818 0.7756 1.1179 1.2737 -0.3678 0.5230 -0.7588 0.5142 0.4364 1.0706 -0.0151 0.0072 0.5981 -1.9193 0.3798 0.5761 -1.7581 1.1644 -0.1247 -1.1920 -1.9156 -2.0391 0.5105 -0.3408 0.8698 -1.0979 -0.3718 -1.5853 0.9934 0.9634 -1.6545 0.9446 -1.8404 -0.1648 1.0836 0.0425 0.0560 1.1415 0.6276 0.2781 1.7088 -0.6511 -1.5242 0.1360 0.6878 0.3745 0.3964 -0.3888 -0.0147 0.9694 0.9858 -1.6432 1.4708 -0.4266 -1.6196 0.7530 1.0201 0.7605 0.1013 -1.8095 0.3287 -1.6776 1.3909 -0.4672 -0.6078 0.5637 -0.5918 0.6804 0.4491 1.5266 0.6733 -0.4634 0.0745 -1.6102 0.3764 -1.8199 1.3040 0.1762 -1.8198 0.4761 -1.7721 0.3918 -0.5630 -0.5095 -0.6045 -1.8008 -0.1534 0.7364 -0.5310 0.6213 -1.8686 -0.6882 0.8577 -0.2175 -0.1852 0.0554 0.3298 -1.5124 -0.1238 0.0647 1.0652 1.2882 0.9346 -1.7189 1.2930 0.3968 1.0856 0.3270 0.6443 0.5260 0.3255 0.8642 -0.6250 0.8566 -1.5617 1.2678 -0.2642 1.2018 0.9018 0.3129 0.9108 -0.1429 -0.0857 0.8671 0.3935 -0.4324 0.2470 0.0967 0.6902 -0.1369 -0.2535 0.0928 -1.9976 -1.7064 -0.1559 -1.8656 -1.2810 0.7652 -1.0406 0.4934 -0.0512 1.5204 -0.0685 -1.2889 1.2276 -0.0315 0.6507 0.8590 1.1199 -1.6970 0.3894 -1.7168 0.5740 0.9025 -0.0074 0.4040 -1.9293 0.3377 0.4937 0.8708 -1.2623 0.5868 -0.1813 0.5579 0.3415 0.3763 0.1218 0.5328 0.0690 -1.5205 0.7829 -2.1384 0.2018 0.1583 0.5556 0.2868 0.2423 0.7262 0.5253 -2.1238 0.3725 0.7827 0.2740 -0.4584 -1.6873 0.5167 -0.3487 -0.5233 -0.3477 -0.9015 0.0111 -1.8739 0.3981 0.9700 -0.2287 -2.1931 -0.2839 0.4830 -1.7314 -1.4650 -0.0078 0.9324 -2.1734 0.1288 -1.6686 -0.0724 -0.2980 N-formylanthranilic acid -0.8930 -1.6557 0.8163 0.6984 1.3105 0.2882 0.8320 -1.3760 0.0189 -0.8401 -1.0727 -1.3896 -1.1528 -1.2695 1.3305 -1.2950 -0.0716 0.9965 0.3038 -0.9748 2.4074 0.3950 -0.8220 1.0414 -0.0670 1.1819 0.1357 0.8912 0.5848 0.6769 0.6990 -1.0325 -0.7687 0.2121 -1.5672 0.5620 0.0443 0.9529 1.5119 0.5184 0.7011 -0.6990 0.1672 -1.4268 0.9625 1.2478 1.9500 0.9254 -1.1829 -0.5692 0.5070 0.3170 0.9724 -0.5043 -0.8682 0.6074 1.1300 0.4538 -1.2651 0.3693 1.1226 0.2215 0.3132 -1.0997 0.7935 1.2439 0.7382 0.0392 -1.3949 0.7139 0.6462 0.6421 -1.2773 0.4190 1.7372 -1.3927 0.8145 1.1102 -1.0159 0.5098 0.6339 1.2664 1.0385 0.6268 -1.1080 0.8575 -1.0394 0.2855 0.4687 0.6554 0.3945 -1.1314 2.1953 1.6209 -0.1091 -1.1214 0.0867 1.6483 0.3831 -1.3325 -1.3821 0.1704 0.2878 -1.4618 0.7754 1.5604 -1.2827 0.4968 -1.6386 -1.0839 -0.1346 0.3926 -1.0228 -1.2232 -1.2249 -1.1953 0.7633 0.5605 -1.3363 -1.4878 -1.0752 -1.1597 1.0385 -1.3141 1.2986 -1.3049 1.0372 0.5551 0.2667 -0.4354 0.5397 -1.0785 0.2991 0.4672 0.2916 0.2157 0.2469 -0.8524 -1.2423 -0.7054 -0.9916 -1.2807 1.5601 0.3805 -1.0804 0.5391 -1.1918 0.2668 2.9715 1.2326 1.3401 -0.9951 1.2543 -1.7248 -1.2597 0.2092 -1.1841 1.8080 -1.3419 1.1544 0.7064 1.2253 0.7499 -1.2177 0.5604 -1.4158 0.2207 -0.0531 -1.3999 -1.1989 -0.5854 0.4179 0.9905 0.6746 -0.5389 -0.2264 1.1129 0.3477 0.4013 -0.9503 0.6217 0.4965 1.2012 0.6915 1.5837 1.0103 -1.2524 0.0490 -0.9956 0.9340 1.3385 0.2908 -0.2037 -1.0554 -0.0298 0.0838 -0.7714 0.6119 0.2800 0.9352 0.7225 0.7525 0.1774 -1.1513 0.8750 -0.8719 1.5778 0.7602 0.7845 -1.1807 -1.1686 -0.1898 1.2299 1.4345 0.4122 0.5967 -0.3229 0.3917 0.7185 -0.1317 -0.2604 -1.3535 -1.0178 1.5733 -1.5986 -1.5018 -0.4216 0.5070 0.6625 0.5023 -1.2874 0.4475 0.3333 -1.3364 0.8433 0.2832 0.7782 1.1635 0.1138 -1.1052 0.3304 -1.4968 0.9187 1.9417 0.6651 -1.2446 -1.2895 0.1006 0.3301 -1.3411 0.3069 -1.3988 1.0340 -1.2835 0.3342 0.5170 0.3192 -0.0083 1.0664 0.1598 1.3228 0.4396 0.8733 -1.5437 -1.3512 0.5256 0.8157 0.6632 -0.5091 -1.3698 0.3118 -1.1441 -1.4316 -1.3636 0.5804 0.4047 0.3719 0.7250 -1.4461 0.9168 0.1827 -0.3817 -1.4680 -1.4184 0.4568 -0.1361 0.1171 0.6671 -1.4329 -0.1360 -1.4796 -1.4723 0.7179 -1.4796 -1.2155 0.8955 -1.3610 -0.2730 2.9183 -0.0486 1.0735 0.2642 0.5618 0.9872 0.6355 -1.5197 -0.3054 0.9095 -0.1017 0.8404 -0.3803 0.2568 -1.3338 0.7062 -1.5627 -0.1008 0.4453 1.3785 1.2855 0.9634 1.4444 0.3267 0.5704 0.7264 -0.1253 -0.3576 1.3544 -1.2695 -1.3239 0.8806 1.5935 0.0934 0.6142 1.1969 -1.3020 0.9467 -0.2511 0.1822 -0.2908 -0.1036 -1.2449 1.1550 -0.5550 0.3079 0.9992 0.7024 0.4085 0.4607 0.5590 0.6959 -1.0278 1.2746 -0.3466 -0.2803 0.4456 -1.5692 -1.5284 -0.0566 -1.6628 -1.5208 -1.4040 0.1476 0.9284 1.5994 0.2766 0.3284 0.2882 -0.7461 -1.5195 0.2878 0.3096 -1.3790 0.2457 0.5801 0.3851 0.3384 -0.5910 -1.5002 -0.0367 -1.3994 -0.0243 -1.6421 -1.6567 1.5724 0.9552 -1.7118 -1.6950 -1.3570 -0.0790 0.3960 0.9431 0.1226 -0.8192 0.6468 -1.4840 -1.4960 -1.6233 0.2022 0.7527 1.0325 -1.6239 0.7557 0.4384 -1.4664 1.0053 -1.6899 0.6875 -1.3448 0.3584 -0.6583 N-formylmethionine 1.6412 1.8396 1.2292 0.0050 0.8961 -0.7753 0.6765 -0.4838 0.6220 0.5328 0.2298 -0.5622 0.9525 -0.3341 0.4275 -0.2323 -0.6254 1.5793 0.8665 -1.2757 -0.3869 1.1470 0.3726 1.2123 1.5699 1.9738 0.0529 0.0005 0.0095 -1.4599 0.8957 -0.2299 0.3378 -0.4223 -1.6973 -0.2790 -0.6353 1.3873 1.4575 -3.1936 1.2127 1.4835 -0.2354 -0.0175 0.5830 -0.4199 -0.3956 0.9184 0.0161 1.0030 0.1491 -0.2395 0.3806 0.7604 -0.6712 -0.5465 1.3113 -1.0132 -0.2276 -0.8321 0.9190 1.1139 -0.7531 -0.3961 0.0782 -1.3091 0.7649 -0.3637 -1.1619 1.1200 0.5550 -0.3087 -0.2747 -0.1923 1.5628 -0.3437 1.9929 -1.8839 -0.2090 0.1777 -1.3111 -0.5104 -2.5717 -0.8958 -1.2419 -0.2820 0.5540 -2.0138 -0.1464 0.9521 0.0905 -0.4983 0.4449 0.9688 1.0165 0.7855 -1.3160 -0.1837 -0.5786 0.3540 -0.6437 0.7937 0.6593 -0.3327 1.7561 -0.2054 0.2931 2.1686 0.2777 0.9391 -0.8276 -0.8315 -0.5674 -0.4417 -0.1890 0.0817 0.4616 0.4618 -0.8936 -1.0651 -0.1783 -1.1833 0.3674 -0.5159 -0.6496 -1.1295 -0.1522 0.0186 -0.7290 -0.7388 -0.4725 -0.3930 -0.8279 0.9601 -0.6007 -0.9574 -0.0265 0.6845 -0.5057 0.0741 -1.0745 1.3856 -2.6809 -0.0962 3.6857 0.2471 -0.0629 1.1808 0.0142 -0.3640 0.4102 0.3107 0.3337 1.4535 -0.4488 -1.7186 0.3919 -1.4284 -0.6029 0.3598 -0.2339 -0.3799 1.4006 0.7301 0.1212 0.1217 -1.2891 -0.0837 -1.0164 -0.5127 -0.6115 0.4050 -1.4055 -0.7532 -0.0877 0.2180 0.4232 0.0132 0.3482 0.0233 1.6495 0.3240 -0.4748 1.2923 0.4716 -1.5175 0.6187 0.0673 1.4938 -0.5111 -1.4673 -0.4903 -0.8400 1.4087 0.0384 -0.5837 -0.3138 -1.1541 0.1189 2.1879 -0.3751 -0.1846 -1.5721 -0.3722 1.2423 2.0519 -0.1528 1.2951 -0.7949 1.0719 0.1364 -0.0394 1.2334 -0.1237 -0.1352 -0.4568 -2.2383 -0.8664 0.5205 -0.8017 -0.9134 -0.3566 0.5126 -1.1168 0.5233 0.0801 -1.7399 0.5712 0.1647 -0.1792 0.1078 0.3541 0.4491 -0.0361 -1.6619 -0.5015 0.0581 -0.3282 0.0447 0.1368 0.3270 0.8283 -0.7193 1.3884 -0.5736 -0.3469 0.7360 -0.3229 -0.5591 -0.4752 -1.0955 0.8496 -0.4258 -0.7040 -0.3965 0.0861 0.0674 1.3131 0.1444 -0.1433 0.9876 -0.2857 -1.2640 -1.7824 0.0950 -0.8019 -0.9208 -0.6004 -0.9015 -1.2322 -0.6269 -0.2846 0.7589 0.3860 1.4731 1.7861 -0.0789 -0.4446 -0.7548 0.4421 -0.0398 -0.1728 -1.5016 0.5949 0.6576 -0.3045 0.2659 1.5322 -2.1003 -0.6366 -0.6522 -0.2162 -0.1397 -0.7314 -1.4576 1.0152 -1.5437 2.5700 0.4264 -0.6534 1.1076 -0.8760 0.5184 -0.9012 0.8120 0.0365 -1.1049 0.3856 -1.9904 -0.3955 0.0207 0.4983 -0.3914 0.5981 0.4692 -1.9274 -0.9304 0.8356 1.3280 0.7658 0.9261 0.0704 0.8429 -1.1135 0.9847 -0.8701 1.6432 0.8109 -0.3199 -0.5005 -0.7809 -0.3692 0.1688 -0.8242 0.7826 -0.1509 -0.1497 3.1002 0.0338 -1.0271 0.0847 0.5448 -0.4500 -0.8564 -0.8516 0.8378 -0.2932 0.8130 1.1708 -1.2698 1.2838 5.0008 -0.3387 -0.7405 -0.2656 -1.4375 0.7888 0.3305 -0.7098 -0.4902 0.0929 1.0640 1.0350 -0.5088 -0.2384 1.4598 0.5849 -1.0243 -0.8335 -1.3299 0.4158 0.9559 0.1940 -0.4469 -0.8684 -4.0529 -0.3241 1.8013 0.7275 0.3721 0.0279 0.7330 0.1625 0.6528 1.1897 0.3961 -0.4236 -0.6451 -0.7824 0.1669 -0.1021 0.2662 4.0425 1.3009 0.7342 -1.3778 -0.6373 0.6875 0.0809 0.8757 -0.2829 1.8222 -0.9579 -1.1380 -0.1107 -0.4634 -0.6628 -0.0316 -0.8216 -0.7240 N-formylphenylalanine -2.5159 -1.2952 0.2772 0.1597 -0.1205 0.5624 0.1301 -0.1446 0.7926 0.5149 0.4577 0.3299 -1.4390 0.4605 -0.0643 -0.6801 0.0156 -0.4863 -0.7853 -0.4293 0.5511 -1.5586 -0.2890 -0.1865 1.6780 0.5954 -0.2063 0.9086 -0.3016 -0.0229 -0.4072 0.3693 -1.9176 -0.4001 0.1771 0.2562 -2.8783 -0.1666 0.8603 -0.2116 0.1404 -2.2641 0.3852 0.1345 -0.4409 0.2706 1.1681 1.8070 -0.4180 0.7996 0.0516 1.3484 -0.9842 -0.1178 -2.4872 -0.2957 0.8168 -0.3903 -3.0348 0.1887 -2.7284 -0.4884 -1.2003 -0.2314 -0.0117 -3.2875 1.2944 0.4174 -1.3777 0.5634 0.0399 -0.9930 1.2973 1.4241 0.0697 1.1667 0.6998 -0.6667 0.0085 0.4816 -0.3899 0.6423 0.2400 0.1265 0.4403 -0.0247 -0.2471 0.3646 0.3110 -0.1387 -0.7879 0.3822 0.0844 -0.3240 -2.8800 0.3219 0.0855 -0.5828 0.5754 -0.3273 -0.1063 -0.2316 1.2930 -0.8660 -0.0441 0.3739 -0.1638 -0.9672 -0.4801 1.2495 1.3974 0.2247 1.0478 -0.0989 0.0849 0.4859 0.3900 -0.3417 0.6841 1.0862 0.4341 0.0547 -0.4875 -0.5020 1.0501 -0.2739 -3.1805 -0.0317 -0.2777 0.6308 -0.6630 0.4810 0.5121 1.7422 -0.2049 0.3985 -0.9840 0.1312 -3.0053 0.0923 0.3300 0.7093 0.8697 -0.1555 1.7315 -0.4624 1.7946 -0.2398 0.5813 -0.1204 0.1043 -0.9322 1.2536 -3.6373 0.8911 0.0125 -0.3974 -2.6814 -0.2583 0.4610 0.3897 0.4912 -2.7267 0.8767 -0.0967 -0.4214 0.0976 1.1811 0.3698 0.0052 0.4121 -0.8690 0.0874 0.4334 0.0519 0.2152 0.5704 -0.0753 -2.8730 -2.6311 0.4130 0.0757 0.2777 0.2455 -1.3891 -0.2284 0.6629 1.1009 0.3296 0.0601 0.2599 -1.4012 1.8559 1.4508 -0.7643 0.1147 1.4836 0.7697 0.5770 -1.5444 -1.8043 -0.7217 0.1203 0.1978 -1.3154 -0.1764 0.2492 0.0228 -0.4205 0.0114 1.0259 -0.2395 -2.5463 -0.4262 0.3042 0.5854 -0.0043 -0.8669 -0.4294 0.7001 0.0340 0.2670 0.7449 0.4927 2.4155 0.7007 0.2233 1.7677 -0.2050 0.3918 0.5690 -0.1612 0.3635 -0.9709 0.7922 0.0798 1.0473 -0.0310 0.4282 -1.5986 0.5108 -0.2408 -0.0162 -0.6657 0.7809 0.2101 -3.0627 -0.9657 1.2475 1.3772 -1.1481 0.3095 0.1680 -0.5559 0.4895 -0.2208 -2.2811 -0.7454 0.8666 -0.3653 -0.2430 -0.3793 0.3364 1.1532 -0.5967 0.6762 -0.9732 0.6199 -0.0917 -1.1952 0.1862 0.1422 0.5286 0.7891 0.5376 2.8806 -0.3108 -0.6427 2.0087 -0.4210 -0.4020 0.7205 1.7169 0.1484 1.0449 1.0133 -0.3998 -0.3263 0.4790 -0.2006 -0.0770 -0.1499 -3.1451 -0.5396 -0.8912 -0.3828 0.2254 -0.0868 0.2675 0.2463 1.2785 0.6327 -0.3805 -0.0694 -0.2270 0.8188 0.0466 -0.7643 -0.2673 -0.0643 -0.3103 0.9214 0.6250 1.0857 -0.7225 0.6002 -0.2731 -0.0098 0.5337 0.4383 1.8474 -0.5095 -0.8394 0.6808 0.7352 1.4489 1.1045 1.1564 0.7035 -0.3603 0.2206 -0.2023 -0.6950 0.7220 -0.5305 1.3124 1.5988 0.4761 -0.7287 0.9992 0.4545 0.3981 0.2789 -0.1266 0.6077 -0.7645 -0.2420 -3.2628 -0.7913 -0.5014 0.8592 0.1897 0.4818 1.2868 1.0638 0.3068 0.0093 0.7753 0.5894 -0.0033 -0.0424 0.1911 0.7559 -0.0284 0.8390 -0.8530 0.4317 0.5555 -0.2629 0.4478 0.0841 -0.8683 -0.2617 0.8574 -0.0966 1.6517 1.2650 -0.4214 0.4349 -0.2293 -0.6283 -0.1463 -0.3849 -0.9024 -0.3130 0.8927 -0.7773 1.5190 0.1761 -0.5214 1.1539 -3.0188 -2.4238 1.7682 -0.0101 0.5561 0.1356 -1.2067 -3.5983 -0.1267 0.8024 0.9257 0.4113 0.2456 0.3647 -0.6136 -0.3781 0.6644 0.1132 0.4093 nicotinamide 1.5596 -0.3702 1.4095 1.4654 -0.1255 2.1758 -1.3358 2.3003 1.9011 2.1093 1.5316 -0.0837 -1.5926 -0.0936 0.5530 0.1177 1.1242 1.0541 0.1029 0.2594 0.5478 -1.0414 1.0599 0.4126 -0.1261 0.5257 1.0743 1.1407 1.4787 0.7885 -1.1233 0.3632 -0.3587 0.2318 0.6117 1.6410 -0.4398 0.1099 -1.0664 -0.0974 0.7680 -1.1003 -0.1518 -0.2366 -1.1946 0.7418 -0.5688 0.2930 -0.7027 -0.7474 0.0815 0.1653 -1.3002 2.4508 -0.9768 -0.6021 -0.1047 -1.2290 -0.8886 1.0998 -0.7532 -0.5092 -2.2145 2.4363 -0.5407 -0.0533 1.9598 -0.9015 -0.2903 -0.3162 0.6606 0.7795 0.8049 0.2814 -0.8121 -0.3102 0.1510 -1.9964 -0.1605 -0.5279 -0.0728 0.3776 -0.3654 -0.8255 -1.6519 0.6855 1.0963 0.8735 0.1493 0.1099 -0.9223 1.2061 -0.9486 0.8449 -0.0432 1.5455 0.6129 0.3284 0.1499 0.1212 0.1474 -0.0544 0.4630 0.0827 -1.9680 0.5190 1.1585 -1.3309 -0.2510 0.7704 1.5739 1.4790 -1.1249 -0.4555 -2.6619 -0.8162 -0.2358 0.8009 -2.1749 -1.3301 1.2197 -0.4606 0.2701 -0.5981 -1.4668 0.8146 0.4101 0.4469 -0.0577 0.1645 0.1709 -2.5533 0.6356 -0.4640 0.0459 -2.4711 -0.5187 -1.1756 0.2491 -0.9454 -0.0175 -2.2090 -0.5833 -0.2417 0.0195 -0.5783 -0.5773 0.4695 -0.8018 -0.7164 -0.2822 -0.6481 -1.5928 -0.3294 0.0792 0.4690 1.2281 0.9949 0.9513 0.6141 1.8689 0.4266 1.0105 -0.6756 0.2694 0.0222 0.4027 -0.7152 -1.7147 0.7782 0.4956 -0.5644 0.1257 1.1614 0.2479 -0.1575 0.3161 -0.8620 -0.3632 -0.0717 0.8727 0.4769 0.4931 -0.7096 0.2237 1.6254 1.0197 -0.3269 0.9943 0.2133 1.0602 -0.0538 -0.0019 1.4281 -0.7673 -0.1291 0.2005 -0.3771 0.6807 0.5692 -0.1190 0.2965 1.9442 -1.6684 0.1809 0.2529 -1.0095 0.6933 -0.4016 -1.1479 0.9837 0.2694 -2.9083 -1.7027 -0.5720 -0.5735 -1.7723 -1.5482 -1.0723 0.2927 -0.3586 1.0175 -0.2305 0.3953 -0.1353 -1.1552 -2.9210 -0.5128 1.1512 0.6582 1.0702 0.3892 -0.5915 0.1357 -0.9803 -0.1155 0.9374 0.5124 -0.6407 0.5942 1.0793 -0.4562 -1.6365 -2.7842 -1.1813 -0.8980 -0.0180 -0.9458 0.5024 0.6985 -0.0704 0.5120 -1.5048 -0.5293 0.3424 0.1594 -0.4055 1.4487 0.5757 -0.7543 -0.7089 0.3717 0.4514 0.1257 0.1882 -0.2940 -0.0528 0.7357 0.6604 0.5129 -1.2992 -1.3635 0.1935 -1.9946 0.0288 -0.4047 -0.2000 -0.4646 -0.8247 0.3514 -0.2040 -0.1469 -0.1398 -0.9294 -1.1967 -0.6907 0.4959 -0.2702 -0.4571 -0.5842 -0.9028 -0.0516 -0.1543 -1.4434 0.2446 -0.4093 1.1916 -2.9384 -0.8518 0.4808 0.5235 0.8716 1.1790 0.3257 0.6913 -1.6951 -0.1525 -0.0136 0.7236 -0.3390 0.3650 0.3215 -0.2092 -0.7661 -0.9209 -0.1860 0.3549 0.1321 0.6625 0.5423 -0.4405 1.8440 -0.3614 -1.6738 0.5814 1.2919 -0.0555 0.8612 0.6695 -0.5517 0.3287 0.2712 -0.3113 0.6110 -1.4950 -0.2741 1.6673 0.2434 -0.7295 0.4321 0.7823 0.3303 0.0949 -0.1155 -1.1327 1.2242 -0.3937 -0.3102 -0.4357 0.2268 0.3910 0.8842 1.6961 0.6701 2.0834 0.3269 -0.1270 0.7026 -0.0203 -0.7599 -1.8772 0.1298 -1.3714 0.2327 -0.0082 1.2774 -0.3400 -0.5979 1.0547 0.1060 2.0749 -2.3186 0.3238 1.7939 0.8172 3.4159 -0.0563 1.6866 1.9065 -0.8404 -0.5957 -2.8190 0.3638 0.6138 -0.4136 0.2360 -0.2661 -0.0360 -1.6353 -0.1892 1.5068 1.0259 1.5012 0.3806 -0.9729 0.3311 -0.3458 -0.2425 0.1978 -0.9495 1.5680 2.8262 0.7969 0.7854 0.3512 -1.7460 0.0914 -0.6860 -0.1194 -1.8327 nicotinamide N-oxide -2.5662 0.6335 0.5595 -1.5283 1.2708 0.5935 -1.2723 -1.7466 -1.1516 -0.1587 -0.0541 0.2683 -0.0648 0.0995 -3.2313 -0.2096 -0.5166 -0.1268 1.1488 1.5176 1.0744 0.0957 -0.1381 0.0177 0.6748 -0.8324 0.5249 0.4635 0.3397 0.2676 -0.5275 0.6654 1.5059 -0.0950 0.8437 -0.1421 0.1430 0.8807 -0.0806 1.0977 0.4166 0.3852 -2.9504 0.3398 -0.5964 -1.3695 0.6761 -0.0634 0.5600 -2.8920 0.3924 0.8442 1.4216 0.2091 1.0269 0.8551 0.0064 0.5727 0.4877 0.5203 -0.3784 -0.1464 -1.2489 0.0661 0.3654 -0.1575 -0.2302 0.2691 0.4343 -0.5676 1.7976 0.4408 0.1146 1.5922 0.3308 0.7012 1.8294 1.2199 -2.7303 0.5475 2.4803 0.6808 -0.5152 -0.1831 1.7850 -0.3532 1.8276 -0.1455 -0.0796 1.4586 0.0433 0.1451 -0.4652 0.9226 1.2875 -0.0426 0.6479 0.0542 1.2429 0.9230 0.1986 0.6281 0.6757 -0.9142 0.5029 -0.2042 -0.2099 -3.0028 -0.2223 0.5850 0.9500 -0.9465 0.1049 -0.3928 0.8213 -0.5479 -0.0192 1.4739 -0.7037 0.0990 0.6752 -0.5220 0.1899 0.7565 -0.8638 0.8594 -0.6973 -0.0309 -0.0165 -1.3438 1.0398 1.1078 0.2105 0.6650 0.6782 -0.2913 0.2125 -0.1064 0.0772 0.5029 -1.6986 0.0566 0.3127 -2.9809 0.1981 0.6080 -0.3523 -0.0755 -0.2383 -0.2759 0.0882 0.6267 0.5353 0.0011 -0.1188 0.7984 0.5524 0.4808 0.2888 0.4220 -0.5173 -3.2658 -2.7464 0.7074 0.0704 0.8954 -0.5150 -0.7448 -0.5404 0.8355 0.4757 0.9723 1.0120 0.5566 -0.1123 -2.5958 0.1464 0.6828 0.0866 0.2198 -1.2603 -0.3638 0.1429 0.2024 -0.5245 0.0439 -2.9836 0.0706 -1.7345 0.7604 0.4801 0.6080 0.4056 0.1369 0.1404 0.0737 -0.3375 -0.2254 0.8806 -0.6058 -1.1016 0.4700 0.3192 -0.2607 0.9503 -0.1358 0.8094 0.1314 0.0344 0.4098 1.3160 1.2876 0.7667 -0.3966 0.8022 1.1894 0.0380 -1.3099 -3.3230 -0.9904 -0.2581 -0.6216 -0.3748 -1.4605 -0.0580 -0.7352 0.4981 -0.8337 1.7186 0.7697 0.2470 0.5463 -0.4049 0.9803 0.0086 -0.4241 0.2035 1.0120 -0.7942 0.0504 -0.4967 -0.5324 0.4126 -1.2283 -0.1514 0.4342 0.0803 -3.2360 -0.4482 -1.2857 0.6499 1.3899 -1.2202 -0.4528 -0.1415 1.6830 0.3001 1.7663 -2.2078 0.1616 -0.4710 -0.9771 -0.8819 -0.1766 0.5775 0.0755 0.1409 -0.5521 0.7219 -0.3588 -0.2677 0.1499 -0.8651 -0.1478 0.5037 0.1980 0.3073 0.9466 1.8278 -2.6904 0.8739 -0.4954 0.2181 -0.8000 -0.6008 -0.3692 -0.0040 0.0995 0.0496 0.2092 -0.4589 0.6491 1.3298 -0.5804 1.7789 0.5128 1.8110 0.2454 0.3967 1.2202 -2.5616 -0.5668 -2.2439 0.2429 -0.2306 -0.0006 -1.0709 0.6189 0.4710 -0.2769 0.9190 -0.3985 -3.0701 -1.0010 -0.5230 -0.0616 0.9758 1.2764 0.1307 -0.6710 -0.1239 0.7459 0.1497 -1.0370 0.6338 1.6550 -0.3835 0.7615 -0.2139 -0.8760 0.0388 -0.0141 1.6277 -0.0573 0.1724 -0.2048 -0.0147 0.0283 0.4026 -2.2624 -0.4777 0.8503 -0.2445 1.2731 -0.3528 -0.0757 0.1027 -0.5874 -0.2554 0.1920 1.4421 -2.2821 -0.0172 -0.9557 0.1443 -1.3123 -0.6851 0.4767 0.1351 0.9486 -0.6701 1.4735 0.2997 1.1462 -0.0914 -1.1090 0.7769 -1.4315 -0.4256 0.1982 0.4662 -0.6882 0.2810 0.0355 0.5930 0.1435 -0.1770 -1.0762 0.0769 -3.1608 -0.8406 0.6384 1.2985 -0.9067 0.2255 0.9388 0.4557 0.5107 0.1541 1.4624 2.2169 0.5556 -2.4886 0.0248 0.1594 -1.0713 -0.6591 0.5395 0.2823 -0.5673 -3.3967 -0.6219 0.4314 0.5066 0.4079 2.0442 -0.7697 -0.4557 0.5096 -0.0426 nicotinamide riboside 0.5505 -0.9531 -0.1395 0.3709 0.0086 -0.8194 -1.2025 0.6288 0.7872 1.2511 0.4833 -0.0367 -2.5122 -0.6164 -0.8154 0.5529 0.6632 0.1218 -0.7040 -0.2292 -0.0877 0.1001 0.1759 0.5592 -0.3438 0.1627 0.1441 0.5057 -0.8427 0.2860 0.1852 -2.3207 -0.0909 -3.1009 -1.0668 0.4888 0.0054 0.4123 0.1790 -1.6226 0.6291 -1.7744 -0.6165 0.1912 -2.3228 -0.0283 -1.8668 0.9747 0.8652 -1.1620 -0.0626 0.5051 0.7618 -0.1960 -0.4407 0.6800 0.5367 0.0904 -2.6995 -0.0271 1.0871 -0.2647 -2.8725 1.0291 -2.5339 -2.9759 -2.6422 0.2137 -0.4242 0.2695 0.5118 -0.4566 0.9088 -0.1666 -0.2460 0.5074 -2.3201 0.1069 -2.2962 0.1771 0.3975 1.0435 0.0263 -0.9849 -0.5657 -0.3216 0.0300 0.9009 0.2789 0.4924 0.0565 0.2044 0.2504 1.2694 -0.3104 -0.4174 -1.4169 0.5794 0.5921 0.8977 0.5682 -0.2565 -1.2009 -0.1408 0.6610 0.1520 -0.9527 -2.6913 -0.7808 0.0235 -0.2213 0.7552 -2.3056 0.2408 0.3896 -0.2967 -2.2710 -0.6808 0.4708 0.0507 -0.2419 0.6160 1.0074 -0.5249 -1.1063 0.8316 -0.9941 0.4581 -0.6315 -0.1025 -0.1242 -2.3858 0.7865 -2.8639 0.0618 0.1426 -0.1662 0.5385 0.8410 -1.7847 -0.5401 0.7465 0.1824 0.3820 1.3677 -0.2839 -0.3004 0.9023 0.8705 -0.2698 0.0296 0.5176 -2.4157 0.3987 0.3720 0.5430 0.3335 -0.3594 -0.9987 -1.8351 0.8501 -0.0545 -2.3213 -0.5651 -0.0899 0.6125 -1.2117 0.0794 -0.2351 0.4942 -0.6959 -2.6537 -0.0063 0.7640 0.3294 -1.5004 1.0130 0.3585 0.6077 -2.1932 -0.6902 -0.0677 -2.7186 1.0539 -2.2874 -0.5200 0.2283 0.0524 1.4588 0.1495 0.1909 0.0418 -0.3904 -0.1272 0.6159 -2.8013 -0.0451 0.1001 0.5622 0.9092 0.0461 0.9188 0.8882 -2.5292 1.2099 -0.1852 0.4941 0.0408 0.5977 -0.6148 0.9542 1.7887 0.2333 -2.7411 0.2223 -0.4629 0.0271 -0.1070 -3.1530 -0.3871 0.2394 1.1720 0.3573 0.6170 -0.1593 -0.0397 0.2842 -2.0427 -0.0969 0.0503 -0.0577 -2.3778 0.9740 0.1568 -0.3271 1.0358 0.7649 0.4832 -2.9429 0.2466 1.1692 0.7394 0.6397 -1.4047 0.0522 0.4077 -0.8873 -0.5929 -0.0866 0.6909 0.7708 0.4785 0.3305 -0.1820 0.4438 1.0319 0.0630 0.3861 1.0826 0.0295 0.6154 -1.0888 0.3140 -0.5025 0.4195 -0.6028 0.1191 -0.8757 0.1610 0.2163 -0.7385 0.3057 0.2356 -0.6796 -0.7194 0.2625 -0.3053 -0.6744 -0.0932 3.5544 -0.8080 -0.6110 -0.2428 0.9686 -3.1871 -0.2771 -0.0621 0.4299 1.1142 0.1954 0.1650 0.2006 0.9356 0.3355 0.5433 0.2501 1.1066 -0.2326 0.1679 -0.6142 0.4458 0.3824 -1.1543 -0.2659 -0.1735 -0.1931 0.6134 0.5644 0.2887 -0.4895 0.2037 0.9865 -0.3251 -0.2206 -0.2842 0.4877 0.2320 0.9521 0.7728 0.9278 0.1254 1.2268 0.5676 0.4004 -0.3448 0.6390 0.6425 0.4930 0.7842 0.3538 0.5757 0.5649 1.0717 -0.1095 0.6643 1.1910 1.2483 0.3736 -0.1102 0.3869 0.3617 -0.1447 0.2161 0.2741 0.5779 0.8085 -0.5134 -2.9677 0.2031 0.5960 -0.2934 2.8106 1.4126 0.3442 1.5479 -0.1283 0.8453 0.6157 -0.2779 0.6015 0.3332 0.8671 0.4555 2.2282 0.2241 0.2573 -0.2941 0.0575 0.6306 0.3808 1.3242 1.0908 0.2452 0.9836 1.1695 1.9336 0.2289 0.6616 0.8141 0.6204 0.1316 0.6410 0.7699 0.3496 -1.9504 0.6175 0.0919 0.8172 -0.4677 0.3856 0.7673 0.6425 2.0815 0.2571 0.3557 0.4153 0.2165 -0.0643 0.6106 0.1355 0.7151 2.0333 1.0747 0.5482 0.1368 0.0818 0.1779 0.2616 0.8043 0.1423 nisinate (24:6n3) -0.7136 0.5443 0.9075 0.0757 0.6228 0.6325 0.0113 0.0234 0.1806 -0.0286 0.6047 0.6601 0.3740 0.1936 -1.5491 0.2335 0.0305 0.2224 0.7698 2.1184 0.5525 1.1166 -0.2052 -0.3892 0.7677 -0.5588 -0.1175 0.3200 -0.1906 0.2305 -0.2044 0.3753 -0.3399 -2.7119 2.1112 0.2496 1.0644 -0.1178 -0.0113 0.5432 0.6320 0.9957 -0.7041 -0.1982 1.7150 -0.7682 -0.3379 -1.2082 0.7724 -2.3794 0.5463 1.1175 0.4587 2.0275 0.3976 0.0032 -0.0404 1.4995 0.4560 1.9759 0.0502 0.3320 -1.3947 0.1036 0.2378 -1.1336 0.6501 1.2522 -0.0237 -0.4456 1.7073 0.5715 -0.1964 0.6188 0.2213 0.7615 0.0129 -0.1293 -0.4369 -0.8309 1.1031 0.6976 -0.0779 1.2023 1.1568 0.3498 -0.4004 -0.4331 0.2176 -0.0616 1.3472 0.4292 -0.2004 0.0110 1.3254 0.2416 1.1362 0.4739 0.0374 0.7572 -0.0714 0.6290 -0.0700 -1.3102 0.5450 0.2902 -0.6438 -0.8772 0.6784 -0.0951 -0.5031 -0.8124 0.6336 0.8757 0.8125 0.3974 0.5456 -1.1091 -2.5383 1.4346 -0.2992 1.8310 -1.0284 2.3722 -0.6517 0.8931 0.4335 -1.1327 -0.3092 -1.0479 0.8967 0.9039 1.3084 -0.4865 0.4387 0.3328 0.6906 0.0160 0.3812 -1.1411 -2.1969 -0.2022 0.1448 -2.4479 0.8874 -0.6254 0.4894 0.6513 -0.4641 0.6608 -0.4022 0.4029 -2.2878 0.0420 0.9357 1.0181 0.5229 0.6856 0.2735 -0.1591 -0.1442 -0.5196 -2.2333 1.2306 1.3919 -0.8792 -0.1329 -0.9292 0.0777 0.0237 0.0207 0.2269 -0.7157 0.7580 0.7981 0.5097 0.6005 0.1232 0.1662 -0.3774 -2.3350 0.0373 0.1116 0.0877 -1.2603 0.7734 -0.4843 0.6940 0.2275 -0.4732 0.6261 -0.2267 -0.4893 0.2419 -0.1299 0.3726 -2.3437 1.2007 1.1320 0.3490 -0.2582 -0.0517 -0.8935 -0.7965 -0.2073 -2.0736 0.4097 -0.0903 0.8130 -0.9667 -2.3702 -1.5893 -0.8154 -1.0012 -0.7350 0.1795 0.4207 -0.5112 0.0319 0.1710 0.8039 -2.5539 0.3222 -0.2492 0.4190 -0.2838 1.7793 0.3064 0.4166 1.1568 -0.3767 0.5087 0.5917 -1.2990 0.8334 0.9171 0.4568 1.7018 -0.0340 0.7069 -0.2657 0.6925 -0.5732 -0.5888 -0.2256 -2.4469 0.1932 -0.9866 -0.2760 -0.9362 -0.1925 2.4834 -0.7959 -0.0265 0.1809 -0.0169 0.1004 0.4290 0.3490 0.4810 -0.0853 -0.1442 0.3271 0.2349 1.0760 0.9671 0.3406 -0.9459 -0.0925 -0.7319 0.2161 -1.1333 0.0790 -0.2807 -1.1757 -2.1318 1.4929 1.2839 0.3852 0.5505 -0.1012 -2.6479 -0.0475 -0.4553 0.3528 -0.2316 0.1862 0.2139 0.5689 0.3356 -0.1179 0.6775 -1.5026 -2.6811 -0.1088 0.4095 1.6635 -2.8804 0.5870 1.9069 0.5128 -0.4746 -0.0755 -0.8359 -0.5774 -0.7537 -0.3206 0.2091 0.4275 0.4303 -0.0596 -1.2465 -2.5356 0.7020 -0.1574 0.1311 1.4508 -0.1339 -0.0206 0.1896 -0.2936 0.0372 0.5842 -1.5614 -0.1928 0.4302 -2.4851 0.6764 -0.5333 -0.5912 -0.1628 -2.3508 2.1795 -2.2660 -0.5077 -0.0018 0.3894 0.4512 -0.5764 0.5043 -0.6354 1.4254 0.1725 1.2868 1.1130 -0.3111 0.1319 0.0389 -0.1225 -0.1871 -2.2302 0.0561 0.8643 -0.4007 -2.5778 -0.9222 0.9081 -1.1954 2.0454 0.6245 0.2997 0.7467 0.3259 1.4988 0.5535 -2.6577 1.2649 -0.4750 0.1758 0.5759 -0.6068 -2.5787 0.1532 0.6561 -0.3048 1.9283 -2.9337 -0.6782 -1.1241 -2.5992 -0.3880 -1.2088 -0.2820 -0.2370 0.0451 1.3329 0.9388 1.0476 0.3314 0.6559 -0.1658 -1.6790 0.7727 -0.9288 1.0528 0.7532 0.3545 -0.9626 -0.4783 -0.5873 -0.2004 0.1807 1.2472 -2.6672 0.1837 -0.4432 -2.5180 0.3082 1.1513 1.9171 N-linoleoylserine* -0.1757 -0.1593 0.1005 0.9002 0.8644 0.1782 0.1234 0.5350 0.6894 0.3504 0.6607 2.1481 0.5845 -0.7533 -3.3598 -0.8804 0.5401 0.6088 0.0090 0.3067 -1.2639 -1.6602 2.0701 1.2854 -2.9418 -0.6584 1.4103 0.0067 1.1449 0.3334 0.1122 0.4086 -2.3474 -0.1987 0.1130 -3.0189 0.4730 0.4652 -0.3272 1.1899 0.4031 -1.7176 0.2393 0.9824 0.7247 0.0361 -0.7672 0.1926 0.6672 -1.0426 -0.1545 -0.0790 -2.8708 -3.1571 0.7161 0.8475 -0.0823 0.5611 -0.4184 1.3100 1.0203 0.4759 -0.5262 -0.0403 -0.1377 0.7377 0.4212 -3.4597 -0.4956 0.4085 1.2371 0.5154 -0.8513 0.2350 -0.7298 -0.0636 0.2053 0.5202 0.8703 0.0893 -1.0369 1.0118 0.3682 0.9025 -0.5027 0.3895 0.6639 -0.5980 -0.4121 0.5884 0.1177 1.2495 -0.5672 -0.0302 0.0766 0.1983 0.9080 -0.0761 -1.8526 -0.5536 -1.3504 0.3004 0.6498 -0.2897 0.3164 0.2912 0.2993 -0.0165 0.7084 -0.0205 0.9138 -0.3057 -0.2440 0.7237 -0.3419 0.5350 -1.0376 1.3288 -0.4036 0.8032 1.0321 -0.3607 0.4764 0.6072 -1.3990 0.1246 0.5436 -0.0605 0.0562 0.8089 0.3680 -0.6468 0.3543 0.4824 -0.4398 -0.1160 -0.3501 -2.4601 -1.3054 0.6181 0.5613 -0.5293 -0.6833 0.4054 -0.3879 0.4686 0.2272 -3.0923 -0.0360 0.6096 0.4364 1.2591 -0.8641 -3.7509 -0.6644 1.3418 0.6772 0.2051 0.6314 1.5266 0.4857 -0.5718 0.4637 0.7972 0.8272 -0.4541 0.7790 0.1593 0.5474 -0.3786 -0.1430 0.4675 0.4958 0.6169 0.7527 0.8123 0.1028 -1.1326 -0.3613 0.3944 1.2054 -0.6627 -0.1097 -0.8068 -0.2220 -0.3164 0.0041 0.2213 0.0892 -0.4404 1.0651 -0.9334 1.5368 1.4051 -0.0122 1.1245 1.0921 -0.6007 1.0846 0.3107 -0.3595 0.8224 0.6160 -1.0210 -0.1349 1.4709 -3.0969 -0.1238 -0.2806 0.0226 0.1982 -0.3224 -0.0265 -0.5269 0.1995 0.7230 -0.2483 -0.2980 1.7068 -0.3104 1.4798 1.1786 0.0083 0.8172 -0.1859 -0.3146 -0.0874 0.5377 -0.4896 -1.5652 0.6084 0.8711 0.0044 0.2308 -0.9146 -0.2342 -0.0737 -0.4953 0.6879 0.8323 1.8883 -2.1497 0.5371 -0.5990 -0.5326 -0.3312 -0.1741 -3.3736 0.0088 0.6869 0.5503 -0.3100 -0.3917 1.1490 0.6793 -1.3028 -0.0451 -1.0540 0.1797 0.1418 -1.3882 1.0239 -1.1076 -0.4412 0.2404 0.5990 0.7495 0.5306 1.1286 0.8151 0.7123 0.0354 -0.2869 -1.2506 0.4245 -1.1087 1.1452 -3.1528 0.2778 0.7483 0.3532 0.4013 0.4249 -1.0858 -0.8650 0.2820 0.5633 0.5296 -1.6624 -0.3456 -0.7380 1.5886 -0.2754 -1.3043 0.0267 -0.6854 0.6312 -1.2886 -0.3912 1.4642 -0.6477 -0.2958 1.1406 0.1747 0.1672 -0.2853 -0.5449 -0.3031 1.2387 -0.6389 1.6730 -0.2052 -0.3549 0.6282 0.5193 0.4872 -0.6730 -0.3721 -0.3918 0.0782 -3.0441 0.4766 -0.8107 -0.2726 0.6227 0.6815 -1.0113 -0.6502 -3.1688 -0.3501 -0.7353 -0.3359 -3.0557 -0.0231 -0.3460 0.4205 -0.7675 -0.3382 1.4302 0.3076 0.2047 1.2156 -0.1788 -0.0668 1.3052 -1.3882 0.7035 -1.6312 1.0750 -0.3722 0.4276 -2.1136 -0.0323 0.9781 0.5243 1.2276 1.2787 0.7313 1.1449 -0.0856 -0.6961 -0.0754 0.3572 -1.6400 0.8264 -0.9659 -0.0496 -0.1822 0.3135 -0.0228 1.3120 -2.3734 0.8571 1.5523 -0.2105 0.6158 0.8363 -0.1699 0.0056 -0.4191 1.1251 -1.0175 -0.0062 0.2156 0.7858 0.0849 0.0134 0.8431 -0.0611 0.4011 1.0208 0.9041 -2.4128 -0.0938 -3.3957 1.6661 -0.1602 -0.4507 -1.1497 -0.2913 1.2229 0.4791 0.3294 1.5437 0.5477 -0.2593 1.5100 0.1159 0.8173 -1.1168 N-methylhydroxyproline -1.7773 0.0148 -0.1804 0.6402 0.1120 0.8736 -0.8762 -2.0788 -2.0182 0.2766 0.5264 1.5872 -0.0735 0.8950 -0.2809 -0.1845 0.3222 -1.9616 0.2457 0.7492 -0.3749 1.0674 -0.6178 -0.6776 -1.0897 -0.0177 -0.0185 -1.8993 0.9157 1.2330 0.1519 0.7779 0.3068 0.6002 -0.4454 -0.9216 0.2952 -0.2999 0.6445 0.0909 0.6958 0.5379 -0.9982 -0.4080 -0.5091 0.8464 0.0366 -1.9585 0.8728 0.5277 0.9129 -2.1261 -0.2697 -0.4285 -1.7630 0.3074 1.2551 0.5446 0.5910 -0.7514 1.5284 -0.2123 1.3954 1.2427 -0.8324 0.4073 -0.0624 -0.6514 -0.9817 -1.8538 -1.9834 -0.3087 -0.1717 0.6967 -0.5499 -0.3043 0.7128 0.5743 0.2329 0.1645 0.2580 0.6854 -0.5362 0.5704 0.0200 -0.1705 1.5344 0.7766 -2.1145 0.9411 -0.0332 0.2494 0.5123 0.1786 0.0562 0.8956 0.3187 0.1121 -0.5643 0.2028 0.0659 1.7692 0.1463 -0.6607 0.8223 0.1500 -2.0198 0.1855 -0.3705 -0.8266 -0.9347 -0.3478 1.7061 -0.8537 0.9185 0.0980 -0.9443 -1.9329 -2.0522 0.1717 -0.6353 -0.4160 -0.4345 2.0975 1.1992 1.3851 -0.3513 0.1859 -0.6016 0.1417 0.1306 -0.1856 0.5362 0.1669 -0.3065 -0.9137 -1.9531 -0.2661 0.4772 0.0253 0.5330 0.8586 0.1540 -0.0670 -0.0930 0.0044 0.5023 1.2945 1.2219 -0.1887 1.2042 -0.4169 0.3397 -0.3695 1.2081 1.2698 -1.9639 0.2634 -0.3956 0.0581 -0.4367 1.4001 0.5577 -1.9797 0.8264 -0.3672 -0.2456 1.8741 1.4776 0.5218 0.3737 0.4260 1.2853 0.6217 0.6376 -1.7839 0.7352 1.2500 1.1454 -0.1910 0.3073 0.5585 1.3329 0.9386 -0.2514 -2.1485 0.9341 -0.1887 0.3153 0.2544 -0.0257 0.5788 -0.1432 -0.4995 -1.8592 0.8541 0.6769 0.6188 -0.4914 0.1178 0.9663 0.1090 -0.4771 -0.7232 -0.0619 -0.5825 0.4473 -1.5094 -0.2378 -0.9209 -1.9518 0.6899 -0.6137 -0.6553 0.7291 -0.2043 0.4138 0.0245 -0.3102 0.4656 -1.0328 -2.0664 0.3676 0.6712 0.6144 -0.5225 1.7325 -0.5034 0.7520 1.4513 -0.1733 0.5287 1.2730 -2.0607 -2.1258 0.3891 -1.1227 -1.9365 1.7375 -0.0180 0.8971 1.2674 0.2927 0.9556 1.3878 0.0657 -0.0179 0.3679 1.3930 -2.0570 -0.1681 -0.0939 1.3415 -0.4199 -2.0543 0.9010 -2.0461 -1.1460 1.1447 1.2473 -2.0610 -1.8969 1.3298 0.1515 -0.4253 1.5635 -2.0887 1.8364 -1.2194 1.7402 -0.4774 0.5790 -0.3666 -0.0329 1.5218 0.0883 -0.2738 1.5401 -0.3454 -0.4969 0.4526 0.5568 -0.4106 -0.1780 1.8440 0.3110 0.9954 1.2566 1.3783 0.2473 -1.4856 -0.5062 0.6211 0.0027 -1.0544 0.6108 -0.0606 1.9067 2.1337 -2.0943 0.0773 0.5313 0.1126 -0.5317 -2.0052 1.3162 1.1750 0.3150 -1.2310 -0.4201 -1.9664 -0.0539 -0.6038 0.8950 -1.9655 -2.0276 -1.9821 -0.4101 0.3222 0.8357 -1.9998 -2.0984 -0.3135 0.1624 1.7387 -0.0281 1.4176 -0.3572 0.9537 -0.4280 0.2986 0.1533 0.7762 0.0293 1.4327 -0.2277 0.1247 0.0875 1.2573 -0.0356 -2.0014 0.3134 0.2128 0.1462 -0.4682 0.0228 0.3906 -0.3902 0.8808 0.1397 -1.8644 -1.6101 0.1377 0.1492 -2.0784 0.5718 0.1047 0.7030 -0.3536 -0.7718 -2.0940 -0.0287 -1.2251 0.0002 -1.0190 0.6219 -1.1905 -2.1966 -0.6737 -0.6506 -0.6735 -0.0310 -1.9959 -0.0094 0.6255 -0.0146 1.2526 -0.4227 -0.1360 -0.2898 1.1955 0.5161 1.8424 0.4859 -2.2950 1.1650 0.5668 0.6935 0.2845 0.0516 1.1304 -0.0677 0.5506 0.1737 0.6154 0.8187 -0.5584 -0.7993 0.5939 0.1090 1.1224 -0.1436 -1.9708 0.1880 0.2018 -0.0297 0.9977 -0.6715 -0.2224 1.8575 N-methylpipecolate -0.5242 -1.4147 -0.1636 -1.8145 -0.7694 -0.3976 -0.2840 -0.4374 -0.2527 -0.1384 -1.0844 -0.0607 0.3548 2.0651 1.1992 0.9797 1.6242 -1.6401 0.4595 0.0512 -0.0408 0.2329 0.0712 1.2062 2.0947 0.0518 -0.1432 1.6625 0.6111 -0.9588 0.0892 1.0270 -0.8687 -0.4559 -0.0299 -0.8439 -0.3878 0.0408 -0.8922 0.1551 0.1651 1.7243 1.6148 -0.1671 0.3820 -0.1678 -2.2102 -0.3681 0.3770 2.5297 -1.0856 1.5309 2.6322 0.2945 -0.9584 1.8016 1.1852 -1.2173 -0.6790 -0.7211 -0.2324 2.1336 0.9455 -0.3184 -0.3656 -0.9002 -0.5734 -0.3469 1.1080 1.5298 0.5208 0.0962 1.5823 0.5304 -0.6256 -0.9819 -0.7544 1.6706 1.0447 -0.1050 1.0871 -1.3886 0.3473 1.1798 -0.6195 1.8672 -0.2519 -0.5844 0.6651 1.9560 1.9766 1.2810 -0.8795 -1.4965 0.8232 -0.6026 -0.9045 -0.9743 1.1573 1.1949 0.1446 0.4577 0.2719 0.0974 0.3544 0.7801 -0.2145 -0.8937 -0.2601 -0.8386 2.3388 -0.7684 -0.8360 -0.7768 -0.8992 -0.7642 -1.4358 0.4225 -0.2072 -0.1610 0.7287 -0.1607 0.1911 -0.5228 -0.3708 -0.4515 1.3383 0.7975 -1.7072 -0.4357 1.7556 0.2994 0.0240 -0.2040 -0.0538 -0.7403 -0.3203 1.9954 0.2481 1.8097 -0.9507 -0.0952 -0.1282 1.8149 -0.7352 -0.6878 -1.5397 -0.3193 1.2727 -0.3626 1.3285 -1.1929 -1.3291 -0.1399 -1.3950 -0.6500 -0.9816 -0.9513 -0.1878 -1.0518 -0.2279 0.9138 -0.5156 1.9605 -0.9128 1.8018 0.6731 -0.5904 -0.5122 -1.1298 0.1928 0.9379 0.0237 1.6724 -0.6124 -0.9466 -0.9956 0.2991 -0.2190 -1.3842 -0.6465 1.2202 -1.5610 0.3561 -0.1559 -0.4414 -0.8408 0.0733 -1.1953 -0.8053 -0.4853 -0.3688 2.1222 -0.4171 1.1509 -1.0906 0.0497 -0.5136 -0.6101 -0.3864 0.2269 -1.0983 0.0287 -0.2073 -0.8822 0.0500 1.0562 -0.9007 -0.6495 -0.7930 0.6733 -0.1933 1.9962 0.4644 0.3097 -0.2830 0.4327 1.0189 -0.6411 0.1749 -1.0424 -0.1962 -0.0032 -0.8991 0.0468 -0.5394 0.0876 -0.4439 0.3878 -0.3479 -0.1575 -0.4439 -0.4492 2.0186 -0.5775 -0.2487 -1.0134 -0.8166 -1.6666 -0.5684 -0.6514 -1.4582 -0.3089 0.2954 -0.8418 -0.4367 -0.0592 0.5972 0.7945 0.6276 0.1635 -0.7040 -0.0384 0.6516 -0.4593 -0.1014 -0.8298 -1.5173 0.1881 1.1619 0.0606 -1.0097 0.1009 -1.2160 -0.7193 -1.1467 -0.8485 -1.7763 0.1500 -0.7984 -0.1185 -0.1156 -0.4732 0.6347 -0.0600 -0.2319 -0.1709 1.2858 1.3212 -0.4913 -1.1300 1.9751 -0.2481 1.0542 -0.8252 -0.8213 -1.6404 -1.4272 0.6999 1.0995 0.9329 -0.0225 2.1241 0.1821 -0.4294 1.9586 1.2310 -0.5148 0.9988 1.8327 -0.6645 -0.6769 -1.8472 -0.4735 -0.1686 0.6043 -0.4734 0.4992 -0.3565 0.4638 -0.0761 -0.5722 0.1152 -0.5133 1.8879 -0.6243 1.6388 -0.1213 -0.0532 -0.8443 -0.3231 -1.1812 -1.2306 -0.2786 -1.1199 0.0042 0.2085 -0.0288 -1.4383 -0.3059 1.0081 -1.4608 0.7501 -0.3768 -0.9102 0.8215 -0.1410 -0.7164 2.2004 -1.2439 1.3798 -0.7500 0.5099 -0.3882 0.2905 -0.3090 -1.0943 2.2039 2.6658 -0.4545 -1.0830 -0.1357 -0.0837 -0.5176 0.9072 -0.0515 -0.6472 0.7234 1.5866 1.8086 -0.1075 1.6820 -1.0589 2.2087 0.1922 -1.1998 0.4707 -1.0739 -1.1524 2.6383 -0.6376 1.7129 -1.1652 -1.6283 -0.6977 0.4050 2.1751 0.0978 0.3348 0.0578 -0.1423 3.2561 0.4706 0.3051 -0.4721 0.4509 1.2737 -0.4882 0.3984 -0.1148 -0.9799 -0.8765 -1.1158 -0.5290 0.1251 -0.0972 0.0029 -0.8243 -1.3570 -1.0211 0.3866 -0.3196 -1.2837 3.1581 -0.3007 -0.4672 -1.7745 1.0127 0.4133 -0.7375 N-methylproline -0.9313 -0.1675 -0.9587 1.0237 -1.4417 1.8390 -0.3817 -0.7491 -0.2454 0.4871 0.3430 2.3424 -1.0062 0.9127 -0.7924 -0.2330 0.5259 -1.3692 0.3433 0.8083 -0.6455 1.1977 -0.6987 0.1553 -1.5627 -0.5884 -0.3920 -0.3181 1.0727 1.1799 -0.1903 0.5278 -0.1640 1.9332 -0.9775 -1.4126 -0.0226 -1.1343 0.1809 0.0220 0.1210 0.0890 -0.6167 -0.8819 -1.0833 0.9283 -0.0940 -0.9063 0.6351 0.6672 1.0616 -0.6868 -0.5798 -0.8520 -1.1510 0.1879 0.8963 0.7225 0.7472 -1.6279 1.2169 -0.1019 2.2540 1.4799 -0.7760 0.3208 -0.6317 -0.1792 -1.0549 -1.1752 -0.9720 -0.5946 -0.5325 0.2288 -0.8826 -0.7961 0.9058 0.1958 -0.4982 -0.8974 -0.5006 0.8672 -0.2908 0.6065 -0.6732 0.2097 1.7130 0.9954 -0.9317 0.6894 -0.3337 0.0315 0.7205 -0.4306 -0.6856 0.8207 0.0082 -0.2789 -0.5231 -0.2779 -0.5877 1.9533 -0.2371 -0.7253 0.5939 -0.1416 -1.0655 -0.1249 -1.0617 -0.9825 -0.3803 0.2652 2.2964 -1.4072 0.8392 0.9586 -0.6279 -1.2961 -0.1919 -0.0932 0.1118 -0.7900 -0.8323 2.0486 1.1630 1.7402 -1.1568 -0.0256 -0.8072 -0.1603 -0.7192 0.0840 0.3303 -0.5218 -0.1466 -1.1059 -1.4046 -0.6990 0.0374 -1.1538 0.9462 0.7045 0.0919 -0.0399 -1.1072 -0.5100 0.7202 1.0840 1.7525 -0.2872 1.5142 -0.7968 0.3453 -1.0666 0.9442 1.2700 -0.7872 0.3159 -0.3740 -0.4195 -1.0329 2.0127 1.0304 -1.2427 0.8411 -0.2642 -0.2847 2.5246 1.6513 0.0405 0.7398 -0.1972 2.3179 0.3759 0.2546 -0.4140 0.7845 0.8432 0.9180 -0.4780 0.4285 0.4844 2.2040 0.4821 0.1593 -0.8677 1.0911 -0.4571 -0.1853 -0.7351 -0.8709 0.2588 -0.0602 -1.5933 -0.3206 0.6721 0.4128 0.3037 -0.4877 1.1008 0.7279 -0.5951 -0.5700 -0.7064 -1.2749 -0.9163 -0.0177 -1.2588 -0.8933 -1.3185 -0.9950 0.8467 -0.8232 -1.2200 0.7317 -1.0986 0.4128 -0.4392 -0.3583 -0.0394 -0.9920 -0.4572 0.1218 0.5185 0.2952 -0.2473 1.9764 -1.1231 0.7161 1.4000 -0.9484 0.2866 2.1439 -1.2886 -1.1701 -0.0880 -0.9405 -1.0191 2.4337 -0.5881 0.9881 1.1256 0.0779 1.9275 2.5547 0.7542 -0.2218 0.1086 1.8454 -1.3360 0.0200 -0.7299 1.4570 -0.7937 -1.4676 0.1207 -1.0041 -1.1264 1.0496 1.5238 -1.1259 -0.4618 2.0313 -0.5215 -1.3924 2.1835 -0.7235 1.9044 -0.8784 2.4424 -0.9116 0.3328 -1.0080 -1.7069 1.7334 -0.6564 -1.1107 2.4903 -0.6502 -1.7902 -0.1207 0.3252 -0.5652 -0.1425 2.0036 0.5347 1.3258 1.5286 1.8346 -0.0047 -1.5109 -0.6779 0.6759 -0.9392 -0.8133 0.3623 -0.0885 1.6607 1.2881 -0.3314 -0.4032 0.3242 -0.0897 -0.3905 -1.2872 2.3600 1.8307 0.3959 -0.9873 -0.1408 -0.9804 -1.0713 -0.4552 0.5508 -1.3829 -0.2564 -0.7650 -0.7144 -0.2963 0.6836 -0.9261 -1.1321 -0.5722 -0.2199 2.0119 -0.3250 2.2989 -1.2622 0.7828 -0.3275 0.3811 0.3027 -0.1304 0.1431 1.8413 -0.4425 -0.3109 -0.0346 1.1202 -0.7630 -0.6971 -0.1747 -0.3707 -0.1812 -1.4950 -0.8076 1.0150 -0.6632 0.6660 -0.3377 -1.3547 -1.2920 -0.1702 -0.1439 -0.8252 1.9996 -0.1823 0.2217 -1.4292 -0.9234 -0.8039 -0.6484 -1.1107 -0.0032 -0.9724 2.4225 -1.2582 -0.4236 -1.2092 -1.0282 -1.0744 -0.7693 -1.4546 -0.6798 0.4285 -0.9531 1.7359 -0.8260 -0.9865 -0.3421 1.1904 -0.1001 1.8593 0.5091 -1.0363 1.0990 0.5591 0.2438 -0.2620 -0.7635 1.0668 0.0328 -0.1367 0.1494 2.1463 0.1448 -0.3886 -0.4234 0.4983 -0.5236 1.3730 0.2024 -0.9842 -0.2357 -0.1218 -1.1430 1.3032 -0.8218 -0.2632 1.8925 N_N-dimethyl-5-aminovalerate 0.1766 -0.1122 -0.3216 0.2010 0.3342 1.3489 -0.7222 -0.6681 -0.6049 -2.3699 0.0035 1.6661 -0.0029 0.2245 -1.2250 1.6077 0.9848 -0.0346 -0.3762 0.2588 1.1068 -1.0952 -0.2270 1.9588 1.2052 -0.6164 -0.8946 0.1919 0.4913 -0.5933 -0.1972 0.1613 0.7063 1.2716 0.0805 1.8040 -0.6451 0.2426 0.2776 -0.4989 -0.3539 -0.2092 -0.3410 -0.4641 -2.5567 0.1062 -0.5428 2.2408 0.2901 0.4283 -0.3820 0.2245 0.4295 -0.3682 0.5038 0.0974 0.0941 -2.3938 0.1882 -0.3890 0.1323 0.8718 1.1451 -0.0386 -0.2090 -0.0938 0.7287 -0.5335 0.3226 2.1504 -0.2442 -0.7760 -0.0348 -0.0668 -2.7151 -2.5555 0.8251 0.3197 0.5446 0.5816 -0.6624 0.1222 2.4629 0.5336 0.7771 0.5284 0.8134 -0.4328 -0.2664 0.4974 0.2674 -0.2861 0.2660 -0.2221 -2.6658 1.7880 -0.0932 1.6048 0.3229 -0.1298 0.0702 2.2031 -0.2597 -2.9451 0.1982 0.3357 -0.1571 -2.7581 0.6620 0.2562 0.3145 -0.3108 1.0426 -2.7169 0.5624 -0.2287 -2.5336 0.1150 -0.5422 -0.1640 -0.5252 -2.6597 -0.4016 2.2488 -2.9437 0.7863 0.2967 -0.3249 0.3727 -0.2857 0.3112 -1.1072 -0.1187 -0.4862 1.5626 -0.2319 -0.0896 0.4960 1.1140 0.0960 0.0277 -0.5513 0.1538 0.1312 -0.2731 1.4962 -0.0437 0.7253 0.0724 -1.0758 0.5750 0.8809 -0.6270 -0.0771 -0.0743 0.5154 -0.5650 -0.1394 -0.7311 -0.4425 -0.4928 0.5996 0.0405 -0.2207 1.4172 -0.0018 0.0709 1.7955 1.0206 -0.5492 -0.6528 0.2756 1.2261 0.2285 0.4193 -0.4759 -0.1485 0.0881 -0.9684 -0.8508 0.4570 0.1818 1.5649 -0.2261 0.9536 0.7387 -0.0933 0.2462 0.5008 -0.3690 1.8708 0.2756 -0.6285 0.0992 0.0681 -0.2078 -0.0088 0.4395 -0.0257 0.7216 0.9473 0.1047 0.0500 -0.9791 -0.5649 0.2674 -0.3417 -2.0424 -1.0063 0.8872 -0.4260 0.3056 0.2116 0.3986 1.1950 -0.2319 -2.9706 -0.1109 0.2314 0.0088 -0.0937 -0.5970 -2.5366 -0.6902 -0.2046 -0.7680 1.0527 -0.3825 -0.4887 0.1094 0.2415 0.7196 0.2105 -0.1100 -0.3687 -0.0905 -0.3913 0.1214 1.1474 -0.7493 0.4226 0.6782 -0.5690 0.0510 1.6131 -0.8979 -0.4228 0.2952 0.6268 0.6222 -0.1905 -0.8206 0.2935 -0.1717 -0.5594 0.0467 -0.9274 -0.2534 1.7034 0.4948 -2.8350 1.0909 1.2161 -0.6130 -0.4148 1.3501 -0.1422 1.2953 -0.1942 2.0990 -0.5248 -0.4057 -0.0815 0.0014 0.6702 -0.1321 -0.2897 1.7987 0.3929 -2.5119 -0.6995 0.7637 -0.9966 0.6339 1.4872 0.1695 0.2573 0.3172 0.9866 0.6359 -0.0970 -0.6726 0.5633 -2.9404 -0.1353 0.1956 0.7487 0.3854 1.7913 -0.2913 -0.1662 0.3370 1.4571 0.7637 -0.0207 2.0780 0.6562 0.2722 -0.6027 -0.1340 -0.4158 -0.0723 0.0024 -0.1008 -0.2276 -0.4608 0.5834 0.2103 0.3963 -0.6143 -0.2281 0.8273 -0.3627 -0.1473 1.9790 -0.6445 2.1931 -0.1447 -2.8202 1.4869 0.4954 0.1228 0.9031 0.4203 1.4541 -0.4527 -0.5118 -0.3394 1.0009 -0.2325 0.5910 -0.8575 -2.9361 -0.3427 0.5703 -0.1116 1.1005 0.1109 0.2706 -0.7047 -0.6416 -0.0999 -0.6800 -0.4354 -0.2312 1.5487 -2.9821 0.4972 0.0782 0.1060 0.4307 0.5103 -0.0236 1.0976 -0.0907 2.0488 -0.3134 -0.5946 0.0179 0.0014 -2.6450 0.1052 -2.7366 -0.4847 -0.4271 -2.5860 1.3172 -0.4794 -1.0878 0.6890 0.1615 0.9424 1.3807 0.0806 -0.8882 -0.4070 -0.1438 0.1165 -0.0812 -0.1555 -0.1079 0.1988 -0.0296 -2.8610 1.1231 0.1265 0.4041 -0.0104 -0.5674 -2.8859 0.7570 0.3698 -0.5791 0.4601 -0.1138 -3.1389 -0.0693 -0.5803 -0.0086 1.1021 N_N-dimethylalanine -0.9127 -1.2986 -1.1105 1.7120 0.4923 1.7690 -1.1740 0.2226 -1.0888 -0.9048 -1.0763 -1.1844 1.4176 0.7074 0.6298 -1.0582 -1.1785 1.0086 0.1524 0.3346 -0.9259 1.3850 0.9044 0.4835 0.0360 0.6986 0.2087 0.5751 1.1409 0.7951 -1.1346 0.0268 -0.7919 1.0306 -1.2451 -1.0618 -1.0245 -0.1381 0.5474 0.4651 -0.9013 0.4844 0.5132 -1.1599 1.2813 -0.6121 -0.2320 -0.9756 -1.0399 0.7380 0.7250 -1.2615 0.9556 0.6239 -0.8914 0.2948 1.2119 0.6642 -0.3000 -1.1570 -0.9293 1.1658 1.5445 1.2260 2.2580 1.2875 1.1167 -1.1793 -1.1125 -0.9367 1.3643 -1.0877 0.2780 -0.5626 0.7362 1.6011 1.8312 1.7463 -0.9322 -0.1597 -1.0074 0.4494 0.3922 0.5689 -1.0395 0.7057 -0.9716 -1.0140 0.5166 1.2372 0.9213 -1.0057 -1.0293 0.6026 1.5678 -1.0109 -1.0600 -1.0551 0.3694 -1.0859 -1.1549 -1.1781 -0.9132 -0.1427 1.1379 1.8537 -1.1160 0.6385 0.2421 -0.9744 0.5573 -1.1072 -0.9454 -0.0986 -0.2279 0.4084 -0.9097 0.6351 0.2420 1.2041 0.8921 0.1611 0.3210 1.0896 0.6608 1.2302 0.7495 -1.0912 0.5683 -1.1726 0.3307 -1.0328 -0.9071 -1.1171 -1.0931 -1.1346 0.5849 -0.8868 -1.0654 0.0417 1.0986 -1.0772 1.3974 1.1719 0.0334 -0.6079 0.8015 0.6303 -1.0107 -0.9269 -0.9291 -0.9478 1.3668 1.2839 -0.3630 -0.4518 0.3103 -0.9183 0.1932 -0.7413 0.2565 2.0007 0.7895 1.6054 0.8890 0.6116 2.2103 -1.0954 0.6567 0.0962 -1.1376 -1.0729 1.2041 -0.9755 0.6163 1.0900 0.9589 -0.9875 -0.2904 -0.8764 -0.9805 0.0895 1.4442 0.5168 0.0101 -1.1974 1.1334 0.7717 -0.9530 -0.9818 -1.1642 0.1547 0.8340 -1.0040 -0.9271 -1.1442 -1.0310 1.5574 -1.0403 0.6797 0.7601 0.2152 -0.9615 1.5522 -1.0316 0.4999 -1.0729 -0.6486 -1.0587 -0.9749 0.2447 -1.0285 -1.1704 1.1249 0.9963 1.0750 -1.2564 -1.1778 0.6083 -1.1640 -0.2369 0.5736 1.2864 -1.1928 0.4137 0.5338 1.3071 1.2813 1.4297 1.1602 -1.0964 0.3407 1.2230 -1.0855 1.2025 0.6959 -1.0919 0.3101 -1.1198 -1.0036 0.8255 0.6480 -1.0741 1.8129 1.2236 -0.6743 -1.1015 -1.1865 1.8747 -1.1402 -1.1113 -1.1663 0.8623 1.0314 -1.0914 -1.0175 0.7123 -1.1027 0.6238 0.8913 0.5544 -0.9547 1.0618 -1.2076 -1.1170 1.5800 0.1663 1.0182 -1.0657 1.3273 -1.1580 -1.0044 -1.1962 0.2705 -1.1064 0.9438 -1.0734 1.6188 0.0044 0.5482 0.5971 0.7123 -1.1625 -1.0930 1.6844 0.5554 0.8831 -1.0392 0.7401 0.5327 -0.2196 0.4496 1.0926 -0.2725 -1.0572 0.7466 -1.1515 1.3053 0.5965 -1.1647 -1.1056 -1.1191 -1.0269 0.5208 -1.0450 1.3524 1.1874 -0.8967 -1.2201 -1.2054 -1.0433 0.9037 1.9047 -0.8481 -1.2661 0.6883 -0.2696 0.8687 -1.0227 0.9361 -1.0288 -1.1838 1.7098 0.8907 1.5027 0.8847 -1.0573 -1.1010 0.9275 -0.0060 1.4808 0.7797 0.4951 0.8764 1.2281 1.0049 -0.2261 0.3578 -1.1605 -1.0452 -1.0566 0.3694 0.3996 -1.1911 0.2965 1.0038 -0.9740 1.0121 1.1497 0.5380 0.9560 -0.6765 -1.1497 -0.3667 -1.1631 1.7961 -1.2680 -1.1030 -1.3377 -0.4564 -1.1895 -1.1757 1.1611 0.8563 -1.1444 1.2192 0.4241 -1.2033 -1.2432 0.5339 -1.0008 1.3172 1.1422 0.3148 0.4552 -1.1594 0.7345 -1.2592 0.8042 -0.3466 -0.2259 0.3666 -1.2701 -1.2627 0.2267 0.0446 0.5698 -1.1382 0.8696 1.0691 -0.9546 1.9822 0.8480 -1.0896 1.1741 0.3947 -1.2839 -1.0956 0.6209 0.9985 -1.3098 1.3170 -1.0761 0.2432 0.7185 -1.3069 0.6841 -1.1176 -1.1404 -1.3604 N_N_N-trimethyl-5-aminovalerate 1.0885 -0.1099 -0.2759 -0.3633 0.3730 0.4220 1.0180 -0.2961 -0.3106 -0.4194 0.9735 -0.8957 0.1197 -0.1678 1.0279 1.3930 -0.3010 -0.7037 0.2083 -0.7198 1.0475 -1.2362 -0.9326 -0.3629 -0.4456 0.0420 -1.8624 0.0389 0.2581 -0.8877 -0.1987 0.3626 0.3651 -0.0031 -1.0892 0.6232 0.1374 0.1081 -1.2866 1.1520 -0.4763 -1.1565 -0.3111 -0.1841 2.7887 0.1593 0.3979 0.5868 -1.3514 -0.1585 -0.4782 0.2146 -0.2764 -0.5931 0.2918 -0.8633 -0.4491 0.3398 0.6389 -0.8592 -1.0245 0.2157 0.1315 0.5041 0.8058 0.1046 1.0459 0.6359 0.4773 0.6512 0.1288 -0.8223 0.1260 1.4726 -1.9005 -0.5401 0.8016 1.6286 0.0011 0.9410 0.7920 0.6158 1.4610 -0.8553 -1.6199 -0.3337 -0.9666 -0.3822 -0.2350 -0.5492 -0.1545 -1.3841 -0.4385 -0.0453 0.8804 -0.3197 0.8542 -0.9939 -0.8125 -3.7952 -0.0355 0.3349 1.2991 0.2330 -0.4067 0.3094 0.1916 0.9231 -0.0498 0.2770 0.3421 1.3421 0.8136 -0.1407 -0.6220 -1.2483 0.8555 0.5221 -0.0013 -0.7754 0.9957 -0.3249 1.2826 -0.4329 -1.2621 -1.4263 -0.9263 1.1130 0.6195 -1.4434 0.6108 -1.4053 -1.7524 0.1432 -0.3747 0.6042 -0.3201 -0.5904 -0.5178 -0.9755 0.4894 0.7872 0.3859 -0.8655 -0.5965 -0.2466 -1.4072 -0.1660 -1.1104 -0.5127 -0.6537 -0.8455 -0.6250 -0.5801 -1.2354 -0.9139 0.8928 0.5426 -0.0477 -0.7108 1.3418 -0.7394 0.6413 0.5973 -0.9969 -0.2835 1.4658 -1.8029 0.4196 -0.7726 0.4544 0.4202 0.6332 -1.6470 0.1421 1.2859 -0.7523 0.4356 0.3027 -0.1488 0.6862 0.2632 -0.1484 -1.1923 0.1433 -0.0975 1.0208 -1.1201 0.0628 -0.3190 -0.9122 -0.0303 -1.7341 0.3604 1.2926 -0.6409 1.3282 0.1248 0.3734 -0.1051 -0.1549 1.0219 0.2894 0.9086 1.1260 0.3650 -0.4246 2.1227 -0.0109 0.4113 0.2284 -0.5741 0.0187 0.3827 0.0864 0.0325 -1.1231 -0.7042 -0.8095 0.5343 -0.3261 0.1997 -0.6237 0.9855 -0.4037 0.3868 -1.9019 -0.4591 0.7906 0.1859 0.9790 -0.5088 -6.2718 -0.8946 0.5917 0.1194 -1.3051 0.1181 -0.1729 1.2926 -0.1111 0.6131 1.4333 4.2425 -0.5705 0.6729 1.5077 1.6437 -0.1241 -0.3526 -0.1556 -2.7576 1.3832 0.5391 0.6287 -0.3815 0.9186 -0.7248 -0.5210 -1.6432 -0.5377 -0.6472 -0.5728 -0.7632 -0.3522 -0.9451 1.3036 -0.1370 1.0265 -0.2680 0.2706 0.2868 -1.3868 1.5519 -0.5148 0.6758 1.6671 -0.2951 -0.1457 -1.3101 0.0740 -0.4026 -0.0138 0.4287 0.4741 -0.3443 0.7790 0.0676 0.7352 0.6152 0.5057 -1.3499 0.2563 0.8269 0.6355 0.9743 -0.1934 -0.5665 0.7563 -0.2655 3.7159 1.4344 0.0837 -0.8170 -0.7834 1.1353 0.0237 -1.1848 0.8636 0.4678 -0.0452 -0.6630 1.1430 0.5976 0.4468 -0.6657 -0.5538 0.8117 0.7339 -0.9290 0.3162 -1.6475 1.1426 -1.5145 -0.1839 1.4062 0.0609 -0.8108 -0.1584 0.0143 0.0696 0.0914 0.5964 -0.2704 -0.8160 1.6079 1.4418 -1.1473 -2.2520 -0.1733 -0.1314 0.1851 1.6205 -2.1208 -0.6539 0.8826 -0.2283 0.8595 -0.6384 0.1671 -0.1526 0.9924 1.5472 0.4651 1.5937 0.4691 -1.7120 -0.6370 -1.7313 -0.4369 0.0475 -0.7961 0.4324 -2.8564 0.4793 -0.6695 -1.0173 -0.8146 -0.7088 -0.3768 0.6445 0.7827 -0.5751 1.3198 -0.1254 3.0902 0.0692 0.8601 -0.4277 1.0785 -0.0054 1.4023 0.9042 0.6837 0.2790 1.1191 -0.8886 -0.6873 0.6463 0.1475 -1.6989 0.2655 1.5154 3.1361 -1.5328 0.2620 -0.3111 0.4434 -0.9486 0.6788 -1.2449 0.9350 -1.0845 0.7281 0.2742 0.5219 -0.8712 1.4482 -1.6074 1.5093 N_N_N-trimethyl-alanylproline betaine (TMAP) 1.6513 -0.1185 1.1558 0.1532 0.4152 0.4993 0.1359 0.7113 -0.2310 2.0492 0.4039 -0.6602 0.9425 1.1593 -0.8254 1.7088 0.3726 0.8888 0.5038 0.0476 1.0947 1.0648 -0.3323 0.7548 0.5470 1.0449 1.1273 -0.1590 0.9170 0.3051 0.4088 0.8213 -0.2287 1.0292 -0.4941 1.0376 1.2284 2.3404 0.6670 -0.4272 0.5382 0.3050 -0.4739 0.0120 0.9500 0.0524 0.0746 0.4182 0.8001 0.0144 0.2436 0.5252 0.6192 1.3276 0.4979 0.8268 1.8686 0.1212 0.8045 -0.9230 -0.5560 0.3444 0.9715 -0.1727 -2.0015 -0.3090 -0.6845 -1.0691 0.5739 1.0644 -0.1773 0.6847 -0.1835 -0.8467 -0.2163 -0.0779 1.4573 0.4738 -2.3158 -0.4113 -0.4465 0.0435 -0.6436 -0.7704 -1.4017 -1.2840 0.5098 1.2958 -0.8085 -1.2632 0.3003 0.6887 0.9999 1.4071 -0.1191 1.1656 -0.3723 -0.1776 -0.4751 1.2049 0.5305 0.2403 0.8642 0.0923 0.1061 -1.8585 0.1404 1.1364 1.6558 1.0844 -0.2809 1.1617 -0.1241 -0.3424 0.0068 -0.5464 -0.6410 -0.0139 0.2520 0.1905 -0.0868 -0.1780 2.1473 -0.3068 0.2390 -1.5027 -0.4210 -0.4794 0.7036 -0.5326 -0.5103 -0.1785 -0.6024 -1.0309 -0.4351 -0.9384 -0.0224 -0.4708 0.6486 -0.1171 0.1594 0.4891 -0.0917 0.2040 -0.4733 0.4082 0.2575 0.7299 -0.8539 1.0465 0.3328 1.0232 0.8436 1.7158 0.1618 -0.5078 0.9532 0.1076 0.1758 -0.8717 0.0860 0.7524 0.7654 -0.3176 -0.9279 -0.0430 -1.4279 -0.2341 -1.6451 1.2072 0.8707 1.2617 -0.8304 0.2648 0.0105 0.0460 -1.5404 -0.3227 0.1009 0.9826 0.4729 -0.8087 -0.0377 0.6180 0.8125 0.4620 1.2775 0.1287 -0.1561 -0.3069 0.3709 -0.1926 0.2605 0.4656 0.3012 -0.9675 0.1364 -4.6950 0.0168 -0.1966 1.2986 1.9806 0.5637 -0.2976 0.3537 -0.8660 0.1831 -0.0131 -0.7457 0.9560 1.2550 -0.3983 0.4770 -0.8447 -0.8245 -0.1745 -0.4492 -0.2127 -0.4431 -1.3529 -0.8995 -1.0979 -0.4980 0.1957 -0.3372 0.3017 -1.6942 -1.6555 0.3434 -0.5623 -0.4821 -0.7191 -1.2633 -0.0915 -1.7902 -0.3302 -0.7724 1.3050 -0.1512 0.3503 0.5187 -0.5681 0.3151 1.0106 -1.2102 -0.4082 0.0042 0.3759 -0.2140 -0.9506 -1.2487 -0.8982 -0.1626 -0.2797 1.0574 -0.5457 -0.1922 -0.9838 -0.5525 0.3373 0.4451 -0.1164 0.4756 1.1327 -0.3474 0.7298 0.1814 -0.9653 -1.1200 1.6678 -0.3664 0.2425 -0.9285 0.1826 -2.9472 -0.6533 -0.3343 -0.2304 -0.4060 1.4299 0.6052 0.5223 -1.1623 -5.4477 1.8968 -0.2327 0.1033 -0.4089 -1.6835 -0.3044 0.2970 0.0979 -0.2894 -0.5716 -1.4859 -0.0650 -0.9675 0.8829 4.9303 -1.8248 -1.6113 -0.5813 1.4651 0.6462 -0.7394 -0.0339 -1.2736 1.4160 -0.3298 -0.5458 -0.0386 -0.1338 -2.3102 -0.2459 1.1728 -1.1090 -1.6028 -1.1309 -0.2294 0.3202 0.6371 0.1067 1.4539 -0.1358 0.8271 -0.3095 -1.0271 -0.6449 -1.3053 -1.0860 0.6460 0.2172 1.4122 0.8847 0.0737 -0.3973 -1.3383 0.8801 0.8038 -2.0334 -1.0247 0.8759 -1.0475 -0.9731 -1.9747 0.7233 -0.4568 1.1269 0.9778 -0.1253 0.6008 1.4236 -0.4882 -0.1776 0.6261 -1.2503 -0.6557 0.6513 -0.8728 -0.5227 0.0532 -0.5859 -1.4563 0.2411 1.2493 0.2285 -1.7458 -0.3479 -1.2138 -0.4786 -0.6603 1.4145 -0.7930 -0.4787 0.4730 1.4533 -0.5031 0.1703 -0.3350 2.3072 -0.6030 1.0655 -0.0263 1.1648 0.4946 0.3983 -0.4146 -1.7495 -0.3643 0.6657 -0.5732 2.9438 1.4948 1.5740 -1.0942 -1.4140 -0.3111 -1.2591 0.1376 1.0347 0.3455 1.1748 0.5313 1.8019 -1.0901 0.4788 -2.8651 -0.7518 -0.3733 -1.7059 N-oleoylserine 0.5318 -1.1262 0.4596 0.9758 0.4407 0.4034 0.1879 0.3343 1.4614 1.0110 0.4191 1.7172 0.2169 -0.1347 -1.6990 -0.2392 0.9259 0.8363 0.4111 0.1605 -0.4276 -1.5332 1.5638 0.5967 -0.5365 0.1417 1.2030 -0.3358 1.3395 0.3623 0.3648 0.5919 -0.8118 -0.2819 -0.1002 -1.2144 0.2581 0.3315 -0.0747 0.9183 1.6065 -0.5056 0.3101 0.2395 0.9024 0.1554 -1.3511 -0.3463 -0.0487 0.1170 -0.1477 0.0567 -4.0850 -0.1243 0.8575 1.5622 -0.2780 1.1304 0.2058 0.2981 0.8055 -0.0029 -0.2328 -4.0320 -0.7072 -0.2927 0.8707 -1.1512 -1.1033 -0.3945 1.5634 0.3290 0.5697 0.2645 -0.1894 -0.1734 0.1438 0.5862 0.6035 -0.4164 -0.7249 0.3366 -0.0135 0.2099 -0.3588 0.8204 0.7984 -0.2933 -0.1356 0.0027 -0.0046 0.3973 -0.3857 0.4240 0.1207 -0.1490 0.4753 0.3061 -4.1089 0.2258 -0.6313 0.4180 0.9947 -1.2475 0.7063 0.7100 0.3397 -0.2093 -0.3668 -0.4305 0.0908 -0.2429 -3.9140 0.3786 -0.4757 0.8022 -0.5252 0.3701 -0.8555 0.2709 0.7837 -0.8790 0.2490 1.1054 -1.4658 -0.2668 0.3514 0.6827 -0.3531 0.2845 0.9872 -0.5799 0.4491 -0.4748 0.5435 -0.5556 -0.3468 -3.5802 -0.3997 -0.0983 0.7376 0.3698 -0.0951 0.7390 0.5105 -0.1669 -0.0855 0.4607 -4.0398 0.4777 0.0428 0.5385 -0.5530 -1.3146 -0.9153 1.2315 0.1717 0.5280 0.7748 1.0214 1.0911 -1.0892 -0.0325 0.7561 0.3793 -0.1745 0.6699 -0.7270 0.5886 -0.0341 0.2497 0.7293 -0.0348 1.3485 0.7722 0.6102 0.1307 -0.5065 -0.2530 -0.2754 0.7708 0.3022 -0.3780 0.0268 -0.1665 -0.9025 0.3748 0.0641 0.0408 -4.0366 0.0352 -0.8598 1.4601 2.0248 0.9906 0.5245 0.6878 0.0382 0.2102 0.5748 0.1638 0.7485 0.2623 -0.4798 0.8389 0.7495 -1.3262 0.7589 0.0298 -0.2974 0.0687 -0.7138 -4.7638 -4.3997 0.1982 0.2406 -0.8799 0.5873 1.1322 -0.0764 1.2719 0.5630 -0.3980 0.5549 0.3476 -0.6855 0.6939 0.4524 -0.4987 0.0978 1.1747 0.7705 0.4716 -0.2444 -1.1153 -0.4161 0.0378 -0.0652 0.5589 0.5957 1.1770 -1.0617 0.2169 -0.3030 0.0256 -0.5007 0.4919 -1.2963 -0.3286 -0.3150 -0.0148 0.2977 -0.3673 1.5539 0.4127 -0.6614 -0.3915 -0.2420 0.2833 0.4239 0.0769 1.1341 -0.4788 -0.4783 0.3648 0.0047 0.5339 -0.3416 0.6004 1.3352 0.2379 0.4699 -0.5942 -0.6259 -0.7231 -0.2297 0.8998 -0.2764 0.0592 1.1718 0.1704 1.0077 -0.2044 -0.7098 -1.5295 -0.5325 0.5303 0.6353 -1.1898 -0.1324 -0.9164 1.0353 -0.1941 -0.8310 -0.3029 -0.1829 0.9227 -0.5890 -0.2512 1.6143 -0.2675 -0.4147 1.1765 1.3547 0.4701 -0.8177 -1.2689 -0.8827 0.6136 -0.4670 1.1005 -0.6099 -0.7823 0.6600 -0.5735 0.3792 0.3907 -0.0858 0.0974 0.1230 -4.3265 0.7233 -0.3643 -0.6402 0.1617 0.5703 -0.5799 -4.3361 -0.4865 -0.5066 -0.0267 -0.6792 0.0838 0.7811 -0.2344 -0.0049 -0.3096 0.1904 1.3476 -0.1056 0.3085 1.4524 0.1512 0.1953 0.1527 -0.1931 0.1618 -1.0526 -0.2069 -0.2290 0.0443 -2.5965 -0.1935 0.5727 -0.3489 0.9346 1.0080 0.5298 0.6339 0.2542 -0.2210 0.2310 0.5985 -1.0968 0.4475 -0.4709 0.0102 -4.8933 0.5768 0.1945 1.1775 -1.3202 0.6153 1.1634 0.1905 -0.4006 0.0903 -0.1790 -0.0447 -0.7972 1.0007 -1.0826 0.0941 0.6617 0.0206 0.4104 0.2050 1.2614 -0.0490 0.6897 1.4368 1.0321 -1.0633 0.4662 -0.9120 1.3092 0.1011 -0.1977 -0.8673 -0.3661 1.6503 1.0327 0.6298 0.2237 0.6577 -0.3595 1.0460 -0.2502 0.4574 -0.2640 N-oleoyltaurine 1.5000 -1.4910 2.4047 0.7440 -0.2172 1.2939 0.3804 -1.1168 0.6206 1.6793 1.7427 -1.1292 1.0498 0.4879 -1.2301 -1.0249 1.6616 1.3448 -0.8323 1.2971 -0.6497 -1.5032 -0.3801 -0.8612 0.4400 -0.8600 0.7155 0.7689 -0.6450 1.2118 -0.0256 -0.6653 -0.3209 0.5245 0.6536 -0.9221 -0.8215 1.0261 0.7305 -1.1855 -0.5171 -0.2174 0.4817 -1.1913 0.9705 1.0839 -0.8977 0.5523 -0.8640 -0.8492 -0.8585 1.3665 -0.7879 1.1640 -0.4401 1.4275 -0.9153 1.2523 1.1195 1.4239 -0.6653 -1.1490 -0.6005 -0.7494 -0.8436 -1.2079 1.1328 0.2286 -1.1575 -0.6348 1.2890 -1.0874 0.9903 -1.1920 0.9829 -1.1457 -0.6673 -0.8798 -0.6472 0.6911 0.4562 -0.7958 -0.8928 1.4850 -0.7533 0.4206 -0.6709 2.0164 0.7721 -0.4698 -0.2052 -0.7974 -0.8111 -0.3992 -0.8396 -0.7812 0.6359 -0.8279 -0.7904 1.0804 -0.2474 -1.3305 -0.6850 0.2836 -0.7439 -0.7664 1.0733 0.7349 1.4061 -0.7361 0.2222 0.5411 -0.6537 2.2005 1.2821 0.0712 -0.6284 -0.8043 -1.0596 -1.2653 0.8034 1.4527 -0.9560 -1.0135 -1.2465 0.3104 -1.1124 -0.9823 -1.0406 0.9086 0.4106 0.8383 -0.4768 -1.1108 -0.9806 -1.1287 0.8344 0.4550 1.4401 -0.2257 2.1503 -0.9984 1.2618 1.2094 0.7542 0.7146 -0.8830 1.3451 0.5658 0.3627 0.7318 1.2060 -0.7468 0.9412 -0.9742 -0.6449 -0.8709 -0.6206 -1.0826 -0.2758 -0.8470 0.9460 -0.6672 1.8445 -0.8038 -1.1813 -1.1143 -1.0510 0.8189 1.2859 0.8332 -0.9361 -1.3557 -0.6013 0.8283 1.2320 1.1380 -0.6209 1.0777 -0.5659 -0.8100 0.5891 -0.9897 -0.9649 -0.6411 0.4367 1.0069 -0.7996 -0.6112 -0.7444 -1.3292 -0.6502 -0.7632 0.6328 1.4491 1.8547 -0.8051 0.1074 1.1796 -0.4881 -1.1140 0.7387 -0.6978 -0.8462 -0.2534 -0.4596 -0.9935 0.1032 -0.8768 -0.8793 -0.8449 1.8202 -1.2753 -1.0103 0.5269 0.5032 0.9210 0.5184 0.6746 -1.1585 1.7266 -1.0904 -0.6398 -0.0027 -1.4213 -1.2996 0.7459 1.2287 -1.0749 0.2481 0.4251 -0.7088 1.3664 -1.0785 0.3830 -1.2397 -1.0074 -0.8116 0.3548 -0.7593 0.7789 1.7895 -0.9746 -1.3891 0.5950 -0.9390 -1.0045 -0.1536 0.3375 1.0627 1.1438 1.6096 0.0104 -0.9957 1.2082 -0.8496 -1.0469 0.4225 1.1566 0.5917 0.9275 -0.7275 0.6309 0.9671 0.9332 -0.4762 -1.1383 0.1338 -0.8665 -1.1103 1.1408 -0.8166 -1.1881 0.8120 -1.0932 -1.0410 2.1372 -1.0438 -1.2023 0.7735 0.2039 -1.2053 0.0845 0.4304 1.1790 -0.8942 0.5657 0.2932 -1.1833 -1.3287 0.9539 0.3702 -1.0815 0.9791 -0.9075 -1.4637 -1.0961 0.2096 -1.3308 0.8692 -0.9241 0.5681 0.4129 1.5117 -0.9595 -1.3173 -1.1169 1.3988 0.8593 0.4329 1.7127 1.1592 -1.0574 1.0151 1.0408 -1.0070 0.0742 -0.9833 -0.8463 1.0992 0.1697 2.1053 0.5036 1.7892 -1.0610 1.2369 0.6769 0.9126 0.3777 0.4537 -0.8107 -0.8227 -0.9525 -0.6910 -0.0815 -1.3792 0.4755 1.4087 -1.2712 -0.2425 0.6401 1.2809 0.2842 0.1353 0.6945 -0.8655 -0.7384 -1.1955 1.2071 -1.2640 0.9043 -0.1131 0.9793 1.5250 1.5194 -1.3688 1.3140 0.3981 0.5656 -0.2040 -1.1492 -1.0979 0.8339 0.2297 2.0771 0.0653 -1.2847 -1.3696 -1.3050 0.3738 0.4093 -1.1275 1.2567 1.8123 0.4019 -0.7335 -1.5843 0.2061 0.1337 -1.1534 1.8780 -1.4657 -1.5007 0.9798 0.4615 -1.5538 -1.5426 1.2465 0.4937 1.2273 -0.6685 -0.9430 0.9370 -1.1169 -1.2589 1.4459 -0.0659 -1.1015 -0.1226 0.0317 1.0700 1.2504 -0.8852 1.1307 1.2331 1.1404 1.4943 0.4093 0.7749 0.6038 nonadecanoate (19:0) -0.7120 -0.5210 1.0983 1.5142 1.8768 1.5597 0.2691 0.3141 -0.2477 0.6866 1.5119 0.3725 1.2506 -1.5952 -1.5968 -0.7462 -0.3588 0.8227 -1.1105 0.3305 -0.1192 -0.9892 0.9424 -0.0839 0.3931 -0.0652 0.0770 1.2552 -0.5760 -0.3894 -1.1026 -0.9411 0.4491 3.6315 1.5028 0.8544 -1.2071 -0.5859 -0.6105 -0.8784 0.1840 -0.4335 0.0232 0.1794 2.2197 0.6612 -1.0232 -1.0708 -0.3915 -0.4719 -0.7956 -0.5943 -1.0106 0.3678 0.3989 0.0966 -1.5100 2.6216 -0.3260 2.0704 -0.2863 -0.1093 -0.3575 -0.5116 -0.2617 0.3429 -1.0445 0.5327 0.4697 -1.1267 1.0345 -1.5595 -0.2247 -1.9237 0.4594 0.9578 -0.8305 -1.1953 1.3245 -1.3499 0.7425 0.2723 -0.1674 0.8090 0.8134 -1.1924 -0.4020 1.0054 -1.3898 -0.8837 0.0019 0.6198 -1.4906 0.3621 -0.2001 -1.1054 1.0342 0.4337 -0.9959 1.6254 -0.4646 -0.0436 -0.5002 -0.7451 0.0342 -1.2118 0.5110 0.5709 -0.4161 -1.3028 -0.8814 -2.2563 0.0692 2.0335 1.2284 0.2456 0.5949 0.4487 0.3197 1.3532 0.1488 0.8945 -0.4356 1.8265 0.4532 0.6086 0.6930 0.1283 0.0347 2.8667 0.4945 0.6835 0.8269 -1.0501 0.2732 0.4109 0.3076 -0.4137 1.2647 0.1366 2.9852 -0.2961 0.8093 -0.6111 0.8720 -1.1066 0.8590 0.2430 -0.1211 0.5827 0.1917 -0.3551 0.4452 -1.1418 0.5297 -0.9813 1.0845 -0.0827 -1.4301 1.0338 -1.4004 -0.1776 -0.3782 0.7683 -0.2151 1.0230 -0.6018 -0.7771 0.4515 -0.3338 0.8419 0.3328 0.0169 -0.7135 0.2649 0.4602 0.9446 -1.5186 0.0139 -0.6560 -0.0959 -0.0109 -0.4931 -0.6224 -0.4270 0.0906 -1.9126 1.5142 -0.9064 -0.9356 0.1251 1.0095 0.6691 1.1840 0.1828 0.3329 1.0116 0.1070 1.0587 1.5125 -0.8831 -0.6538 -0.0985 -1.0121 0.6765 2.0092 0.7887 -0.0181 -0.2159 -1.2062 -0.7956 -1.2831 -0.0442 -0.4274 0.5129 -0.2915 0.2329 -0.0646 1.4206 -0.0823 0.7301 1.6292 0.3787 -0.0052 -0.6433 1.0191 0.0605 0.3363 -0.2439 0.9652 0.5701 -1.0364 0.1985 -0.5605 0.3386 -1.5638 -0.8437 0.7080 0.4800 0.2250 0.2474 -0.1782 0.0708 0.3814 -0.4249 -0.2856 0.3689 -1.4937 0.1301 0.7694 1.1086 1.4466 -1.5701 1.8871 0.4129 -2.6509 -1.3024 0.5982 1.0470 -0.4852 -0.1843 -1.1356 1.0323 0.1038 1.1138 0.6966 -0.3060 -0.7380 -0.0811 -0.2564 -1.1524 -0.6011 0.5577 -0.3923 -0.0675 -0.2570 2.6812 0.4330 -0.7027 -0.1803 0.3230 -0.8834 -0.3263 0.1780 0.4659 -0.9942 -1.0339 0.3222 1.1532 -0.3125 -1.1141 -0.0666 -1.3457 0.3795 -0.2177 0.3817 0.4657 -0.6572 -0.8326 0.9231 -0.6689 -0.9299 0.6563 1.7526 -0.7917 -2.8786 1.4628 -0.6064 0.9994 -0.9264 1.3489 -0.9434 1.3849 -0.8288 1.3928 0.2458 0.5909 -0.9922 -0.7046 -0.3276 0.1331 0.2042 -0.4598 -0.0209 -0.5193 1.2438 -0.2360 1.3174 -0.4454 0.4230 -0.4234 -0.2182 0.6370 0.5629 -0.7283 -0.8064 -0.9783 -1.1902 -0.6411 -0.1638 -0.0734 -0.3792 0.3995 -1.6407 1.4884 -0.6281 0.2030 -1.4661 0.0700 -2.4863 -0.0113 -1.0277 -1.5080 -0.0195 -0.5804 -0.5520 0.8142 -0.4118 2.4172 0.2683 0.1710 -1.7741 1.5564 -1.2356 0.6143 -1.1065 -1.1486 0.7998 2.0585 -1.8184 0.4222 -1.0931 -0.2645 -0.5090 0.2196 2.7275 -0.5300 -0.8011 -1.3928 -0.1895 1.4681 -2.5087 -1.4128 0.8388 0.7557 -1.5171 0.8718 -0.6295 -0.4583 0.6569 1.2694 -1.4552 1.6896 -1.7406 -0.6627 0.4851 -1.8265 -0.6864 -2.2579 -1.9922 0.2587 -0.7227 -0.4065 -0.8089 2.1318 1.8890 1.5016 -0.6678 0.9532 1.0254 nonanoylcarnitine (C9) 1.1700 -0.0286 1.1400 1.0700 0.2620 0.9130 1.0600 0.8320 0.9170 0.8770 1.0000 1.1600 0.8880 0.1940 0.1300 -0.1690 -0.8920 1.0300 0.7950 0.6850 0.3590 -1.9500 -1.0400 0.2160 -1.4300 1.4200 1.1600 0.1760 -1.2700 0.4950 0.0574 -1.2800 0.7610 0.2920 0.5970 1.4500 -1.4000 -1.1700 -1.3300 1.3000 -1.1600 -0.9120 1.3600 1.1700 0.6820 0.3350 0.4860 -1.4500 -1.4400 -1.4200 -1.4400 0.4860 0.3870 0.6810 -1.0900 2.1800 0.3030 1.1800 0.5610 1.2800 0.3030 -0.0532 0.3520 0.9920 0.4070 0.0894 1.6200 0.3690 0.2300 0.4100 1.2700 0.2360 0.3530 -0.0136 -0.0141 -0.3610 -1.2900 -1.4500 -1.2700 -1.5300 0.3840 0.6360 -1.4600 0.8020 0.1140 -0.5930 0.5880 1.3600 0.0600 0.3430 0.7230 -1.3900 -1.3900 -1.0700 1.5500 0.1660 0.0559 -1.4000 -1.3900 0.5540 -1.6500 -1.8300 -1.3100 -0.0824 0.3150 0.1730 0.7290 0.6400 0.7000 0.5140 -1.7100 -1.6800 0.4270 -1.4700 0.1830 -1.4600 -1.2600 0.2380 -1.5900 0.3750 -0.1050 1.1600 -1.5300 -1.5300 -1.7500 -1.5600 0.2420 0.3480 0.7190 0.0125 -1.6300 0.1490 0.2860 0.0934 -0.3840 -1.6600 0.0664 -1.0700 -1.5100 -0.9180 -1.2000 -1.5500 0.3450 -1.5000 -1.3100 1.3000 0.5450 0.1610 -1.3500 -0.0152 0.6690 1.1300 1.2500 1.3900 0.9280 0.4400 1.3000 0.0300 -1.6200 1.1600 0.1540 0.1420 -1.2800 0.8540 -1.3700 -0.0559 0.5120 0.1780 0.3300 0.7110 -0.0048 0.4710 0.0001 -1.2100 0.9640 0.7790 0.9310 -1.2300 0.6010 -1.2100 -0.4690 1.0900 -1.5400 -1.5300 -1.2700 1.0800 -1.5100 0.8840 0.4940 -1.3400 0.4680 0.4280 -1.3600 1.2400 0.5630 1.1600 1.1000 -1.7900 -1.5100 -0.7740 -0.4600 -1.2500 -1.3100 0.0414 0.7740 0.2850 0.9050 -0.6570 -1.4400 -1.4700 0.5390 -1.4900 -0.4600 0.1800 0.3550 -1.5600 -1.7700 0.1300 0.0660 -1.6700 0.4030 -1.6200 0.5540 -1.8100 -0.2010 0.6690 0.1000 -0.0384 -1.6100 -1.4500 0.2060 0.3580 -1.4300 0.3410 0.9090 0.1790 -1.5600 1.5100 -0.0654 -1.3500 1.2900 0.9040 0.4490 1.8500 -0.4830 0.5690 0.3210 0.3110 0.2640 0.4730 0.4510 0.1810 -1.7000 0.8430 1.2400 -1.4300 0.7910 0.7730 0.3790 -1.7000 1.0100 -1.3400 -1.7200 0.5640 0.3730 0.3950 0.6810 0.4830 0.7950 0.9280 0.4320 -0.0598 0.3920 0.9280 -0.1890 0.4090 0.6670 0.4640 0.4330 0.4260 1.1800 0.6530 -1.7600 0.7390 1.2500 -1.4600 0.4560 0.4880 0.2530 -1.8200 0.5060 0.5770 -0.0136 0.6360 -0.0600 0.1100 0.6460 -2.0000 0.4810 0.0029 -1.4800 -1.6800 0.1010 0.3490 -1.5200 -1.8100 -1.6400 0.5730 0.6370 0.7960 0.2290 0.1620 0.2160 -0.1260 0.8120 0.1900 -0.0342 0.4360 0.6120 -0.5250 0.4490 0.4390 -0.1600 0.6290 -1.6100 0.3640 -1.5700 0.3040 0.5940 0.5160 0.2970 -1.4100 1.9800 0.8690 0.9690 -1.8600 0.1720 0.7240 -1.7800 -1.2900 0.2640 0.8640 0.3050 0.4460 -1.6800 1.2600 -1.3400 0.7290 0.3620 -1.7700 1.0200 0.9750 0.8600 1.0300 0.3110 0.1390 1.5600 0.9630 0.2040 0.1220 -1.6600 0.3860 -1.5500 -0.3180 0.4050 0.3650 -0.1560 -1.8600 0.5070 -1.8100 0.8770 0.9240 1.2800 1.3700 -0.1250 1.4500 0.9690 0.9070 -1.7100 0.1580 1.0400 -1.9100 -0.3300 1.3500 -0.7470 0.9860 0.0608 1.3600 1.0900 2.1800 0.8890 0.8540 0.7420 0.8220 0.8780 1.5000 0.3970 0.4790 -0.2890 0.5010 0.4430 0.7020 0.9610 -0.0270 -1.8400 0.0348 0.7860 -1.6200 0.1800 0.6400 N-oxalyl glycine (NOG) 1.4608 -1.8654 1.9345 0.8613 0.8975 1.5990 0.0483 0.2902 0.4914 0.7151 -1.2369 -1.5853 -1.3572 1.1577 -1.6789 -0.3299 1.4248 -1.4103 0.0249 1.4564 0.1127 -1.8733 0.4008 -1.4092 -0.1301 0.2743 0.6443 1.2243 1.0867 -1.4210 -0.3698 1.0439 0.0134 0.0442 0.8361 -1.4416 1.1279 -1.1527 0.4517 0.3007 1.5349 0.5424 -0.0902 1.0303 -1.2514 0.6587 -1.4369 0.9869 0.1153 1.0168 -0.2566 -1.6396 -1.3368 1.2167 -1.0739 0.6416 0.7859 -1.0722 0.1180 0.4810 0.1441 0.3766 -1.5806 0.7737 -1.3941 0.1413 -1.4617 -0.4657 -1.6307 0.5614 1.7477 -0.0639 0.2522 0.5587 0.4078 1.0386 0.4592 0.6937 0.4846 0.8171 -1.4923 -1.3534 -1.4174 0.6017 0.6744 -1.5556 0.2219 0.0618 -1.6563 -1.0984 -0.6214 0.7119 0.6681 0.4486 0.8388 0.4732 0.3669 -0.0850 -1.3523 0.1866 -0.1730 1.1990 0.5490 -1.6938 0.8268 1.3121 -1.4849 -1.4783 -0.1763 1.0388 1.5654 -1.6250 0.2249 -0.1253 -0.0636 -0.0835 0.1672 0.8730 0.9121 -0.2232 -1.2825 -1.3605 0.0410 1.3880 -1.6864 1.1411 0.0780 0.9994 0.4316 0.5452 -1.5776 0.7239 0.7302 0.3567 0.7659 -1.5993 0.5752 -1.0561 -1.4603 0.6353 -1.1789 0.2239 -1.3684 0.5537 1.2882 0.8978 -0.1507 0.3976 -1.3117 -1.2732 -1.1877 0.4608 -1.3208 -1.9243 1.1026 0.1176 1.3483 0.3787 1.2402 0.5102 1.5338 -1.7111 -1.2551 0.2271 -1.3375 0.6873 -0.0935 0.3949 0.5550 0.4446 -1.6491 0.2143 0.8996 0.2717 -1.6133 -1.1253 0.3030 0.2433 0.4071 0.8552 0.8327 0.6302 0.2971 0.8411 0.4385 1.1879 1.2287 -1.3413 -1.2041 0.4625 0.9651 -1.2214 -1.3256 0.1732 -0.2169 0.1234 0.9231 -0.2504 -1.4636 -1.1220 0.7796 0.7343 1.2074 -1.4117 -1.5036 -1.1052 -0.4968 0.6840 -0.1582 0.7232 0.8815 -1.4497 0.1638 -1.5131 0.6733 -1.5152 0.3157 0.1519 0.6988 0.7736 -0.0382 0.1056 0.1952 -1.7410 0.4747 -1.7371 1.2588 0.6932 -1.5611 1.0109 0.9069 0.8943 0.0490 0.7418 0.6605 1.4514 0.3539 0.6239 0.7375 1.1347 0.8607 -1.6842 -1.4835 0.0662 0.7210 0.6714 0.1697 -1.6815 1.1685 1.0349 0.1905 0.0677 0.9923 -0.3574 0.9402 0.9783 0.1616 0.2938 0.4025 -0.1829 0.5426 0.2150 0.7257 0.9645 -0.2267 1.5358 -1.6114 -0.0289 1.0031 1.1292 -1.5834 -0.1411 0.7645 -0.0053 1.0142 -0.6779 -1.5375 0.2600 0.5694 0.4702 -0.0482 0.4687 0.9003 -1.6713 -1.7622 -1.4202 1.3788 -1.4881 0.7715 -1.7560 -1.6934 -1.7029 1.0487 0.9612 0.8826 -0.5409 0.5627 -0.1030 0.7881 1.3331 0.0451 0.5454 -1.5282 -0.5761 0.0088 -1.7434 -1.5798 0.8122 0.6368 0.5724 1.3357 -1.6539 0.9856 -0.0656 0.0081 0.7358 0.4458 0.6529 0.8604 -0.0402 -0.0592 -0.0636 -1.9551 -1.7056 0.5077 0.7273 0.8449 0.3507 0.4998 0.2456 -0.2557 -0.1609 1.4586 -1.2547 -0.1025 0.9037 1.2882 1.3904 0.7887 0.8883 -1.4683 0.7974 -1.3274 0.8533 -0.1955 0.2054 0.5297 -1.6523 -1.5838 0.8454 0.9021 0.2884 0.8569 1.0269 1.1555 1.0774 -1.7185 0.2646 0.2817 1.4733 0.2228 -1.5608 0.4468 0.4700 -1.5549 -0.2044 0.2843 -0.6376 -0.1474 0.2361 0.9214 -1.5981 1.1376 1.6447 -1.8857 -1.2501 0.0150 0.3944 0.5213 -0.4814 -1.4844 -0.5095 0.5793 0.3852 -1.9402 0.0337 0.4602 -0.0272 -0.5705 -1.8252 0.1863 1.2155 -1.0276 -0.5552 -1.6873 0.2394 -1.8316 0.2445 -1.8940 -0.4552 0.4604 1.6130 -1.4056 1.0736 0.5468 0.6625 -0.4151 0.1255 -0.3132 -1.7924 N-palmitoylglycine 1.9436 0.4147 0.7265 1.1144 1.0722 0.7626 -0.4861 0.2761 0.7761 1.3635 1.2943 -1.7969 0.8737 0.3821 -0.7481 -1.0867 1.2428 0.7902 -1.4450 1.1208 -1.2301 0.5158 -0.9161 -1.4775 -0.4429 -1.4786 -0.4897 1.2998 0.6987 -1.5406 -1.8595 -1.2498 -0.8440 0.2950 0.1433 0.9178 -1.4335 0.4024 0.8728 -1.8582 -0.3708 -0.1358 0.1107 0.5871 0.6592 0.4489 0.2548 0.1561 -1.4834 0.9671 0.2879 0.6085 -1.3948 1.6436 -0.9869 0.6280 -1.5430 0.9146 0.5118 1.0623 -1.2483 -0.1125 -0.2218 0.4516 -1.4571 -1.8832 1.0307 1.0171 -1.8254 -0.4885 0.2859 -0.0875 -0.1225 -1.8707 1.3660 -0.1606 -1.2510 -1.5022 0.6326 -0.0679 0.6425 0.8851 0.1707 0.9493 0.3428 -0.5766 -1.2572 1.0407 0.2695 -1.0213 -0.1543 -1.4048 0.5812 0.1244 -0.0389 0.4474 0.7139 0.8021 -1.3951 1.3908 -0.2168 -2.0283 -1.2701 -0.6136 -0.4292 0.4121 1.1388 0.7202 0.9939 -1.3324 -0.3513 -0.2072 -1.2358 1.3229 0.8066 1.0671 -1.2047 0.4984 -1.7149 0.6908 -0.2144 1.1622 0.1635 0.0023 -0.2600 -1.6681 -1.7734 -1.6226 0.0232 1.1484 0.3006 0.6188 -1.0300 -1.7719 -0.1795 -1.7935 -0.2816 -0.0916 0.8768 -0.7347 1.5675 0.8414 1.0325 0.7374 1.9625 0.4499 0.5566 0.1658 -0.3444 -1.2677 1.6312 0.6141 0.5042 0.3784 1.0417 0.4525 1.2145 -1.1962 -0.4299 1.1289 1.2758 0.4631 0.8336 0.5393 0.9701 0.3255 -0.2289 -1.7018 -0.3566 1.3506 0.3120 -0.0223 -0.0551 0.4901 -1.8453 -1.0366 2.3900 -1.2006 0.5439 -1.1309 -1.4178 0.0452 -1.6309 0.3974 -1.2199 0.4624 0.8147 0.8022 -0.1863 -1.3424 -0.4593 0.9800 -1.3644 -1.2758 1.1323 1.0375 1.0419 -1.9816 0.9209 -0.0816 -1.7745 -1.1940 -1.2875 -0.1470 -0.6626 1.2028 -0.0402 -0.3476 0.8367 -0.2995 -1.4610 0.9620 -1.9643 -1.6540 0.1764 -0.2846 0.0960 -0.1369 0.5340 -1.8295 0.2869 0.3495 -0.1275 -0.2454 0.5655 0.1418 0.2985 -0.2302 -0.8453 0.2730 0.4250 -0.0446 0.2107 -1.7329 -0.3929 -1.9237 0.4860 0.5759 0.1107 -1.3607 0.9772 0.2729 0.6859 0.7226 -1.7699 -1.5730 0.0606 -0.3956 0.2072 -0.0414 1.4095 0.6920 -0.1472 0.1413 1.1894 -1.4656 -0.2010 0.6441 0.3827 0.1206 0.2771 0.4674 -1.1327 0.8485 0.5542 1.6505 0.5569 0.2131 0.2087 0.5159 0.7279 -1.4268 0.6425 0.0019 0.2349 -1.6902 1.3276 -1.6933 -0.6799 1.8094 -1.9339 -1.8862 0.2057 -0.0207 0.4881 -1.5189 0.7990 0.7428 0.6746 -0.6681 -0.2787 0.6356 -1.7380 -0.4211 0.8130 -0.2011 0.6271 0.0237 0.2138 0.9235 0.9018 0.7166 0.5446 0.5804 0.3948 -2.0144 -0.1768 -1.1817 0.2384 0.0794 1.6164 0.2092 -1.7121 0.4392 -0.2022 -1.6527 0.2161 -1.6232 -0.5703 0.5878 0.9094 1.7968 0.6837 0.3315 0.4626 0.3803 0.5679 1.1575 0.6703 0.4111 0.0750 0.0566 -1.5892 0.7755 0.3096 -2.0881 1.1059 1.0737 -1.9590 0.3715 0.4346 0.9046 -0.2727 0.1217 0.1324 0.6102 -1.3350 0.1117 0.9662 -1.9522 1.5335 1.1306 1.1275 0.9672 1.3529 -0.9370 0.3342 -0.7979 -2.2216 0.2963 -0.4504 -1.0349 1.1942 -0.1082 1.8251 0.5674 -0.1634 -2.0748 0.0074 -2.0367 1.8775 0.0661 1.4678 1.1195 -0.6090 2.5068 -0.0120 0.1957 0.2217 0.4648 1.2553 -2.1918 -1.2047 -0.3921 -1.0892 0.0369 -0.1361 0.5215 -0.5007 0.7804 0.9387 0.6213 0.8371 -0.9065 -1.9483 1.2402 -0.4730 -0.2635 -0.2388 0.0371 0.4426 0.9828 0.3227 1.0569 0.2819 1.1538 0.6364 0.1450 0.2119 0.6749 N-palmitoyl-heptadecasphingosine (d17:1/16:0)* -1.7059 0.0630 -2.1749 0.8479 0.4074 -0.0530 0.1293 0.0563 -0.2475 -0.0933 0.4917 0.7692 -2.0285 -0.1196 0.4639 0.3204 0.1827 0.6603 0.5390 0.0107 0.1589 -0.0583 -1.6133 0.7558 -0.1587 0.0060 0.2883 1.0509 0.4601 1.0298 -0.5635 0.5386 -1.5352 0.4161 0.1535 0.5092 0.2474 0.5382 0.5568 0.3994 -1.7348 -1.4587 1.2737 0.0332 0.9896 0.6804 0.2216 0.2871 -0.1142 -2.0596 0.1811 0.4844 0.2295 -2.2436 1.4610 0.6848 1.0219 -0.0573 0.7317 0.8326 -1.8586 0.2320 0.8884 -0.3173 0.7165 0.2047 -0.9393 0.2578 1.0867 0.6122 0.0104 0.9658 0.6298 1.5936 -2.0817 0.8932 -1.8632 0.4520 0.9917 0.9326 1.0774 0.7093 0.4942 0.9274 1.0446 0.1098 0.5953 0.7237 -1.1225 1.3229 0.7881 0.0869 -0.7942 -0.0760 1.0766 0.2240 -0.0018 0.8388 -1.9749 0.7669 1.3316 -2.4751 -1.8654 0.7140 -1.9620 1.0104 0.3075 1.0502 0.3319 0.5632 -0.1956 -0.3997 0.4910 1.3266 0.5423 0.2148 0.0124 -2.0010 -2.2608 -2.4460 0.5809 0.6692 0.7203 -2.2492 0.9308 0.6791 -0.4612 0.5966 0.3963 0.4632 0.4085 0.6301 1.3162 0.8735 -0.3390 0.6466 0.4786 0.7121 -2.1331 -1.4671 -0.2303 -0.2769 0.9487 1.3704 -1.9439 1.0654 -0.4530 0.4960 -0.0877 0.1006 0.3059 0.4603 0.7728 0.2464 0.2715 -0.5460 -0.3328 0.4956 -2.2525 0.4736 1.0282 -0.3983 0.2837 0.3647 -2.0296 1.2906 0.7116 0.3781 -2.3440 0.4970 -0.2552 -0.1835 0.8966 0.4964 0.3792 -1.6855 -1.7970 -1.8542 0.9535 0.6187 -1.2772 0.5515 -2.1780 0.8036 0.4318 -0.2574 0.1515 0.8816 0.3038 0.2990 -0.0558 -0.1583 -0.6875 0.5322 0.0926 0.9319 -2.0124 -2.4528 0.3962 0.6994 -0.5785 0.3816 0.0940 0.0620 0.4606 1.2526 0.4156 -1.1498 -2.0793 0.0309 1.1637 0.8526 1.0720 1.2000 -0.1884 0.6041 0.5292 1.7527 0.2642 0.0236 0.2659 0.7081 0.7125 0.0229 0.0348 -0.2067 0.0126 0.2795 0.6218 -2.0874 1.4155 0.8683 -2.0350 -0.3045 0.3598 -0.2682 0.8291 -0.7351 0.2266 -1.9649 0.1921 0.6298 0.8093 0.3890 0.6017 -0.3206 -0.3352 0.1234 0.8460 0.4892 -0.2680 0.2112 0.3092 -0.4092 0.8213 -2.0389 -0.5423 -2.2195 1.7059 0.3877 -0.0316 -1.9173 0.2554 -1.1021 -0.1064 -1.6903 0.2945 0.4801 1.1950 0.6042 -0.1717 0.6710 -2.3782 1.4727 0.0105 1.1298 0.1165 0.0328 -0.3160 -1.3053 0.6649 0.2821 -2.4088 -0.4148 0.7102 0.5436 -2.2897 0.0058 0.5414 0.6439 -0.2297 -0.3759 0.8551 -2.4421 -2.1014 0.2311 0.8545 -0.0378 0.2218 0.5459 0.6766 0.4794 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-1.0502 -0.2431 0.0505 0.8263 -0.9364 0.0701 1.3676 0.7093 -0.3017 1.5622 0.4194 0.0996 -0.4347 -1.7768 -0.5746 0.7945 -0.5694 1.4157 -0.4847 -0.1540 0.3788 -0.3817 0.0146 0.0832 -0.2054 -0.2015 0.2152 -1.3130 0.6568 -1.7848 -0.1391 0.5303 0.4360 -1.3163 0.6253 -0.4089 -0.2751 0.3720 0.3232 0.0684 0.4383 -0.3256 0.3095 -0.3535 -2.7640 1.3341 0.5177 -0.4097 1.3807 -0.5586 0.3889 0.5721 -1.3148 0.1965 -0.6574 0.7739 -0.8064 -3.1043 -2.4228 -0.0105 0.9841 -0.0947 1.0747 0.5667 1.0158 1.1607 -0.4996 -0.3422 0.2971 0.5916 -0.5383 0.3384 -1.0075 0.6809 -0.6319 0.8960 0.0054 1.4450 -0.7849 0.7161 1.1989 -0.0979 -3.3217 0.7726 -0.2667 -0.1624 -1.3033 0.8014 -1.2626 0.1653 -0.1601 0.4282 0.6628 0.4834 0.1496 -4.0619 0.2205 1.4205 1.2479 -2.7882 -0.1091 -1.2996 1.1739 -0.1622 -0.5691 -0.7756 0.0938 1.2812 0.7640 0.6897 1.2879 0.3899 -0.8878 1.4999 0.2131 0.7533 -0.6179 N-palmitoyl-sphingadienine (d18:2/16:0)* -0.3303 -0.0766 -0.4158 1.0292 1.4016 -0.2737 -2.2674 -0.1962 0.7299 1.1814 0.9302 -3.1239 1.0173 0.6749 0.2429 -0.4495 0.3308 1.2788 -1.8056 -2.4200 -0.0109 -0.6847 0.2226 -0.7618 0.0520 -0.1225 -0.1558 1.4380 0.2981 0.7458 -3.1051 -2.4915 0.0200 0.7627 -0.9586 0.8316 0.6063 0.4319 0.7285 0.2778 0.0401 0.9979 -0.1854 -3.1403 0.5949 -0.0310 0.2185 -0.4464 0.0806 -0.6499 -0.7272 -3.2861 0.4603 -0.4008 1.2764 0.9113 0.8104 0.2711 0.2267 1.0148 0.0067 0.6112 -0.4886 -0.2905 0.9237 -0.0291 -1.5446 -0.3776 -0.9265 1.2274 0.3350 -0.7416 0.9876 -0.7481 0.3485 0.4698 0.2142 -0.4823 1.0101 0.5163 -0.3054 0.4287 0.3423 -3.1241 0.8388 0.1405 0.3369 1.8000 0.2601 1.5514 -0.4978 0.5067 -0.2249 -0.9084 -0.6583 -0.4831 -0.0803 -2.7372 0.3760 -2.9594 0.5740 -0.9664 0.3314 1.0263 0.0038 0.9272 0.4165 0.5436 0.3502 0.8399 -0.3326 -0.1698 -1.1969 1.4771 0.8628 -0.6424 -0.9377 -0.1610 0.9722 0.0790 0.4643 0.9333 0.0284 -0.2411 0.9296 -2.9701 0.4595 -2.8981 0.9372 -0.1507 0.0505 0.7241 1.2426 0.8525 -0.1481 0.3381 -1.2229 1.1104 -0.3858 1.0236 0.6200 0.1868 1.0747 0.8937 0.4752 0.6023 0.2720 0.6675 0.3423 -0.5736 0.2577 1.5517 0.9509 -0.2211 0.4215 -2.4592 0.0671 0.6852 -0.4073 1.9144 1.3595 0.7178 0.3581 -0.8300 -0.6907 0.6334 0.1372 0.6225 -1.2559 0.8301 -0.2754 -0.2440 0.2197 -0.2312 0.1533 0.5881 -0.2358 0.1398 0.9563 0.9396 0.3796 -0.3581 -0.0624 0.5753 0.6401 -3.2432 0.9377 0.8265 -0.5876 -0.7927 0.4974 0.3641 0.3902 0.2482 0.4780 0.7270 0.7523 0.1691 1.1456 2.0791 -1.1583 0.7147 0.6662 0.6098 -0.0963 1.6597 1.2509 1.4684 -0.0541 0.9544 0.9335 0.9762 -3.2165 0.8891 0.2747 0.3593 0.6068 0.4622 -0.2998 -0.1552 0.5463 -0.2338 1.1935 -0.3025 -0.3887 0.8614 0.2368 -1.5134 0.5176 0.0630 -0.9862 0.1666 -0.9574 -0.3708 1.1137 -0.6878 0.4210 -0.0958 0.3877 0.0548 0.1232 -1.3189 1.1723 -0.6666 -0.2808 0.0694 -0.8659 -0.2545 0.0028 0.2632 0.7152 -1.8083 -3.1190 0.7083 -0.7676 -0.0489 -0.4370 -1.7389 2.3634 -0.5171 0.1919 -0.7054 -0.2481 0.6470 0.7358 0.4822 0.8887 0.3568 1.1259 -0.0349 -0.1869 0.3552 0.8208 0.7286 0.4998 0.2630 0.6610 0.7530 -1.1450 0.4386 0.0731 0.1865 0.3983 -0.1789 -0.3270 -1.6357 -0.9330 -0.6939 0.2834 1.0728 -0.2878 -0.5766 -0.1382 -0.0379 -0.6960 -1.1264 0.4127 -0.0292 0.2641 0.2614 -1.0377 0.7309 -1.3769 0.5528 -0.3939 -0.0033 0.4452 -0.0725 0.6491 -3.2735 0.3974 -0.3134 0.1374 0.3589 0.9427 -0.9309 0.3472 -0.3973 0.0838 -0.2838 0.4736 1.3394 -2.9160 -0.1729 -0.6818 0.0122 0.2208 0.5002 -0.2192 0.1912 0.1688 0.0366 -0.0877 0.6832 0.1691 0.7905 -0.3277 -0.7853 -0.4979 -0.5287 0.9815 -1.1788 -0.8081 0.1407 0.5727 -0.4271 0.2158 -1.4564 0.3223 -0.0382 0.3674 1.1784 0.6942 0.4137 0.4736 -0.1058 -0.8917 0.4139 -0.3301 -0.2492 0.8091 -3.0896 -2.8792 0.0398 1.7956 0.0459 -1.6981 -0.3652 0.5783 -0.8262 0.2767 -0.6988 0.8568 1.2051 -1.1533 1.5553 0.6125 0.9620 -0.8039 0.3862 0.2254 -3.5412 -0.1529 0.7891 -1.5191 -0.4403 -0.7622 -0.0508 0.2867 -0.3662 -0.0192 -0.1987 -0.6897 -0.2070 -0.1615 -0.0836 -0.6653 0.6977 -3.6462 -1.0671 0.6051 0.1258 0.7165 -0.1217 0.4406 0.6810 1.6066 -0.7331 0.6992 0.6412 N-palmitoyl-sphinganine (d18:0/16:0) -2.2737 0.7427 -0.9816 1.0297 -0.1506 -2.1017 0.9319 0.5614 -0.3551 -0.6181 0.6154 -0.3093 -0.0086 -0.6427 1.6311 -1.0539 0.3626 -0.5173 -0.6164 0.0903 -1.0413 -1.4406 -1.0971 -1.6764 0.6940 -0.9377 -0.4930 -0.7635 -1.3703 -0.1684 1.1823 -0.9050 0.2366 -0.5151 -0.3906 0.9823 -1.4637 -1.0917 0.1041 -0.7720 -2.4058 -0.8592 2.1734 -1.3386 0.2766 1.7695 -1.0699 -1.1369 -1.0050 -0.4413 -2.5061 -0.4470 -1.1857 -1.8385 2.0369 -0.0215 0.0674 -1.2124 -1.3518 -0.2261 -1.3286 0.4944 1.2727 0.1200 0.8560 1.4927 -1.8639 -0.6544 0.0641 -0.7312 -0.1964 -0.8911 0.9800 1.1833 -0.1313 -0.4432 -2.0624 -0.3614 0.4318 -0.8766 0.2260 -1.0678 0.9558 -0.7018 0.3639 -0.6637 -0.4452 0.9274 -1.5766 0.3890 -0.6539 -0.9043 1.0378 0.0910 -0.6353 -0.6585 0.2850 0.4668 0.5352 1.0215 -0.1159 -1.1712 -1.7245 0.3077 0.5407 0.9519 -0.6362 0.9612 0.0181 0.0205 0.5557 -0.2322 0.3046 1.1083 0.6686 -0.0934 0.0464 -1.1082 0.6670 -0.8143 -0.7151 1.1726 -0.1641 -1.8470 2.1737 -0.0957 -0.3971 1.0635 0.1669 0.2742 0.7373 0.5299 -1.0316 -0.4278 -0.1091 0.9937 -0.5102 -0.4596 -0.3261 -0.7432 -0.3277 0.9327 1.3638 2.3417 -0.5447 -0.1992 0.4847 0.2179 0.2836 -0.8764 1.2687 -0.1059 2.4073 0.5604 0.9666 -0.0147 -1.3878 1.5080 -1.0026 -0.3688 1.8188 0.6994 0.6187 0.6172 -1.6520 0.9916 1.0458 -1.0545 -0.4719 -0.5428 -1.3619 -0.7538 1.2769 -0.4536 -0.0704 0.0744 0.2511 -0.8249 0.5230 -0.5408 0.9202 0.7624 0.3000 -1.1880 0.2982 -2.3064 -0.6079 1.9031 -1.3637 0.4407 -1.6776 0.1882 -0.6201 -0.3847 0.1420 -1.1777 0.9491 0.0046 -0.4306 1.0722 -1.5414 0.2124 0.0263 -0.8763 1.0962 0.0961 1.6301 -0.5443 0.6680 -0.0989 0.1241 1.4375 -0.8341 0.7398 0.9831 -0.3283 2.0799 -0.0799 -0.0322 1.2689 0.2743 1.0804 0.6077 -0.3421 0.9057 -0.1740 0.3790 1.1636 0.2305 -1.2244 0.1748 0.7249 -0.7418 -0.3790 -0.9130 -2.2995 0.5585 -0.5811 1.4987 -1.3207 -0.6546 1.7628 0.5322 -1.3290 -0.2366 -0.2088 -0.1993 -0.2729 -0.0094 0.8238 -0.7867 0.1246 0.0417 1.0736 -0.4778 0.3408 -0.9555 -1.0898 3.5387 -1.3073 0.5351 -0.0325 1.2519 0.0332 0.3999 0.2792 1.0681 0.2786 1.1122 -0.3878 0.4317 1.2884 0.8983 1.9528 -1.3063 -0.1320 -0.0651 0.1328 -0.4032 -0.8238 1.3550 0.2211 -0.7614 -1.2045 0.6912 1.1898 -4.9513 0.0961 1.0477 0.1713 0.3807 -1.0411 -0.3213 0.4726 0.3716 1.1576 1.2180 0.0083 2.0566 -0.5680 -0.7553 0.5524 -0.3527 0.6380 1.1757 0.1043 1.7031 -1.4343 -0.8252 -0.1299 -0.2563 0.2249 1.7164 -0.8937 1.7185 -0.3661 -0.1538 -0.0520 -0.3504 0.6419 0.5799 1.1653 -0.2869 0.1819 -1.2973 -0.6666 -0.1524 0.3294 -0.9689 -0.3845 -0.5849 -1.0831 -1.6049 0.9642 -0.6434 0.4735 0.3799 -0.3515 -1.2115 -0.2786 2.1926 -1.3915 -0.4614 -0.3792 1.3003 0.2660 -0.6597 -0.3596 -0.0113 -0.6370 0.7671 1.6130 0.4042 0.8989 1.9731 0.1286 -1.4172 -0.4658 0.4060 0.2864 0.2027 1.3350 -0.3947 -0.6485 1.9477 -0.9629 0.4831 0.1599 0.9133 -0.7433 -0.1225 -0.1776 0.1413 1.3294 -0.5899 1.9374 1.7105 1.4561 -0.0136 0.3460 -1.8250 -0.4923 -0.2918 -1.6143 0.4337 -0.8857 0.4816 -0.3706 -0.0797 -0.3352 0.3828 -0.6421 1.8792 -0.9935 -0.9907 0.6520 -0.8411 0.3313 -0.9763 -1.2713 1.2077 1.3891 -0.1492 1.3125 2.0093 -0.5055 -0.0833 0.6916 -0.2355 0.6271 N-palmitoyl-sphingosine (d18:1/16:0) -2.2040 0.2760 -1.0192 0.6870 0.0530 -2.3521 -2.1179 -1.3007 -0.5122 -0.6126 -0.5922 -0.1112 -0.3188 -0.9504 -0.0482 -0.8570 -0.2402 0.4270 -0.1166 -0.2089 -0.2855 -1.0722 -2.0443 -1.0360 0.6308 -1.7350 -1.3399 0.2082 -0.5480 0.2735 -0.6539 0.1966 -0.1595 0.6805 -0.9703 1.6919 -0.3659 -0.3903 1.1828 -1.0122 -0.6483 0.4466 1.3325 -0.7867 1.3251 0.7942 0.8684 -0.4878 -1.0274 -1.8884 -1.7080 -0.7541 -0.9509 -2.0947 1.5604 1.1534 0.9296 -1.0019 -0.3938 0.3844 -0.2361 -0.5344 0.7785 -0.5005 1.4789 0.1804 -1.5440 -0.4587 1.2765 0.7066 -1.3951 0.2771 1.1394 1.7832 -0.5526 1.2316 -1.0878 -0.9148 0.6084 0.8891 0.3084 -0.8834 0.4799 0.2582 0.8821 -0.7041 0.3430 1.7932 -0.4021 1.1717 -0.1538 -0.6737 0.0918 -1.5314 -0.0400 -1.2088 -0.3846 0.9218 1.3637 0.4996 1.7970 -3.0787 -0.2341 1.1999 0.5791 0.8103 0.1537 0.5752 -0.6098 1.2046 -0.5882 -0.0724 -0.9156 1.4177 0.0523 -0.2809 -0.5546 -1.4334 1.1880 -0.6613 -1.2786 1.6537 -0.7203 -1.4328 1.0647 -0.5865 0.1896 -0.0473 0.2235 1.0389 0.2507 0.3959 0.9157 0.6843 -1.1378 0.2107 -0.3264 -0.7014 -1.8462 0.7668 -0.3770 0.0927 0.7110 0.8391 -1.3331 0.6010 0.0368 0.4251 0.9385 -0.2620 0.1476 0.9188 1.9609 1.1376 1.6671 -0.4419 -1.2092 1.5730 -0.8536 -0.3650 2.2238 0.3564 -0.1571 0.5386 -2.6394 1.3053 0.3679 -0.5372 -1.6257 0.3978 -1.6828 -1.3856 0.5857 0.0077 -0.1693 -0.2913 -0.0044 0.2987 0.8957 0.1092 -1.7130 -0.1766 -0.8868 -0.2170 0.3144 -1.2420 0.3813 2.3516 -0.4290 0.3101 -1.8415 -0.2817 -1.4385 0.5908 0.0663 0.8376 0.1115 -0.2547 -0.3819 1.8070 -1.7774 0.9011 1.0979 0.4452 1.8429 2.3454 1.3198 0.2491 0.3574 0.0417 1.7003 1.4478 0.0962 1.5493 -0.3414 -0.0215 0.2559 1.7712 -0.2785 0.5129 0.5063 -0.4326 0.4627 -0.9453 -0.1439 -1.0268 0.2128 -0.6161 -0.3681 -1.2817 1.0413 0.6912 -1.0962 -0.3724 -0.3597 -0.4132 0.9726 -0.8385 -0.1264 -0.5379 -0.4088 1.0110 0.4534 -1.6568 0.7564 -0.8587 -0.9701 -0.7764 -0.1930 0.0532 -1.0544 -0.5390 0.5619 0.8093 0.3104 -0.0682 -1.1375 -2.1603 3.5029 -0.9851 1.1757 -0.3204 -0.3399 -2.0516 0.2928 0.2536 0.6921 1.3223 1.3924 0.6154 -0.4825 1.0242 0.9391 1.6621 -0.1976 0.6100 -1.0804 0.0017 -1.2754 -0.4363 -0.3779 -0.5724 -0.3967 -1.3519 0.2524 0.9750 -2.3266 -1.4792 -0.4200 0.3503 -0.3146 -1.8234 0.1554 -0.6922 -0.7134 -0.4730 0.7306 -0.2556 1.8887 -0.5491 -0.6167 1.3045 -1.6794 1.8110 -0.5092 0.5078 0.2635 -0.5957 0.6181 1.8121 0.4437 0.9266 0.3200 0.6137 1.6329 -0.8111 -0.2844 -0.7348 0.0187 -0.4486 2.4525 1.4337 -0.2613 0.3043 -1.7061 0.0333 0.1940 0.2085 -0.2986 1.5779 0.1611 -0.1544 -0.8110 0.7110 -0.4268 0.2845 0.5713 -0.4144 -2.4475 -0.1942 1.9922 -2.1951 -0.1258 0.3652 1.1239 -0.4623 -0.7737 0.2704 0.4948 0.3012 1.0932 2.4948 -0.1075 0.8788 1.3750 -0.1495 -1.4576 0.3763 -1.2831 -1.0684 -0.7708 1.2635 0.4092 -1.0693 1.5659 -0.1948 -0.6327 -0.2308 1.3910 0.9299 0.1324 -0.6163 2.1646 1.2249 -0.7479 0.5374 0.3691 1.5455 1.1942 -0.0733 0.0944 -0.6783 -0.3194 -0.8103 -0.2145 -0.8794 -0.1866 -0.0075 -0.0465 -0.2561 -0.5625 -0.8348 -0.3630 -0.4102 0.0128 0.1702 -0.7611 0.9337 -0.9377 -1.1058 0.6497 0.8698 0.0607 -0.3805 0.1441 0.7713 0.3824 -0.9536 0.3521 0.0069 N-stearoylserine* 0.4353 -0.4867 0.6176 1.0476 0.8229 -0.0470 0.4194 -2.5382 0.8192 0.2317 -2.0549 1.6141 0.4059 -0.7826 -2.6672 0.1756 -0.6650 0.7581 0.7906 1.1317 -2.0127 -2.9742 2.3294 0.6530 -0.4674 0.2952 1.3108 -0.0449 2.2092 0.2116 0.3324 0.6230 -0.7758 0.3439 -0.2689 -1.3284 0.3190 0.9057 -0.2311 1.0432 1.2156 -0.9061 0.8124 1.1599 1.2626 0.2905 -0.4667 0.2656 0.4894 0.0484 0.3964 0.1506 -2.1675 -2.4560 0.7698 0.7784 0.3664 0.7174 0.0643 0.6250 1.1162 -2.5749 -0.4336 -2.1240 0.1654 0.8563 0.6869 -0.3787 -0.4231 0.2086 1.2790 0.4585 -1.1469 0.5212 -0.6689 -0.2621 0.3330 -2.2713 0.8831 0.1368 -0.4767 0.5575 0.5722 0.6455 -0.5873 0.6966 0.7271 -0.3678 0.0692 0.7275 0.3047 1.6490 -0.7810 0.6757 -0.5209 0.1197 1.2336 0.7130 -1.3470 -0.5462 -1.0264 0.5987 1.1626 -0.5357 0.8608 0.4259 0.1804 0.0304 -0.0189 0.3559 0.4547 -0.6373 -0.4148 0.7717 -2.3081 0.5950 -0.4346 1.4411 -1.2159 0.2775 1.1095 -2.2096 0.1588 -0.6810 -2.6852 0.4001 0.9771 0.5012 0.2707 0.6904 0.0443 0.0175 0.2216 0.8556 0.0617 -0.1027 -1.1694 -1.7499 -0.5099 1.1533 0.8754 -0.1213 -0.4074 0.4243 0.1040 0.1723 0.1787 -0.3059 0.4041 0.4057 0.9203 1.3357 -2.1225 -3.0577 -0.7874 1.3300 0.1078 0.7024 0.6467 1.5961 0.7146 -0.4712 1.2956 0.4968 0.8137 -0.5222 0.4537 0.4336 0.7979 0.0871 -0.0772 1.2781 -0.0008 0.9141 0.7739 1.2367 0.2542 -0.1385 -0.6396 0.5370 1.2599 -0.4437 0.5275 0.0487 0.5139 0.2870 0.5063 0.4648 0.3120 -2.1191 0.5584 -0.6608 1.6565 1.6922 -0.4870 1.2228 0.6161 -0.5223 0.5409 0.5750 -0.5794 0.7587 0.1663 -2.2362 0.8127 1.1054 -2.4002 0.4852 0.2809 -2.2729 -0.1289 -0.2502 -0.0063 0.0070 0.2801 0.8067 -1.0723 -0.2079 0.7878 -0.2138 0.7575 0.4895 0.1967 1.1961 0.3066 -0.8902 -0.1496 -0.0565 -0.2876 -0.4724 1.0764 0.8976 0.0606 0.5097 -0.7592 0.0545 0.2348 -2.1933 0.6871 0.6008 1.0412 -1.4487 0.6490 -0.2952 -1.2824 -0.0192 0.2082 -0.4966 -2.6492 0.8432 0.0759 0.0476 -0.0967 1.3503 0.5097 -1.6950 -0.2328 -0.7554 0.2680 -0.1083 -0.4610 1.2595 -1.2926 -0.2455 0.1377 0.5169 0.9442 0.3646 1.0184 1.1262 0.1803 0.3105 -0.4973 -1.2085 0.3418 -0.0568 0.9332 -0.6874 0.0521 0.8987 0.1188 0.5739 0.3035 -0.8377 -2.8196 0.7418 0.1350 0.7998 -2.6123 -0.5065 -0.4234 1.3332 -0.6418 -1.1896 -2.3027 -0.9031 0.2626 -3.0238 -1.3420 1.0475 0.4096 -0.0993 1.5153 0.3164 0.6475 -2.7655 -1.1044 -0.6431 0.7276 -0.5047 1.1261 -0.8256 -0.4090 1.1596 -2.8151 0.4110 0.2739 -0.2427 -0.1071 0.1401 -2.3496 0.0351 -0.5085 -0.2517 0.8505 0.3883 -1.2312 -0.2052 -2.4741 -0.0739 0.2532 -0.2665 -2.3525 -0.1053 -0.0206 0.3017 -0.4140 -0.6492 1.5874 0.4152 0.0274 1.4964 -0.2763 -0.1377 0.3266 -2.2547 0.1347 -0.9671 0.4132 -0.2663 0.3818 -1.4085 -0.2328 0.5339 0.0160 0.7905 0.7358 0.9583 0.5184 -0.5767 -0.0917 0.2985 0.9174 -0.4365 -0.1313 -1.2185 0.3741 -0.5079 0.7388 0.0076 1.1045 -2.5511 0.5632 1.2158 -0.6259 0.9377 0.3459 0.2173 -0.0742 -0.4068 0.6555 -0.6811 -0.2277 0.0614 0.4810 0.1389 -0.2877 1.0684 -0.2832 0.1618 1.4170 1.2024 -1.7031 0.4641 -2.6984 1.0725 -0.5354 -0.4411 -0.5897 -0.3249 1.2509 0.2536 0.2519 0.8346 0.4678 -1.8200 1.0255 0.1720 0.4120 -0.9205 N-stearoyl-sphingadienine (d18:2/18:0)* 0.7525 0.6394 -0.0343 0.0702 -0.0855 -0.0252 -1.5553 -0.8084 0.1856 0.6275 0.7669 0.4090 -2.6905 0.0168 0.2594 -0.5678 0.5445 0.6686 0.6106 -0.4189 -0.2243 -0.5881 -2.2486 -0.0149 0.5296 -2.7195 -1.1368 0.7516 0.2741 0.6332 -1.3249 -0.0032 -0.2914 0.8275 -0.5580 0.4886 -0.5993 -0.4803 0.8645 -0.0892 -0.3365 -0.3541 0.9067 0.3485 -0.2211 0.6784 1.2958 -0.4997 -0.9401 -2.7237 -0.1110 0.1994 -0.1249 -0.6610 0.9323 1.5947 1.0332 0.8368 0.0583 0.2667 -0.3438 0.0593 0.4718 -0.9405 0.9649 -3.0285 -1.2463 -0.2401 0.7698 1.1975 0.3652 -0.1770 0.9754 1.0439 -2.7450 0.6451 -1.1847 -0.9288 0.5413 1.1539 0.3275 0.1401 0.5127 0.4428 0.7204 -0.3395 -0.0715 1.5307 0.2182 0.7618 -0.1031 0.0287 -0.4682 0.0745 0.1472 0.4104 -1.2866 0.6440 0.1270 0.7850 0.5169 -3.1626 -2.5138 0.6599 0.1114 0.7401 0.6529 0.5618 0.9385 1.0347 -0.5231 -0.0134 -1.8304 1.8936 0.3849 -0.5596 -0.5359 -0.7955 0.3829 -3.1344 -0.0321 1.5753 0.1975 -0.1077 1.1014 0.4020 -0.4435 -0.3856 0.3732 0.6839 -2.9791 0.7838 0.7215 0.6912 -2.8439 0.4014 -0.6129 0.4884 -2.8006 -2.0929 0.5839 -0.0566 0.9792 1.1340 0.4106 0.6939 1.1061 0.8913 0.5957 0.0803 0.3117 0.7290 1.5178 1.2276 1.1779 -0.4407 0.1351 0.6074 -0.4533 0.7643 0.6432 0.3187 -0.5022 1.2258 -1.9462 0.6927 -0.2050 0.5268 -3.0271 1.0411 -1.3247 -0.4897 -0.3432 -0.0473 0.0032 0.0379 -0.4140 0.7561 0.5181 0.8393 -1.1747 -0.3566 -0.4092 0.7564 -0.3972 -0.4373 0.9134 1.4008 -1.1615 0.2169 -0.4268 0.3643 -2.6163 0.1895 0.5695 0.8050 0.7563 -0.7371 -0.4220 1.2266 -1.6249 0.8305 -0.3318 -0.4914 -2.8116 0.9450 1.1824 0.9893 -1.1279 0.3488 1.4771 0.6561 -0.7003 0.8152 -0.4560 0.1936 0.3825 0.6258 -0.2092 -0.2613 0.4785 -2.9512 0.4342 0.0571 -0.6963 0.0425 -0.4790 -0.8210 -0.4360 -2.7529 1.1358 -0.0399 -2.1757 0.1716 0.8914 -0.0620 0.9562 0.7447 -0.3817 0.4534 0.5468 0.4937 0.0598 -1.0442 -0.0924 0.0736 -0.0852 0.1929 -0.4587 0.1091 0.2115 -0.3466 -0.0004 0.7492 0.8845 -2.7000 0.0150 -2.8925 2.5095 -0.2221 1.1427 -2.5701 -0.0806 -0.3770 -0.2860 0.4918 0.5354 0.8707 1.1241 0.0844 -0.0144 -0.0564 0.8374 1.6036 0.1467 0.4592 0.3179 0.2101 -0.2102 -0.1570 -0.0607 -1.3129 -0.4274 -0.5403 1.1988 0.7553 -0.6921 -0.8593 0.7881 -0.0266 -0.1482 -0.8589 -0.3459 -0.3744 -0.4477 -0.3743 0.5200 -0.0269 0.9487 -0.8189 -0.4901 0.6258 -1.0300 0.8650 -0.5571 0.7243 0.0673 -0.4373 0.7706 0.5712 0.3907 0.1027 0.0490 1.2497 1.2071 -0.9984 0.1379 -0.8137 0.1871 0.4457 0.5273 0.9886 0.1618 0.0459 -0.5338 0.1541 -0.0236 0.3372 -0.2537 1.1253 -0.8692 0.3789 0.2482 1.3279 0.0830 0.7621 0.5788 0.9337 -3.1068 0.2975 1.4720 -0.1728 0.2689 -0.1687 0.4793 0.8438 0.7183 -1.0359 0.7829 -0.2291 1.0358 1.6614 0.3506 0.7070 1.1495 -0.2164 -0.5321 0.6740 -3.3763 -1.1807 -0.0278 0.2357 -0.0477 -0.2921 1.5171 -0.7043 -0.1043 -2.3211 1.0954 0.1978 0.1832 -0.3022 1.4280 0.4204 -0.2027 1.2373 0.4306 0.9829 0.7927 0.9483 0.1455 -0.4626 0.5711 -0.0496 -0.1067 -0.0674 -3.4077 0.3036 0.3089 0.0127 -2.5244 -0.2099 -2.2451 -0.5183 -0.2345 0.6591 -0.5731 0.5641 -0.2899 -0.1459 -0.5584 0.0488 0.1602 -0.7601 0.4580 0.9571 0.7233 -0.1993 0.9675 0.6910 N-stearoyl-sphinganine (d18:0/18:0)* -1.3310 1.1990 -1.6689 -0.3952 0.0517 -0.4556 -0.3649 -0.3266 -0.0114 0.8615 1.1981 0.5815 -1.5639 0.9035 -1.8296 -0.5832 1.4851 0.7130 0.6769 0.4832 -1.4357 -0.3044 -1.2655 -0.5664 1.0314 -1.5857 -1.7821 0.5543 -1.4336 0.2863 0.1309 -1.4528 -1.2126 0.2307 0.0373 -1.6275 -1.5603 -1.3572 0.3719 0.6594 -1.3540 -1.1544 1.0506 0.5908 -1.4540 0.7726 0.8484 -0.2995 -0.1982 -1.5859 -0.3012 0.4679 0.1280 0.0409 0.7394 0.9452 -0.1030 0.2681 -0.0023 0.3545 -1.4454 0.0325 0.2311 -1.5155 0.4459 -0.9596 -0.7665 0.1826 0.3692 0.7694 0.7005 -0.3880 0.0436 1.0501 -0.6113 0.0420 -1.4483 0.0035 0.6764 0.2192 0.2921 -0.0991 0.5982 0.7140 0.4330 -0.2811 -1.4605 1.9430 0.4624 0.2826 0.5033 -0.9234 0.3086 0.1932 0.1272 0.9247 -1.5957 0.9689 -1.5294 1.1073 -1.7689 -1.8905 -1.4521 0.3877 -1.5155 0.6796 -0.2414 0.6464 1.6669 0.8713 -0.0688 -1.7683 0.0401 1.7542 0.5853 -1.0630 -0.6115 -1.5462 -1.7303 -1.8648 -0.0066 1.5835 -0.7262 -1.7172 1.0180 -0.0641 -1.7486 0.0668 0.6323 0.5359 -1.7598 0.8042 -0.4595 -0.5008 -1.6693 0.0708 -0.5246 -0.4095 -1.6413 -1.1604 -1.4227 -0.3499 1.7544 0.8548 -1.5013 -1.6903 0.9741 1.0493 -0.1222 -0.5289 0.3806 0.7395 1.3122 1.6071 1.1923 0.3904 0.0958 1.1341 -0.4190 0.1234 0.8983 1.2345 0.1111 0.5021 -1.5624 -1.7950 -1.7556 0.4559 -1.7891 0.9977 -1.4450 -1.6385 0.3050 0.4925 -1.8087 -1.3214 -1.4000 -0.6235 1.0347 0.6321 0.1202 0.7196 -1.6732 -0.0402 -1.4295 -0.1089 -0.1091 1.2786 -0.4777 0.2099 -0.0550 -0.1330 -1.5171 -0.2273 0.4107 0.3041 -1.5528 -1.8720 0.2707 1.1837 -0.4145 0.7036 -1.4728 -0.5526 0.5568 -1.3049 1.5654 -0.9332 -0.0877 -0.2198 1.2679 0.7608 -0.2437 1.0172 0.2883 0.2498 1.3814 0.5204 -0.6564 0.4631 0.4137 -0.6218 0.4145 0.6813 -1.9608 0.7942 0.2791 0.1985 0.3114 -1.6068 1.2327 -0.1241 -1.5716 0.7409 1.0537 -0.8320 1.1183 1.2240 0.6887 -1.5193 0.6777 1.7611 0.4486 -0.5435 -0.7244 -1.6471 -1.6851 0.2176 0.0589 0.7330 1.1229 0.6353 0.0594 -1.6801 0.4970 -1.5742 -1.7094 -1.7034 2.7813 -0.4808 1.5343 -1.4877 0.0744 1.1229 0.0349 -1.3229 0.8084 1.2319 1.3176 -0.8633 1.1282 0.6792 -1.8152 1.8658 -0.2273 0.3202 1.0606 0.2318 -0.8755 0.3275 0.7480 -1.8297 -0.4542 0.2667 1.8626 0.9960 -1.7551 -0.1643 1.0569 0.1394 1.4939 0.1277 -1.7322 0.7178 -0.3114 0.5341 0.8379 0.5788 1.2611 -0.5454 -1.6409 0.4581 -0.7749 0.1235 0.1577 0.5462 0.5722 -1.4046 0.2884 0.7898 0.5040 -0.4669 0.3004 0.9627 1.5292 -0.7603 0.3811 -0.0884 0.5104 1.0039 0.8209 1.0542 0.2542 -0.0386 -1.7095 -0.3335 0.2934 0.7200 -0.3211 0.6360 -1.5475 -1.5575 0.3885 1.5253 -0.6678 0.3613 0.5302 1.1054 -1.8521 -0.0929 1.0345 0.6284 0.1520 0.0449 -0.2787 0.9823 1.2727 0.0745 0.8782 0.1937 0.7963 1.0723 0.8867 0.8329 1.9483 0.2186 -0.4623 0.6457 -2.0255 -0.1282 -0.0617 1.2594 -0.1403 -0.0483 2.1615 -0.5932 0.7758 -1.1145 0.1420 -0.1769 0.0730 1.1282 1.3132 0.9051 0.1403 0.8931 0.8329 0.8963 0.4988 0.7961 -0.7856 -0.7303 0.6185 0.3374 0.8207 1.0888 -0.7579 0.7738 0.8557 0.0348 -0.1667 -1.6233 -1.2630 0.5963 -0.0347 0.6074 0.2434 1.0441 0.0180 0.1863 0.7815 0.4616 -1.6107 0.4312 -1.9397 0.6593 1.2766 1.2629 1.0075 1.2446 N-stearoyl-sphingosine (d18:1/18:0)* 0.1107 0.6038 0.2500 -0.4757 -0.9157 -0.7044 -2.1946 -1.5685 -0.2209 0.3778 -0.3020 -0.0342 0.3682 -0.3075 -0.5550 -1.2281 0.2792 0.6859 0.1146 -0.2369 -0.7786 -0.5712 -1.2475 -0.3014 0.4482 -0.4588 -1.4815 0.7083 -0.2084 0.2598 -1.0758 -0.5001 -0.4795 0.7025 -0.9275 0.0005 -0.7654 -1.1750 1.0569 -0.4203 -0.2911 0.5873 0.0531 0.7170 0.1265 0.4214 1.6861 -0.4140 -1.0632 -2.8961 -0.9294 -0.7798 -0.5333 -0.0532 0.7832 2.0120 0.8901 0.7424 -0.4233 -0.9644 -0.6171 -0.6278 0.1804 -1.0391 0.7078 -1.5446 -1.7078 -0.8148 0.8916 0.7028 0.1903 -0.9433 1.5629 1.5467 -0.9398 0.8185 -0.5272 -0.2361 0.9604 0.6935 0.1188 -0.1352 -0.3091 0.2147 1.6190 -1.5500 -0.6384 2.4207 0.2232 0.4526 -0.3223 -1.1532 -0.3043 -0.4336 0.3435 0.1079 -1.6107 0.6351 0.7724 0.7544 0.9834 -3.3679 -0.4743 0.3880 0.4530 1.2528 0.5124 -0.3674 0.9769 1.2509 -1.5785 -0.0442 -1.7202 2.3713 -0.8163 -1.2588 -1.6658 -0.8335 0.1135 -1.0298 -1.0293 1.7758 -0.1286 -0.7730 1.1888 -0.0739 0.2966 -0.6990 0.1402 0.8745 -0.1095 0.3783 0.5964 0.7315 -2.0772 0.3861 -0.4837 0.3506 -1.5136 0.0705 -1.5320 -0.2221 1.5667 0.7248 -0.2467 0.3307 1.3053 0.5174 -0.1687 -0.3472 -0.2794 0.6900 1.2472 1.5051 1.5308 -0.4875 -0.6485 0.8601 -0.0607 -0.3001 0.7136 0.1102 -0.2118 1.3220 -1.6171 0.5369 -0.6150 0.1224 -1.9854 1.4038 -1.4227 -1.0736 -0.9172 -0.3786 -0.9894 -0.2476 -0.5146 0.9166 0.5794 0.5219 -2.4417 -0.6426 -0.9485 0.3667 -0.3564 -1.3263 0.5095 1.4664 -1.0257 -0.3456 -1.5354 -0.1946 -1.8438 -0.0726 0.3229 0.3423 1.2983 -0.9932 0.1521 1.1771 -1.2137 1.3604 -0.4866 -0.0365 0.0448 0.6058 1.6225 1.0163 -0.0482 -0.0484 1.4628 0.4512 -0.1115 0.9876 -0.9351 -0.3995 0.0070 1.1512 -1.2132 -0.1332 0.1476 -1.3225 0.4729 -0.2627 -1.3140 -0.3169 -0.9516 -1.4228 -0.8406 -0.0593 1.9685 0.2527 -3.7529 1.6087 0.7720 -0.5282 1.3342 0.9869 -1.0646 0.0357 0.4616 1.0363 -0.0861 -1.9542 0.0400 -0.7131 -0.6677 0.3360 -0.6705 -1.0192 0.2920 -0.4878 -0.2898 0.4428 0.6944 -0.5748 -0.2659 -1.9841 3.8051 -0.6858 1.5284 -0.8599 -0.4920 -1.0801 -0.1688 0.7496 0.2425 1.9074 1.2663 -0.8975 -0.1703 0.4659 0.5367 2.0319 -0.0486 0.8704 -0.1640 -0.2387 -0.7409 -0.3384 -0.0474 -1.6711 1.0722 -1.4094 2.0311 0.5086 -1.3471 -1.1713 0.7493 -0.1872 0.7282 -1.1504 -0.3160 0.0819 -0.0528 -0.7671 -0.0005 -0.5640 2.1033 -1.5891 -0.2091 0.5181 -2.0202 0.6193 -0.2276 1.0322 0.1537 -0.1095 0.4636 0.9948 -0.0582 -0.0113 -0.0885 1.8241 1.6703 -1.2812 0.5719 -1.4508 0.8406 0.0405 2.2528 0.5777 -0.0207 -0.8164 -0.9915 0.4774 0.8124 0.8880 -0.4894 1.4186 -0.6187 0.1763 -0.1165 1.1589 -0.0417 0.5488 0.6664 1.2121 -1.1467 -0.1945 2.2286 -0.6104 -0.1178 -0.0817 1.0435 1.6399 0.7904 -1.1473 0.9773 -0.3462 0.6376 2.5710 -0.1309 0.2391 2.1046 -0.1819 -1.5144 1.1552 -0.5906 -0.6855 -0.4957 0.6186 -0.9029 -0.6198 2.3402 -1.1472 -0.3630 -2.4567 1.1576 -0.3119 0.4413 0.0301 1.9010 0.5977 -0.6953 0.5156 0.2058 1.0810 0.4125 1.0152 -0.2841 -0.7756 1.0325 -0.3588 0.3389 0.7400 -1.3560 0.2429 0.6632 -0.6167 0.2402 -0.0412 -0.2061 0.5957 -0.7555 0.5121 -0.1736 1.2498 -0.8620 -0.9366 -0.2999 -0.0678 -0.7941 -0.0276 0.5492 1.0681 0.6214 0.9473 1.0424 0.2836 O-acetylhomoserine 0.4698 1.0902 0.2893 -1.4252 -1.0236 0.5378 1.0731 0.3358 -0.1208 -1.1663 0.2722 -1.7100 -1.4773 0.6668 0.1746 0.1030 -0.0917 0.1223 0.1443 0.0355 -1.3462 0.8960 -1.1511 -0.2471 -0.0912 -0.3614 -0.0041 0.9558 -0.6173 -1.5481 -0.3295 -0.4028 -1.1017 -0.6236 0.1601 0.1768 -0.0034 -1.2582 0.3099 -1.1267 -0.0754 -0.0028 0.3032 -0.1048 -1.3618 1.8288 -1.5280 -1.4981 -0.2822 1.1636 0.3124 0.1585 -1.4537 -0.8919 -1.1963 -1.7039 -0.0055 -0.7473 0.1821 -0.4746 0.0324 -0.0431 1.0304 0.4307 0.7919 0.3358 0.1954 0.2664 -0.5948 0.1454 -0.0840 0.2422 0.1667 0.0107 0.0834 0.4053 -0.0652 2.1490 0.6261 0.3715 -0.4643 0.4355 -1.5308 0.2019 0.4059 -1.6740 -1.3663 -0.3826 -1.7487 -0.7430 -0.0637 -1.4583 0.3910 0.4459 0.1879 -0.0834 -0.5373 0.4049 -1.4500 0.1538 -0.2728 0.8715 -0.0158 0.9243 5.4730 0.5824 -0.5115 -0.6032 0.3951 0.8032 0.4846 0.2724 -0.0785 -1.1854 0.0061 1.1347 0.7865 0.4257 -0.0188 0.7412 -1.4011 0.3882 -0.1826 0.1447 0.5010 1.3452 0.1734 0.3750 -1.6308 -0.3245 0.8782 0.5521 0.8296 6.8207 0.4654 0.1562 0.0779 3.5541 -0.2803 -0.4968 -1.3155 0.2701 -0.5597 0.3942 -0.3265 -0.3550 -1.5195 0.2458 0.0126 -1.3689 1.0741 -1.3225 -1.4172 2.2386 0.0307 -0.3219 -0.7012 -1.3250 0.8334 -1.0645 0.6514 0.0006 0.8607 -1.5414 0.1439 0.0576 0.3595 0.2623 0.8963 -0.7641 0.2644 -1.5626 0.1205 0.0634 0.0684 -1.2228 0.0978 5.2083 -0.4564 0.6390 0.1971 -0.1311 0.7835 1.4845 -1.3396 -1.8070 -1.5762 -1.4641 -0.1896 0.3276 0.3272 -1.3563 0.3588 -0.0089 -0.2153 -0.4704 0.3935 1.7298 0.1162 -1.2271 0.8049 -0.5112 0.5791 -0.1100 0.9117 -1.2041 -0.5665 -0.7900 0.0196 0.2446 -1.4945 0.5824 0.4943 0.8469 0.4796 0.0996 0.4741 0.4821 0.6624 0.3721 -0.1165 -1.6770 0.7338 -0.2415 -0.3700 0.1657 1.0462 0.7497 -0.0218 0.1148 0.2252 0.3455 0.3255 -0.6863 0.8753 0.8329 -1.6144 0.6904 0.4536 0.7278 -0.2753 1.1245 0.0720 1.2851 -1.6874 0.3801 0.7036 0.9793 0.7210 0.2035 0.2538 0.1982 0.2152 -0.0929 0.4332 0.2808 0.4188 0.3672 0.8662 -0.1999 -1.6636 -0.3873 0.3119 0.7095 -0.2685 -1.2193 0.0951 0.0013 0.3716 0.4577 -1.6992 0.4051 0.9102 0.1031 0.4656 -0.1529 -0.2906 -0.1082 0.1885 -0.0944 0.2782 -1.7663 0.3795 -0.2471 0.1450 -0.0981 -1.6955 -0.5491 0.3535 0.0008 0.2031 -1.7970 1.4097 0.9908 0.6729 0.7092 0.3740 -2.0082 0.4634 -1.7223 0.8160 0.6219 -1.6090 -1.7397 0.5460 0.5756 0.3129 -1.3145 0.3676 1.3269 -0.2402 0.1771 0.6972 -0.3801 -0.2466 0.1673 0.4420 0.0081 0.7283 -0.1340 -1.5657 -1.7305 1.4771 0.1594 0.7606 -0.0572 -1.6138 0.4563 0.5755 -0.3983 -1.4669 0.1646 0.5526 -0.1766 -0.1214 1.5728 0.1902 -1.6620 0.4948 -0.0748 0.5017 -0.1270 -0.7934 0.2643 0.2576 0.7078 -0.3717 0.8965 0.2588 -0.5274 -0.4029 -0.9437 -1.6858 0.2259 -1.6983 0.1287 0.3971 -0.2523 0.2293 0.2686 1.4308 -0.2892 0.2279 -0.8490 1.5954 -0.0248 0.2252 0.7601 0.3221 -0.0608 -0.1106 0.5594 -0.3776 -0.7312 -1.9870 1.0130 0.0574 0.2920 0.5308 0.5550 0.6419 0.9252 -0.1219 0.2792 0.4702 0.1981 0.7035 -1.6802 -0.3477 -0.3074 0.1586 -0.0693 0.2076 -1.6904 4.0482 0.1273 -1.9428 0.6618 0.7795 0.1846 -0.5909 0.1999 -1.5276 0.0726 -0.1152 0.6310 -1.6440 0.2084 0.3607 -1.9381 o-cresol sulfate 0.7227 -0.3992 0.8569 1.1690 -3.0738 1.7227 -0.9594 1.4066 1.8895 2.6012 2.4472 -0.0978 -1.9598 -0.1558 1.3154 -0.0944 1.8221 1.8813 -0.0514 -0.0474 -0.2411 -0.2110 -0.5158 0.2927 -1.9472 -1.2096 -0.9351 -3.5445 0.8266 1.1204 0.5074 -0.0247 -2.3128 -1.3258 -0.4082 1.8520 -0.0781 1.2621 -1.0089 -0.0644 0.4755 -0.7330 1.0673 -0.4528 0.2539 -0.1244 -0.0471 0.6109 0.0779 0.2708 -1.0154 -0.4686 -1.4522 1.4222 0.5074 0.2950 -0.3596 0.7596 -0.1026 -0.0815 -0.1356 -0.4344 -1.1142 2.2502 -2.0035 -0.3445 0.5913 -0.7242 -0.3723 0.3939 -0.0406 -0.0838 0.0402 -0.2614 -0.1702 -0.4445 -0.7418 -0.3295 0.3209 0.1068 -0.8024 1.3719 -0.5422 -0.6133 -0.2740 0.4616 1.3492 -1.1138 -0.3253 0.2688 -1.2221 0.8328 -2.0831 0.5743 1.3297 0.3766 1.0388 0.5257 -0.4526 0.3563 0.2663 0.2469 -0.2540 0.4744 0.2999 1.3445 2.6411 -2.3094 -1.4450 1.8442 0.8027 0.8878 -0.3164 0.4993 1.3655 0.8503 -0.4613 0.6246 0.9424 -0.6212 0.8597 -0.0328 -0.0602 -0.8553 -0.5926 0.9230 -1.1797 0.7455 0.4890 0.6437 0.6132 1.4904 1.6881 0.2589 -0.2334 -1.1790 -0.5433 0.1340 -0.5000 -1.1314 0.8496 0.1977 0.0659 0.1315 1.1362 -1.3294 -1.4831 0.8578 -0.2103 -0.3017 -2.3353 -2.0083 -0.2937 -0.1801 -0.3702 0.5544 0.6404 0.0046 -0.2246 -1.7346 0.9908 1.0827 -0.7521 -0.8139 0.7454 -0.3219 0.4567 0.6122 0.5657 -0.2942 -0.6290 -0.2080 0.2798 0.7803 0.0910 -0.8684 0.4488 0.6685 -0.1680 1.1648 1.0841 0.9039 -0.0226 0.6202 0.1618 0.8263 0.4611 -2.2255 -0.0939 -0.4961 0.2825 2.2981 0.5918 0.5431 -1.2912 -0.6542 -0.2410 -0.5574 0.0241 0.6013 1.0582 -0.1757 0.8087 -1.6575 0.3694 -3.2954 0.6283 1.1642 0.6544 0.9693 0.1002 0.4948 0.2081 -0.4530 -1.4880 0.1120 1.5053 1.3922 0.1011 0.5362 -0.5212 -0.2275 -0.1192 0.0522 -0.4096 0.0368 0.4136 -0.2914 -1.2132 -0.7965 1.1270 0.4088 -0.7855 0.1646 0.4995 0.7002 1.3128 -0.4059 -1.8822 0.0862 1.1805 1.1230 1.0447 -0.9923 -0.2781 0.1151 -0.3443 -0.1086 0.6556 0.2102 -0.6132 0.9341 -0.7853 0.1370 0.4182 0.3952 -0.9885 -0.0193 -0.1401 0.1844 0.6485 0.2515 0.3437 0.2866 0.4218 -3.3086 -1.4545 -0.6928 0.0661 1.7984 -0.4806 -0.2006 0.1150 -1.5839 0.7998 -0.5348 -0.0646 -2.7282 0.2197 0.2043 0.7878 0.0934 -0.4425 -0.1551 -1.7432 1.6028 -0.5296 0.1638 -0.1060 -1.3627 -0.9499 0.3704 -0.9235 -0.6132 -0.7143 0.7712 1.1131 -0.8975 -0.1365 0.2034 1.1542 -0.0062 0.1232 -0.1376 -0.5179 1.6241 1.0156 -2.9134 -0.5265 -0.2898 -0.3994 -0.0447 0.2989 0.3172 0.3012 -0.3356 -0.0369 0.0321 -0.2570 0.5868 0.1777 1.7045 -0.4549 -1.3572 0.8178 0.9860 -0.3731 0.6914 0.6149 0.5710 -0.6987 0.1798 -0.0722 0.4319 -0.1462 0.0378 1.9149 0.8107 0.1404 -0.4824 0.7596 0.0679 0.3264 -1.1112 -0.1162 -0.4707 -0.0865 -3.5220 -2.3114 -0.6299 -0.4417 -2.9802 0.0867 -0.0473 1.1840 0.6820 -0.9511 0.4453 0.2454 0.0029 0.0295 0.2321 -0.1447 -1.1839 -3.8597 0.1937 -0.9505 0.4721 0.5607 0.5345 1.5872 -0.5473 -0.5870 -0.4624 0.3413 1.8933 0.4988 0.9063 1.5541 0.3128 0.2061 -0.5617 0.0713 0.6031 -1.4221 -0.3692 0.6945 -0.4159 -0.6630 -0.4371 -0.7551 0.4117 -2.5400 -0.4125 0.0383 0.6403 0.3069 0.9119 -1.2855 -1.9101 0.6109 1.4715 0.7089 -0.1697 -0.1359 0.9628 0.5984 0.1834 -0.4146 -0.1991 octadecadienedioate (C18:2-DC)* -0.1955 0.3855 -0.1877 0.6516 0.3839 -0.3152 2.6668 1.6561 0.8017 0.0043 -0.0418 -0.7251 0.6900 0.1075 -0.2217 -0.8818 -0.2201 -0.9803 -0.8666 -1.4144 -1.0944 -0.3918 -1.1588 -0.6930 -0.1211 -0.7763 1.4739 -0.6409 -0.6727 -0.6656 0.0709 -0.5596 0.8719 0.9944 0.0388 0.3345 -0.5957 -1.4171 0.8071 -0.5280 1.2309 -1.0224 -0.8745 0.1030 0.0228 0.2660 -0.7427 0.0941 -0.8248 -1.0914 -0.8862 -1.2250 -2.1641 0.0369 -0.7778 -1.0659 0.5942 -0.6372 -0.6989 -0.7103 -1.8514 -0.7137 -0.5182 0.0986 -0.4695 1.5899 0.3088 -0.1168 -0.8879 -0.1149 -0.0881 -0.3575 -0.3935 0.1681 -0.2204 -0.0119 -3.2185 1.4391 -0.1109 -0.3123 -1.7939 -0.4515 -0.3340 0.6123 0.4894 2.5150 -0.3478 -0.1074 -0.7290 -1.1447 0.1614 0.5533 -0.2215 -0.6710 -1.4799 -3.3543 0.5764 -1.2721 -0.3301 -0.8977 0.6681 0.3728 0.0460 2.2169 -1.5779 -2.6675 0.3284 -0.5961 -0.0104 -0.4298 2.3468 -0.1816 1.1754 0.2427 1.3459 1.4726 -1.4150 0.2705 0.5845 -1.6554 0.4055 -0.6066 -0.2125 0.3127 1.2304 -1.0020 -0.0188 0.3784 0.3607 0.2611 1.2463 -0.8699 -0.0765 -0.1096 1.0859 3.2894 -0.8009 -0.6222 -0.8516 -0.9103 0.3985 -0.5620 -1.2933 0.1607 -1.2122 -0.9193 0.4119 -1.4463 -0.2292 -1.0030 0.5945 -0.7298 0.6243 -0.2812 -0.8991 0.3323 0.0527 -1.6175 -0.3380 0.0069 0.3563 -0.1380 -0.3340 -1.0727 1.4936 1.2477 0.1292 1.7476 -0.0921 -1.0590 1.1862 -1.1339 -1.2547 -1.6539 0.5202 0.2415 0.2427 -2.5953 -0.6683 -0.0761 0.5299 -0.2922 1.7371 -0.9226 1.0221 -0.5086 0.3018 1.6888 -0.6506 -0.9868 0.8210 0.5284 -0.6393 -0.4869 -0.0565 0.0915 0.6602 0.5796 -0.5975 -0.3770 -0.8958 -0.5615 0.0718 0.2778 0.5953 0.1667 -0.2567 -2.4556 -0.8636 0.7906 -0.8651 -0.7462 -0.7497 1.4227 -0.4214 -0.7811 -0.7762 0.6955 2.9399 0.7341 1.8384 1.4124 0.2199 -0.7909 0.5180 -0.3499 0.3128 0.4630 0.5004 -0.4781 -0.5295 0.3144 1.2607 -0.6931 -0.8863 -0.1639 0.0183 -0.5611 0.5962 0.8456 0.3582 2.2388 -0.3116 1.9645 0.8658 0.5432 -1.4462 0.1792 0.3746 0.1002 0.3287 -0.3604 -0.2485 0.0518 -0.2141 -1.1121 -0.8892 -0.8470 -0.8733 1.2926 -0.9615 1.5155 0.8228 1.2505 0.1332 1.6248 -0.8219 0.2079 1.1489 1.3120 -1.2224 0.9273 2.3658 0.5416 -0.3230 -0.5016 0.0502 3.2889 -1.4404 -1.2072 0.4660 0.9129 1.1480 -0.5114 -1.0093 0.5438 0.6966 1.4272 0.1978 0.4956 0.2690 -1.7013 -0.2460 -0.2026 -1.1586 0.9403 0.4693 2.9128 -0.7642 -1.3414 -0.5782 -1.0912 2.0172 1.7597 1.3716 0.4817 1.2084 -1.2339 0.4393 1.1242 -0.2873 0.0695 0.4917 -0.9525 -0.2603 -0.3092 -1.6505 0.0933 -1.3628 0.8798 -0.8557 0.3984 0.5248 1.7394 -0.7801 1.3638 1.5488 0.4099 0.6119 0.0212 -0.8343 1.3233 -1.3286 -0.5175 -0.9632 0.3396 -2.2970 -0.4105 0.0969 0.3772 0.3722 -0.8450 0.2705 -0.9712 0.6037 -0.3996 0.6331 -0.2120 -0.5875 0.2316 1.2371 0.0436 -0.4159 1.2479 -0.3825 -0.4307 1.6142 -0.2548 0.7848 -0.5939 2.7376 0.1616 0.9372 -0.2689 -0.0197 1.0097 -0.2266 1.4573 1.6618 -0.5094 0.5438 0.1354 0.3365 1.0074 -0.3432 -1.4428 -0.0347 0.8035 0.3564 0.0201 -0.5792 0.6580 -0.4717 -0.4049 0.4601 0.7404 -0.1305 -0.6831 -0.7416 0.0440 -1.1620 -0.8829 0.6000 0.2474 -0.3012 1.4025 2.9433 0.3655 1.8506 0.2662 0.2058 0.6483 0.3796 -1.7426 0.3278 -1.1550 0.3061 -0.2816 -0.1479 -1.2285 octadecanedioate (C18) 0.8150 -1.2588 0.3882 0.6551 0.8085 0.1747 -1.4543 -0.0573 0.3508 0.8270 1.6398 -1.2430 2.0703 -0.3598 -0.7825 -1.3390 0.6949 -0.4513 -0.8196 -0.5100 -0.3435 -0.6356 -0.6182 -0.7158 1.2742 1.0885 -0.6627 0.3861 -0.5906 -1.5427 -1.3335 -0.7316 0.2451 0.5720 1.1427 0.8120 -0.0273 0.0497 0.9869 0.5432 -1.1989 -0.1038 0.4120 -0.8216 0.7296 0.7821 -1.4037 -1.4260 -0.5194 -0.3651 -0.4034 -0.8240 -0.5868 1.3274 0.2743 0.7678 0.5150 1.0931 -0.8880 -2.2760 -0.9647 0.4042 0.1790 -0.4523 -0.2581 0.5610 -0.0280 -0.7747 -0.2010 0.3651 0.1837 -0.7493 -0.9021 1.3660 -0.4878 -0.0788 -2.4170 -0.5382 -0.1489 -0.8281 -0.1686 0.2764 -0.0781 1.4446 -0.1826 -0.5034 0.4407 1.2464 0.2554 -0.0707 0.4526 0.6291 -0.7880 0.5822 -0.3425 -1.3505 -0.4204 -1.5835 -0.6244 0.0910 -0.2626 -0.0687 -1.6876 1.4021 -0.6152 -1.6658 -0.1408 0.6142 0.1531 -0.5678 1.4373 -0.6654 -0.1900 1.7715 1.4299 0.4735 -0.5958 0.0865 0.2995 -1.5397 0.5650 0.3081 0.0530 0.1959 -0.2322 -0.4360 0.4057 -4.3441 0.5173 0.0384 1.0498 0.4776 -0.2816 -0.1196 -0.5646 1.5745 -0.7059 0.6517 -0.8753 -0.9137 1.8715 0.0696 1.5544 0.1862 -0.5606 -1.1027 0.8061 0.3899 0.4742 1.1360 0.8099 0.4082 1.0039 0.9897 0.2902 0.1200 0.0796 -0.9689 -0.7512 0.8243 1.4262 0.8934 0.1716 0.4738 -0.1831 4.4151 -1.5139 -0.2989 -0.9671 -0.1348 -1.4488 -0.0019 -0.3270 -0.4100 0.1714 0.9702 1.1820 -1.7355 0.2916 -0.1691 -0.2845 1.0764 2.3612 -1.7196 -0.4677 0.4526 -0.1874 -0.0088 0.2266 -0.9694 0.2126 0.4180 0.5947 0.0142 2.2305 0.3642 0.2717 -0.3478 0.1542 1.6391 -0.8553 0.5673 -0.4157 1.0194 2.9977 0.6082 1.0438 -1.5273 0.3485 -0.2213 -0.4190 -0.2712 0.2570 -1.3411 0.0943 -0.4801 1.4056 0.3122 1.7792 -0.7309 0.4181 -0.1992 -0.0888 -0.6684 -0.0134 -0.3352 -0.2728 -1.2242 0.0283 0.4049 -0.8505 0.1293 1.1427 0.9678 -0.3946 1.5034 -0.7198 1.0811 0.5129 2.5886 0.3607 0.9920 0.4885 0.1110 -1.1280 0.9139 -0.8237 0.2466 -1.1807 1.0979 0.6305 -1.3183 0.8626 0.0819 0.2548 0.1382 -0.9177 1.1574 1.1694 0.2789 0.6295 0.2712 -0.2454 0.5283 -0.6881 1.3264 -1.2065 0.9786 -0.6147 -0.3797 0.1968 -0.2719 0.1562 0.1622 -1.5012 -3.4939 1.0872 -0.3033 -2.0217 0.4786 0.7149 -1.0778 0.0095 -0.3160 0.2929 0.1562 0.4293 1.7103 -0.0176 -0.5756 -1.1730 -1.5126 0.4070 1.2025 -0.4105 1.1444 -1.1437 0.1083 -0.7805 -1.0391 -0.8350 -0.5140 -1.6310 1.2264 0.8089 -0.4380 0.0506 0.3000 0.4563 -0.2861 1.0205 -0.6481 -1.1578 -0.8874 0.4510 0.0591 -2.1731 -0.8585 -0.9236 -0.0140 -0.2773 2.1465 -1.6513 1.4292 -1.2712 0.9741 2.6269 0.5577 -2.3210 0.7423 -2.3602 0.2186 0.0958 -0.7334 -0.8715 -0.5885 -1.0326 -0.0760 -1.7818 -1.0085 0.5081 -1.0784 0.5706 -0.9547 -0.7167 0.1038 1.0862 0.2854 0.1179 -0.3058 1.2694 0.7158 -0.8210 0.8591 0.6969 0.1055 0.7780 -0.5492 -0.4022 -1.3220 -0.3993 -1.1897 0.9676 -0.2333 0.7908 1.3681 0.2316 0.4898 0.7328 -1.6006 0.6813 0.5622 0.1702 0.6498 0.2342 0.0791 0.1310 -4.9066 0.2352 1.6536 0.6018 -1.5785 0.6381 -0.1575 0.5263 -1.1305 1.2812 -0.1894 -1.2780 -0.4066 -0.5231 0.2709 1.9782 0.1030 0.7308 1.4092 -0.4880 -0.9554 -0.3073 0.3034 -0.0311 0.3103 0.4607 -0.7051 1.3429 -0.8044 1.2113 -0.8079 0.5133 0.2815 octadecanedioylcarnitine (C18-DC)* -1.4110 0.2015 0.2911 0.5450 0.8628 0.3911 0.2939 0.1698 0.4810 0.9570 0.8119 -0.3296 0.5193 0.2589 -0.5581 0.4466 0.1975 0.1750 0.8723 -1.5108 0.1838 0.0136 -1.3291 -1.7613 -0.2040 0.7953 0.4336 1.0557 0.0601 0.1709 -0.2416 -1.5856 -1.2750 0.8860 0.0362 0.2166 -1.7263 0.6849 1.2253 0.2204 -1.4522 -1.1826 0.0378 0.1464 0.2558 0.1469 -1.7941 0.9591 0.2492 0.1992 -0.0078 -0.7966 -1.6963 0.4502 0.1427 0.7427 0.6995 -0.0368 -0.4538 0.0468 -1.5851 -2.0213 0.6184 -1.6617 -1.7455 0.2026 -0.1992 0.5807 0.3205 0.6954 -1.8084 0.7790 -1.8770 -0.1028 -1.7977 -2.0181 -1.5870 0.5654 -1.5690 -0.0544 -0.0722 0.0244 -1.7907 1.2363 0.0664 -0.4245 0.7467 1.7710 0.2861 0.2597 1.1536 1.1351 -1.7172 -1.3454 0.0528 0.2698 -1.7672 -0.6993 -0.0892 0.9967 0.3713 -2.1838 -1.6025 1.1579 0.5260 -1.6772 1.5265 0.9175 0.8364 0.2105 1.3516 -2.0205 0.3720 0.9535 0.1407 -0.3445 -0.7723 -1.7107 0.1735 -0.1734 0.3284 0.4086 0.6801 -0.0886 0.5705 -0.2377 -0.0312 -0.0058 0.7337 0.2407 0.4869 0.6569 -1.4163 -1.9864 -1.8697 0.3379 0.6202 -1.3634 -1.8372 -1.1900 0.9244 0.3744 -1.7211 0.3620 0.3048 0.0435 -0.0510 -0.1489 1.2082 0.8352 0.7041 0.8426 0.2169 1.5177 -1.8632 0.1843 0.4341 -1.5450 0.4906 0.1924 1.2675 1.0479 -1.5871 0.4148 0.4392 0.6436 -1.9898 0.2538 -2.0143 0.2559 0.5827 -1.8296 -0.0150 -0.6237 0.9717 0.4775 0.9991 -1.5465 0.3123 0.3041 0.5691 0.3908 0.6222 -1.8551 -1.5633 2.2256 0.1785 1.0903 0.3675 -1.6568 0.4318 0.5237 0.3595 0.2675 0.9259 0.3614 -1.7118 -2.1471 0.3398 0.7880 0.4035 0.4462 -1.6147 0.9392 0.7537 -1.3998 0.5548 -0.8936 -1.7763 0.3860 0.9309 -0.8903 1.0745 0.1651 0.1794 0.0758 0.2367 0.6960 0.7724 -2.0298 0.5446 -0.0865 0.4062 0.8879 -2.2661 0.7237 -0.3668 -0.0228 -0.1978 -1.7832 0.8067 -1.6253 0.3837 0.4373 0.0655 1.3193 0.0410 1.3644 -0.8286 0.9216 0.9729 0.4798 1.0037 1.6632 -1.9851 0.2539 0.0604 0.7707 0.3345 -0.1210 0.6755 -0.4098 0.7889 0.4111 0.6585 -1.7514 -0.1809 0.2814 -1.7921 0.7909 0.6234 -0.0942 -0.2682 0.4931 -1.9692 -1.4152 -2.0111 -0.0185 0.9347 0.6400 0.0884 0.4429 0.5551 0.6721 0.4220 -1.9236 0.6894 0.3651 -2.0700 0.0950 1.1486 -2.0726 0.2585 1.1335 0.5127 0.0398 -0.0593 0.9107 -0.5715 -0.8363 0.1442 -0.1365 0.2612 0.7424 -0.7600 0.1639 -1.9739 1.2533 -0.1505 -2.0224 -0.0676 -0.4381 0.9571 -2.0415 1.7982 -0.3622 -0.2258 0.7528 0.2005 0.7334 0.3861 -0.5695 -0.1450 -0.8583 1.4672 0.6954 -1.8061 -0.5042 -1.7485 0.6753 0.6289 1.1961 0.0611 1.4198 -1.9412 0.7107 1.9303 0.2466 0.5628 0.6082 -1.7162 0.2277 0.6450 -1.6097 0.6302 -2.2285 -1.9772 -0.1310 -2.1305 0.0156 -1.8427 -0.1645 0.6134 0.0986 0.2928 0.4270 0.9561 0.9283 -0.1370 0.9224 1.3645 1.1942 0.3716 0.7711 1.0860 0.5343 1.2970 0.0727 -2.3295 -0.3157 0.6291 -0.3096 0.7310 -1.6330 0.6375 0.8360 0.2974 1.1601 0.4770 0.2853 0.9777 1.8574 0.9753 0.3415 1.2481 -0.3829 0.5665 0.5177 0.6485 1.3617 0.9461 0.2587 0.0700 0.8875 -0.0294 0.6636 0.2169 0.0714 -0.4966 0.8100 -1.5884 0.4373 1.3940 0.4325 0.5783 0.0785 0.7869 0.4164 0.8937 1.4476 0.7193 0.5282 -1.7842 0.3732 0.5837 0.4854 0.7779 -0.0910 0.3679 0.2007 octadecenedioate (C18:1-DC)* -0.9605 -1.1561 -0.3743 0.8678 -1.1034 -0.9890 0.8027 1.0540 0.0109 -0.2890 -0.1033 0.3790 0.6764 -0.5164 -1.1292 -0.7017 -0.0624 -1.5587 -0.9027 -1.5271 -1.2789 -0.8249 -1.2405 -1.1556 -0.1582 -0.0622 -0.2407 -0.6227 -1.5081 -0.4980 -0.1675 -1.0629 1.2783 1.5171 -0.4186 -0.2514 0.7385 -1.1337 0.3481 -0.2693 -1.2881 -1.0319 0.0505 -0.2458 -0.2101 1.0139 -1.8061 0.2098 -0.9380 -0.4768 -1.4307 -1.8716 -1.9498 -0.2772 1.1731 0.0054 -0.5840 -0.8266 -2.2130 -1.5804 -2.2104 -0.8893 0.4287 1.0282 -0.4367 1.0302 -0.3143 -0.0367 -0.6604 -0.9870 -1.1651 -0.7175 -0.7119 -0.1844 -1.2603 -0.7890 -2.2827 1.7884 0.9687 -1.2666 0.5807 -0.8432 0.3610 1.1925 0.4398 -0.3024 -0.7039 -0.1282 -0.9326 -1.6300 -0.0267 -0.4950 -0.4907 -1.1731 -1.6926 -1.4812 -0.0310 -2.3876 0.5761 -1.4123 0.4735 -0.2292 -1.3308 1.3912 -0.6864 -2.6084 0.4359 1.3321 0.1220 -0.5050 3.1145 0.5737 1.5922 0.6313 1.9493 1.1561 -1.2090 0.0294 1.2357 -0.4501 1.1817 -0.8691 -0.1546 -0.6275 1.1602 -0.5840 0.3256 1.3270 0.2658 1.4098 2.4905 -0.3810 0.0961 0.2264 1.8227 1.9374 -0.8282 -1.4603 -0.9703 -1.0685 0.4270 -0.5669 -1.1002 0.0197 -0.9646 0.5122 -0.1615 -0.5721 -0.4967 -0.7548 0.1656 -0.7969 1.1530 0.3384 -0.9660 -0.1945 -0.6406 -1.2018 -0.0165 0.8962 0.5890 0.6758 -0.1240 -0.8981 0.1879 0.8970 0.5872 -0.4498 0.4472 -0.2017 -0.6222 -1.2756 -0.6704 -2.3127 1.1219 0.1882 -0.2414 -2.1085 -1.4144 -1.3344 0.1571 0.9373 2.4469 -1.5959 1.2744 -0.9767 0.4250 -0.3688 -1.1893 -0.3185 0.2243 0.0266 0.1881 -1.0868 0.8273 -0.1458 1.0269 -0.0437 -0.4059 -0.2307 -0.7526 -0.7234 0.5377 0.9654 1.0961 0.1420 1.4430 -2.3067 -0.5520 0.0280 -0.3368 -0.9902 -0.5749 1.2896 -0.0567 -0.1741 0.2500 1.0168 3.0957 -0.0130 1.9566 2.0391 -0.0693 0.8614 1.4689 -0.2612 0.6640 0.5628 2.1108 -0.2056 -0.1956 -0.1343 1.0849 -0.3623 -1.0096 -0.2244 0.5283 -0.3979 0.6935 2.4130 1.1809 1.0394 -0.3733 0.0382 -0.0325 0.1412 -0.6892 0.5563 0.0034 0.2405 0.6077 -0.5275 0.6693 -0.2276 -0.3520 0.2298 -0.6508 -0.3342 -0.3198 1.2938 -0.7720 1.0138 1.3543 0.1200 -0.2211 0.1385 -0.9213 0.5538 0.2905 1.0476 -0.5970 1.0974 1.7143 1.0473 -0.4571 0.8874 0.1801 -0.0576 -0.9672 -0.8147 0.7986 1.6383 1.3126 -0.3952 -0.4976 0.2322 1.0926 0.8269 1.0910 -0.3495 0.3075 -1.2837 -0.2873 1.0121 -1.0770 2.0393 0.7586 0.8077 -1.4285 -0.8551 -1.0774 -0.8376 -0.3054 1.9436 2.0445 -0.3890 1.2628 -0.5743 1.0449 -0.3823 0.0209 -0.2919 1.2154 -1.1900 0.1936 -0.2141 -1.8843 1.7055 -1.0763 0.5482 -0.4635 1.2404 0.1459 0.9655 -0.2112 0.1647 1.5089 0.0117 -0.8064 0.2162 -1.5990 0.4752 -0.5967 -0.8533 -0.9512 -0.5000 -1.4149 -0.8772 1.4566 0.3365 0.4783 -0.9963 0.2293 0.0848 0.7853 -0.7597 -0.1204 -0.4470 -0.9323 0.4298 1.2272 0.5525 -1.1638 1.2322 0.2381 -0.5976 1.8108 -0.4026 1.7988 -1.1021 2.2077 0.9716 0.0127 -1.0894 0.4767 0.9008 0.8391 2.0533 1.0064 1.2075 0.2218 0.1592 0.1279 -0.0025 0.4250 -1.8632 -0.1473 -0.1164 -0.1727 -0.1405 -0.1559 1.7794 -0.6641 1.6571 0.2070 0.1931 0.9939 -1.0243 -0.1750 0.2455 -1.6974 -0.4672 0.9938 0.2557 0.5359 1.3951 1.1146 1.6610 1.3333 0.4392 0.2476 0.6580 -0.2628 -1.1615 0.9455 -0.9654 0.4185 -0.2922 0.0557 1.0367 octadecenedioylcarnitine (C18:1-DC)* -0.9009 -1.6455 0.7567 0.9313 0.6590 0.3930 0.6706 0.6189 -1.2761 -0.8470 0.6465 -0.1717 0.7482 0.4570 -1.4520 0.8355 1.0478 0.1800 0.5928 -0.9814 0.3384 -0.2960 -0.8333 -1.1802 0.6401 -1.1831 0.5546 0.8247 -1.0238 -1.2237 0.4699 -1.0403 -0.7862 0.9918 0.1807 -1.2285 0.5418 -0.9400 -1.0922 0.1826 -0.9323 -0.7140 0.5503 0.2399 -1.0416 0.9077 -1.2068 0.4555 -1.1861 0.5968 0.0068 -0.9065 -1.1316 0.7467 0.8485 0.4081 0.4568 -0.8599 -0.9072 0.7504 -1.0382 -1.3951 0.9050 -1.1036 -1.1679 0.3514 -0.1813 0.3907 -1.3971 0.5393 -1.2222 0.2037 -0.2086 -1.4294 -1.2110 -1.3914 -1.0401 1.1615 -1.0258 -0.3303 0.3966 -1.1342 0.2514 1.1922 -1.1087 0.0420 -1.0456 2.0377 0.1038 -0.8988 0.8758 1.0224 0.2146 -0.8426 -0.1326 -1.1259 -1.1896 -1.1621 0.5945 -1.3356 -1.3789 -1.5234 -1.0506 1.4234 0.3647 -1.1170 1.3179 1.3240 0.4815 -1.0913 1.5271 -1.3909 1.2187 1.1887 0.8726 0.0255 -1.0108 -0.2543 0.9437 0.0104 -1.0797 -1.1605 0.7812 -1.3036 0.6415 -1.3024 -1.3655 0.7092 0.3246 0.8326 0.7589 -1.0790 -0.9046 0.2904 -0.1308 0.7892 0.2913 -0.8619 -1.2447 -0.7201 1.3915 0.5362 0.3323 -1.2475 0.3882 0.8319 -1.1977 0.0861 0.8261 0.6575 0.3201 0.9128 0.7239 1.2383 -1.2641 -1.0250 -1.1895 -1.0060 -1.3438 0.2837 1.0220 1.1971 -1.0407 0.9861 -1.1464 -1.4158 -1.3686 -1.3213 -0.5781 0.3906 0.2550 -1.2392 -1.5456 -0.9973 1.5423 0.9248 0.3935 -1.0120 0.4008 -0.9644 0.2243 1.0635 0.9855 -1.2582 0.7263 0.9346 1.0388 -1.1413 -1.0024 -1.0978 -1.5214 -1.0342 0.4228 -1.0584 0.7619 -1.3273 0.8806 -1.4959 -1.2394 0.9368 0.5088 -1.0038 -1.0635 0.3356 0.8009 0.3453 0.6486 -0.4781 -1.1966 0.8325 1.1955 -1.2244 -1.4842 0.7800 -0.1241 0.0552 -1.5039 0.9672 1.5386 -1.4021 1.4915 -1.3519 -1.0236 0.5913 0.3834 0.6563 0.4120 0.3848 0.5724 -1.2023 -1.2878 -1.0744 1.2042 -1.3397 0.1013 0.8309 0.6265 1.3698 0.2628 1.3420 1.1472 0.7859 0.4172 0.9926 -1.3632 -1.2433 -1.2893 0.9454 0.2995 0.5227 1.2785 0.0502 0.9810 0.3735 0.5602 -0.0351 0.1220 -1.3117 0.8016 1.3972 0.7819 -1.0837 0.8940 0.5002 -1.3514 -0.9014 -1.3845 0.2569 0.9542 -1.3671 -1.3733 0.2582 0.8105 1.0720 -1.3517 -1.3141 0.8685 0.5380 -1.4375 0.3378 1.5012 -1.4388 1.1663 1.0748 1.1434 -1.2083 0.7893 0.2792 0.6898 -0.6134 1.1632 -1.4714 0.5789 1.0848 -1.2179 0.9462 0.5398 1.6503 -1.5337 -1.3963 0.3175 -1.3902 0.5811 0.8591 1.9567 -1.5161 0.8532 0.9047 0.7370 0.6034 0.9951 -0.1537 -1.3300 -1.4188 1.6109 0.8474 -1.2221 0.6638 -1.1723 0.8478 -1.2439 1.2248 0.4320 1.4356 -1.3266 1.0195 1.5996 0.5526 -1.3263 0.4574 -1.1456 0.6939 0.7048 -1.0634 0.1761 -1.5628 -1.3620 0.0111 -1.4805 0.1225 -1.2484 0.2002 0.6662 0.5069 0.4070 -1.1890 0.8589 0.7680 0.4629 0.7671 1.5431 1.1312 0.3055 1.1450 1.2484 -1.5584 1.9057 -1.3871 1.2383 -1.5099 1.2568 0.6767 0.5063 -0.5705 1.0043 0.6356 1.1638 1.4099 0.4595 0.9810 0.8545 1.7711 1.2021 0.5404 1.2689 -1.1048 0.8406 0.1885 0.3454 0.5188 0.9905 0.5650 -1.6499 1.0551 -1.7087 1.7303 0.6179 -1.3549 0.5277 0.8143 -1.0425 -1.2384 1.1228 0.5736 -1.4769 0.9224 1.4081 0.5558 1.3717 1.0902 0.9359 1.1029 -1.2039 0.2214 0.6198 -1.6799 1.0649 0.3191 0.2262 0.3811 octanoylcarnitine (C8) 0.7809 -0.1720 1.5858 1.2604 0.2890 1.3856 0.9830 -0.6375 0.8800 0.5454 1.2785 0.9902 1.8553 0.2230 -0.1493 -0.5423 0.8698 1.3951 0.3978 0.8992 -0.3278 -0.8690 -1.2722 -1.7415 0.4232 0.8021 1.6576 -0.2586 -2.0286 -0.0014 -0.4814 -1.9132 -0.0633 -0.0560 0.7639 -0.6152 -1.9635 -0.3763 -0.3713 1.9281 -1.6292 -0.3512 0.0959 2.0237 0.2731 -0.2119 -0.2195 -1.2796 -0.9905 0.4774 -0.5943 0.7207 -0.0122 1.2263 -1.2543 2.8429 -0.5831 1.1370 0.1230 1.9936 -1.7070 -0.7495 -0.0732 -1.5242 -1.7806 -0.4839 2.0216 0.4758 -0.0732 -1.4358 1.5843 -0.0924 0.0650 -1.4030 0.1704 -0.6368 -1.6874 -0.0192 -1.6566 -0.9200 0.2313 -0.4427 -0.9398 0.5482 -0.8631 -1.4023 -0.6782 1.9969 0.3053 0.7560 0.9021 -0.3808 0.2676 -2.4808 -0.6391 -0.9392 -0.2326 -0.2850 -1.4978 -0.1445 -0.3642 -1.7643 -1.8093 -0.1034 -0.3367 -0.4697 1.6244 0.4151 0.9395 -0.5606 -1.3990 -0.0399 0.1020 0.6560 0.3171 -1.5837 -1.9284 -0.4580 0.0603 0.8062 -0.7415 1.2595 0.0992 -0.3371 0.5154 -1.6167 0.6268 -0.6571 1.2041 -0.8725 -0.2809 0.1079 -0.8421 -0.9941 -1.6334 -0.5562 -0.0705 -0.5038 -1.3643 -0.7261 1.0062 -1.2337 0.1063 -0.0101 0.9635 1.5728 0.0129 0.0084 0.9155 0.1019 -0.6932 1.9707 1.8813 1.6376 1.1272 -0.5011 1.6442 -0.0186 -0.6456 1.3215 -1.1132 0.4771 -0.1773 1.7027 0.2937 -1.5997 -0.7660 -1.1441 -0.6001 -0.0132 0.3766 0.4337 -0.5201 -1.1791 1.2628 1.4519 0.3016 -0.3986 0.4929 0.0142 -1.3767 0.2146 -1.6103 -2.3971 -1.7069 0.2468 -1.0369 0.9544 -1.5445 -2.1727 0.9597 -0.0978 -0.3631 1.0398 0.0526 0.0755 0.4606 -0.9781 -0.7440 0.9078 -0.5038 -0.9358 -0.2955 -1.5047 0.0158 0.0386 0.9805 -1.3451 -1.1539 -1.2261 0.4779 -1.2718 -0.8775 -0.4518 0.3565 -1.4369 0.3734 -0.8123 -0.0787 -0.6914 -0.5199 -0.8033 0.2298 -0.9674 -0.8272 -0.2940 -0.1413 -0.4084 -1.1629 -0.5947 -0.5514 -1.5485 0.3891 0.2933 0.5323 -0.2686 -0.8818 2.2093 -0.8403 -0.1911 1.6160 0.1431 0.1325 1.8065 -0.3901 0.1917 0.0760 -0.5264 -0.8126 -0.4549 -0.0703 -0.4754 -0.6572 1.2901 1.5063 -0.5941 0.8619 0.3845 0.3321 0.1255 1.5572 -0.7105 -0.2881 0.7071 0.8030 1.2229 0.6363 -0.7413 0.5911 0.9707 1.1147 -1.3473 -0.6035 0.7987 -0.5158 0.2399 0.5247 -0.3241 0.9009 1.2087 1.5486 -0.2721 0.1662 0.4866 2.3722 -1.4317 0.5898 -1.0372 -0.5456 -0.7632 1.4385 0.2425 -1.1484 0.4831 -0.0883 -0.7682 -0.4506 0.0499 0.1354 -0.6266 -0.4624 -1.7343 0.2597 0.3541 -0.1625 -0.1901 -0.9840 0.5658 0.9107 0.7079 0.1798 -1.7470 -0.2378 -0.4108 0.9628 -0.3522 -0.2948 0.0335 -0.3305 -0.7760 0.1805 1.0672 -0.4688 0.0945 -0.5927 1.0393 0.5090 0.0136 -0.1528 -0.1659 -1.2548 -0.9377 2.7298 0.6856 1.2262 -0.4562 -1.0169 1.5129 0.0190 -1.6773 0.2710 -0.0452 -0.0423 0.7078 -0.7252 -0.5191 0.1180 -0.0243 0.5533 -1.2544 1.1974 1.7625 -0.1913 1.2363 0.6569 -0.4546 2.3619 1.8430 0.1347 0.1294 -0.2970 0.1210 -0.7235 0.3468 0.5595 -0.0717 -0.2114 -0.3012 -0.1327 0.2789 0.2676 1.2467 1.6686 2.3259 0.4692 -0.1605 0.7088 -0.5252 -2.1273 0.0697 0.8328 -1.7873 -1.4792 1.4693 -1.3038 1.3037 -0.2286 1.1216 1.5487 3.0840 1.2207 1.0821 1.2239 1.8276 1.3011 1.7221 -0.6029 0.1333 -1.1291 0.0908 0.5722 0.4989 -0.7624 -0.5700 1.0156 0.7003 0.0136 -1.1431 0.1706 -0.0865 oleate/vaccenate (18:1) -0.9069 0.1370 0.8813 1.6940 0.7237 1.1893 -0.1673 -0.2973 1.0397 -0.1662 0.7101 0.1681 1.5715 -1.0338 -1.5489 -1.9443 1.0439 1.5090 -1.0077 0.0172 -0.7521 -0.0515 -1.9911 -1.5940 0.3147 -1.0552 0.5423 0.2477 -2.4167 -0.3556 -0.8157 -1.5408 -1.0536 1.8532 1.6425 -0.1354 -1.3598 -1.3774 -1.4281 0.0925 -1.9658 -2.3474 -0.8122 1.0308 0.9811 0.5924 -1.0007 -1.5468 -1.6316 0.7690 -0.9569 -0.0654 -0.7655 1.7165 -0.5463 0.8814 -1.9003 1.8228 -0.7179 1.2743 -1.3127 0.1167 -0.5672 -1.1602 -0.8924 0.0188 0.5048 0.8530 -0.1785 -1.8676 1.4534 -1.0553 -0.0325 -0.7207 1.1661 0.6378 -2.6870 -1.3731 -0.0410 -1.7833 0.8212 -0.4030 -0.2228 1.6048 -0.1863 -0.9366 -1.5709 1.1397 0.3812 -2.0849 0.6542 -1.1609 -0.3776 -1.2148 -1.0137 -1.1063 0.0361 -0.2416 -1.0715 0.5461 -1.2790 0.2229 -1.5714 -0.5291 -1.1074 -1.3112 0.6268 0.1065 1.6996 -1.2688 -0.0948 0.3187 -0.3546 1.6845 0.6637 -0.9470 -0.7270 -1.6512 0.4111 1.1262 -0.4218 1.2938 -1.0348 1.9941 0.5417 -0.1973 0.5430 -0.8644 0.5337 0.6652 0.8026 0.2674 -0.5953 -1.5900 -0.5328 0.1360 0.7886 -0.6300 -0.4839 -2.7976 0.7278 -1.1891 0.0512 0.0858 0.1911 -0.2138 1.6881 0.4964 -0.2860 -0.9714 -1.1474 0.4256 0.3697 0.1513 0.0763 -0.9034 1.3875 -0.0391 -0.4331 0.4256 -1.0965 0.6902 -0.5833 1.2588 0.0676 0.3568 -0.6231 -1.5008 -0.0213 0.2039 1.1841 -0.3772 -0.2728 -1.6388 0.4143 1.1505 1.2359 -2.1092 0.2940 -2.3455 -0.5104 0.1752 -0.6911 -0.9758 -2.5144 -0.2201 -1.8064 0.2527 -1.5172 -1.9975 0.4771 0.4247 -0.7281 -0.0738 -0.1860 1.1483 0.2980 0.1498 1.1774 1.0784 -0.4762 -1.3627 -1.2344 -1.4494 0.2335 1.3326 1.1147 -2.1786 -0.1701 -2.3781 -0.9259 -0.1816 0.1256 -0.8002 1.5147 -1.4054 0.3736 0.4581 1.1857 0.7636 1.6542 1.1208 -0.3621 -0.0312 -0.4319 0.4126 0.7933 0.5077 -1.6952 0.5439 0.0537 -1.3510 0.9311 0.4346 0.8444 -0.5793 -0.5749 1.4279 0.0934 0.5472 1.5278 0.3292 0.2347 -0.1514 0.5547 -0.0014 0.5042 -0.6246 -0.0961 -0.0831 1.5771 0.7889 -1.4869 0.8995 0.6882 -1.0411 0.0904 0.2426 1.4629 0.5337 0.5836 -1.3549 0.7492 0.8070 0.9252 0.9484 0.0325 0.2733 -0.1265 0.2315 0.0378 -1.7308 -0.4161 0.5751 0.3959 -0.8997 2.0664 -0.5072 0.3096 1.1068 -0.1414 -0.2208 0.2722 0.0835 1.6763 -2.0937 0.6222 -0.3524 0.2686 -0.2480 0.1467 0.1155 -1.4123 0.4803 0.3033 0.4816 0.3252 0.5815 0.7338 0.9612 -1.1237 -0.8880 0.0936 1.2099 -0.5941 -0.7710 0.0457 0.2440 1.1038 0.2716 1.3991 0.2485 0.8418 -0.1153 1.4258 -0.1070 -0.0702 -1.1783 -0.6738 -0.3433 -0.2614 1.0420 1.2532 1.0361 -0.6304 1.3898 0.2900 0.6543 0.1945 0.2678 -1.2136 -0.3173 1.0413 0.8653 -0.5488 0.0273 -0.2645 0.7351 -1.0801 -1.1808 0.9722 1.0584 -0.3173 0.2205 1.0490 -0.3859 0.2160 -1.2121 1.5915 -0.9540 0.9488 0.7470 0.2965 1.1893 1.1821 -0.7861 1.4381 0.1741 1.3248 0.5019 0.2936 -0.1745 0.1490 1.3693 1.3792 -0.6790 0.3019 0.3827 1.0620 -0.1660 -0.2789 0.6747 0.8649 0.8063 0.4461 0.7090 0.9750 -0.6731 -1.4929 0.0454 1.4060 -1.7644 -0.8722 1.8985 0.9892 0.6843 0.6431 0.9782 0.8237 1.8095 -0.1513 -0.9307 1.0474 -0.5108 0.4804 1.5802 0.1599 -0.6880 -1.3630 -1.5865 0.0860 0.5331 -0.1203 0.6569 1.2920 1.4570 1.9289 -0.2122 0.8424 0.4767 oleoyl-arachidonoyl-glycerol (18:1/20:4) [1]* -2.0261 -0.8455 0.7188 0.0295 -0.8103 -0.2572 -0.1340 -0.4331 -0.4625 0.4000 -0.3306 0.4153 -0.5282 0.5767 -2.3205 0.0005 -1.2403 -0.1477 1.0432 1.5850 0.5512 0.2747 1.3064 -0.8710 0.4905 -1.6931 -2.8570 0.6848 1.1273 -0.4557 -1.1044 0.9503 -0.4984 -0.3421 0.3241 0.0096 1.2412 0.3123 0.1588 -0.0615 2.2383 0.8795 -0.4315 0.4080 1.2282 -0.5809 -0.0240 -0.4275 -0.6262 -0.9690 1.0177 0.7744 2.1759 0.5668 -1.2536 0.2430 -0.5231 0.7948 2.3497 -0.1407 0.3683 0.6845 -0.0179 -0.3956 1.1606 -0.0269 0.0431 -0.2579 0.8333 -0.4749 1.3323 1.5004 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1.0770 0.5262 -0.2166 0.4030 -1.4411 0.0832 0.5372 0.0017 0.2056 0.1594 0.2064 -0.9827 0.5211 0.0376 3.7208 0.1463 0.3681 -0.0895 -1.2819 -0.7451 -0.8239 3.1147 -0.5549 -0.3662 2.5831 -0.9792 0.5744 0.7640 0.0629 1.4830 -1.7388 -1.0409 0.3158 -3.0335 -0.9366 0.3505 0.1345 -0.3904 1.5177 -0.8235 -0.4115 -1.2128 -0.1710 -0.7048 -0.0103 -0.5786 -2.8421 1.1949 1.6932 -0.5749 0.0220 -1.2994 0.5306 1.7279 -0.3063 1.0568 -0.0472 -1.3869 0.0497 -0.9134 -0.5897 0.5972 0.1745 1.1678 1.9868 0.7045 -0.3933 0.8065 -1.8708 -0.8894 0.0118 1.0391 1.1218 oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]* -2.0812 -0.7837 1.2979 -0.0474 -0.7107 0.2656 0.2935 0.0335 -0.5624 0.8611 0.4637 0.3573 -0.3029 0.3202 -0.7311 0.4775 -0.9221 -0.6228 0.5998 1.7517 1.0384 0.3527 1.0713 -0.4284 1.0683 -0.8981 -2.1961 0.4692 1.2283 -0.4795 -0.8792 0.8947 -0.8665 -0.1675 0.5438 0.0300 0.8855 0.3306 0.6853 0.2384 1.9262 0.7050 -0.2814 -0.2043 0.8088 -0.5498 -0.1361 0.2215 -0.3929 -1.1799 0.6402 1.1140 2.1755 0.1126 -0.5179 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-0.4738 0.6978 0.5384 0.7827 -0.8238 -0.0915 -0.2808 -1.6579 0.7630 1.0570 -0.5028 1.1457 -1.0199 0.7211 0.0234 -0.6989 -0.0378 0.0005 1.2028 0.4795 -0.6841 1.0662 -1.7481 -0.1768 0.7909 -0.3093 -0.5767 0.2201 0.3355 -0.3314 0.7555 0.2297 3.7333 0.0998 0.6390 -0.8816 -0.9621 -0.4699 -0.5001 2.2389 -0.4217 -0.2334 1.6741 -1.1115 0.0746 0.6293 -0.0729 1.1014 -1.2197 -0.4843 0.0441 -2.7245 -0.9659 0.6339 -0.5016 0.2433 1.1210 -1.2052 0.6763 -1.1706 -0.1072 -1.2448 -0.5661 -1.7435 -2.1766 0.3423 1.5743 0.0258 -0.0930 -1.7421 0.2172 0.4283 -0.6754 0.1720 0.6933 -0.6897 -0.2180 -0.2499 -0.8768 0.1003 0.5731 2.1360 1.9808 1.4540 -0.7383 1.0542 -1.6400 -1.0411 -0.3939 0.3600 0.6775 oleoylcarnitine (C18) 0.2536 -1.3256 1.3061 2.3973 -0.1901 1.5486 0.2579 0.5282 2.1946 1.4663 2.9823 -0.0598 0.2011 -0.3200 0.8286 -0.5559 2.1782 1.1523 1.6345 0.0074 0.1812 -2.2328 0.3737 -1.3591 0.5234 -0.0660 0.8056 1.2979 -0.9722 0.5625 -0.6763 -0.7165 -1.3959 1.5912 0.3760 2.1558 0.1241 -0.4783 -0.9824 0.9950 -0.9256 -0.8925 1.0335 0.1598 0.6245 0.4801 -0.6632 0.5761 -0.9211 2.0017 -0.0678 0.1590 0.3140 3.1358 0.0460 2.0262 -0.3872 0.6738 -0.0449 1.5149 -0.8734 -0.3194 -1.3176 -0.2135 -1.5127 -0.9481 -0.4910 -0.6636 -0.1611 0.2930 1.5312 0.3457 2.5951 -0.5592 0.5096 -0.1417 -1.2616 -0.7649 0.3736 -0.9309 -0.0024 0.0930 0.2266 1.1346 0.7508 -0.1074 -0.6131 1.3301 1.1718 -0.9782 -0.3984 0.5137 -2.3230 -0.3775 0.7146 0.9182 0.4006 -0.3990 -1.1753 0.7125 0.8378 0.1947 -0.0884 0.2838 -0.4995 -0.1142 3.1659 -1.2507 0.3710 -0.2150 0.1311 -0.3933 0.1577 1.4849 1.6680 -0.4319 -1.2851 -0.2025 2.6741 0.6257 1.8649 0.9114 0.8654 -1.4669 -0.6697 0.4398 -0.0041 0.1737 0.8223 -0.7794 0.3565 1.5705 0.0987 -0.6388 -0.7645 -0.6159 -0.3695 0.0812 -0.9279 -2.0462 1.7438 -0.1279 -0.1802 0.7890 1.3179 -0.2646 -0.8304 1.7409 -0.3309 -0.7895 -0.4080 0.5224 0.6714 -0.5725 -1.0943 -0.7309 1.5808 0.9630 -0.0781 0.0583 -0.2594 -0.2485 -0.4424 0.4297 -0.2182 -0.8445 -0.0711 -0.1432 -1.3545 -0.5574 0.2505 -0.7111 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1.9825 0.2690 0.7030 -1.3513 2.1807 -1.1399 -0.0300 0.6827 -0.7506 -0.5584 -0.5426 1.0006 -0.2996 1.4159 1.3817 -0.1103 1.0281 0.2024 -1.0921 1.4543 -0.8775 -0.6097 -1.5705 -1.1365 1.6402 1.9444 3.5492 -0.8119 0.2553 -0.2314 0.1595 -0.2188 -0.1641 0.2044 -1.7813 -0.0196 -0.0727 1.2871 -0.5045 0.3951 -0.5812 -0.9885 1.4832 -0.6613 -0.9612 -0.1051 -0.5491 -0.8249 0.6597 -0.0176 -0.6441 3.1522 1.4072 -0.9327 1.1781 0.1592 0.1623 1.5046 2.5624 -0.7232 0.0865 0.9709 1.1194 -0.9118 -0.2149 -2.2590 0.6703 0.5895 -1.3760 -1.1693 -0.0986 -0.4335 1.8295 1.5740 -0.6458 -0.3872 -0.0655 1.5661 -0.8065 -0.3431 0.2110 0.2006 -0.3875 1.4696 1.0235 -0.2198 -1.3731 0.1892 0.1051 -1.3530 -0.3736 -1.2214 0.2150 2.0634 -1.2567 -2.1169 -1.0082 0.8082 -1.4272 -0.4672 0.3004 0.0487 -0.6343 -0.1881 1.4456 1.5703 -1.7498 -0.6501 1.0531 1.0071 1.1217 -0.0586 0.2323 1.1095 -0.0594 1.5422 -0.2032 -0.0959 1.3826 0.5574 -0.0302 0.1691 -1.3290 -1.4256 -0.3163 0.4158 0.1510 1.2332 0.2485 -1.1761 -0.1450 -1.3416 -0.6980 -0.3417 -0.3044 -0.7810 -0.0645 -0.3413 -0.5443 -0.5214 0.8746 -0.7359 1.0957 -1.2448 -0.2240 0.9770 -0.5637 -0.6759 0.2571 -0.2297 -1.2619 -1.3215 -0.5148 -0.6167 1.1011 -0.6444 -0.5205 -0.6262 -0.3827 -1.4947 -0.6532 0.6304 -0.8345 1.3282 -1.6120 -1.4064 -0.9959 0.6240 -0.4841 -0.6241 -1.0335 0.4346 0.0735 -1.8071 1.1569 -0.9358 0.2145 -0.5270 -0.5738 -0.7281 -1.4078 -0.6550 -0.6377 -0.4337 -0.6386 -0.9145 0.3644 0.4300 -0.2796 -1.1307 -1.1742 -0.1080 1.7333 1.6091 -1.2610 0.2878 -0.9457 -1.2651 0.0034 -1.9298 1.1891 0.4293 1.2575 -0.5825 0.3442 1.2261 0.0691 0.6225 -0.4085 0.4196 -0.2917 -0.4056 -0.6048 -0.6611 1.1855 0.2861 -1.1024 -0.3165 1.6563 orotidine 0.6328 -0.7025 0.0514 0.6428 1.3383 0.1663 -1.5657 2.0656 0.5427 2.0976 0.5168 0.3376 -0.4078 0.9745 -0.4224 0.1179 0.2312 0.1976 -2.3567 0.0546 0.6477 -3.9286 -0.4878 0.2468 -0.7060 1.0294 -0.5373 -0.2073 0.8729 -1.7975 -0.7260 1.6925 -0.2822 -0.1807 -0.1426 2.1883 0.2545 0.8222 0.1222 -1.3942 0.5024 0.1185 -0.2481 -0.5505 0.1016 -2.1855 -0.7058 0.0630 -0.4279 0.9833 0.8230 0.7870 0.6178 0.7521 -0.2921 0.0515 0.1756 -0.7696 -0.4512 0.0395 -1.0172 0.6857 -0.0892 0.6462 0.1164 -1.0296 0.4271 -0.2502 -0.7512 1.1897 -0.0923 -0.5248 -0.3291 0.3781 -0.0723 -0.5426 0.3776 -0.0510 -1.9492 -0.4665 -0.8628 -1.2324 -1.1534 -1.3534 0.3854 0.4687 -0.0121 1.8626 0.3700 0.5374 0.0305 0.0228 -1.6339 1.6182 -0.1572 -0.5386 0.3650 0.7934 0.2282 0.0041 0.0323 -1.8119 -0.3000 0.3157 0.4787 0.5553 0.5453 -2.3728 -0.2895 0.2573 -0.3964 0.2958 -0.9598 -0.2069 0.7320 -1.6358 1.4275 0.8197 1.3575 -0.6023 1.3100 0.5911 -0.3663 0.3663 -0.2859 0.0581 0.2185 -0.1389 -0.4233 -0.2496 -0.6174 1.4527 0.6230 -0.3308 -0.2318 0.0826 -0.6855 -1.8802 0.4533 0.2263 1.3749 -0.0049 0.1097 0.2013 0.0236 0.3256 -0.9483 0.9073 -0.8440 -0.8568 -0.0936 -0.7667 -0.1716 0.6308 -0.1089 -1.4177 1.2607 0.6556 0.4708 0.6108 0.1820 0.3284 -0.1561 -0.7775 -0.0809 0.2556 0.1215 0.6562 -0.5195 -3.1172 0.0768 -0.5237 0.3433 1.5565 0.4009 0.5144 0.4520 -0.0743 -0.5761 -0.6341 -0.0021 -0.0615 -0.5498 0.1789 0.0104 1.0013 1.0005 -0.2849 0.8191 0.3928 1.1459 2.0139 -0.2322 0.6284 0.0194 0.4966 0.2942 -0.2694 0.1379 -0.3636 -0.0476 0.2620 0.9456 -1.5343 -2.8933 0.1525 -0.1913 1.0720 0.8395 -0.2990 0.9172 -1.0864 0.1058 -1.4164 -0.8768 -0.4639 0.9389 0.5412 -1.3843 -0.1696 -1.5121 0.1995 -2.3058 0.3302 -0.2194 -4.8948 0.1381 -1.0016 0.5403 0.3320 0.1624 -0.6391 -1.4728 0.1590 -0.5520 0.8966 0.1406 0.7596 -0.1711 0.5351 -0.6896 -0.5144 1.0713 -0.5646 -0.9643 0.4003 -0.2389 0.6749 0.2451 0.8310 -2.6289 -0.9010 1.5104 0.2285 -1.6640 0.2044 -1.1394 0.2386 -1.5050 -1.7077 0.8761 -0.9728 0.4101 1.1119 -0.6222 -0.0499 0.0600 0.7795 0.4330 -2.4166 -0.0481 0.5839 -0.2028 0.1458 1.0272 0.2786 -0.3395 -0.5410 0.2531 1.7046 -0.1447 0.5035 -1.5190 -0.3750 1.3637 -0.8217 -0.1331 -1.1040 0.5686 -0.6068 -0.3248 -1.2834 0.1200 0.5381 0.4567 0.3602 1.0601 0.0432 1.0976 0.1717 -0.3123 -0.8942 0.3121 0.1660 -0.2381 -0.6730 0.2765 0.4341 -0.8314 -0.6284 0.4851 0.1884 0.1838 -0.4812 0.0129 0.7640 -0.0317 0.1940 0.7038 1.4902 0.2565 0.7081 -0.1655 0.4714 0.6017 0.1792 -2.3271 0.4140 -0.0743 0.7385 0.1691 0.6893 1.4387 -0.0559 -0.4901 0.8411 1.1310 0.1342 -0.2711 0.1743 0.2109 -0.0038 -0.5902 -0.7493 -0.1402 1.9662 0.1807 -1.7045 -0.5133 -0.3546 -0.0959 1.1673 0.0566 -0.0101 2.5615 -0.0454 -0.2307 0.0883 0.1143 -1.3195 -1.0180 -0.1348 -0.5230 0.3995 -4.6042 0.5965 -0.4074 -0.8919 -0.6339 0.8846 -0.4831 -0.1041 -0.5386 0.7654 -0.3416 6.7362 0.0204 0.6895 0.2438 1.0666 -0.7212 1.8772 0.5530 0.7069 -0.0538 1.2460 -1.6809 0.0298 -0.7903 -1.0063 -1.0036 0.4841 0.4912 1.1560 -2.3240 -0.2787 1.5856 -0.8297 -0.3193 0.9110 0.3350 1.6316 0.1686 0.8512 0.1261 0.9585 0.3592 0.9795 1.2273 0.8132 O-sulfo-L-tyrosine 0.2808 0.8456 0.4660 -0.4470 1.9713 0.7701 -2.4657 0.6536 -0.8799 1.9572 1.8416 -0.4388 -0.2189 -0.9776 -0.4830 1.3132 0.6879 0.3736 -0.5013 -1.4447 0.4302 -1.0495 0.5225 0.8557 -0.4049 0.8008 0.5139 0.8381 1.1350 -0.3479 0.3604 0.1444 0.7027 -0.7736 -2.1991 1.0170 -0.1829 -0.0875 0.7496 -1.3603 0.9273 0.9427 0.3457 0.0429 0.1294 -0.6424 -0.4789 0.8787 -0.0555 -0.1151 -0.1518 -0.2229 1.4009 -0.2576 0.1589 0.3218 2.0431 -0.4719 -0.8348 -0.3530 0.4393 2.3796 -0.2615 -0.7451 -2.7794 -0.1677 -0.8065 -0.1519 -0.0439 0.6014 1.4563 0.7947 -0.6502 -0.5388 0.5486 0.1482 -0.0782 -1.0806 -0.9347 -0.9161 0.3842 0.3801 -0.7975 -2.4622 0.5052 -0.5199 0.5564 1.0395 -0.2563 0.9982 1.0882 0.7468 0.6727 1.3604 1.0320 1.1637 -0.4344 1.8295 -1.5389 1.1714 0.9088 -0.7866 -0.7306 -0.4349 0.7108 0.5728 0.5268 -1.2572 -0.4827 0.8088 -1.1693 -0.4078 -1.7201 0.1536 -0.0489 -0.5460 -0.3086 -0.3156 -1.4891 -1.2612 0.2931 0.6202 0.0052 0.0482 -0.7612 -2.5530 -1.5980 -1.3702 -1.0872 -0.4592 -2.2720 1.3046 -0.2323 -0.4137 -0.6173 -1.6727 -0.4658 1.7820 -0.0216 0.1504 -0.1817 2.0926 -1.0326 1.2247 1.2018 -0.1418 -1.0581 1.0797 -0.7159 0.7687 -1.0546 0.0205 -0.1862 1.1616 0.2798 0.4869 -0.4462 -1.4353 -0.9111 -1.3132 0.2537 -2.5767 0.2775 0.3474 0.6852 -0.0945 -1.0958 0.8782 -1.9772 -0.1498 0.5757 0.9038 -1.6833 1.0360 -1.1245 0.3808 0.5184 0.6851 -0.6851 0.8046 0.2596 -1.4295 -2.5303 1.6410 -0.1700 1.1076 -0.1997 -0.2820 -0.4377 -1.3067 -1.3920 1.1701 1.4192 1.5922 -0.3476 -0.3475 -0.6488 -1.4364 0.4765 0.2686 -0.6413 1.2581 -0.9956 0.2736 -0.6338 0.9474 -0.6471 1.6211 -0.5789 1.7282 1.4246 0.0318 0.1339 -0.5309 -1.2265 -0.1192 0.9341 -0.9224 -0.4034 -0.4055 -0.6922 -0.8902 -0.2847 -0.9278 0.5872 1.3289 -0.0981 -0.8785 0.0984 0.0769 0.0259 0.1960 0.0393 1.2274 -1.6939 0.2994 -0.3940 -0.1908 -1.1034 -0.2468 -0.0566 1.3520 -0.0377 0.4997 -1.8543 0.7370 -1.5253 1.2308 -0.6780 -0.7087 -0.3333 -0.2181 -0.3971 -2.2173 -0.3851 0.1684 0.5369 -0.4595 -1.0831 0.7259 2.1988 0.3188 -1.6797 -1.4998 -0.6794 -1.5102 -0.7022 -1.2483 0.1103 0.4707 -1.8363 0.1933 -0.7419 0.2201 -0.1671 -0.6862 -1.2357 -2.3868 -0.9954 1.0675 -1.9153 -0.0545 0.7020 0.0885 0.5611 -1.1088 -1.0943 1.6749 0.1882 -1.2970 0.9441 -1.4729 1.3110 1.0415 -0.6645 -1.7787 0.1025 0.2999 2.0699 -0.5041 -0.9019 -1.1143 1.6021 -0.2799 -0.3975 -0.8870 0.0907 1.4828 -1.0253 -0.9688 -0.8275 -0.2867 -1.4296 -0.6569 1.6804 -0.2497 -0.6459 -0.9449 0.7881 -0.0536 0.2565 0.3632 1.7947 -0.2082 0.1431 1.1051 0.3748 0.8992 -0.2412 0.3147 -0.0479 -0.6747 1.4562 -0.3530 -0.5309 0.8374 1.2701 1.3226 0.9079 0.7468 -1.8174 0.4662 0.3798 -1.3210 -0.1339 0.7932 -0.4460 0.6225 1.3693 0.5876 0.8812 2.5591 0.6665 -0.4426 1.8012 -0.7944 0.1322 0.0422 -0.8635 -0.3631 0.2075 0.2471 0.5598 0.9144 0.8823 -0.4125 -0.2016 -0.9085 -0.5877 -0.7937 0.9577 1.8401 0.3668 -0.1132 0.5908 2.3086 0.8091 0.1827 0.3442 0.0723 1.2214 1.6880 -0.3274 0.2139 -0.4576 1.5804 -0.5730 0.7294 -0.1689 1.1344 -0.5118 -0.1693 2.9824 0.6772 -0.2245 -0.3457 0.0950 -0.8939 -0.9329 1.8769 -0.8738 1.8183 -0.4665 1.7989 -0.4414 -0.0792 0.1480 1.1239 0.6374 -0.0006 oxalate (ethanedioate) 0.7222 -1.2051 0.8080 0.0113 2.2003 -0.9408 0.4973 -2.4407 -1.1161 -2.3739 -3.0560 0.1508 -0.7961 0.8793 -0.4658 0.4179 0.0567 -2.9798 0.3535 1.6311 1.0148 1.0403 0.2909 0.6095 1.2187 0.3417 0.3234 0.9387 0.9943 -1.2558 0.4118 1.7643 0.0246 0.3359 0.8260 -2.7133 1.4843 -0.7498 0.9472 1.6149 0.8033 1.1500 0.1550 0.9123 0.3848 0.0779 1.1244 1.2891 0.8517 0.6813 0.1395 -1.3339 -0.3226 -1.0257 0.6483 0.6857 1.6413 1.3439 0.3241 0.1390 0.9687 0.9331 0.9452 -2.1291 -0.8622 0.7858 -0.8427 0.0149 -0.1102 0.6709 1.6321 0.4096 -0.4467 0.1083 0.4739 -0.1766 1.0559 1.5885 0.5677 0.7284 0.7652 -0.8769 -0.7801 1.0285 -1.2511 0.2691 1.1802 -1.2011 0.2078 0.7195 -0.0136 -0.1389 0.6745 1.3564 -1.0518 0.3643 0.1619 -0.0479 0.9418 0.1800 -0.3327 0.8590 1.1234 -1.1510 0.8619 -0.0597 -3.0756 0.1209 -0.5274 0.8149 0.8411 -0.8550 1.0939 -0.9929 -1.4717 0.3035 1.3360 0.8100 -0.8924 -0.3245 0.0279 -1.3576 -0.0989 0.7356 0.3196 -0.3644 0.3445 0.2104 1.4157 0.8024 -1.2262 -1.2458 -0.4106 0.3968 -0.0104 -0.7471 1.1338 0.7655 0.2459 0.7597 -1.2592 0.5194 -0.2489 -0.2206 1.0079 0.6863 0.6940 -0.2048 -2.2111 0.7470 -0.3065 0.9539 0.6915 -2.2593 1.0546 1.3450 0.9484 0.3997 1.0495 1.5904 0.3273 0.2272 -1.9954 0.3784 -1.1683 0.2743 0.5450 -0.0637 -0.1955 0.1228 -0.4733 -0.1094 1.0127 -0.6523 -0.7053 -0.0443 0.0471 0.2308 1.2392 1.1966 0.7648 0.2214 0.2274 0.9088 0.2712 0.9678 0.9671 -2.8978 -0.3136 0.4613 0.7933 -2.9958 -0.0138 -0.7097 -0.8963 -0.2899 0.8466 -0.3055 0.3874 -0.2107 0.5467 1.2899 0.0254 0.7028 -0.6261 0.2978 0.1333 1.5931 -0.6895 1.4365 0.1095 0.1802 0.4243 0.6314 1.2973 -0.4070 -2.2541 -1.5814 0.2795 -0.7971 -0.7866 -1.7738 0.9375 -1.6764 0.4970 -0.6072 0.3746 0.0707 0.5291 0.6966 0.0153 0.9496 1.3299 0.8237 0.8393 0.4299 -0.3418 0.8182 1.1835 0.9917 -0.5473 -0.6618 -1.4387 0.9949 0.8206 -0.4329 0.4077 -1.9168 0.3013 -0.0114 -0.5522 -0.1404 0.4927 -0.1047 1.0674 0.7423 -0.0154 0.2523 -0.1374 0.1007 0.1514 0.5313 0.3808 0.7513 -0.2840 2.1516 -0.4604 -0.1604 0.0608 1.2261 0.1321 0.3074 -0.4226 -0.1197 0.4296 -0.7943 0.4665 1.5414 0.3173 -0.1147 0.4413 0.6054 0.8209 1.2466 0.8772 -0.9550 1.2603 1.0836 -0.3054 -0.2144 -0.9156 0.9665 0.5675 -1.3879 0.6535 -0.4260 -1.2862 0.9914 -0.7397 1.2125 -1.2827 -0.0159 -0.1845 -1.2770 -1.1072 0.0446 -1.7394 1.4719 0.3973 0.1210 1.2087 -0.7003 -0.0332 -0.4595 -0.2611 0.2900 0.0528 0.9113 0.3502 -1.2543 0.5663 -2.7956 0.2821 -2.6657 0.3608 0.0248 0.3730 -0.6431 -0.1554 0.7821 0.0105 -0.4087 0.8538 -1.0030 0.9179 0.1911 -2.0349 0.5722 0.3889 -0.1243 -0.7144 0.1179 0.0035 0.4012 -1.7214 -0.8453 1.0216 1.4127 0.8804 0.3608 1.7626 -1.0761 -1.5372 -0.3830 -1.6158 0.5052 -0.4938 0.1696 -1.1438 -0.0332 -0.0895 -0.6633 0.9284 0.3427 -0.2016 -0.6001 -0.4502 -0.7242 -1.5470 -1.1598 -0.5630 -0.7816 1.1001 0.0769 0.4694 -4.1206 -1.3489 -2.4931 -1.9492 -1.3088 -0.9889 -0.6020 -0.2580 -0.6548 0.3313 -0.2902 -0.0708 -0.2997 -0.9187 -0.1075 0.6255 0.8429 -2.6810 -1.7853 -0.8729 0.0362 -0.6822 0.3001 -0.1049 0.5992 -0.8666 -0.0133 -1.4802 -0.6753 -0.3688 -1.6767 -0.7898 0.4538 -0.6864 -1.8534 palmitate (16:0) -0.6151 0.3507 0.8699 1.9979 0.7407 1.4898 -0.4262 0.5208 1.0149 0.2862 0.7511 0.0577 1.2919 -1.1087 -1.9748 -1.5455 0.8950 1.2838 -0.9003 -0.1809 -0.7068 -0.4206 -1.1269 -1.2760 0.1280 -1.2735 -0.0123 0.0267 -1.6284 -0.6306 -1.0376 -1.0754 -1.4540 1.3339 1.8349 2.3635 -0.8765 -1.1311 -1.6568 0.3251 -1.4610 -2.1102 -0.9188 1.2055 0.9868 0.5025 -0.5361 -1.3433 -1.1750 -0.3906 -0.7378 -0.2447 -1.7200 2.0281 -1.2350 0.5586 -1.7375 1.9907 -0.7966 1.6281 -0.8307 -0.2317 -0.8179 -0.5366 -0.3621 -0.2910 0.7010 1.2745 0.1465 -1.4955 1.4162 -0.7203 -0.3468 -0.8975 1.0136 0.4896 -1.7740 -1.6504 -0.0238 -1.7132 0.7571 0.2333 -0.5778 1.8109 0.4244 -1.4523 -1.4402 0.8685 0.3342 -1.5847 0.7328 -0.6694 -0.3912 -0.7958 -0.5127 -1.3299 -0.2923 -0.0838 -0.8931 0.7826 -1.3329 0.6630 -1.1013 -0.4802 -1.2528 -0.6111 0.6076 -0.0575 1.9245 -1.1266 -0.0791 -0.3944 -1.9437 1.9614 1.1554 -0.5257 -0.3837 -1.0455 0.8693 0.9048 -0.3490 1.3778 -0.8332 2.5632 -0.3863 -0.6594 0.4983 -1.1548 0.9357 0.7693 0.4477 0.4045 -0.7127 -1.1258 -0.4368 0.2354 0.4716 -1.4620 -0.0576 -2.2382 -0.1505 -1.2213 0.1044 -0.9295 0.2648 -0.7872 1.8467 0.4702 -0.7867 -0.8460 -0.9324 -0.0841 0.1562 -0.0207 0.3783 -0.4613 1.7611 -0.1356 -0.1622 0.4533 -0.9492 0.9376 -0.3178 1.0014 -0.0027 0.0314 -1.0066 -1.0252 -0.6809 -0.0382 0.6782 -0.3345 0.0521 -1.1246 -0.2618 0.8956 1.2409 -2.2577 0.2305 -1.5422 -0.4391 -0.1832 -0.1278 0.0432 -2.0618 -0.2189 -1.6319 0.1550 -1.3503 -1.4037 0.8467 1.3161 -0.7519 -0.7206 -0.2270 0.7601 0.5090 0.0197 1.8394 0.8164 -0.6052 -1.0271 -0.7006 -1.3575 0.3280 1.1852 1.0624 -1.6321 0.2680 -1.4207 -1.3348 -0.6013 -0.3736 -1.1845 1.6352 -0.7384 0.5310 0.6009 1.0256 0.5992 1.2902 1.2085 -0.3926 0.2061 -0.4412 0.3258 1.2178 -0.4732 -0.9014 0.1801 -0.3553 -1.0946 0.2651 -0.3002 0.5414 -0.1591 -0.3553 1.6731 -0.3235 0.1666 1.5200 0.1240 0.6784 -0.3547 -0.5343 -0.5454 0.5734 -0.9993 -0.1225 -0.4262 1.8784 0.9849 -1.4179 0.6781 1.0529 -1.2408 -0.1314 0.5000 1.2477 -0.4801 0.3741 -0.8646 -0.1934 0.8419 1.0894 1.1223 0.2076 0.3513 -0.1313 -0.2132 0.1410 -1.8307 -0.1380 0.3791 0.3415 -0.8650 2.7109 -0.6755 -0.0890 1.0881 -0.3068 -1.1932 0.2522 0.1968 1.5019 -1.6404 -0.1172 -0.3776 0.7580 -0.5114 -0.0743 0.8292 -2.2525 -0.0734 0.1718 0.6050 0.5939 0.6603 0.7219 0.7949 -0.9519 -0.6976 0.6929 0.4926 -1.1385 -1.4788 0.4594 -0.2699 1.2836 0.0876 1.6032 -0.3344 0.3814 0.3010 1.3717 -0.5528 0.0416 -1.3868 -1.4998 -0.5348 -0.5030 0.7124 0.9829 0.6010 0.1735 1.5218 0.2853 0.9469 0.2188 0.0493 -1.0733 -0.2759 0.8995 0.6301 -0.9067 0.0248 0.6791 0.1228 -0.6782 -0.5863 1.2046 1.4618 -0.5975 -0.2697 1.5598 -0.4650 0.1779 -0.5929 1.7489 -1.0108 0.5089 0.5165 0.6290 0.7168 1.0242 -1.0571 0.9908 0.3980 2.1190 -0.1321 0.4525 -0.5448 -0.0838 1.7810 1.5127 -1.1753 0.2013 -0.3378 1.1525 -0.7157 0.0189 0.0774 0.8985 0.6568 -0.0529 1.9294 0.7812 -1.0523 -1.4355 -0.2784 1.2681 -2.5738 -0.8256 1.7629 0.7868 0.6063 0.4790 0.8755 0.2421 2.0680 0.1153 -0.5635 2.7863 -0.9949 -0.3874 1.7925 0.1254 -0.4609 -1.5453 -1.1575 0.0360 0.4128 -0.2281 0.3421 1.1930 1.6808 2.0395 0.0783 0.9763 1.0095 palmitoleate (16:1n7) -0.3453 -0.1315 0.2938 2.0249 0.8609 1.0797 -0.9216 -0.5885 1.1012 0.0674 1.3628 0.2523 1.5628 -0.5152 -1.3801 -1.3188 1.5031 1.4181 -0.3487 0.6985 -0.1256 -0.4902 -0.7801 -1.3253 0.5326 -0.1904 0.2514 -0.1390 -1.3646 -0.3945 -1.0861 -0.7485 -1.1723 -0.2453 1.4087 0.5901 -0.7035 -0.8782 -1.1841 0.2040 -0.7236 -1.4663 -0.7664 1.3554 1.3138 -0.2375 -0.4236 -1.6367 -0.8746 0.7949 -0.4892 0.0468 -0.5173 2.0003 -0.2100 -0.0394 -1.4756 2.4133 -0.5373 1.4889 -1.0931 0.0382 -0.7067 -0.8689 -0.4617 -1.1229 0.9697 0.6647 0.1282 -1.2660 1.7156 -0.7464 -0.0583 0.0863 1.0904 0.7675 -1.9068 -0.6432 -0.4473 -1.3497 0.7207 -0.5801 -0.5640 2.2665 1.1727 -1.2280 -0.9096 0.9367 0.5556 -1.3179 0.6431 -1.3473 -0.8625 -0.8015 0.3814 -0.8334 -0.1464 -0.3478 -1.0061 0.0616 -1.1462 -0.7552 -1.3859 -0.7864 -1.0045 -0.1197 0.6464 -0.7758 1.8837 -1.0195 -0.8290 -0.6077 -1.4623 1.0567 1.0347 -0.6435 -0.7744 -0.9928 0.8094 1.2812 -0.3074 1.6657 -1.0499 3.8244 -0.2984 -0.3156 -0.2886 -1.0033 0.0965 0.3917 0.4313 0.6925 -0.2996 -1.0358 -0.8754 -0.2212 0.1567 -0.3946 -0.8285 -2.3857 0.0772 -1.4257 -0.1780 -0.8290 0.2959 0.4832 1.0564 0.0595 -1.0967 -0.9410 -1.3054 0.3180 -0.6546 -0.0810 -0.5012 -0.5793 1.5119 -0.0830 -0.1382 0.8817 -0.8702 0.0889 -0.8226 1.6348 -0.3091 -0.9650 -0.8858 -1.2865 -0.6374 0.1766 -0.1528 -0.2489 -0.4458 -0.4906 0.1684 1.3637 0.7876 -1.3002 0.0576 -1.9170 -0.9388 -0.1415 -1.1697 0.8492 -1.4927 -0.5586 -0.8976 -0.0710 -1.1297 -1.3517 0.2070 0.5456 -0.9322 -0.4488 -0.0599 1.2526 0.4516 -0.3067 1.7561 0.7678 -0.4915 -1.3113 -0.3526 -1.5498 -0.0856 0.9311 0.6761 -1.5574 0.6223 -1.5286 -0.8525 -0.7137 -1.2140 -1.8845 0.9498 -1.3406 -0.1482 0.1984 1.0750 0.2430 1.6281 0.3688 0.0872 -0.2700 -0.4632 -0.0914 1.5255 -0.4471 -0.7026 0.5961 -0.3088 -0.5867 0.0107 -0.4143 -0.0033 0.1072 -0.2062 1.2572 -1.3547 0.4020 1.6833 0.3802 0.1167 -0.5230 -0.6658 -0.1448 0.7421 -0.7200 -0.2266 -0.0195 1.8197 0.8373 -1.4407 0.4089 0.4027 -0.8909 0.2997 0.0088 1.4226 -0.2872 0.0901 -1.8837 -0.1969 0.9295 0.6178 1.0095 0.2023 -0.7250 0.2861 0.2475 0.0963 -1.1796 -0.0167 0.8192 0.4397 -0.5809 2.5996 -0.7294 0.5479 2.1997 -0.3600 -0.7759 -0.0564 -0.6984 2.0704 -1.5397 0.4539 -1.3770 1.5478 -0.7980 -0.1862 -0.0314 -1.7739 0.0263 0.0743 0.1170 0.3177 -0.8208 1.4784 1.5208 0.3291 -1.0832 -0.1967 -0.1485 -1.0241 -1.0945 0.2835 -0.9408 1.6776 0.5790 1.8171 -0.1172 0.4869 0.3848 1.0811 -0.4571 0.4209 -0.7438 -0.7564 -0.0085 -0.9516 1.0967 0.3702 0.5796 -1.1165 0.9385 -0.1917 0.7976 0.5771 0.0115 -0.7174 -1.3773 1.9496 0.7630 -0.7406 0.4247 0.7298 1.0167 -0.5123 0.4156 0.1569 1.1877 -0.3983 0.0574 2.0569 -0.3629 -0.1516 -0.7551 1.6052 -0.4832 0.5606 1.0869 0.6259 0.9192 1.9250 -0.9724 1.7169 -0.2250 2.5848 0.0612 0.1361 0.6535 -0.2693 1.5170 1.6186 -1.3936 0.8655 -1.0886 0.3324 0.2762 -0.2345 -0.0694 0.3759 0.0311 0.2113 2.1295 1.1235 -0.7259 -1.3729 -0.9846 1.4304 -1.8906 -1.0797 1.3231 -0.4108 1.6511 0.1654 1.2777 0.9320 3.0751 -0.6277 -1.2100 1.1085 -0.5614 0.6594 2.2982 0.4071 -1.0528 -1.5729 -1.6345 -0.7093 0.3768 -0.2827 0.7727 0.0211 1.1778 2.2354 0.0853 1.5018 1.7434 palmitoleoyl-arachidonoyl-glycerol (16:1/20:4) [2]* -0.6600 0.4670 0.5310 0.4050 0.6140 0.6290 -0.5860 0.8960 -0.6410 -1.2000 -1.3800 0.4010 -1.4200 1.1100 0.1120 0.9570 0.1450 0.5660 1.1900 1.6000 0.3860 0.6110 0.8280 0.1860 0.5380 -1.4400 -1.6000 0.5670 0.0585 -1.4800 0.0320 0.9210 -1.1200 -1.6900 0.2590 -1.4700 0.6290 0.5980 0.2580 0.1320 1.4800 0.8530 -1.4600 0.9370 1.2300 -0.3430 0.6600 0.4870 0.3590 0.0535 1.2100 0.7080 1.8700 0.7430 -1.2100 -1.5800 -1.4700 0.6630 1.8000 0.9420 0.6600 0.6270 -0.1270 -1.3800 1.3600 -1.6100 0.5930 1.1500 0.9560 0.2280 0.2090 1.1800 0.1220 0.8060 -0.2240 -1.6000 0.0022 0.8840 1.2600 0.4000 1.1300 0.1700 0.4580 0.3920 1.0400 0.5470 -0.1620 0.1090 -0.1520 0.6770 0.4100 0.3520 0.2020 1.0100 1.3100 0.2880 0.9570 0.5620 0.9770 0.3850 0.0944 -0.0459 -1.3200 0.1650 -1.3800 0.8120 0.2650 -1.5000 0.2190 1.2800 0.3000 -0.3430 0.3090 -1.4800 0.8450 1.2700 1.2200 0.5880 -1.5700 0.0008 0.2270 1.5400 -0.0234 1.5300 0.0796 -0.0028 -1.5700 -0.1930 0.1250 0.3050 0.3320 0.8770 1.1000 -0.2630 -1.5100 0.1630 1.4100 0.8400 -1.4800 -1.0800 -0.2160 -1.5100 -0.0091 -1.4900 0.9860 -0.4360 -1.4400 0.2360 0.6680 0.4730 0.9870 0.7200 -1.3600 0.7900 0.4240 0.8370 0.8490 0.9890 0.8420 0.4120 -1.4200 -0.3000 0.5940 0.4880 0.6890 -1.6100 -1.5800 -0.0242 -1.6200 0.5680 -1.6100 -0.1540 -0.7020 0.5210 -1.6300 -1.2100 -0.0338 0.3900 0.2430 0.6840 -0.5270 -0.0252 -1.5100 1.0500 -1.3000 0.7170 0.3210 0.7760 0.8770 1.2900 -1.6800 -1.3400 -1.3800 -1.3500 1.2600 -1.5600 -1.4100 0.3600 0.4540 0.5320 -1.5700 -1.2900 0.8810 0.7870 0.5370 -1.2000 0.8940 -0.8910 1.0800 0.6970 0.5410 -1.4600 -0.1010 -1.5200 0.5580 0.0194 -1.7000 -1.6600 -1.7100 0.6720 -1.5300 -1.5700 1.2200 0.0150 0.7040 -1.6700 0.8900 0.0241 0.3860 0.1090 -0.4840 0.8170 -0.1420 -1.5500 -1.6300 0.8850 0.7960 -1.4300 0.4390 1.2100 0.3070 0.9550 0.7490 -1.4200 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-0.2930 -0.1120 0.8740 -1.7900 -1.7800 0.5530 1.3400 -1.8300 0.3050 0.1140 1.1800 1.0400 -1.4600 -1.1700 -1.5600 -1.6700 0.2330 -0.3360 -0.5270 0.1230 0.2100 -0.1720 0.8400 0.2700 0.5180 -1.7400 -1.8200 -0.1110 0.2930 1.2200 1.0300 palmitoleoylcarnitine (C16:1)* 1.0016 -0.8667 1.9663 2.1150 0.7161 1.5544 0.3028 -0.0421 2.5094 1.1411 2.6867 -0.5910 1.7652 0.0047 0.6333 -0.9879 3.2602 1.2217 0.9885 0.3629 0.3555 -1.6257 -0.0437 -1.5003 1.0744 0.5984 0.7996 0.8303 -0.8496 -0.3060 -1.4247 -0.6556 -0.4564 0.2503 0.6069 1.0860 0.1054 -0.7586 -0.1998 0.4688 -0.3875 -0.3356 0.6450 0.5068 1.3290 0.0454 -0.7302 -0.6337 -1.1915 1.5916 -0.0866 -0.0813 0.1685 2.8589 0.2529 2.4713 -0.8486 1.2266 -0.1031 1.6822 -1.2175 -0.2190 -1.2913 -0.4215 -1.1762 -0.8967 0.4085 -0.3546 -0.5989 -0.3953 1.4567 -0.7426 1.4597 -0.4612 1.0318 0.2853 -1.1354 -0.2900 -0.0305 -1.0394 0.3366 -0.8363 -0.4565 1.2049 1.3346 -0.8115 -0.4673 1.6168 0.8333 -0.6116 0.1777 -0.2768 -1.6572 -1.1811 1.8902 -0.0740 0.1084 -0.6307 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-0.1956 0.2640 -0.3370 1.1060 -0.2995 -0.2023 -1.8601 0.2626 -0.5127 0.2940 0.6515 0.0374 1.2149 0.1576 1.3472 0.6325 1.9237 -1.2361 -0.1306 1.3742 -2.6881 -2.3852 0.3943 -1.5664 0.5645 -0.6962 0.0794 -0.1064 1.6468 -1.2667 0.9019 0.5762 0.4257 0.3125 0.9267 -0.7592 -1.0115 -0.3913 -1.1826 0.0550 1.6570 -0.3868 -0.0036 0.1100 1.4840 1.6058 -1.0839 -0.9366 0.8226 palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1]* -0.5852 0.0690 -0.1017 -0.8673 -0.8018 -0.9723 -1.9558 0.1320 -1.0288 0.3958 1.3055 -0.3391 -1.5373 -0.6171 -0.6951 -0.4526 0.9072 0.4989 -0.2213 -0.4520 1.1217 0.0325 0.9615 -1.4994 0.4678 -0.4097 -1.5637 0.3243 -0.4868 -0.4076 -0.6378 0.4517 -0.1298 -1.4057 -1.0979 0.7073 0.2649 -1.1039 -0.1935 -0.2819 0.2890 0.2870 -1.0187 1.0990 1.0735 -1.0921 0.8847 -0.3913 -0.6923 -4.0667 0.3568 0.5090 0.4865 1.2306 -0.8112 -0.4230 -0.5502 0.0036 0.5071 0.5874 0.9034 0.0802 -0.8731 -0.2368 0.9950 -0.8161 -0.3374 0.3499 1.0099 -0.8649 -0.1192 0.1122 0.3495 1.3915 1.2391 1.9015 -1.6081 1.2258 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-0.7220 -0.7067 -0.7128 2.3443 -0.9969 -0.0485 -0.7455 0.0354 -1.3140 1.7917 -3.2302 -0.3811 0.7223 -1.3575 4.3639 -0.7165 -0.5430 -1.1300 -0.6858 0.6586 -2.3020 -0.9545 0.5796 -0.1125 0.3119 -0.8087 2.7067 -0.2622 1.0521 1.8612 -0.6558 -0.2728 0.2112 -1.3768 2.9726 -1.5767 -0.4910 0.3048 -1.6416 1.6548 1.6730 -0.0128 -1.5657 0.1957 -0.4486 0.3554 0.0991 -0.3172 -0.9252 palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]* -1.2328 0.5076 -0.3224 -1.3736 -0.6766 -0.3174 0.1102 1.4750 -1.5304 0.8163 1.8223 0.7209 -1.4392 0.0132 0.4496 -0.2774 0.9891 -0.1100 -0.1710 -0.4060 1.2919 0.0099 -1.1706 -0.6031 -0.2221 -1.4534 -1.6217 0.5484 0.3882 0.7470 0.2210 0.7843 -1.1122 -1.7232 0.3057 1.6230 0.8379 -0.4429 -0.1853 0.5668 -1.2462 -1.0703 -1.4771 0.7721 -0.2538 0.1123 0.6668 0.6379 0.1277 -1.4600 0.3904 1.0053 0.1761 1.2420 -1.2098 0.2007 -0.1305 -0.2595 0.4989 0.4139 1.2566 0.2374 0.0092 0.7962 0.8317 0.1526 -0.1753 0.3621 1.5807 0.0665 -1.4891 0.8374 -0.0094 1.4987 -0.2830 1.2705 -1.3243 0.4918 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-0.5565 -1.3993 0.3743 0.9110 0.0977 1.1363 -0.3341 2.3457 0.1776 0.1207 0.3065 -0.9130 0.8451 0.2555 1.1938 1.3452 -0.9992 0.9111 1.1052 1.4253 -0.3643 0.3285 1.5398 0.9353 -0.2254 1.2250 -0.2077 0.0587 0.8227 -0.1266 0.1866 -0.4148 0.2352 -2.0743 0.1644 0.1093 1.3050 0.5927 0.3791 0.3034 -1.4164 0.3556 0.1082 -1.0599 0.8751 1.9105 0.2901 -0.6295 1.3074 1.0058 -0.5685 0.5274 0.1624 1.8152 0.7136 0.5574 -0.9157 0.0687 0.3196 -1.0829 2.0875 0.8923 0.7228 1.1224 -0.0878 -0.3202 -0.3263 1.7303 0.2365 0.9205 0.8076 -1.2675 0.1918 1.4109 -0.5829 0.6429 -0.4439 0.9719 0.6645 0.0329 0.2742 0.7648 0.3901 0.1042 2.3408 1.6750 0.7902 0.3370 -0.4669 -0.0484 -0.0099 -0.6966 -0.5962 0.7366 1.6529 -0.0971 0.6776 0.1485 -0.1748 -0.0129 -1.8809 2.8656 -0.4609 -0.7052 0.7132 1.6020 -0.6884 -0.5798 -1.9126 0.1153 -0.3390 1.0719 1.1936 0.6043 1.0914 -0.2608 1.0652 1.6823 1.6341 palmitoyl sphingomyelin (d18:1/16:0) -1.4390 -0.2701 -1.2868 1.3878 0.9800 -1.4194 -1.1005 -0.3462 -0.2521 -0.8451 -1.8743 -1.2134 0.2737 -0.8344 0.2329 0.0700 -0.4749 0.5156 0.2158 -0.4117 0.1899 0.6205 -0.2751 0.3987 0.4662 -0.2512 0.7460 0.9455 0.6502 -0.5707 0.7826 0.0186 -0.1849 0.7022 -0.5507 1.0122 0.6019 0.2985 0.6575 -0.3804 0.3434 0.4206 1.0893 0.5407 0.8536 0.7214 1.1551 1.2903 -0.2893 -2.0438 0.4774 -1.6756 -1.2813 -2.7529 1.0408 0.9581 0.7116 1.0140 0.1742 -0.3683 -0.3955 0.5033 0.1302 -0.2972 0.6228 1.3963 0.8798 0.6495 1.5798 0.2991 -1.5794 0.7533 0.3598 -1.4871 -0.4399 -0.7478 0.6434 -0.5212 0.5574 0.5724 1.8617 -0.9437 -0.5983 0.5847 -1.4354 -0.7794 0.1423 0.4487 -0.3387 0.7075 0.0099 -0.0831 -0.4921 -0.0497 -1.7183 -1.3443 0.2713 0.3069 1.0167 0.2525 0.9762 -0.6125 1.3676 0.6128 0.0184 -1.3456 -0.1263 -0.1902 -0.5313 1.7445 0.0278 0.4403 1.0113 -0.3765 -0.8479 0.2349 1.4592 0.2701 -0.3417 0.2262 -0.6510 -0.8324 0.6354 -3.2238 -0.1786 -0.3256 1.3468 -0.8698 1.5802 -0.1903 -1.1059 -1.2176 -0.2875 0.4331 -0.8937 -0.7706 -0.1740 -1.3901 0.0093 0.6438 -1.2809 0.7082 0.5100 -0.0111 -1.7444 -0.0279 0.9370 -0.5886 1.0036 0.7824 0.6447 0.2699 1.8276 0.4785 0.9965 0.8032 -0.0277 1.8484 -0.0319 1.0917 1.0842 1.5553 -0.2982 0.1236 -1.9730 1.2018 0.8096 0.5537 -1.7403 0.5180 -0.1370 -0.9009 -1.1690 -0.8347 -0.5004 2.0578 0.7791 -0.0187 0.3525 1.8502 -0.0790 -0.4480 0.4748 -0.1761 1.5569 -0.2001 -0.3244 2.0611 0.2174 0.9151 -0.8896 -1.7316 0.2132 -0.4867 -0.0800 -0.2031 -0.3820 0.6476 0.9351 1.5423 -0.0490 2.1418 0.4906 2.3097 1.3410 1.7499 0.7845 1.0975 -1.4300 1.2044 1.4470 1.6079 0.4322 1.0710 0.3681 0.3923 -1.2640 0.1153 -0.2776 -1.0957 -0.7005 -0.7763 -0.2781 -0.1208 0.6203 -0.5215 -1.2739 0.2232 0.8177 -1.3550 0.3544 0.1695 -0.0087 0.5606 -1.0585 -0.7738 0.0915 -0.8240 1.4883 -0.1212 -0.2241 -1.5804 0.0677 -0.3708 0.7221 -0.9245 -1.1204 -1.2054 -0.5259 -0.4913 -1.8965 -0.8573 0.5097 0.2010 1.2388 -0.3566 -0.2488 -1.9290 0.3119 -0.0490 0.9527 1.4897 -0.9474 -0.0217 0.2429 0.7598 1.3605 1.3000 -0.7625 1.8649 -0.9399 1.1788 -0.7551 -0.1070 0.2945 0.2877 0.2127 0.2466 -1.3004 1.1851 -0.0256 -0.2093 0.2816 0.5469 0.2064 1.6604 0.2696 0.4690 -3.0509 0.5945 -0.5808 0.4706 0.2199 -1.5740 -0.3657 -0.6705 -1.0741 0.6292 -1.6448 -0.2061 -0.6262 -0.2059 2.5523 0.9780 1.5196 -0.1512 -0.8663 -0.1169 -0.9242 0.2647 0.3760 1.2619 -1.3245 -0.5689 0.3205 -0.3848 -0.9246 -0.4628 0.1030 -0.5626 1.1715 1.7487 0.2685 1.3530 0.9549 0.2073 0.2787 -0.6740 0.9181 0.8798 0.3418 0.2289 -1.0449 -0.9840 0.6235 -0.0206 -0.2253 -1.4015 0.2657 -1.6716 -0.7860 -0.7168 -1.0447 -0.9797 -2.6328 -1.8454 -1.0461 1.8784 0.9410 0.8017 1.1453 0.8233 -0.1688 -0.4077 0.8472 -0.4580 -0.5222 0.4890 -2.8446 -1.4589 -3.0183 -0.0648 1.2939 -1.4988 -0.0091 1.1230 -1.1553 1.1675 0.1085 -0.6664 0.4605 0.0723 0.9005 -0.1709 0.2936 -2.8996 0.0923 0.7441 0.6248 -0.0256 -1.0169 -0.5102 -0.3817 -0.2794 0.3463 -1.6446 -0.5074 0.2115 -1.6175 -0.5520 0.5013 1.5205 0.4753 1.0335 -0.8408 -0.0295 -1.7032 0.8785 0.1745 2.1778 0.5720 1.3190 -0.2396 -0.4999 -1.0807 -0.9243 0.2846 -1.2402 -2.3192 -2.7633 palmitoyl-sphingosine-phosphoethanolamine (d18:1/16:0) -0.1598 -0.3242 -0.4258 0.3675 1.8252 -1.3191 -0.4403 -0.4241 -0.4423 0.6051 0.1784 -0.1805 0.7368 0.0425 0.1003 -1.0576 -1.1881 -0.4922 -0.4613 -0.0792 -0.0460 0.2545 1.4416 0.2866 -0.0909 -1.1949 -0.7346 -0.1156 1.1821 0.2170 0.4369 -0.0238 0.0559 0.6192 -0.8415 0.9901 0.4644 0.4951 0.9562 -0.9923 0.8970 1.2338 -0.0771 -0.0446 0.8007 -0.4980 0.5801 -0.0639 0.0189 -1.0977 -0.0341 -1.3671 -1.1619 -2.2171 1.9049 0.7431 1.0780 1.4684 -0.3095 -0.3413 0.0050 0.4428 0.0953 0.1570 -0.7648 -0.4402 0.2611 -0.3462 0.3128 0.6671 -1.6656 0.1163 0.4794 -1.5505 0.4343 -0.6843 0.9303 -0.9983 0.8342 0.5621 0.0155 -1.8483 -0.6827 0.5385 -1.1610 -0.0515 1.1202 1.6291 -0.8500 1.3416 -0.8395 -0.6453 0.0775 -0.5246 -0.0674 -2.1284 1.1707 1.1501 0.5793 -0.2106 1.7658 -1.2947 1.1533 -0.2347 1.6558 -0.7369 0.7708 -0.5642 -0.0809 1.6604 0.2585 -0.5777 0.5548 -0.4448 0.3936 -0.1679 1.0337 0.6800 -0.6115 0.4948 0.1113 0.1079 0.5803 -0.8317 -0.5993 -0.5725 -0.3734 -0.3832 0.4322 -0.5558 -0.0540 0.2819 0.6815 -0.8265 -0.7568 -1.3694 -0.5861 0.0014 0.1559 1.5805 0.2340 0.4052 0.3471 0.2894 -0.2989 -0.0486 0.6642 -1.3288 1.3367 1.1197 0.7203 1.2594 1.2372 0.2180 -0.0183 0.8223 0.3314 0.9289 -0.4729 0.7446 0.8556 0.5694 -0.9694 0.8231 -1.1337 1.2309 0.6406 0.2199 -0.7774 0.0995 -1.0555 -0.6570 -0.2803 1.0697 -0.2130 2.5769 1.2331 1.4294 -0.1691 1.4713 -0.0083 -0.8111 0.0177 0.0980 1.0807 -0.5302 -0.1128 2.3933 0.7730 0.5880 -2.7355 -0.4590 0.6319 0.7924 0.5378 -0.1477 0.6645 0.2363 0.9520 1.8989 -0.6922 2.4769 0.5617 0.9630 0.4761 1.6116 0.3776 2.5051 0.0020 -0.3215 1.6447 1.7898 -0.1873 0.4104 0.0205 -1.9546 -0.6023 -1.4562 0.2031 -1.0631 -0.0215 -0.7487 1.0827 -1.3033 -0.4219 -1.8719 -0.7087 -1.0693 0.6952 -0.5495 0.1731 0.2506 -0.0143 0.0529 -1.7406 -2.6524 -0.1018 -0.1204 0.3585 0.4094 0.6289 -1.1750 0.5133 -0.1177 0.0395 0.2996 -0.6823 -1.6809 -0.8820 -0.1062 -1.7663 -1.0297 0.7720 0.5146 0.7172 -0.1603 -0.8077 -2.6432 0.4254 -0.3855 0.3109 0.7654 -1.0008 -0.2782 0.5786 1.5275 1.0891 0.4706 0.7948 2.2799 -0.3425 1.3768 0.3123 -1.0859 0.2230 -0.1971 -0.9152 -0.0348 -0.4718 1.2730 -0.2172 -0.1068 -0.4489 -1.1589 -0.0525 1.8227 -0.1441 0.1256 -2.1782 -0.0755 -1.1958 -0.4473 0.5945 -0.6551 0.3325 -1.6873 -0.8603 -1.3405 -0.8955 0.1763 -0.8375 -0.3096 1.5279 1.1080 1.8987 -0.4108 -0.6208 -1.3424 -0.1007 -1.4159 0.6758 0.4787 0.0934 -1.8367 0.2114 0.3020 -1.1731 -1.0007 0.0144 -1.0062 0.6664 2.3774 0.1164 1.4427 -0.6438 -0.6184 0.7268 0.0344 1.2051 0.7088 0.6667 0.4686 -0.6532 0.5061 0.8237 -0.2295 0.0754 -0.1663 -0.6934 1.1334 -1.5392 -1.4546 -0.7388 -1.5745 -1.1364 -1.2825 -1.4800 2.0504 1.2667 0.2931 1.8620 1.5516 0.3670 -0.3282 1.3241 0.2670 0.2359 -0.8491 -4.0465 -0.2712 -2.8592 -0.0155 1.2710 -2.8832 0.2733 0.2815 -2.0214 -0.1556 0.7083 0.4734 0.8027 0.2721 1.6969 0.0248 -0.4154 0.2023 0.4764 1.1551 1.2857 0.1466 0.2342 -0.7553 -1.1650 -0.8451 -1.5026 -1.6842 -0.8472 -1.9965 -1.8404 -1.1639 0.7161 0.9819 1.5366 0.1925 -0.1103 0.6607 -1.4525 0.2599 0.0019 0.8862 1.0309 0.4109 0.8837 -0.1385 -0.7445 -2.1758 0.5164 -0.1884 -1.7695 -1.8142 pantoate 0.5720 0.1777 4.2120 -0.3119 -2.2876 -0.3074 1.1272 0.3192 -0.2230 -0.3144 0.3084 0.7303 -0.0088 1.3195 0.9384 0.4056 -0.0622 -0.4053 0.2973 -0.1344 -0.0254 -0.3659 -0.2397 0.7600 -0.7499 -0.2784 -0.4039 -2.7819 0.5400 -0.3237 0.7465 -0.1198 0.2594 -0.1427 -0.4120 -0.1185 0.7069 -2.5948 0.1094 -0.8123 -0.2422 -0.1087 -0.3639 -0.8364 -1.3060 -0.3362 -0.8274 -0.9209 0.7990 0.8973 -0.0687 -0.3124 -0.4224 -1.4740 0.4935 -0.2304 0.3402 -0.9607 0.5881 -1.8124 -0.1300 5.1736 1.0721 0.6920 0.4463 1.5712 0.1590 -0.4077 -0.7057 -0.4691 -0.8556 -0.5905 -0.1677 -0.3215 -0.2711 0.4492 -0.3346 -0.3780 -0.0605 0.4124 -0.3009 0.0659 0.3519 -1.4349 -0.9437 0.3467 0.5033 -1.8600 -1.5295 -0.0754 -0.2947 1.9257 0.2368 0.2173 -0.0545 -0.2566 -0.0123 0.3697 -0.5900 0.0866 0.2183 1.1859 0.3845 0.4554 -0.9004 0.2069 -0.1150 -0.6475 0.1155 0.4958 0.9333 0.3177 1.2713 -0.2722 -0.4865 0.5497 -2.6780 -0.0765 0.1435 -1.4113 -2.7909 -1.5977 -0.5001 -0.0557 0.8188 -0.3913 -0.2303 0.5973 -0.5723 -0.3581 1.2586 0.2160 0.9714 0.2645 1.1398 -0.1208 -0.0879 0.4518 0.3250 0.4238 0.2319 0.0304 -0.9210 0.0922 -0.5822 1.1509 -0.7512 -0.4584 -2.8258 0.0854 0.5356 -0.3843 -0.6050 -0.9524 -0.6986 -0.2524 -0.1851 -1.1464 0.1824 0.2017 -0.1366 -0.3296 -0.0536 -0.5283 0.2347 1.3729 0.1728 0.3786 1.1944 -0.0940 0.8200 0.6556 2.0543 0.5866 0.8284 -2.5413 -1.5628 0.9957 -0.7841 -0.1090 0.8079 0.2073 0.4387 -0.6572 0.2681 -0.5222 -0.0895 -0.1987 0.3471 0.3253 0.1238 0.4024 -0.3187 -2.7724 1.3901 -0.1062 0.4695 0.0688 -1.9119 -1.3519 -0.2013 -1.1615 -0.6290 0.1288 -0.5434 -2.5187 -0.0100 0.4230 0.3649 0.5218 0.0076 0.2749 0.0791 0.5595 0.6469 -0.4441 0.0898 -0.2148 0.7042 0.1488 -0.2967 0.2732 -0.1555 0.8827 0.2919 1.0165 0.6607 0.6475 0.2408 0.1223 0.1132 0.3488 0.4080 -0.8579 -0.2976 0.4411 0.3424 -0.1879 0.1694 -0.1982 0.4394 0.0988 -0.0969 0.2935 -1.0244 0.2546 0.4373 0.7283 0.1370 0.0990 -0.2845 2.8189 0.8915 -0.2704 -0.2878 0.2722 0.0106 0.3781 -1.0052 0.5541 -0.4669 0.0913 0.4281 -0.6037 -1.0228 -0.1781 -0.2573 0.7729 0.2720 -0.7368 1.2776 0.5401 0.0622 -3.1445 -0.4988 -0.2280 -0.2720 1.3783 0.5807 -2.6449 -0.5166 0.9719 -0.2364 1.0685 -0.6025 -0.0611 -0.4574 0.6655 0.0910 -0.0123 -0.1199 -0.4766 0.6124 0.3830 0.5562 0.8736 1.4222 0.4356 0.0837 0.0725 0.8522 0.1715 -3.0177 0.7963 0.7043 0.9306 -0.2085 0.1082 0.4803 -0.8179 -1.2103 0.1478 0.3973 -0.1597 -0.1597 0.6342 0.4455 1.2634 0.7121 0.0997 -0.4989 0.2589 -3.6652 -0.0889 0.6700 -0.1317 -1.4338 -0.1016 -0.0291 -0.4328 -2.8601 1.4505 -1.3001 0.4448 -3.0661 0.5786 0.0211 -0.0528 0.5100 6.2528 0.5560 0.6827 -0.0733 -0.1435 0.0308 0.1518 0.5518 0.2856 -0.8635 -0.5219 0.7141 -2.1772 0.5050 0.0577 -0.4782 -0.2462 -1.0359 -0.0532 -0.0017 1.4149 1.1736 -0.2395 -0.0077 1.0661 -1.2290 -0.3048 0.0686 0.5606 -0.0613 0.5025 -0.4452 0.0385 -1.6991 -0.3149 -0.1449 1.1858 0.1093 0.0344 0.2324 -0.2194 0.1353 1.9465 1.3083 -0.2316 -0.2049 -0.1712 0.4921 -0.2918 0.0720 -0.3025 4.6124 -0.8964 -1.9968 -0.1517 -0.0270 1.1237 -0.5220 0.2942 -0.4817 0.4034 -0.1050 -0.1613 0.7124 0.2509 0.3995 0.0445 -1.1379 0.1989 0.5194 1.7611 pantothenate (Vitamin B5) 0.6556 -0.1683 2.7875 -1.0513 0.3649 0.7292 0.4213 1.4555 0.7291 0.7287 2.3354 1.2839 -1.4490 -1.0459 -0.1071 -0.2838 1.2357 -0.3213 1.7154 0.2179 1.3147 -0.8839 0.6681 0.1119 0.0033 1.4486 1.8838 0.9949 0.0684 -0.2953 0.5810 0.1772 -0.8651 -1.7274 -0.3687 1.5368 1.8564 0.4114 -0.2679 -0.0101 0.5888 0.7813 -0.3242 0.0452 -0.6504 -0.3092 -0.8535 -0.4620 1.4999 -1.0777 0.4715 0.0429 -0.4639 1.0984 1.6918 0.1723 1.3669 -1.8522 -0.3285 0.0389 -0.5737 2.6206 -1.4490 0.5380 -0.8980 -1.2687 -1.3984 -0.0621 0.0181 -0.1220 1.5284 -0.1937 -0.0609 0.0415 -0.2821 0.0957 -0.2724 -0.9487 -0.8475 0.3376 -0.2953 0.2319 0.6203 0.8190 -0.6111 1.7232 0.3882 -0.4053 0.4308 2.9484 1.4920 1.1164 -0.8440 0.5269 1.1477 0.2614 0.7522 -0.4607 -1.3262 0.3475 -0.2162 2.1438 0.3409 -0.5659 0.0231 -0.0059 0.1091 -1.5715 -0.1740 -0.4487 0.9730 0.4192 0.4181 0.2859 -0.8819 -0.2778 -1.8892 -0.4430 -0.1901 0.2106 0.7256 0.6119 -0.5180 -1.3696 1.4834 0.6778 -0.6390 0.6136 -1.6328 -0.5874 1.2610 1.4852 1.9732 -0.5194 2.3606 -0.0016 -1.2589 0.6389 -0.1307 0.8014 -0.5345 0.9868 -0.7351 0.7492 -0.4459 1.2130 -0.8291 0.6832 -0.9367 0.8033 -0.7002 0.2266 -1.4409 -1.5801 -1.0223 -0.7930 -0.2123 -0.7402 -0.8070 -1.1787 0.9207 -0.2539 -1.1059 -0.4967 -0.0877 1.5941 -1.2302 -0.5561 0.6266 -0.0366 3.1555 0.9576 2.3381 0.9957 -0.0467 -0.8383 -0.4768 1.9302 -0.4076 -1.2664 0.6986 -0.2024 0.8774 -0.1957 -0.6841 -0.1672 -0.5258 -0.1975 -0.7382 -2.0418 -0.8679 0.2863 0.3234 -0.8651 -0.9283 -0.1445 -0.9403 -1.0756 -0.5974 -1.2101 0.9699 0.6907 -0.0566 -0.7853 -0.1344 0.0441 0.7672 -0.3026 -0.9701 -0.5882 0.3026 -0.2194 -2.2627 -1.2760 -1.9357 0.6348 0.2045 0.9190 -0.2031 0.5554 -0.9558 -0.0977 -0.1587 1.0349 0.7160 -0.7147 1.1640 2.1054 -0.1630 0.1701 -0.1401 -0.8581 1.6623 -1.7143 0.2468 0.6615 0.0473 -1.5133 -0.3500 -0.6250 0.1899 -0.8974 0.1356 1.6912 -0.7112 -0.2198 -0.3504 0.3405 -0.3236 0.3176 -0.4705 0.7302 0.5043 1.4726 -0.3062 0.1874 -0.2492 -0.1252 0.8047 -0.4129 -0.5709 -0.7973 -0.5631 -0.4150 0.5722 -0.7088 -0.1081 -1.6339 -0.5697 -2.2118 -0.1882 1.2230 -0.3900 0.2794 -0.5736 0.7426 0.0879 2.0188 -1.4935 0.0487 -1.3284 -0.0949 -0.2860 -1.2980 -1.0410 -1.3197 0.2385 0.7987 0.1398 0.2919 -1.1466 -0.4921 0.3808 0.4908 -0.6890 -0.4793 2.1938 -2.0275 -0.2185 -0.1334 1.7859 0.1440 -1.5679 0.7168 -1.4793 -0.5364 -0.1623 -1.2055 -0.4859 0.8241 -0.0010 -0.4978 -0.8540 0.3480 -0.6565 -0.7175 1.5993 0.7961 0.2736 0.0185 -0.2807 0.2903 -0.8643 -0.4483 -0.5466 1.9292 -1.2235 -0.6165 -0.0992 -0.3272 -1.0610 -1.0906 -0.9732 -0.5852 -1.1070 1.4344 1.3243 -1.6539 -0.4498 2.1468 -0.5048 2.6096 0.0399 0.0179 -0.2137 -0.5844 -1.2728 -0.8574 -0.1484 -0.2641 -1.7299 -0.4251 0.4775 1.5592 1.2186 -0.7237 -0.2651 -0.1498 -0.5376 1.2862 -0.6954 -0.5629 -0.4655 3.2982 1.1491 -0.3800 -2.2430 -1.7397 0.2383 0.2118 0.0125 -0.9461 -1.1878 -0.5755 0.0281 3.6014 -0.8929 0.3397 -0.6031 -0.3251 0.0988 1.8323 0.6704 -0.1161 -0.1287 0.5009 0.7957 1.5660 -0.4242 0.2214 0.3410 -1.2374 -0.2012 -0.1438 2.2649 -0.3706 -0.4350 -1.2932 -1.4374 -0.6020 -1.1751 0.3456 1.2430 -0.5164 -0.2500 0.4853 -0.7690 -0.0371 0.1435 1.3113 paraxanthine 0.9962 -1.6406 1.2710 -1.2421 -0.9531 -0.2624 0.5902 -0.8802 -1.3704 -1.0625 -0.8850 0.2677 1.1894 0.8749 0.5954 0.7243 0.6076 0.4512 0.3607 0.1881 1.1162 -1.6478 -1.0488 0.9410 -1.2980 -0.2266 1.1727 0.7142 0.2346 0.3015 -0.1957 -1.1979 -1.0100 -1.5388 0.0996 -1.3355 -0.4485 -1.1234 -1.2377 1.6069 0.0763 -0.9614 1.0548 1.2683 -1.1989 -0.6448 -1.3152 -1.2926 0.7587 1.0431 -1.2991 -1.5061 1.2605 1.5144 0.9246 0.1044 -1.3307 0.9510 -1.3630 1.0042 1.3551 0.1453 1.2295 0.9438 1.3015 0.3648 -1.3343 1.1906 0.9844 -1.1806 0.0816 0.7454 0.1385 -1.4861 0.3725 0.7157 1.7623 0.1938 0.9225 -1.3610 0.2411 -1.2646 0.0423 1.4233 -0.3412 0.7492 0.2555 -1.2681 0.7220 -0.0955 0.1457 -0.0198 -1.2782 1.6622 -1.3023 0.6578 -1.3091 -1.2901 0.2058 0.3836 -0.2104 0.8369 -1.2006 1.4124 1.5399 1.0032 0.9329 0.0243 1.2556 0.2076 -1.4799 0.9931 -1.1909 -0.1120 0.5315 -1.3133 -1.1734 1.0325 0.9668 0.7260 -1.2287 0.5504 0.2253 0.5194 0.5057 0.0236 1.1518 0.8538 -1.3870 -0.1027 0.6382 1.6467 -1.1015 0.6940 -1.3680 -0.4432 0.9799 -1.0707 -0.3873 0.7707 0.9253 0.2426 0.7135 0.7779 -1.2330 1.0352 1.2094 1.2720 1.0438 0.5635 -1.1556 -1.1716 -1.2363 -1.1711 0.4252 -1.1862 0.5111 0.3792 0.6305 -0.9809 1.5934 0.1413 -1.1971 0.9556 -1.2808 0.5740 0.7807 -1.4015 -0.3634 0.0394 -0.3183 0.8024 1.5408 -1.1709 0.1334 0.5334 -1.1569 0.3380 0.9440 1.7647 1.0758 1.6189 0.2298 0.5934 -1.1811 -0.5721 -0.2899 -1.2748 -0.2583 -0.4557 -1.5433 0.0352 -1.2491 -1.2150 1.1192 -1.4105 -0.3368 1.5797 -0.0563 0.9961 -1.4316 1.2151 0.3639 0.7288 -0.2598 0.8939 -1.3709 0.8144 0.1115 -0.0145 0.5768 1.1336 0.8928 0.5369 0.4320 -1.3707 1.3442 -0.3693 -1.5612 0.7957 0.4283 1.1687 0.8781 0.2373 -0.2679 0.8295 0.1556 1.2767 -1.4144 -1.3181 1.6190 -1.2253 0.1328 0.0996 0.4704 0.7477 0.4579 0.1589 -1.4652 -1.2497 -1.3842 -1.5288 0.2653 -0.1352 1.4988 0.4708 1.5757 1.1313 0.4301 0.6162 1.0420 1.0912 0.0962 0.0246 0.4862 -1.2945 -0.2842 -0.6792 -1.3238 1.0716 1.5896 -0.2715 -0.4415 -1.5604 0.6378 0.4649 -0.5148 -1.5075 0.0269 -1.4377 -1.4429 -1.2769 -1.4819 0.9032 0.4746 -0.3914 0.7607 0.6038 -0.5001 0.6763 -0.0883 -1.4927 1.1733 -0.5438 0.8076 -1.3210 0.7415 -1.3537 -1.4833 0.8234 -0.7026 0.5593 -1.4189 -0.0900 0.0082 0.2705 0.2447 -1.6599 0.5702 -1.4591 0.6366 0.5529 1.2236 1.2091 -1.3505 0.9176 -1.4438 0.1486 -1.4796 -1.5330 0.3616 0.3345 1.0029 0.7266 0.6125 0.2707 0.1856 -0.0121 -1.2937 -1.4553 0.1277 0.5117 0.2161 0.1612 -0.3200 0.2841 -0.0767 0.1090 -1.4043 1.6150 -1.2735 0.3411 0.8288 -1.2197 0.7260 0.6758 0.9483 0.1041 0.7311 -1.2308 1.6900 1.2915 -1.5069 -1.4826 0.5361 0.7544 -1.2352 0.5103 -1.4375 1.3081 0.3826 0.7853 0.1820 -1.6044 -1.4427 0.0781 2.3604 -1.4466 0.3853 1.5399 -0.3587 -1.4362 0.3651 0.6189 0.5552 1.1691 0.4748 0.5770 0.4254 0.9713 0.3527 -0.0213 -1.3474 -0.1844 1.0469 1.1391 0.4744 0.2440 1.5435 0.2496 -1.3789 0.9493 0.6962 -1.6277 -1.6842 -1.6815 0.8267 -1.4285 1.1556 -1.6108 -1.1993 -1.3364 -1.0469 -1.4316 -1.5190 0.1204 -1.6177 0.5289 -1.6739 -1.0134 0.5200 0.1445 1.1927 -0.5890 1.6441 0.8467 1.2548 -0.1784 -1.3875 -1.3560 p-cresol glucuronide* -1.2000 0.4807 1.3835 0.4076 0.3441 0.5141 0.4646 0.0534 0.7480 -1.1577 -0.2300 -0.5635 1.6150 -0.8257 0.7423 -0.5452 0.8832 -0.4008 0.0960 -1.2584 0.4047 1.0105 0.4736 -1.4118 0.3632 0.4835 0.3150 0.7951 0.4524 0.9600 -0.3026 -0.4909 -1.1314 0.8059 -1.6696 1.2353 0.1471 -1.2372 1.2710 0.5715 0.1364 -1.0723 0.1569 -1.5766 1.3624 -0.0338 0.3903 0.8266 -0.2632 -1.3953 -1.4062 -1.5775 0.4068 0.1378 -1.1855 0.0483 -1.4343 -0.6379 -1.4641 0.4037 0.5495 1.0718 0.4779 0.3817 1.2697 0.3910 0.4601 -0.0968 1.4555 0.2963 1.1643 -0.1653 0.5738 -1.5699 1.2299 0.8352 1.6698 0.4572 -1.2980 0.8911 -1.4674 0.8689 1.4205 -1.5627 1.1273 1.0085 -1.3060 0.8294 -0.9379 0.8596 1.2295 1.0763 0.0827 1.3049 1.4512 0.8115 -1.4053 1.0733 -0.0391 -0.9795 0.2203 1.4254 0.5901 -1.6078 1.5665 2.6222 0.5309 -0.5196 1.0328 -0.4927 -0.5534 0.6803 -1.2998 -1.1055 -1.4281 -1.4194 0.2844 0.5487 -1.5026 0.6951 0.4750 -1.3828 0.1878 0.1563 -1.6045 1.5922 1.3330 -0.1992 0.0226 0.0115 -0.0525 -1.3206 -1.2043 -0.5606 0.8621 1.4503 -1.3995 0.3910 0.5660 -1.0763 -0.3811 -0.2718 1.1079 1.2469 0.4191 1.3137 -0.4678 0.7660 -1.3484 -0.1936 0.9000 0.8462 1.5052 -0.0975 1.2810 -1.2954 -0.6869 0.3016 -1.5230 -1.1128 0.3411 1.0781 -1.3077 1.1620 0.2230 0.1406 1.2172 0.5627 -1.5421 -0.1684 0.9164 0.5594 0.1618 -0.4025 0.3732 0.2015 -1.2687 0.2534 1.0908 0.1192 -1.3842 -0.4813 0.5968 0.6942 1.3728 1.3187 0.6891 0.0937 1.2685 -0.6355 1.1260 -0.5543 -1.3564 -1.3098 0.7996 0.8838 -1.3743 1.2381 0.7811 0.3483 -0.2988 -0.7273 -0.1276 1.1609 1.9022 -0.1267 -1.4759 -0.9094 0.1738 1.1547 -1.3967 -1.4403 1.6823 1.1456 1.6958 0.5305 -1.6214 0.6015 1.1431 -1.5573 -0.3738 0.9707 1.1944 -1.6408 -1.6959 -0.9492 0.4909 0.4240 1.2956 -0.6269 -0.6290 0.6152 -1.0247 0.2294 -0.4160 0.9339 -0.2494 -0.6256 -0.6841 -1.3520 -1.4810 0.1562 0.8632 -0.8270 0.2643 -1.4413 -1.4782 1.5919 -0.8200 -1.5102 0.7637 -1.5510 0.8313 1.0578 0.5823 -1.4016 0.5263 1.1381 2.3976 -1.5774 0.5540 0.8062 -0.4603 -1.6611 -1.5257 0.6349 0.2347 0.9833 -1.4045 0.4975 -1.5351 0.1789 -1.5698 -1.5324 1.0344 -1.5003 -0.7545 -0.4133 -1.5742 -1.0355 0.5904 0.0734 -1.6107 -1.5898 0.4549 0.1611 0.7132 0.6333 -1.5637 0.6285 -1.0749 -1.6142 1.0051 0.1522 -1.4291 1.0366 -1.5235 -0.2136 0.3589 -1.5525 1.8626 -1.5569 0.9197 -0.0414 0.5400 -0.1117 -0.3604 -0.7925 0.1199 -1.0433 -0.3239 0.4950 0.7847 0.4677 -0.6550 0.3637 -1.4255 1.6732 -0.9461 1.3994 -0.4614 0.6058 0.1382 0.5907 0.9704 0.2398 0.7048 -1.4614 0.5051 1.5319 0.7515 0.0107 -1.4474 1.1381 0.8148 0.1107 -1.5213 -0.0996 0.4553 -1.3153 -1.4541 -0.0129 0.3404 -1.5722 0.2160 -1.4044 -0.6602 -0.3835 -0.3661 0.5372 -0.3613 1.7926 -1.5261 -0.4923 0.9766 0.5245 0.3771 0.0583 -1.2242 -0.0567 -1.5485 -0.4026 0.7228 1.8261 0.0674 0.4112 -1.0725 -1.6724 -0.9753 -0.3546 -1.3746 0.4618 -0.1884 1.3065 -0.2152 0.0374 -0.3339 -0.4222 0.2631 0.5889 1.1286 -0.9486 1.7157 0.2289 0.3281 -0.1253 -0.3896 -1.5242 0.1889 0.5728 0.8633 0.8886 0.1785 0.5407 0.7558 -0.8220 -0.9176 -0.2801 -0.0251 0.7910 -1.6980 1.8883 -1.4137 2.3937 0.7884 0.8002 -0.0054 -1.5201 -0.1572 0.0777 p-cresol sulfate -2.5092 0.5481 1.1066 0.8327 0.5388 0.4236 0.6001 0.2886 0.5272 -1.5552 -0.3596 -0.0519 0.8755 -0.1974 0.3324 0.4731 0.7321 0.0041 0.6876 -0.7786 1.0294 0.9498 0.5368 0.2157 0.6357 0.1974 0.9287 0.5534 0.7565 0.2314 0.2487 -0.7442 -0.0075 0.6648 -1.5079 0.8873 -0.4892 -1.2607 0.9174 0.8144 0.1034 -0.8783 0.0660 -1.1809 0.1512 -0.3063 0.2999 0.5494 0.0059 -0.9389 -1.1842 -2.3536 -0.0813 0.6422 -0.1920 0.1275 -0.1382 -0.1961 -1.9740 0.2712 0.5698 0.7628 0.4871 0.6656 1.2047 0.7566 0.4250 0.3122 0.8290 0.4518 0.3753 0.3875 0.5350 -0.9524 0.8044 0.4638 1.5225 1.0347 -1.3814 0.8338 0.0542 0.8305 1.1415 -0.7753 0.6162 1.0433 -1.5227 0.0722 0.3123 0.8296 1.1782 0.7809 -0.3586 0.8726 0.7943 0.7329 0.0056 0.7990 0.0833 -0.2771 0.3971 1.4314 1.0199 -0.8388 0.7479 1.2808 0.2143 -0.5394 0.3497 0.0832 0.0310 1.0106 -0.5091 -3.0514 -3.5499 -0.6991 0.5004 0.6207 -3.3814 0.9754 0.2608 -1.6695 0.6635 -0.1366 -0.4639 1.1182 1.3025 -0.0584 0.4853 -0.0728 -0.2725 -3.3826 -1.0737 -0.9452 0.8340 1.1268 -0.0172 0.4002 0.5440 -3.4764 -0.8261 0.3209 1.0504 0.5088 0.0986 0.4861 -0.3098 1.0138 -1.6052 -0.1726 0.4731 0.5329 1.1626 0.1341 0.8439 -1.4726 -0.4986 0.1045 -0.7248 -0.3739 0.4291 0.6469 -0.7948 0.6306 0.2034 0.0607 0.3967 0.5220 -0.5049 -0.0911 0.9182 0.6965 0.4795 -0.4692 0.6246 0.0275 -0.8966 0.0737 1.0781 0.0177 -1.2049 -0.0972 0.5705 0.5044 0.8390 1.1854 0.5226 0.1161 1.1669 -0.1560 1.0679 0.0502 -0.7284 -1.4650 0.5577 0.4819 -3.3318 1.2420 0.9189 0.3667 0.5547 0.1288 -0.1839 1.3705 1.5726 -0.1626 -1.1963 -0.4421 -0.0730 1.3089 -1.6095 -1.0742 1.3023 0.7927 1.1328 0.4815 -1.6177 0.6401 1.3161 -0.4090 -0.5371 0.4924 0.7903 -1.9310 -0.3524 -0.0720 0.3894 0.2612 0.9568 -0.3602 -0.1327 0.6742 -0.4376 0.4365 -0.1825 1.2104 0.0872 -0.5567 -0.0672 -1.1639 -1.1182 0.0564 0.2522 0.6229 0.4084 -1.2451 -2.0258 1.4258 -1.0328 -0.5909 0.4744 -1.0504 0.7400 0.4640 0.4357 -0.8459 0.1938 1.2359 1.3562 -0.9033 0.1360 0.4724 -0.0123 -2.3844 -0.7840 0.0734 0.1314 0.4863 -3.2903 -0.4440 -3.2528 0.3463 -1.8240 -0.8246 1.0729 -1.6217 -0.7241 -0.2064 -0.3844 -0.4672 0.8049 -0.0497 -1.7373 0.0992 0.4183 0.5392 0.7554 0.9373 -1.9674 0.6655 -0.9907 -1.4583 0.8883 0.1876 -2.4588 1.0003 -1.3100 0.3319 -0.2630 -2.9409 1.4914 -1.8939 1.0732 0.4026 0.4440 -0.0787 0.1662 -1.6464 -0.3423 -0.4544 -0.7629 0.4729 0.4174 0.4933 -0.0928 -0.1252 -0.4109 1.0128 -0.2981 0.8185 0.3331 -0.1567 -0.0882 0.6504 1.2131 0.4708 0.6395 -1.8381 0.6519 1.5279 0.7556 0.3317 -1.4681 0.7812 1.2097 0.2500 -1.9818 -0.3557 0.9889 -0.6158 -3.4425 0.1890 0.5268 -1.3679 0.0837 -0.5436 0.1925 -0.1956 -0.0270 0.5616 0.1286 0.7870 -4.0680 -0.3546 0.4730 0.5403 -0.2367 0.1440 -0.9544 -0.0933 -2.1703 -0.0274 0.6905 1.3131 0.0303 0.8795 -0.8980 -0.5496 -0.8469 -0.2724 -1.6452 0.2374 -0.3409 0.6548 0.0710 -1.2314 -0.0807 -0.3216 0.2179 0.6142 0.5873 -0.4926 1.1726 0.9771 0.9328 0.1063 0.1071 -0.6385 0.2066 0.4791 0.6305 1.1324 -0.1640 1.1063 0.8156 -0.2212 0.1095 0.1042 0.3829 1.5109 -1.2299 0.8778 -0.6577 2.0845 0.3861 0.8029 -0.1360 -1.9976 -0.2851 -0.3166 pelargonate (9:0) 1.9006 1.1750 1.9999 1.0709 -1.1378 1.6199 -1.2382 1.7166 1.7203 2.0202 1.9650 0.7416 -0.4018 1.6680 -0.8134 0.7126 1.5407 0.1994 0.3061 1.2549 -0.4399 -0.8593 0.1078 -0.5936 -0.2779 0.2060 0.4570 -3.4257 0.4221 1.2151 0.1380 -0.5144 -0.9157 -0.4099 -0.2882 1.4917 -0.1821 1.0736 0.9828 -0.9491 0.1019 0.4083 -0.4463 -0.6132 -1.0170 -1.1705 0.1743 0.0737 0.4714 1.5543 0.6467 0.9537 0.9009 0.5958 1.1610 -0.3307 0.2013 -1.3964 1.2039 -0.4868 -0.0738 0.2756 2.4048 2.2533 -0.0788 -0.5103 0.6904 -1.2899 -0.9947 0.6752 -0.1304 0.1392 1.2536 0.0861 -0.6073 -0.6437 -0.4541 -2.3129 0.4797 -0.3755 -0.5941 1.4299 2.0466 0.2738 -0.1655 -0.4965 0.1609 -0.4287 -0.6339 -0.3913 -0.3095 0.7117 -0.2722 -0.3266 0.4072 -0.2019 -0.8316 1.5066 -0.8306 0.4378 0.9855 0.4773 0.7236 0.4442 0.1534 0.9019 2.1115 -0.1500 1.2360 1.2788 1.0895 0.8222 -0.0365 0.9501 -0.1492 1.0109 -0.7056 -0.6412 1.4087 -1.0793 0.3507 -0.2331 -0.0054 0.4894 0.9409 -0.2385 -1.5949 -0.6444 -0.4976 -0.1775 -0.2881 -0.7210 -0.1759 0.1216 0.0447 -1.0341 -0.6379 0.9715 -0.7435 1.2154 1.4628 0.5880 -1.2979 0.8160 0.9129 0.6459 -0.7976 0.4618 -0.6220 -1.1738 -0.4173 -1.1862 -0.3353 -1.0099 0.5423 0.8136 0.6228 -0.7675 -0.0257 0.4406 1.5269 0.0609 0.0220 0.7157 1.5580 -0.6216 0.6526 -0.2054 0.4896 0.4807 -0.4878 1.8334 -0.5458 2.0947 1.3597 -1.7381 -1.0640 1.5708 -0.2441 -0.3340 0.7317 0.7073 0.4418 -0.5337 -0.1825 0.6341 1.0401 -0.6889 2.0685 0.3892 0.0266 1.9749 -0.0974 0.3430 -0.9052 0.6315 1.8205 -0.8343 -0.9776 -0.2602 -0.5836 0.9998 -0.0708 -1.1963 -0.6324 -3.0500 -1.0753 0.7903 1.0282 0.5798 -0.6191 -0.9862 -0.0585 -1.0727 -0.8360 -0.7170 0.1273 0.0030 -0.9838 0.4030 0.0509 -0.0318 -0.7234 1.9874 -0.4740 -0.4526 0.3298 -0.0395 -0.4389 -0.5223 0.1324 -0.4777 -1.0887 -0.5555 -0.5961 -0.5554 0.7788 0.2049 -0.0738 -1.2617 1.6473 -0.8043 0.1275 -0.7616 -0.5907 1.4499 0.5129 1.6399 0.3054 -0.7032 0.5294 -0.4966 0.5185 -0.0500 0.1154 -0.5792 0.9689 -0.8562 -0.5190 1.4928 -0.4793 0.6542 0.7622 0.1470 -0.8063 -1.0747 0.3739 0.4745 -0.5893 -1.1556 0.7174 -0.3594 -0.4888 -1.3589 -0.8715 1.5135 -1.7517 0.2776 0.8131 -1.0354 -1.5758 0.5189 -1.4209 -0.4491 -1.1720 -0.6845 -0.2335 -0.6507 -0.6250 -0.6842 0.2324 0.1826 0.6628 1.2472 1.7257 0.0637 0.3180 -2.7886 -0.8896 -0.9038 1.3348 0.9879 -1.4597 0.2211 -0.5167 -1.5412 -0.3639 -0.4427 -0.7361 -0.3533 -0.2199 -1.0854 -0.1170 -0.6176 -1.1475 1.3199 -1.1348 0.6771 -0.6714 0.7049 -0.7546 0.9575 -1.0256 -1.2033 1.0624 -0.0324 -1.2390 0.6049 0.0130 -0.9523 0.2872 -1.2919 -1.6624 1.8454 -1.0635 0.2231 1.6686 -0.5439 -0.4775 1.6818 -0.7177 -1.5336 0.0202 0.1570 -0.1879 1.7774 1.0736 -0.5942 -0.9781 -0.5755 -0.4880 -2.6645 1.9746 -0.6242 0.7718 -0.3828 -0.2839 -0.8546 -0.6919 0.4908 1.1309 -0.0802 -1.5767 -0.2538 -4.0006 -0.6108 -1.4919 -0.7405 0.7223 1.1502 1.4108 0.0838 -0.0805 1.3064 -1.1661 2.4334 0.1481 0.2617 1.6649 -0.5572 1.4277 -0.7629 -0.7353 0.3980 -1.1175 -1.6758 -0.6209 -0.5728 0.5666 -1.6486 -0.9153 -0.5600 -3.0684 -0.2902 0.3203 -0.7095 -0.5638 -1.0069 -0.1825 -0.3777 0.5252 0.8526 1.7738 -0.7504 -0.1188 -0.4652 -0.3701 -1.2965 0.8990 0.2167 pentadecanoate (15:0) -0.1690 -0.4191 0.9659 2.2740 0.7159 1.4428 0.0214 1.2878 1.4807 1.0278 1.6324 0.7043 1.0129 -1.6547 -1.3503 -1.1315 0.8346 1.4950 -0.8050 0.0667 -0.5472 -0.8687 0.0467 -0.9712 0.7144 -0.7293 0.4202 0.3633 -0.8811 0.2976 -1.4809 -0.6699 -0.8615 -0.6102 1.5793 3.8102 -0.3786 -0.6472 -1.0066 -0.0710 -0.5442 -1.1099 -0.4671 0.9224 1.5286 0.9355 -0.2378 -1.1692 -0.8761 -0.7376 -0.5326 -0.3802 -1.3881 2.1664 -0.4458 0.5715 -0.8714 1.8417 -0.7027 1.9914 -1.0411 0.3337 -0.7092 -0.3582 -0.3828 -0.2059 0.3566 0.6947 0.6495 -0.8803 2.3473 -0.8050 -0.0728 -1.0895 0.1925 -0.3256 -1.6469 -1.4030 -0.1863 -1.3458 -0.0012 0.2855 -0.4788 1.8949 0.1097 -1.1657 -0.8204 -0.0340 -0.5810 -0.7735 0.4747 -0.2159 -0.9461 -0.5322 0.4483 -1.5409 0.0858 0.4551 -1.0660 1.0161 -1.1865 0.2752 -1.0801 -0.6749 -0.5794 -0.7375 0.7568 -0.0844 1.2103 -1.1330 -0.1004 -0.7353 -1.0783 2.0020 1.2315 -0.5994 -0.6789 -0.9166 0.2986 1.0339 -0.0269 1.7543 -0.7960 3.1515 0.5021 0.2576 0.6658 -1.4190 0.1004 0.9149 1.0000 0.8191 0.0607 -1.3059 -0.8796 0.2031 0.2286 -1.0659 1.2911 -0.8755 0.3188 -0.3927 -0.1367 -0.9363 0.3263 -0.6571 1.3320 0.3503 -0.9640 -0.2414 -0.1194 -0.3649 -0.2598 -0.7664 0.3094 -0.8725 1.7374 -0.0328 -0.2174 0.4325 -0.5849 -0.0757 0.1186 1.3513 -0.3066 0.5308 -0.6607 -0.9887 -0.7903 0.0539 -0.3048 0.3116 0.4487 -0.2809 0.2041 0.8673 1.0575 -2.0998 0.5592 -1.0293 -0.7304 -0.3791 0.7592 -0.1836 -1.3523 -0.0814 -1.5029 0.6195 -0.8048 -1.4301 0.8160 1.6674 -0.0187 -0.2146 -0.2044 0.8118 0.6822 -0.0264 1.4456 0.3722 -0.6518 -0.5632 -0.6614 -1.2856 0.1541 1.6017 1.3307 -0.9568 -0.4820 -1.1090 -0.9708 -1.3222 -0.4302 -1.2373 1.2194 -0.4683 0.5198 1.3640 0.6962 1.1317 1.2530 0.3452 0.3987 -0.1547 -0.5889 -0.0046 0.7754 0.2286 -0.7717 0.0002 -0.7788 -0.8105 -1.1556 -0.1808 0.2593 -0.5516 -0.7272 1.4594 -0.7681 0.3169 1.2207 -0.6404 0.9655 0.2957 -0.6613 -0.8462 0.5581 -0.7960 -0.4509 0.0410 1.6559 1.3678 -1.4799 0.7390 0.4986 -2.8972 -0.9503 0.6752 1.0398 -0.2621 -0.9155 -0.9783 0.1902 0.2970 1.3669 1.2675 -0.0415 -0.6693 -0.0045 -0.0314 -0.3751 -1.4271 0.0066 -0.0235 0.4246 -0.3617 2.7781 -0.5556 0.1208 -0.1322 -0.0009 -0.7424 -0.0578 -0.4146 0.8772 -1.5454 -0.4979 -0.3477 1.5449 -0.5708 -0.9408 0.7737 -2.3238 0.1648 -0.1766 0.3276 0.7888 -0.6024 0.2343 0.6182 -0.9705 -1.6434 0.0723 0.6626 -1.2822 -2.3869 0.8716 -0.8002 2.0307 -0.2650 1.3044 -1.1680 1.5037 -0.5921 0.8196 0.4073 -0.3974 -1.1779 -1.3454 -0.4737 -0.3189 0.1663 -0.3568 -0.3712 0.0464 1.2994 -0.5184 0.9470 -0.0873 0.2806 -0.7758 -0.8481 1.2465 0.8927 -0.4612 0.0642 1.0179 -0.4426 -1.0678 -0.5280 0.3194 0.7518 -0.1609 0.1191 1.3606 -0.6954 0.4170 -0.5202 0.8833 -1.7396 0.0349 -0.0107 -0.1197 0.3397 0.2517 -0.9316 0.8569 0.0527 1.9707 0.1569 -0.0369 -0.6671 -0.0324 0.1559 1.2335 -1.5363 -0.8601 -0.5740 1.7526 -0.8723 0.3784 -0.8287 0.2901 0.5273 -0.6297 4.2238 0.4340 -1.1063 -1.1562 -0.3444 1.0227 -2.5476 -1.3058 2.0550 -0.8582 0.4115 1.0802 0.6717 0.4085 2.4416 0.4872 -1.2161 2.7218 -0.8510 -0.4224 1.5037 -0.8089 -0.7841 -1.6710 -1.4170 -0.0224 0.2781 0.5142 0.5693 0.8070 1.6502 1.3606 -0.5516 1.6812 1.7615 pentose acid* -0.2492 0.4829 -0.8226 -0.5728 0.0039 -0.4266 1.4791 1.5947 -0.3446 -0.4859 -1.2108 0.2954 -0.4163 0.9565 0.1760 0.2313 -1.3341 -0.6869 -0.2411 -0.1182 0.4637 0.4803 -0.7423 -0.2269 -0.7777 -0.4986 -0.6501 -0.2075 -0.1540 -0.3610 0.8693 -0.3083 0.5413 1.6452 -0.4335 0.2125 -0.1446 -2.6822 0.0558 -1.1180 -0.3241 1.0686 1.2238 -1.1579 -1.2803 -0.5762 0.2501 -0.4403 0.0978 0.7623 -0.1093 -0.6812 -0.4957 -2.6991 -0.3572 -0.9652 -0.3814 -0.5413 0.2871 -0.3042 -0.5457 -0.0832 0.8127 0.3659 -0.0720 -0.2433 -0.0728 -0.3522 0.5270 0.0955 -0.9316 -0.6521 0.3516 1.5404 -0.1225 0.2578 -0.7142 0.4466 1.4157 -0.2768 0.6665 -2.8661 -0.8376 -3.1361 0.2593 -0.4203 0.4360 -0.0906 -1.2976 -2.6542 -0.9290 -0.3873 0.9834 -0.0490 -2.9361 0.1478 -0.2067 -0.4685 -0.0504 0.2963 0.1904 0.9417 0.5974 0.3028 -0.0512 0.9326 -1.1478 -0.0206 -0.4018 -0.2036 1.0631 0.8848 1.2835 -2.9683 0.2762 1.6767 0.6654 -0.6159 0.4277 -0.3436 -2.8281 -1.1376 -0.3967 1.2297 1.1116 -0.3495 0.2730 1.1600 1.0847 -0.0548 -0.2253 0.7008 0.7460 0.4476 0.7647 1.1256 0.8077 0.0429 0.5595 0.1317 -1.1884 0.3113 -0.8736 0.5205 -0.0709 0.6718 -0.0771 0.2443 0.8205 -0.6695 0.2668 -0.5804 -0.4179 0.4149 -0.0266 -0.7613 -0.1477 -1.0341 0.3194 -0.2171 -0.9600 -0.1273 0.5496 -1.4139 0.2001 -0.1684 0.2132 1.1902 1.9437 0.0962 0.8976 -0.3901 1.5529 -0.4867 1.5709 -1.1765 -0.3837 0.3973 -0.4236 0.1497 1.7268 1.7276 1.5490 0.1341 0.2742 -0.3480 -0.4751 -0.0046 -0.6418 1.2716 0.7750 -0.9620 -0.4868 -0.6443 -0.8900 -0.2787 -0.0865 0.6990 -0.8445 0.3555 0.8557 -2.7355 -0.8421 1.6406 -0.5506 -0.7638 0.3299 -1.0795 -0.4797 1.3258 -0.4701 1.1204 -0.2258 1.6996 0.4330 -0.4515 1.4321 0.4528 0.6965 -0.4079 -0.7422 -0.5597 -0.2601 0.5220 -0.5582 0.3640 0.9679 0.5051 0.0899 -0.1535 -0.0477 1.9097 1.1200 -1.1324 0.1481 1.8010 0.9000 0.9361 0.4668 0.0264 -0.1372 1.4265 0.3462 0.6189 0.6641 -0.2194 -0.4988 0.0279 1.1495 -0.7446 -1.0819 -0.7463 0.0988 -1.0551 -0.3808 1.6949 -0.5445 1.6710 -1.5594 0.0440 -0.5790 2.0930 1.4456 0.0962 -0.2515 -0.1247 -0.5155 0.3914 0.7563 0.5344 -3.1088 1.7230 0.8081 -0.0159 -0.8113 -0.2856 -1.6068 0.9642 1.3302 -2.2978 0.8639 0.7997 -0.1763 0.3615 0.6842 0.4161 0.4088 -2.9785 0.7062 1.1673 0.2699 -0.0742 -0.0201 1.1256 0.4211 0.7149 1.2692 0.2933 1.3428 1.5866 -0.1887 0.0983 -2.9954 0.0338 2.5802 1.8092 0.6841 0.5175 -3.1657 -0.1848 -1.0507 -0.0931 0.2422 0.1020 1.1140 2.0681 -0.2667 -0.4492 0.4585 1.3330 -0.8453 -2.5182 -0.6004 0.2313 0.4851 -1.5456 0.9561 -0.0259 0.9070 0.0639 -0.0953 0.0988 -0.3648 0.7466 0.3804 0.8413 -0.3347 0.2596 0.4442 0.9558 0.0687 0.4800 -0.2627 1.2557 0.0436 -0.3352 1.9402 0.4253 -0.0390 -0.4270 -1.1133 0.6857 -0.4732 -0.2323 -0.6474 0.6558 -0.9916 -0.5193 -0.4871 1.0711 2.0027 0.2138 0.0186 1.1255 -3.0832 0.9553 -0.3756 0.4692 0.8142 -0.2897 -1.0301 0.1073 -0.7788 -1.6367 1.0142 -0.4691 0.0770 -0.2041 -0.6198 0.1655 -3.0290 1.8671 0.3786 0.2598 -0.2893 -0.6253 0.1660 0.4374 -0.2675 -3.3260 -0.0528 1.0268 -1.5251 -0.8469 0.8594 -0.2103 -0.3905 0.2858 0.0202 -0.8295 -0.0010 -0.3090 0.0924 -0.2086 0.0074 -1.5061 -3.0448 1.4128 0.0574 0.4201 perfluorooctanesulfonate (PFOS) -1.2263 0.2372 -0.0872 -1.3482 -0.3246 -0.5456 1.1127 0.8074 -1.3213 -0.8303 -0.7791 0.2446 0.3638 -0.4322 0.8414 2.2989 -0.6896 -1.5703 0.9241 0.0237 1.2155 -0.0663 1.8332 1.8944 1.5217 1.3656 -0.1273 0.6279 0.9955 0.3448 1.2415 1.3272 -0.6919 0.0827 -2.0514 1.1596 1.0736 0.2348 -0.6860 1.7929 0.7342 -0.4306 0.2796 -0.6729 -0.3972 -0.1970 -0.5318 0.2419 -0.3082 0.0632 0.1116 1.4281 -0.3923 -1.1998 0.3462 0.4928 1.0245 0.8993 0.6548 -0.8481 -0.1559 -0.0372 -0.8931 0.1947 -0.6061 -0.5045 -0.6274 -1.0208 1.3065 1.8040 0.4844 1.9391 0.0718 1.3594 -0.6184 0.0913 0.7643 0.0516 0.4588 1.0024 1.9309 0.3054 1.0736 2.1302 0.9119 0.8122 2.6063 0.3223 -0.0572 0.0037 1.0878 -0.5616 -0.2271 -0.3414 0.7398 1.0683 0.8398 0.1529 0.1998 -0.5221 0.8083 0.6488 -0.8068 -1.0944 2.4620 -0.4955 0.1234 0.2046 -1.0201 -1.2941 -1.2244 0.4097 -0.7281 -0.4262 2.7755 0.7323 1.3819 0.8704 -0.6092 0.0783 0.3565 1.6009 0.8272 -0.4936 -2.1465 -0.1332 0.8934 0.2219 0.3417 0.1776 -0.9289 -0.2797 -0.3575 -0.0451 -0.8906 1.2857 1.8854 1.1596 -0.6150 1.8353 1.5335 1.0210 0.6460 0.2026 -1.6793 -0.0604 0.6483 0.0028 2.6282 0.2322 -1.4744 0.0663 -2.2003 -1.2386 -1.4972 -0.7435 -1.4315 -0.6986 -0.2376 -1.7601 0.0133 -1.1083 -1.5136 0.5832 0.5685 -0.3745 0.6320 -0.6937 0.7535 -1.0177 0.7783 -0.0139 0.2445 1.4767 0.8255 0.0448 -0.6111 0.1980 0.8745 -0.7226 -0.9845 -1.6131 -0.6209 3.3829 -0.6381 0.0764 -1.0708 -0.4238 -0.4807 0.5872 1.5591 -1.6802 0.3566 1.5894 0.0212 -0.3378 -0.4428 1.2322 0.0992 0.4785 0.0107 -0.0823 -0.2350 0.7192 0.5016 0.8106 0.5298 0.0845 -0.5289 1.1071 0.3328 -1.4723 1.2440 -0.8123 -1.8921 0.5109 0.0441 0.8403 -0.0331 -0.2614 0.7633 0.7737 0.9246 -0.3928 -0.2656 -0.1553 0.4336 1.3357 -1.0580 -0.9477 0.1412 -0.0519 0.0787 1.0791 2.0002 0.0801 -0.0051 0.4341 -1.3617 1.6102 -1.6326 -0.4957 0.2891 -0.8920 1.2756 1.0525 -0.7364 -1.1064 0.8155 -0.5260 -1.5343 0.2555 0.5240 1.0043 1.0441 0.2972 -0.7643 1.3636 0.7708 0.3075 0.8274 0.5867 0.5179 -0.5079 -0.1704 -0.5067 -0.2196 -0.1337 -0.5084 1.1429 -0.2315 0.7548 1.2507 -0.8616 -0.7673 2.1948 -0.5305 -0.2621 1.1261 -0.4521 -0.5239 0.1574 0.4001 0.1586 -0.8182 -0.9305 -0.7733 -1.1912 1.8720 0.1758 -0.4576 -0.3660 0.8948 0.2993 -0.4827 0.3652 -0.9642 -0.9097 -0.5357 -0.2383 1.6960 -2.5814 -1.0338 -0.3081 -0.1603 -1.5570 -0.5133 0.6042 -0.9322 0.2076 -0.1834 -0.4465 -0.3902 0.1959 -2.3600 0.9577 0.1752 0.3309 1.2747 -0.1501 -0.3304 -1.4612 -1.6820 -2.2060 -0.0014 -1.6619 0.6234 -0.1640 0.8153 -1.8207 0.2705 -0.7503 1.7071 -0.7704 1.1490 -0.1901 -1.0566 -0.9998 -1.6946 -0.2011 0.2102 0.1671 -0.1924 -0.2254 -0.1679 0.5240 -0.4995 0.1733 -0.8151 -0.8662 -0.5894 -1.4988 -1.3558 -0.2122 -0.6651 0.2737 0.1185 0.7867 -1.4859 0.9094 -0.3619 -0.0474 -0.0106 -1.0808 0.0682 -0.6818 0.7976 0.0741 -0.4267 0.2187 -2.0220 -1.8626 -0.1421 -1.1214 0.5876 -1.4124 -1.2933 -2.6302 -0.9916 -0.3354 -0.6747 -1.8539 0.7600 0.4897 -0.3830 -1.2288 0.3786 0.0376 1.5819 -0.5119 -0.4708 0.7260 0.5503 -1.6535 0.3347 0.7345 0.3470 1.6758 -1.3128 1.5639 -1.9512 -1.4498 0.3332 -2.7961 1.1526 -0.5438 0.4021 -1.7750 -0.4245 -0.9865 perfluorooctanoate (PFOA) -0.0479 -0.3313 -0.9899 -2.2609 0.7776 -0.0781 1.1430 0.9882 -0.2827 -0.5728 -0.5050 -0.4534 0.6258 0.5030 0.9105 2.7313 -0.7233 -0.1594 1.0393 0.3390 1.3164 1.0196 -0.3210 1.1042 1.6552 1.2218 -0.5552 0.9963 1.1135 -0.0273 1.0682 0.7045 -1.3557 -0.7951 -1.1632 0.5464 1.1778 0.3424 0.4864 0.4206 0.4019 0.6740 -0.0691 0.3734 2.1403 -0.9101 -1.0101 0.9736 0.6054 -0.0519 0.3818 0.9877 -0.7342 -0.4003 0.6098 -0.2034 0.8791 0.1241 0.6998 -0.3555 -0.8798 0.0465 -2.1816 1.2848 -0.4099 -0.8139 -0.4162 -0.4628 0.1758 1.8049 0.1537 1.4076 -0.8742 0.1204 -0.1657 0.7147 0.3654 0.0644 -1.1388 0.3936 1.5246 -1.0442 0.1653 2.1102 -1.0070 1.4761 1.6732 0.0559 -0.0886 0.7265 1.2013 0.6799 0.9095 0.6573 0.3478 0.6571 0.3237 -0.3746 0.8896 -0.7621 0.3552 1.5702 1.0751 0.0794 0.4000 0.5372 0.1939 -1.3088 -0.5573 0.4403 -0.3271 -1.7214 -0.0321 0.4569 -0.3001 0.4943 0.2842 0.0484 -1.0444 0.0282 -0.0978 0.7200 0.1412 -0.3046 -1.4557 0.3346 0.9120 -0.1121 0.2722 0.0849 -0.7990 -0.1742 -0.6844 0.5432 -1.4467 0.0026 0.6473 1.3972 0.3647 -0.2035 0.5772 0.9238 -0.1021 0.1495 -1.7695 1.0613 0.8550 0.5636 2.1694 1.6305 -0.1437 0.6774 -1.9040 -1.0298 -0.2459 -0.6059 -0.9488 0.1984 -0.1561 -1.0824 -0.5063 -0.9421 -1.3915 0.1647 -1.1461 -0.0967 -0.3969 -0.5613 1.3301 -1.8690 -0.4587 0.1388 0.2095 1.7249 0.3185 0.2515 -0.3129 1.5389 1.2436 -0.7623 -0.0003 0.8494 -1.4552 1.9970 0.0507 -0.1691 -0.5011 -0.8888 -0.5574 -0.4706 -0.5412 -1.2978 1.6180 2.4457 -0.0677 -1.3214 0.3719 1.0690 -2.0841 0.0885 0.8989 -0.3327 0.0691 0.4422 1.0986 0.6326 -0.2572 0.6345 -0.8734 0.6968 1.8547 0.1394 1.3758 -0.4074 -1.3815 0.7486 0.3807 1.4911 -1.2445 0.5883 0.4156 -0.8762 -0.8547 -0.7026 1.5768 0.4012 -0.1222 -0.1128 -0.7509 -0.1559 0.1427 0.6134 2.0885 1.2064 -0.3311 0.5402 -0.2361 0.7098 -0.8180 0.1635 -1.3110 -0.2303 -0.7539 -0.8410 0.5970 0.1683 -0.4493 0.7920 0.5204 -0.4106 -1.1335 -1.4927 -0.1537 0.8641 0.4518 0.6656 0.0279 0.9236 0.0696 1.1505 0.9700 -0.2496 0.4654 0.1515 -0.1478 -0.6328 -0.3017 -1.1471 -0.1092 0.9217 0.3285 0.1892 -0.5312 -0.5718 -0.4715 1.5871 0.4061 0.0469 0.8208 1.3527 -1.4053 1.3176 -2.5472 0.2749 -0.5894 -1.9202 -0.6215 -4.0654 0.2143 -0.2271 -0.4823 -0.4395 1.0005 2.5042 0.0169 -0.0463 -0.5236 -0.5799 0.5829 -0.8190 -0.7996 -2.2197 -1.0601 -0.0868 -0.8509 -0.8619 -0.2240 1.1017 -0.0304 0.1745 0.0072 0.0687 -0.6787 0.3427 -3.9076 1.0359 -0.1620 -0.4598 1.1673 0.1847 0.9678 0.7119 -1.7087 -2.6775 0.0142 -1.3497 0.3810 0.5313 0.2573 -1.8024 0.2608 -0.4677 0.2086 -0.9588 1.3979 -0.2233 1.6089 -1.0798 -0.1398 -1.1091 0.0911 1.3555 -0.8406 0.1355 -0.5377 -0.4185 0.2139 0.3819 -0.3809 -0.9830 -0.3118 -0.0132 -0.5154 -0.5564 -0.5338 0.6192 0.7374 0.5389 -0.9598 0.7932 -0.1322 0.7048 0.5910 -0.2039 -0.4636 -1.2564 -0.4396 1.2742 -1.1892 0.6017 -0.6751 -0.5904 -1.2219 -2.1469 0.9027 -0.6144 0.2675 -1.7259 -1.3607 0.1171 -1.3944 -1.3232 -0.3632 0.2106 0.0325 -1.1565 0.0093 -0.0133 1.1322 -4.5848 -0.1061 -1.5487 -0.1810 -0.4098 3.1163 -0.2445 1.3304 0.2285 -1.8142 2.8327 -1.3170 -1.1936 0.9253 -1.5682 -0.0408 0.5061 0.3465 -0.8912 -0.1894 -0.0574 phenol sulfate 0.0009 -1.1343 0.3327 1.2114 2.1045 0.2637 0.1136 0.1323 0.6620 -0.7231 -0.3583 -0.2094 -0.2443 -1.6871 2.6510 0.1268 0.0654 -0.2765 1.3312 -0.9386 0.0400 -0.1214 1.4784 0.1906 -0.3354 -0.1152 0.9169 -0.6490 0.0185 2.7835 1.4502 -0.5662 -1.0872 -0.4642 0.6753 1.7341 -0.4210 -0.1523 0.4514 -0.4855 0.9828 -0.4540 -0.1582 0.9445 -0.8072 0.1568 -1.1917 -0.1274 1.5670 1.7738 0.0805 0.6372 -0.0990 0.2714 -0.2097 -0.0293 0.3325 0.4386 1.2026 1.6408 1.8778 -0.2770 0.3908 0.8645 -0.0082 0.1139 -0.1711 -0.3748 -0.3152 1.3336 -0.8021 2.4053 -1.7338 0.4328 -0.0219 -0.0140 0.1508 -0.4220 1.3113 0.0664 1.1880 0.0760 -0.4678 -0.9377 0.2170 0.7087 1.6172 1.9277 -0.2537 1.1131 -0.2225 -0.6446 -2.0607 -1.1588 -0.1843 0.1570 0.5088 0.2820 0.3152 -0.6041 -0.0032 0.1420 0.6308 -1.7671 -0.1543 -1.2724 -1.4742 0.5278 -0.5172 -0.4521 0.2519 0.1326 0.1991 -1.9393 -1.6473 -1.2793 -0.6999 2.1490 -0.1430 0.0933 -0.9082 -1.5918 2.0785 -0.6308 0.3203 -1.3139 -0.6390 0.7976 -0.3014 0.0415 0.0058 -1.7235 0.0815 -0.6707 0.7338 0.4801 -0.0375 -1.3666 1.2373 0.4161 -0.4238 -0.4627 -2.9364 0.0632 -0.9166 -0.0636 -3.0637 -0.2097 0.7869 0.4314 -0.3091 -0.5400 -0.1502 0.5991 -1.8971 -0.9970 -0.5587 -0.8380 -0.3333 0.2006 -1.3970 2.6895 0.8129 1.5569 1.3547 2.8046 -1.0486 0.9323 -0.5535 0.3906 0.2312 0.1928 -0.5143 -0.6466 -0.2319 -0.8358 0.7221 0.8338 0.6379 1.9549 0.3477 1.7159 3.3647 0.2501 0.0199 1.4133 -1.1458 -0.0652 0.5735 -0.3496 -0.0294 0.1770 0.2690 -1.1995 -3.2719 -0.2754 -0.5907 -0.5047 -0.3482 -1.4453 2.1150 -0.9074 0.4676 -0.1076 -1.2774 0.8377 -0.7734 -1.5789 -0.0161 0.7020 -0.3695 0.7957 0.4658 0.6216 -1.2123 -0.0116 -1.0158 -0.0405 0.8259 0.8099 -0.2160 0.6928 -1.4261 -0.5267 0.3784 -0.1349 1.1316 0.2629 -0.5563 -0.5784 0.1332 0.3235 1.0977 0.2581 -1.1493 -1.2105 1.6802 -1.0720 1.9877 -0.6704 1.0318 -0.4333 -1.8065 0.3939 0.3315 -1.0116 0.5733 1.0542 -0.4215 -0.9496 0.4434 0.4952 -0.5936 -0.5624 -0.7033 -2.6705 0.1524 0.1873 3.1217 -1.0129 -1.3936 0.5656 0.1891 -0.1514 -0.7397 -0.5286 -0.6984 -1.6462 0.2126 0.1759 -1.7222 -0.5130 0.5743 -0.3580 0.9457 -0.8252 0.8329 -0.0444 1.4075 -0.7909 -0.1605 -0.5237 0.6435 0.6452 -0.2363 -1.1489 -0.1306 1.1232 -0.1287 0.2400 -0.2845 -0.8345 -0.9120 0.1477 0.4353 0.7042 -1.2034 2.4813 -0.4870 0.3992 -0.9724 -1.4539 -0.2774 1.1981 -1.3258 1.5070 0.2839 -1.6738 -0.1912 0.5956 0.5978 -0.5191 -0.4451 1.2092 0.4462 -0.8712 1.2686 1.4563 -1.2130 -1.3877 0.4247 -2.0774 0.0581 0.2713 -0.9005 -0.2418 0.4275 -0.3744 0.4921 1.0459 -1.1918 -0.5673 1.0093 -0.7506 0.9970 -1.0580 -1.7063 -0.0621 -0.0139 0.1078 0.5824 0.9599 0.7253 0.4054 0.4615 -0.2701 0.3983 0.3739 -0.6375 -0.4612 -0.3672 1.8718 -2.6084 0.1534 -0.2315 -0.8460 -0.2784 -0.0811 1.3157 -0.7965 0.5338 0.5936 -0.5811 1.5840 -0.5240 0.1730 0.9230 -1.7122 -0.5288 0.0539 -0.2114 -0.2960 -0.7747 -0.9667 0.5806 -0.8764 -1.5118 -1.0575 -0.7548 2.5841 0.4942 0.3623 0.0521 0.1571 -0.1089 1.5679 1.2986 0.6333 1.5375 -0.7561 -0.8309 0.6635 0.8112 0.0512 -0.0206 -0.4747 0.1119 -0.3812 0.5387 0.2205 -0.3811 -1.7209 0.1523 -0.4908 -1.0914 -0.1224 -0.0440 2.0651 0.0273 -0.0207 phenylacetylcarnitine 0.5390 0.6616 1.5551 1.5151 0.7258 1.9851 0.6014 0.3698 0.9738 -0.6955 0.7073 -1.1328 0.3905 -1.0376 1.6880 -1.0582 0.7427 0.5279 0.8072 -0.8029 1.5753 0.5576 0.8347 -0.2455 0.0142 -0.2326 -0.1760 -0.1975 1.0503 2.2000 -1.1563 -0.8490 -0.6393 0.9442 -1.2744 0.8048 -0.9434 -0.7659 0.2927 0.8798 -0.7611 -0.5835 -0.9928 -1.1628 1.4629 -0.1030 1.5091 -0.3392 -0.9686 -0.9636 -0.9628 -1.1918 0.5790 1.8972 -0.7181 -1.1250 -0.9980 -0.7001 -1.0341 0.8128 -0.8452 0.9360 0.6136 1.0309 1.0462 0.7507 -0.0931 -0.0714 0.6349 0.9542 0.5093 -0.3786 0.6162 -1.1706 0.8334 1.4816 0.8792 1.0362 -0.8359 1.2030 -1.0171 1.2727 2.1345 -1.1501 1.5353 1.0512 -0.8544 0.9966 -1.1601 0.6254 0.4305 1.2808 -0.9385 0.8667 0.9683 1.4506 0.1756 -0.0918 -0.9197 -1.0879 -1.1271 1.2918 0.6270 -1.1909 0.5451 2.3448 -0.0599 0.1930 -0.7140 -0.8900 0.5014 -0.2390 0.0594 -1.0005 -1.0019 -0.9786 0.7757 0.1693 -1.0905 0.7014 0.2110 -0.9499 -1.0169 -0.1297 0.0571 1.8535 0.6879 -1.0400 0.1645 -1.1954 -1.1184 -0.8852 -0.7402 -1.1131 1.2733 1.8939 -0.9576 -0.7055 0.3639 -0.5886 -0.8159 1.1411 2.3459 0.5117 -0.8868 0.7617 0.2652 0.7518 -0.2549 -0.8541 -0.8014 0.5959 1.7546 -1.3996 0.5052 -0.8360 0.3091 0.1287 -0.2148 -0.6076 0.7817 0.6080 -0.5530 -0.9962 0.6940 0.8747 1.0349 0.7172 -1.1410 -0.9817 1.7381 0.2307 0.2205 -0.8173 -1.1585 0.7838 0.3082 -0.1419 0.6589 0.4342 -0.9308 -1.2399 1.2599 -1.0259 0.9675 1.2886 1.1244 -0.9342 0.7883 -0.8956 1.1339 1.1873 -0.9066 -0.8670 0.5325 0.9212 -0.9355 0.5833 1.4003 0.7893 0.8664 1.1061 -0.8675 1.9993 1.9153 -0.7214 -1.0433 0.6733 0.0466 1.1374 -0.9573 -0.9973 0.1551 1.7404 0.8209 0.2980 -1.2319 0.5857 0.2303 0.4596 -1.0586 0.9863 -0.3396 -1.2327 -1.2995 -1.2227 0.3535 1.2330 1.3388 0.6479 -1.0518 0.9066 -0.9557 0.1363 1.3498 1.2104 -1.0536 0.0364 -1.1499 0.3347 -1.0574 0.1992 0.9783 1.2585 0.6527 -1.0175 0.2389 1.9825 0.6516 -1.0944 -1.0810 -1.1403 0.7091 -1.0487 0.3981 -0.9576 0.7009 1.5546 1.5283 -1.1735 0.5330 0.1097 0.0136 -1.2560 -1.1027 -0.7349 0.1100 1.1133 0.2002 -1.1173 -1.1230 0.8231 -1.1664 -0.0541 1.4911 -1.0719 -1.0668 -0.4298 -1.1777 -0.8022 0.9269 -0.0165 0.1715 0.3509 1.8444 0.0459 1.2276 0.3376 -1.1672 -1.2416 -1.2047 -1.1992 0.6181 -1.2044 -0.9946 0.3718 -1.1102 -0.5975 -0.3941 -1.1413 1.4989 -1.1329 -0.2931 0.5817 -0.0765 -0.3171 1.8880 -0.8101 1.5401 0.3997 -0.9757 -0.7254 1.7246 -1.1574 -1.2707 -1.0577 -1.0006 1.5661 -0.9566 0.7168 -0.5342 -1.1487 0.5260 -1.2058 -0.3108 0.4870 0.5707 -1.0374 -1.0811 1.3442 0.8934 0.1607 -1.0265 1.6393 -1.0635 -0.2334 -1.1160 -0.2869 -1.2061 -0.8836 -1.0181 -1.3374 -1.1946 -1.1673 -0.3326 1.1511 -0.8912 -1.1638 -1.1174 -0.5426 -0.8452 1.2531 -1.1121 0.3979 0.6294 1.7074 -0.0234 -1.1292 -1.3502 -1.2372 -1.1443 -1.1146 0.7127 0.7619 -1.1008 1.2672 -1.2239 -1.2654 -1.2363 -1.2557 0.2314 1.0940 -1.0160 1.2750 -1.3534 -0.9154 -1.4065 -1.2207 0.5150 1.0126 0.8477 -1.3338 0.8082 1.3862 0.5941 -0.2566 -1.3761 -1.1071 1.2430 -0.1577 -0.8506 0.3872 -0.6791 1.2173 0.6748 -1.2176 -1.3190 -1.1050 -0.3119 0.2416 -1.3193 0.4219 1.0013 3.1629 -0.1144 1.3237 -1.0766 -0.3098 -1.0600 0.7695 phenylacetylglutamine 0.0028 0.2372 0.5515 0.3249 0.6412 0.8353 0.4433 -0.1386 0.5806 -1.8857 -0.5234 -0.8043 1.1236 -1.3316 1.0124 0.2317 0.4874 0.6619 0.8571 -1.4208 1.1087 1.2358 0.7763 -0.1189 0.5927 -0.6944 0.5774 0.1392 0.5679 0.8990 0.1829 -1.7251 0.3053 0.6921 -0.9638 0.8230 -0.7988 -0.5433 0.8700 0.5572 -0.5664 -2.0169 -0.5217 -1.2537 1.9115 0.2329 -0.0857 0.8708 -1.1762 -0.4152 -0.7979 -0.8725 -0.1200 0.1185 -0.8843 0.8463 -0.5520 -0.6889 -2.3043 0.4497 0.4858 1.4201 0.8034 -0.2886 0.3802 0.6858 -0.2410 -0.1405 0.7799 0.3630 0.6808 0.0434 0.3139 -1.8383 0.9736 0.7262 1.5225 1.6186 -1.0714 1.1516 -0.6174 0.6040 1.0520 -1.1121 0.8423 0.8837 -2.8740 0.9783 -0.2323 0.6320 1.4069 0.8549 -0.7911 0.9000 0.9841 0.3601 -0.1119 0.1762 -0.1210 -1.2968 -0.4915 1.1455 0.8738 -1.0668 0.6850 2.1592 0.4729 -0.4147 -0.4438 -0.8605 -0.4685 0.4401 -0.3658 -2.1326 -2.7466 -1.7864 0.5333 0.2377 -2.7908 0.4540 0.5957 -2.2249 0.3883 -0.7525 -0.3530 1.3920 0.7720 -0.2698 0.4467 -0.9202 -0.6397 -1.9334 -1.4394 -0.9630 0.6552 1.2001 -0.8877 -0.0564 -0.1116 -1.4907 -0.4599 0.5339 1.0562 0.9653 -0.7577 0.6064 0.3221 0.5577 -1.1096 -0.2640 0.2944 0.9857 1.6862 -0.1739 0.8336 -2.8001 -0.4745 -0.1209 0.0606 -0.4661 -0.0297 1.0186 -0.2339 0.7783 0.1082 0.8959 0.8796 0.4367 -1.8092 -0.3731 1.8233 0.2454 -0.3551 -1.0728 0.4661 0.9764 0.8224 -0.2660 0.9791 0.3529 -0.9427 -0.6448 0.6312 0.2213 0.9467 0.8904 -0.0574 -0.0776 0.8493 -0.7661 1.5645 -0.2354 -1.4232 -1.3020 0.6270 0.7953 -2.5722 0.6587 1.4030 0.5218 0.5997 0.8588 0.0842 1.2902 1.7244 0.0459 -1.3844 -0.5648 0.0618 1.2399 -2.2501 -1.9980 1.1874 1.2179 1.4112 0.9727 -1.8507 0.1414 0.5684 -0.2352 -0.7749 1.1321 1.0238 -1.7653 -0.3291 -0.3766 0.1314 0.4210 1.6692 -0.8778 -0.6697 0.5855 -0.3872 0.4694 0.2796 0.7677 -0.8061 -0.2929 -0.0480 -0.0440 -0.5151 -0.2708 1.3408 0.6294 0.0635 -1.2580 0.2647 1.5020 -0.9135 -0.9463 0.7244 -1.2898 0.4711 0.1049 0.5520 -0.9515 0.5665 1.1383 2.0590 -0.8882 -0.2307 0.4002 0.1308 -2.0763 -0.5438 -0.2360 0.2028 0.7919 -0.7747 -0.7251 -0.7645 0.4055 -1.3353 0.0195 1.2380 -1.2088 -0.0742 0.0429 -1.3793 -0.8768 0.7710 0.0520 -0.5747 -0.1796 0.4575 -0.2944 0.9858 1.5348 -2.3204 0.5105 -1.2162 -1.3863 0.8966 -0.6307 -2.9365 0.7619 -1.7838 0.7207 -0.2937 -2.0949 1.0201 -1.0877 1.1406 0.2318 0.5338 0.0177 1.0826 -2.1521 1.0286 -0.5920 -0.8495 0.7372 1.3570 0.3486 -0.3421 0.0456 -0.8941 1.3652 -0.9173 0.4631 -1.3458 -0.5433 -0.2210 0.5559 1.0252 0.2527 0.7862 -2.2581 0.5887 1.7720 0.8891 0.0411 -0.9370 0.9726 0.8561 0.2804 -1.5137 -0.0905 0.8400 -1.2087 -2.3231 -0.4590 0.6336 -1.1988 -1.4874 0.0381 -0.8027 -0.1240 0.2881 0.2242 -0.3668 2.0540 -2.2170 -0.4269 0.7163 0.6233 -0.2244 0.3785 -0.5137 -0.9375 -1.2429 -0.3397 1.0801 1.6985 0.1790 0.6933 -0.3973 -0.8709 -1.0135 -0.5859 -0.3249 0.2051 -0.2484 0.5606 0.8679 -2.5960 -0.0325 -0.7588 0.7941 1.1437 0.5478 -0.6927 1.2112 1.3846 0.6646 -0.5399 -0.1030 -1.3634 0.0497 1.3152 0.2413 1.0033 0.2370 0.9966 0.5892 -0.2345 -0.6327 -0.2438 0.0315 1.4465 -1.8680 1.2188 0.0215 2.3901 0.2525 1.0411 -0.1836 -0.5080 -0.1008 -0.0129 phenylalanine 0.3580 -0.3065 0.0110 1.7491 -1.9014 0.0487 -0.0252 1.4009 1.7077 0.2664 -1.2483 -0.5871 -2.2740 0.9996 0.0304 -0.3175 0.6343 1.0492 -0.0520 -1.4443 -1.5115 -1.7130 -1.2299 0.3551 -1.1109 -0.5098 0.7768 1.9960 -0.0469 -0.4899 -0.2734 -1.0151 -0.8234 -0.6847 0.1382 1.0224 -0.3023 0.3022 -1.0671 0.8259 0.0189 -1.8228 0.8595 0.1850 -1.2704 1.2036 -0.0020 1.9016 -1.8182 -0.6071 0.1621 -0.2012 -1.2833 -0.0961 -2.0547 1.4202 -0.3694 -1.4880 0.3093 -1.0347 -0.7970 -1.1281 -2.5544 0.6937 0.6556 1.2564 2.0448 0.4170 0.6103 -0.1507 -0.1598 0.1489 -0.1613 -0.3044 0.2456 1.4404 -1.3182 -1.0296 1.0855 0.9670 0.3301 1.8113 0.8862 0.1924 0.6865 -1.1345 -0.5570 1.4115 1.6958 -1.1573 -0.6147 -0.2442 -1.8521 -0.7331 -0.8965 -0.3360 -0.5253 -0.1799 -0.1409 -0.5487 -0.7372 1.5905 0.7270 1.6048 -2.0349 0.0581 0.4146 -1.5945 -0.9734 1.4032 1.2505 2.1452 -0.8966 0.1549 0.0662 0.4396 -1.3445 -0.0611 0.2283 -1.1714 0.6343 -0.0693 0.6446 -2.1759 0.6180 0.3045 0.1193 -0.3363 0.6482 0.0441 0.6154 -0.0557 -0.1246 0.5907 0.3183 0.3249 -1.1688 -1.8609 -1.7424 -1.3308 -0.9093 -1.4091 -0.1855 0.8629 -1.2828 -1.2126 0.6788 0.8654 -1.5000 -1.5657 -1.1197 -1.9815 -1.6699 0.0122 1.0507 0.0628 0.8315 -0.0200 1.4488 -0.4303 1.9721 1.3926 1.3977 -1.8215 -1.1216 -0.0704 0.4142 1.3616 -0.6405 1.1147 1.5824 0.0723 -0.0424 -0.4577 -0.8069 -0.9131 0.1650 -1.6504 -1.1487 -0.4609 1.1319 1.0682 0.0445 0.5454 0.4517 -0.2383 0.0124 -1.3064 -0.7735 0.6117 2.4786 0.3184 -0.8569 -0.1256 0.5616 -0.5075 -0.2668 -0.8491 -0.2332 -1.1931 0.7918 0.9515 1.0549 0.5901 1.8900 0.2616 -0.7026 -1.3126 -0.0256 1.0208 0.0456 0.5824 -0.3268 -0.8811 0.5324 2.0555 0.3711 1.6577 -0.8918 1.0103 -0.6604 0.5730 -1.2736 2.6549 0.0704 1.3507 -0.4278 0.4236 -0.3116 0.3155 1.1979 -0.5580 -1.0384 1.0017 0.8128 0.7664 1.3336 -0.9906 1.3006 -0.4447 0.5952 -0.3406 0.3661 -0.1651 0.3658 -0.3608 -0.1779 0.9646 0.4067 1.1523 -0.6039 -0.7444 -1.0754 0.2661 0.7649 0.9429 -0.2892 -0.0635 -0.7201 -1.7471 1.2884 0.6481 0.6254 1.5228 -0.1464 -1.1184 0.1683 2.3180 0.2509 -0.8024 0.3503 1.2004 0.3011 0.9911 1.2785 0.9295 -0.6807 -1.1741 -1.0553 0.8426 -0.9133 -0.3026 1.0957 1.2249 -1.3659 0.1576 0.2456 -0.7792 -0.2970 0.9548 0.4559 0.6245 0.1490 -0.1577 0.3328 0.2622 0.8511 -0.3129 -0.6384 -0.5548 0.6277 1.5619 2.1373 -0.2727 0.4980 0.9623 0.5510 -0.5903 -1.7601 1.2097 0.0341 1.7677 0.4049 0.6636 -1.2293 -0.4709 -0.5472 -0.5004 0.6889 0.6244 0.9518 0.8477 -0.9609 0.2024 1.7074 0.7392 0.7341 -0.0215 0.6073 0.6050 -0.1375 -0.3437 -1.0307 0.1090 -0.9287 1.2443 1.6039 -1.2248 1.4356 -1.1919 0.8847 -0.1289 -0.3618 -0.3079 -0.8137 -0.0458 -0.8299 -1.5931 -1.1911 -0.0327 -2.3011 -2.6430 0.6052 0.8524 1.9829 -0.3842 -1.4856 0.9309 -0.1492 -0.7407 -1.3907 -0.7040 -1.0855 1.1039 -0.4146 0.6020 -0.4541 1.1555 -0.3797 -0.8183 0.8300 0.2263 -1.0222 0.2380 -0.2484 -1.2558 0.2129 0.7378 0.1341 0.6346 -1.0956 -0.9373 0.0675 0.9224 1.1719 -1.3925 -0.6749 -0.4940 -1.2022 -0.8368 -0.6530 1.7913 -1.7030 1.7364 -0.6958 -0.9565 0.7413 1.0276 -0.0175 -0.6068 -0.2873 1.7378 -0.0489 0.1951 -0.4951 0.6923 -0.0011 0.0228 -0.8725 -1.6828 phenylalanylglycine -0.9320 0.0743 -1.2942 -1.1353 2.1536 -1.3391 1.6218 -1.3988 -0.3128 -0.8783 -1.0959 -0.5644 1.7453 -1.2991 0.6189 0.6889 -1.4618 0.3901 -1.1905 0.0015 -0.0104 1.9711 -0.8654 1.3916 0.7080 0.7390 0.1914 0.4881 -1.0547 -1.2512 -0.0655 0.6698 1.0776 1.1690 0.2261 0.6741 -1.1841 -0.5877 0.5584 0.5678 0.4897 1.1975 0.6507 0.2446 1.9566 0.1668 -0.1417 -1.2077 -0.0482 -1.2057 -0.3089 -1.4760 0.6332 -1.3470 1.0469 0.3034 0.0210 1.7164 1.2682 -0.3111 1.0066 -1.4215 1.4596 -1.1328 1.2657 1.5545 0.1488 1.0068 0.2081 0.4772 0.4982 0.1143 -1.3053 -0.1985 1.2453 -0.1725 0.5503 0.8116 0.0240 0.3170 1.4625 -1.1639 -0.2265 0.5085 0.2175 -1.3749 -1.0756 -0.0221 1.2876 0.5177 0.2815 -1.1661 0.1576 0.9788 -0.6040 -1.1551 0.2820 -1.1905 1.0139 0.8806 0.0507 -1.5494 0.6553 -0.5395 0.6355 0.3415 -1.3078 0.8111 0.1981 0.0982 -0.8857 -1.4183 1.5888 -1.2505 -0.3910 -0.0894 0.8547 0.6934 -1.3585 1.0873 -1.1091 1.1858 0.7051 1.0077 1.2102 -1.3294 0.4433 -1.3007 1.1681 0.1789 -0.1087 -0.2466 -0.9359 0.0895 0.3326 -0.0530 0.2095 1.1509 0.6730 1.0646 -1.0235 0.3669 0.7976 0.0012 -1.1107 0.3875 1.2329 -1.3044 0.0487 1.7783 0.9058 2.1646 1.4659 2.0886 -1.2926 0.6155 -1.2185 0.3618 -1.3713 1.2172 -1.2012 -1.4999 -1.0712 -1.2455 -1.1745 0.9707 -1.3955 0.1319 0.3227 -0.5795 0.8333 -1.2672 0.1372 -1.0272 -1.4393 2.2011 -1.0166 0.4644 0.6915 1.5664 -0.2677 -0.0625 -1.3057 0.1684 -1.0515 -1.5059 -1.2799 -1.1700 -1.0327 -1.1276 -1.5477 -1.0635 -1.1411 0.3505 -1.0557 -0.0250 -1.1731 1.0235 0.0322 1.5897 0.8112 -1.0352 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0.9800 -0.0953 1.3290 -0.0949 0.3378 -1.0300 -0.4374 0.3268 0.0182 0.4870 -2.0388 -0.1156 -0.8280 0.6589 0.6242 0.3864 0.0187 -0.5678 0.1806 -0.4534 0.3773 0.1564 -0.3361 -0.0216 -0.5358 0.1103 -0.9848 0.0233 -1.2414 0.5540 -1.5418 -0.6974 1.1943 1.8366 0.6915 -0.5488 2.7300 -0.0686 -0.9671 1.9912 1.1388 0.5128 -1.0466 0.6313 1.0734 0.9650 0.9619 0.8895 0.0802 0.1143 -1.9415 1.0794 -0.5408 -0.3817 0.4975 -1.8010 -1.8052 -3.6293 -1.4225 0.4935 -0.5371 0.3292 -1.0433 1.8819 -0.0223 -0.1272 -0.0473 -0.5455 1.3008 -0.4577 1.7988 0.4718 0.5426 0.2300 0.4366 0.4808 -0.1956 -0.4785 0.5997 0.4393 -1.6952 -0.5856 -0.9560 -2.1523 -0.1857 -3.7109 -0.2550 -0.2986 1.4687 0.8851 0.1345 -0.7140 -1.3857 -0.9272 1.3246 0.8552 1.2772 1.1645 -0.3172 -0.3645 -1.5625 0.8734 -0.1416 -0.6048 1.5579 -1.3747 -1.6614 -0.8663 0.0465 0.3725 0.7203 0.4457 0.5348 1.1426 0.2990 0.4739 -2.6818 -0.1942 -0.1233 0.8926 0.6169 -0.3045 -1.1642 -0.1629 -0.1801 0.1150 -1.0876 0.8572 -0.7786 0.6556 0.7650 2.1754 0.7483 -1.0532 0.1861 0.6158 0.3423 -0.6643 0.8633 -0.7807 1.0440 -0.5298 1.9422 1.2339 0.6185 0.2494 -1.4329 1.6498 1.2843 1.8576 0.3664 0.8680 0.1888 -0.1249 -0.9731 -0.0458 -0.1654 1.1655 0.6724 -0.7074 -1.3196 0.3132 -1.0704 -0.3854 0.4100 0.3148 picolinoylglycine -0.9168 0.1175 -0.4916 -1.8024 0.8894 -0.0768 1.0470 -0.8269 -0.1224 -0.9942 -3.3060 0.4210 0.3329 0.6152 1.3702 0.6749 -0.7771 0.7074 -0.1424 0.0007 -0.8267 0.8402 -2.9681 0.8242 -0.0618 0.5949 0.6044 0.1094 -0.4771 -0.1519 -1.5492 0.1279 1.5227 -1.1689 1.2342 -3.4967 0.6685 -0.6669 0.6944 0.2428 0.3448 0.4189 -0.4613 0.5415 0.7339 -0.7347 -0.0266 -0.5622 0.6504 1.2452 0.5551 -0.2378 0.8990 -1.3987 -0.8722 0.1911 1.5675 0.2710 0.5647 -0.3435 -1.0310 0.8534 0.3328 -3.3325 -0.0874 -0.1940 -3.4918 -0.3365 -0.4096 -0.3377 0.6745 -0.8159 -0.8640 0.1978 0.6710 0.6632 -0.4830 2.1571 -0.6552 0.8105 0.6490 -0.6244 0.8324 -1.0377 -0.4025 -0.7017 -0.0372 -0.3786 -0.1182 -0.0371 0.4043 0.3353 -0.2409 0.5162 0.3143 -0.1832 -0.4704 0.3153 0.4863 0.6971 -0.4999 -0.1447 -1.3607 -3.8019 0.5746 1.0810 -2.3029 0.3792 -0.6906 0.1643 -0.6510 -0.1944 -0.5418 -0.3510 -0.9352 -1.3520 -0.0687 -0.0055 -3.6445 0.3676 1.1027 0.2539 0.4721 0.4378 0.8540 -0.4194 -1.3654 0.3921 0.3156 -0.3867 -0.2395 -0.3652 0.6819 -0.2280 0.1297 0.7464 -0.4717 0.1698 0.6991 -0.2611 -3.1949 -0.5760 -0.5325 0.2862 -0.9025 1.3722 -0.1074 0.0309 -0.6602 0.9181 -1.4004 0.3861 0.4880 -0.3867 0.6344 0.1081 0.3194 -0.6422 -0.2240 0.0023 -0.3056 -0.8478 -0.0855 -0.6725 -0.4753 0.3411 1.5589 -0.3952 -1.7032 -0.1038 0.7206 0.4877 -1.3936 0.2725 0.2056 -0.8434 -3.1659 0.0719 -0.7504 -0.4596 0.7651 0.5715 -3.5633 0.0817 0.2118 0.1726 0.0422 0.3506 -3.1957 -0.2433 0.3014 -3.2485 -0.2761 0.9930 0.0784 -0.4910 -0.2508 0.0189 -0.0366 -0.7596 -0.0121 0.2376 -0.5084 0.1408 -0.6968 -0.1538 0.4296 -2.4849 -1.5192 0.4382 -0.0818 0.8592 0.4346 1.0685 1.9752 0.1393 -0.0374 0.0907 -1.2272 0.0312 -0.5001 0.2816 0.5426 0.6128 0.7276 0.3769 -0.5143 0.8118 0.8757 0.4349 0.7167 -3.2944 0.3732 0.8889 0.1892 -0.0074 -0.2716 0.0367 0.6840 1.2533 0.2634 -0.4670 -0.8740 1.6999 0.2536 0.0923 1.4734 0.8110 0.0621 -0.0440 -0.4583 0.2862 0.1557 0.2528 -0.2448 0.3498 0.9010 -0.1021 -1.2262 0.6383 -0.1501 -1.4700 0.5388 0.5427 0.7187 -0.1966 0.4913 -0.0656 -0.3213 -1.3175 0.3525 1.2811 -0.2719 1.4771 0.3916 0.5905 0.9872 -0.1461 1.0079 -1.0607 2.1892 0.5992 -0.0555 0.5239 1.4071 -0.4257 -0.7077 0.9180 0.2606 0.5361 0.5512 0.1590 1.5084 1.1675 0.1010 1.3788 -0.6100 0.7199 1.1159 0.1212 -0.8267 -0.3868 0.2328 0.5514 0.1450 0.9860 -1.2514 0.2784 0.1440 0.4263 1.1290 0.0902 1.3115 0.4135 1.0597 0.7309 -0.0272 0.8516 1.7617 -0.3145 0.0438 -1.0140 0.1708 -0.0377 -0.7764 0.6418 -3.0627 -0.2883 0.4132 -0.8370 -0.3943 -2.1214 1.6150 -0.2809 0.5002 0.4061 -0.8324 -0.2533 1.5435 0.5614 -1.4407 1.4067 0.5270 -0.2279 -0.7061 -0.0830 -0.5058 0.1392 0.8507 -0.2894 -1.4487 0.8963 -0.3999 0.6759 1.4230 0.2456 -0.6741 -0.2797 0.0506 1.0772 -0.2278 0.3224 0.9401 1.3664 1.1509 -1.0887 0.7411 0.1920 -0.5482 -0.4492 -0.3161 1.2661 -1.1877 -0.5961 1.0197 -3.3717 0.1356 -0.0038 -0.1175 1.2414 0.1694 0.9715 1.5219 0.6943 0.7036 0.8283 1.9459 1.3557 1.1219 1.5819 -0.6477 -0.0766 0.3121 1.5505 0.3398 0.8424 0.2691 0.6218 -1.2351 0.6110 -1.3127 -0.2159 -0.4614 0.9454 -0.5964 0.5916 -1.3714 1.0762 0.7893 0.8229 pimelate (C7-DC) 1.4000 0.3950 1.4400 1.1400 -2.2800 2.3800 -1.3700 1.7700 1.2900 2.3600 2.7600 0.5380 -0.4050 0.9220 -0.6330 0.0184 1.6600 -0.4130 0.3770 0.0627 -0.1810 -1.3400 -0.1620 -0.8610 -0.9450 -0.6100 0.1580 -2.7200 0.5850 1.2000 0.4440 -0.1560 -0.8930 -0.7330 -0.1200 2.5600 0.2980 0.4360 0.1150 -1.0600 0.3760 0.2990 -0.3600 -1.2800 -1.3300 -1.2800 -0.4290 0.3170 -0.0554 1.2700 0.1650 0.5150 0.4360 1.7800 0.6480 -0.2730 0.0106 -1.2100 0.7470 0.0383 -0.5490 0.3400 0.8860 2.6800 -0.3090 -0.9750 0.2460 -1.1100 -1.3100 0.7470 -0.4420 0.1270 0.4420 0.5010 -0.2630 -0.2490 -1.5900 -2.0300 0.1480 -0.3780 -0.8550 1.2500 0.6030 -0.5200 0.2250 -0.3560 0.3190 -0.3320 -1.3000 -0.2190 -0.5770 0.9680 0.0476 -0.1420 1.5300 0.0746 -0.7410 1.2300 -0.5330 -0.1050 0.7550 0.1690 0.4660 -0.4880 -0.4160 0.2620 2.3900 -0.1950 1.0200 1.0500 1.6800 0.2140 -0.5840 1.3400 0.5340 0.7530 -0.3150 -0.4710 1.3200 -0.9610 0.5280 0.2610 -1.0300 -0.1780 0.0229 0.8110 -1.1400 -0.4380 -0.8240 -0.3410 0.2580 0.3110 -0.0167 -0.0032 0.0140 -0.8480 0.0847 0.3040 -0.1560 0.4150 1.7500 0.1630 -1.1800 0.2860 0.8490 0.4410 -1.1900 0.9290 -0.6110 -2.2000 -0.0866 -1.6000 -0.7810 -0.7410 0.2950 0.0963 0.3750 -0.4600 0.5170 -0.8450 1.6300 0.5960 0.3980 0.4930 1.7300 -0.4210 0.4300 0.2140 0.1880 0.3260 -0.6740 2.1600 -0.1030 2.2400 1.2500 -0.6100 -0.5340 1.4200 -0.2770 0.0107 -0.4100 0.0467 0.0984 -0.3080 -0.1500 1.0400 1.1400 0.2640 1.5000 0.0000 0.4300 2.8700 0.0663 -0.2950 -1.0900 0.4970 1.2700 -0.7450 -0.9350 -0.7920 -0.2000 0.2480 0.8170 -1.7700 -0.8210 -2.4800 -1.0800 0.1070 0.7850 -0.0349 -0.3430 -1.9000 0.1640 -1.0600 -1.5100 -0.7610 0.8950 0.5230 -0.0918 0.4050 0.2300 0.1070 -0.2370 1.9700 -0.7020 -1.4700 1.1000 0.2910 -0.1630 -0.6920 0.3910 -0.6470 -1.1800 -0.0571 -0.7500 0.6510 0.7040 -0.0517 -0.3730 -0.3440 1.3100 -1.0700 0.9740 -0.7210 -0.7760 1.5700 -0.3740 0.9000 0.8820 -0.1400 0.7270 -0.2140 0.5220 -0.4910 0.1210 -0.3270 0.5810 -0.5330 -0.3720 0.8530 -0.2260 0.1220 0.4840 0.5670 -0.5400 -0.7330 0.1490 0.4550 0.0671 -0.9470 0.3590 -0.5500 -0.2580 -1.1000 -0.0791 0.9330 -1.7800 -1.1500 0.8510 -0.7570 -1.5600 0.1810 -1.3600 -1.1100 -1.3300 -0.5300 -1.0300 -1.0000 0.0483 -0.7080 -0.2310 -0.7820 0.3660 1.3000 1.2900 0.0686 1.3300 -2.0200 -0.9950 -0.1330 1.7900 0.3770 -1.0000 0.6280 -0.6180 -1.0900 0.7470 -0.1970 -0.2490 0.1850 0.1880 -0.7590 -0.1710 -0.8560 -2.3900 1.1300 -0.5800 0.3060 -1.0200 0.5520 -0.8100 1.7900 -1.1000 -0.9900 0.8140 0.0518 -1.1000 0.3910 0.0726 -0.9980 -0.4100 -1.0600 -1.2200 1.5200 -1.1700 0.0413 2.9200 -0.5030 -0.5120 1.8400 -0.1650 -0.9270 -0.1990 -0.1650 0.3440 1.6200 0.8240 -0.9320 -0.4380 -0.6850 -0.8970 -2.1800 2.3900 -0.3670 1.3000 -0.3990 -0.3730 -1.1900 0.0524 0.5890 1.1200 -0.6810 -1.5400 -0.2340 -3.0400 -0.2220 -0.6800 -0.7250 1.1700 1.6200 1.4900 0.2780 -0.6790 1.3000 -1.2500 4.1000 0.6730 0.7410 2.5600 -0.6470 1.0600 -0.1570 -0.9920 0.9110 -0.9300 -1.2100 -0.6500 -0.6910 0.4180 -1.7200 -0.8420 -0.0596 -2.4700 -0.6370 0.3910 -0.3890 -0.1970 -0.2550 -0.8260 -0.7770 0.4450 0.9890 1.7200 0.4020 -0.0528 -0.1990 -0.1360 -1.0800 1.3400 -0.0973 pimeloylcarnitine/3-methyladipoylcarnitine (C7-DC) -1.0630 -1.8786 -1.4653 0.8510 -0.8405 1.0895 0.8026 1.0003 0.1612 1.2357 -1.2593 -1.5951 1.0331 0.8869 0.2992 1.6035 0.5465 0.1998 0.3437 -1.1501 1.3790 0.4037 0.4651 -1.3575 -0.0727 0.5181 0.4553 -1.2593 1.4222 0.7288 0.8815 0.2221 0.8740 0.7299 0.3322 -1.4182 0.1662 0.9823 -1.2710 0.5370 0.6998 0.8466 0.5176 -0.0337 -1.2120 0.2638 0.1558 0.2095 0.6291 1.1128 0.1161 0.0582 0.8559 0.4672 0.9745 0.6929 1.2969 0.8156 0.3957 0.9767 -1.2038 -1.6028 1.1474 1.3214 -0.7827 1.1252 -1.4155 -0.1061 -0.1143 -1.1844 0.7829 0.6105 -0.2921 -0.0588 -1.3945 -1.1849 0.7145 -1.3858 -0.2609 -1.4564 -1.4325 -1.3108 -0.2759 -1.6160 -1.2940 0.4444 0.6361 1.2105 -0.1697 0.1508 0.6638 0.9936 -1.3319 -0.9868 0.9851 0.0863 0.7237 0.4391 0.0260 0.0016 1.3509 -1.7348 -1.2135 1.3758 1.1434 -1.3002 0.5900 0.4750 0.9318 -1.2651 0.6986 1.3673 -1.1998 0.9102 -1.4182 -1.3843 -1.1729 0.3371 0.5406 0.1310 -1.2574 0.3849 0.7654 0.1996 1.1492 -1.5037 0.2168 -1.4681 1.2533 -0.0275 -1.5744 -1.2629 1.1388 -0.3316 -1.4673 -1.5820 0.1738 -1.0193 -1.4351 1.0313 1.7336 1.6213 0.7577 0.6279 0.2996 -1.4916 -1.3799 0.9039 -1.2877 -1.2151 -1.1468 -1.1712 0.7496 1.1149 -1.4524 -1.1927 0.4152 -1.1696 0.6838 -0.8820 1.1348 0.7092 -1.2090 1.1891 1.2701 0.9829 -1.5712 -1.5174 0.9871 1.1915 0.4617 -1.4309 -0.0338 1.4697 1.4901 1.3547 -1.1485 -1.1877 -1.3222 0.7758 0.5974 0.4807 0.2479 0.0344 0.7620 1.2808 1.4144 0.8414 -1.1720 -1.2729 -1.7304 1.2787 -0.0623 -1.2372 0.1647 0.2117 -0.0804 0.4171 -1.4254 0.6696 0.9220 1.0293 -1.2349 -1.3331 0.1114 0.6902 0.7151 0.9907 -1.3856 0.6817 1.2733 0.3620 -1.6941 -1.4845 0.0448 -1.4703 -1.7289 -1.6849 -1.7586 0.7781 0.0590 -1.5546 -0.2894 0.9116 -0.1204 0.2711 0.0723 0.4570 0.2790 -1.3923 -1.4838 -1.2524 -1.3532 0.7329 0.4539 0.4627 -1.4858 1.3428 -0.1258 0.0975 0.5882 0.2813 -1.4582 1.7903 0.2778 0.9191 0.5897 1.0347 0.2020 0.3129 0.2052 -0.5669 0.5231 0.3954 0.4762 -1.3559 -1.5164 -1.5089 1.1321 1.0595 0.5333 -1.2540 0.7769 0.1995 -1.5513 -1.0565 0.4579 -0.0391 0.5607 0.7986 -1.5806 0.6199 -0.1148 0.0815 0.0245 0.4331 -1.5017 0.4369 0.5963 0.3070 -1.6829 0.4458 0.9880 0.4556 0.4383 -1.3963 -0.0055 0.6197 0.2445 -1.7370 0.1925 0.1645 -1.5437 1.2656 0.5539 0.5010 0.6429 0.2874 0.3790 -1.6048 0.8747 -0.2777 0.6321 1.9691 1.4205 0.2154 0.8384 0.6859 0.5434 0.3437 -1.3812 -1.6223 0.0232 0.9295 0.9437 1.1461 -1.4169 0.3058 -1.3550 0.8117 -1.4279 0.7473 -0.2691 -1.6896 -1.5191 -1.8239 0.4347 -0.4940 0.2672 0.5618 -1.3243 1.1461 -1.4519 0.4077 0.4185 1.0866 -1.5730 0.2991 0.5756 -1.2617 -1.4373 -1.8671 0.5510 0.6917 -0.0207 -1.3785 0.5080 0.6563 -1.5720 0.6590 0.2962 -0.7511 1.4908 0.6076 1.6681 -0.0793 0.4244 0.9324 0.0985 0.2596 0.6775 0.6401 -1.4712 0.4894 -1.5508 0.3783 -1.7169 0.5659 0.5716 0.8637 0.7976 1.5805 -1.4365 1.2377 0.9634 0.1647 0.4746 0.8855 0.9641 1.0720 -1.4844 0.9345 -1.8780 0.4108 -1.9437 0.5227 0.9473 -0.5198 0.6927 -0.1945 0.1462 0.6446 -0.9832 1.1189 -0.0028 0.6457 1.4196 0.1509 0.3154 0.4507 0.2803 0.6660 0.1382 -1.6768 0.4357 0.1122 1.0314 0.1986 -1.4975 0.4234 pipecolate -0.6825 -1.1396 -0.6106 -1.2571 -0.4241 0.0168 -0.0777 -1.1894 -1.1290 -1.2714 -1.3398 -0.1857 -1.1816 0.9843 -1.4442 1.3636 -0.8459 -1.6063 0.6464 0.0690 -0.3181 -0.4296 -0.5706 0.7482 -0.3666 0.4405 -0.4348 -1.6043 -0.8390 -0.8644 -0.2398 0.1195 -0.3195 -0.1773 0.6330 -1.6480 0.2696 1.3895 0.6971 0.7050 -0.2078 -0.2600 -0.9027 -0.4362 1.7735 -1.1882 -0.4255 -0.1429 1.1790 -0.1701 -0.3583 -0.2506 -0.8071 0.3331 -1.1043 0.5857 0.0176 -0.7249 0.8537 -1.5849 0.0041 0.0139 -0.1075 -0.1228 -0.0797 -0.4656 2.1920 0.0031 -1.7165 -1.2795 -0.3201 -2.3232 1.0940 0.1642 0.3460 1.9411 -0.8169 0.7624 0.9466 0.7375 -0.5289 -0.2864 0.3342 1.3342 1.0888 -0.8626 -1.4501 -1.2251 1.4695 -0.6355 -0.4545 -0.7523 -0.9746 -0.6047 0.0787 0.0070 -0.2665 -1.0931 0.5864 -0.8353 -0.2583 -0.0580 -1.1340 0.1574 0.3050 0.7834 -1.1054 -1.1543 -1.2758 0.6643 0.1286 -0.9199 0.1809 -0.2824 -0.0860 -0.2437 -0.4552 0.3155 -0.1459 1.4991 -1.0291 -0.0152 -0.4588 -1.2710 -0.3841 -0.1690 0.0587 3.3155 -0.0022 3.4728 -0.7163 -0.2992 1.0242 -0.0908 0.7639 0.3345 -0.4454 -1.0125 -0.4672 -1.6699 1.3688 -0.9987 -0.4463 -0.8551 0.2614 -0.1800 -1.2279 1.0420 -0.6605 -0.3602 -0.3369 -1.4383 -0.4666 -0.1408 -0.4947 1.4199 0.8663 0.4913 -0.9699 -0.2926 0.0209 0.0843 -0.9850 -1.7612 -1.5628 -0.7020 0.3584 -0.3075 2.5140 -0.7634 2.6612 -0.5130 0.0952 0.1843 0.1242 -0.7934 -1.3314 -0.3590 -0.9462 -1.0351 -1.0971 0.5063 -1.0268 -1.1844 -1.3818 -0.9788 -0.9705 -0.2371 -0.7809 0.4902 0.8538 -1.4213 -1.0284 -0.6824 -1.4635 -0.1377 0.0738 0.7642 3.1355 0.0010 -0.0528 -0.1935 0.4597 -0.7625 0.6206 1.5333 0.2895 -0.1866 -1.6685 -1.1075 1.1170 0.3209 0.1099 0.2208 0.7706 -0.1223 1.4228 0.0635 -0.3402 -0.2765 0.9545 -0.1671 1.4930 -0.4435 -0.6108 1.6993 0.9188 0.6418 -0.0168 0.1156 -0.5272 0.0848 3.1071 -0.9741 1.0604 0.5650 1.1071 1.5433 -1.1431 -0.0173 -0.5080 -0.1824 -1.0632 -0.7323 0.2521 -0.6720 1.6936 -0.7591 2.1437 1.2877 0.9060 -0.2931 -1.4473 0.5102 -1.3207 0.0281 1.0616 -0.4067 -1.2801 0.0069 0.2224 -0.3930 -0.3665 0.6430 -0.7030 0.5515 0.5620 -0.9341 2.7411 -1.1654 -0.4024 -0.3099 3.0710 1.0248 2.2616 0.4124 1.9233 0.4403 -0.7295 -0.6518 0.3374 -0.6599 0.3756 1.5840 0.5932 -0.8183 -0.2449 -0.4802 2.0828 0.4952 0.4456 0.6258 -0.3137 1.8490 1.9660 0.6903 0.1476 -0.7047 0.7254 -0.6924 -0.7523 0.3347 -0.4500 -0.7671 -0.7468 0.4494 2.1351 0.2653 0.5655 1.8333 0.5068 -0.0886 1.1406 -0.2588 -0.5900 0.7026 -0.0285 -0.0167 0.3948 2.1195 0.4599 0.0185 1.2182 -0.5143 -0.7612 -0.3870 -0.0953 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0.6087 1.2090 1.9509 0.2555 1.2631 0.3581 0.0589 0.9793 -0.0213 0.4487 0.7063 0.5528 1.0815 -2.0488 1.3646 0.3923 0.1245 0.3766 0.0749 0.8531 0.0194 0.2915 -0.0211 1.0089 0.0543 -0.0012 0.8525 0.5310 1.1206 -1.7793 0.4947 0.6368 0.3450 0.2344 1.1138 0.5366 0.0245 0.5698 1.8265 0.9641 -0.4184 0.9474 0.6781 1.5105 0.2647 0.5288 -0.2734 1.0286 -0.0240 0.9726 0.0033 -0.1477 -0.2755 0.8197 1.2533 -1.5106 0.8486 0.1474 0.8745 0.4457 0.3112 1.4427 0.0697 -0.6315 1.5565 0.2987 1.2676 1.1236 0.9031 -0.8728 1.0738 0.6751 -0.1674 1.0721 -0.2511 0.8682 1.2896 1.8480 0.9911 0.9088 0.9235 1.6277 1.6583 -0.1067 1.6502 0.6569 2.1681 0.8018 -0.1186 1.2500 -1.0077 0.3686 -0.0283 1.5682 0.3426 0.4740 -0.4102 1.3652 -0.1787 1.1296 1.4184 0.6206 0.5575 1.0290 0.9741 0.8762 1.7682 1.6950 1.1074 1.6215 0.9515 0.9020 0.7288 2.5711 2.0859 0.7412 2.2634 -0.7355 0.4906 -0.7748 1.0274 -1.3852 0.0415 0.2340 1.7601 pregnen-diol disulfate* 0.5722 -0.7810 1.0953 -1.0328 0.4672 -0.2250 -1.8265 -0.6094 0.0415 1.3991 -1.2570 -0.3805 -0.6732 0.9525 -0.5391 -0.4670 -1.9221 0.3595 0.6631 -0.1056 -0.1221 -0.1318 -0.7072 -0.5719 -0.4044 0.6798 -1.4416 0.1089 -0.5017 -0.8844 0.6342 -0.6368 0.4376 1.4788 0.4584 -0.4494 -3.1152 -0.7118 0.4967 2.3434 -0.0098 0.6954 -2.5098 0.4853 -1.4269 1.4036 0.0856 -0.1622 -0.5787 1.2391 0.2758 1.4071 -0.0154 -0.3067 0.2067 -0.1511 -0.0456 -1.5581 -1.4164 0.7256 -2.4502 -2.1742 -0.3305 0.1620 0.2076 1.0079 -0.9749 0.5784 0.6213 1.3613 0.1593 0.4775 -0.6344 0.2871 -0.8961 1.0447 0.5941 1.1673 -0.4969 -0.6374 1.3266 -0.9169 -0.3136 -0.6901 -0.7644 0.5649 0.3516 0.6867 1.2806 -0.5581 -0.1948 0.0682 1.4894 0.0153 -0.9730 -0.8623 -0.2512 0.4918 -0.7125 -0.4712 -0.2476 -1.2925 -3.1637 -0.0517 -4.3293 -0.7244 0.1204 -0.3763 0.5208 -0.6895 -0.9864 1.1139 -0.0383 -2.8460 -1.0139 -0.9543 -1.0854 0.9917 0.8552 0.8878 -0.0145 -0.0527 0.2426 -1.3078 -0.5880 -0.9457 -0.7084 -0.0975 -0.3878 0.7568 -1.9077 -1.4584 0.0667 1.0753 -1.1240 -0.2641 -0.1615 -0.0555 0.3609 -0.4595 -0.1857 0.4570 0.3187 -1.4133 -0.5289 -1.1393 0.9745 0.9041 1.2433 0.6923 -2.0835 -1.4259 0.1051 1.8488 -0.5410 0.9128 -1.2956 0.0403 1.2519 -0.6853 0.2759 1.0396 -0.9972 -1.0970 -0.5914 -0.3403 -0.5377 1.4826 0.8867 0.2203 1.3511 -0.3322 -1.2692 -1.8867 -1.1333 -1.0891 0.7814 -0.8611 -1.1400 1.2971 -0.5190 0.7333 -0.2016 -0.2534 0.2076 0.7302 0.1340 0.9416 0.5792 -0.7606 0.3522 0.3849 -0.4398 0.5019 -1.3524 0.1146 -0.3793 -0.7016 0.4072 -0.1967 -0.1548 -0.2774 1.1980 0.4186 -2.1913 1.1185 0.6538 -0.6893 0.4467 0.6098 0.0776 0.2866 -0.5467 0.0450 -0.8969 -1.2357 0.8713 -1.2626 0.6513 -0.4064 -0.0242 1.5296 -1.8522 -0.4734 1.0055 0.9293 -1.7621 -1.7471 0.5591 -1.3821 0.0653 -0.1499 1.1926 0.2565 0.7275 0.0962 -0.4891 1.4187 -0.0140 -1.0388 0.8711 0.7153 -0.0353 -0.9991 1.8924 0.0387 1.1607 0.9316 -0.4544 0.5518 0.0241 1.5537 -0.1777 0.0746 0.0400 0.2160 0.7546 0.4025 -0.0338 0.0427 1.1409 1.1904 0.2494 -0.0433 1.1992 -0.5744 -1.1584 0.8674 0.5953 1.3046 1.3632 0.4095 0.8224 -1.1084 -2.4104 -0.5460 0.0892 -1.4121 -0.0493 2.2325 0.3882 0.0458 0.8300 -0.8001 0.5887 1.2800 0.9566 0.0096 1.0019 -0.1222 1.0642 0.3744 -1.7076 0.5036 0.6784 -2.0179 -0.1789 1.3457 -4.4005 -0.6978 0.8100 0.9321 0.6477 0.3989 0.6458 -0.9326 0.3023 -0.0319 1.8707 1.2489 1.2489 1.2466 -0.4180 -0.3537 0.4580 -0.6132 -0.0074 -1.3606 1.0790 0.2782 1.6595 1.3533 2.0827 0.9788 -0.0194 0.1603 -0.8601 -0.0867 0.5174 1.3943 0.4926 -0.5689 -0.0549 -1.5540 0.0618 -3.1119 -0.6617 0.0673 -0.7677 0.0412 0.0120 0.1741 -1.1227 -0.5964 -0.1737 0.1603 0.0226 1.4676 1.2711 1.5221 0.7639 1.1956 -0.8011 0.8086 1.3729 0.8728 1.0913 0.9527 -0.1999 -1.4414 -0.7046 0.7215 -0.0618 -1.2473 1.0773 0.6794 1.6893 0.8330 0.0185 -0.2872 -1.1935 1.3374 1.3474 -0.4933 1.0142 -0.5164 0.0662 -0.5363 -0.4994 0.4886 0.2801 -0.6817 -0.5233 0.3864 0.3183 1.0641 -0.4637 0.6170 0.0435 1.2095 -0.4199 0.2126 0.7066 1.2234 0.3633 0.6920 0.8359 0.0624 1.2082 0.8040 0.4336 0.3291 -1.1150 -1.0954 0.1011 -1.3526 0.3985 2.0490 -0.2520 -0.6580 pregnenediol sulfate (C21H34O5S)* 1.9096 -0.6439 2.1927 1.2203 1.9780 0.8214 0.0406 0.0008 -0.3810 2.8756 0.1704 -0.6230 -0.8821 -0.1805 0.0081 -0.8596 0.2228 1.5788 0.8533 0.4809 0.6124 0.3066 -0.2481 1.2407 1.5559 0.8047 -0.4325 0.4628 -0.1075 -0.0381 0.4793 1.8240 -0.1788 1.6723 0.4512 0.1558 -1.3950 0.9309 0.8752 2.9425 0.8030 1.7779 -0.3398 0.6991 -0.1419 0.9254 1.8153 1.0267 0.2399 0.1841 1.7546 1.9430 -0.4553 -0.0965 1.7726 1.0556 0.6937 -0.0862 -0.3027 1.3347 0.7683 -0.0214 -0.2084 0.1138 0.3741 1.1143 0.0768 0.7685 0.3808 1.2323 -0.3914 1.0169 0.5632 -0.8189 -0.8649 1.0239 0.8294 1.0847 -0.5455 -0.7227 3.3774 2.1570 1.1931 1.4345 -1.1419 1.0336 0.4711 -1.1386 2.2878 0.1106 -0.0655 0.7425 0.6954 0.3488 -0.2977 0.3253 0.6414 0.3146 -0.2427 -0.1216 0.4659 -1.2942 -0.3676 -0.0979 -2.8925 -1.0760 -1.8845 -0.1837 0.3224 -0.5072 1.1208 0.7042 0.1966 -1.6019 -0.5191 0.3031 0.8762 1.0980 -0.3561 0.8836 0.5115 0.2998 0.0672 -0.8916 -1.3239 -0.6482 0.4721 -0.4130 1.3738 0.3312 0.0236 -0.6818 -0.0064 0.4946 -0.8466 0.1852 -0.1830 0.1297 1.6500 0.0117 -0.1092 0.5431 1.2114 -1.1252 -0.2359 -0.6450 0.3392 1.4891 0.7071 1.3700 -1.0204 -0.4404 0.8926 1.3356 -0.5582 1.7951 0.8280 0.3731 0.4407 -0.1055 1.5148 -0.1480 -0.9105 0.0518 -0.9352 0.9408 0.0066 0.5461 0.2753 0.6042 0.6405 0.9815 -0.8146 -0.7499 -1.2685 -1.1756 1.0510 -0.2072 -0.7590 1.7011 -1.1054 -0.1655 0.6187 -0.4309 0.7856 0.1012 0.0346 0.1989 1.0339 0.1461 0.1403 0.6974 1.2640 0.5820 -2.4088 1.6830 -0.2898 0.0069 0.2207 -0.5890 0.2801 -0.5302 -0.6160 0.4019 -0.7470 2.3160 -0.0674 -1.2232 0.4293 0.3804 0.5211 -0.1854 -0.5955 0.2421 -1.0836 -0.9597 -0.3500 -2.4536 0.7810 -0.9126 -0.4352 1.0125 -0.9289 -0.7260 0.0125 -0.3612 -2.3567 -0.7695 0.7257 -0.6447 -1.7729 0.2927 0.4422 -0.6829 0.8249 0.1279 -0.4612 -0.8849 0.0331 -1.0692 -0.5061 0.6810 0.4052 0.0251 1.3852 0.4769 1.0818 0.5837 -0.2663 -0.3058 -1.5350 1.1234 -0.9656 0.0862 0.7737 -0.1687 0.2811 1.6544 0.9425 0.2406 0.5989 0.4059 0.6198 -0.6677 0.5038 -1.1389 0.7331 0.8596 0.3519 0.0054 -0.5243 -2.1738 0.3022 -2.1862 -1.5051 -0.7074 0.4614 -0.5281 -0.1365 0.5775 0.4773 -0.4325 0.3127 0.5829 0.5038 1.1863 1.0859 0.0364 -1.5852 -0.8966 -0.4692 0.7093 -1.0409 -0.3367 -1.2867 -1.1104 -0.8862 0.4187 -4.5660 -0.0834 0.2789 -0.6410 0.3712 0.0821 0.1888 -0.6196 -0.6657 0.3652 -0.5035 0.7326 0.9648 -0.3042 -0.6097 -0.5548 -1.8675 -0.5009 -0.7610 -0.7546 0.1827 -0.2405 1.0228 0.5113 2.1403 -1.8232 -0.3819 0.3233 -1.1130 0.4924 0.2039 0.3905 1.6585 -0.7668 -1.1233 -0.5125 0.3782 -2.1489 -2.2970 0.1346 -1.5038 -0.7759 -1.0548 1.1126 -1.7626 -0.9004 -1.5112 0.0866 -1.4597 0.7841 -0.0729 1.5499 0.0850 1.1693 -0.8547 -1.2870 -0.7202 -0.7237 -0.7059 0.1370 -1.7488 -0.7860 -1.0638 -0.1198 0.6599 -1.1984 -0.1066 -0.4798 -2.2050 -0.1775 -1.4359 -1.1627 -0.5872 0.2883 0.8188 -0.1845 -0.4351 -0.9167 -0.3152 -1.8942 -0.8146 -1.6919 -0.7206 -1.0711 -1.9001 -0.3198 -1.6735 0.6727 -1.3470 -0.6476 -0.6539 0.4707 0.7735 -0.3523 0.1935 -0.7798 0.8821 -0.8636 -0.9063 -0.3253 0.7973 -0.3589 -0.7470 -0.0149 0.3420 -2.7326 0.0082 -0.8168 1.2461 -0.4301 -0.3468 -1.0149 pregnenetriol disulfate* 2.0740 -0.2204 1.3153 -0.4590 0.1871 0.2513 -1.4790 -0.0955 0.5858 2.3462 -1.6300 -1.3526 -0.6738 1.9399 -0.9635 -0.4819 -1.8027 1.6999 0.4037 -0.5486 -0.1599 -0.5311 -0.9784 -0.1390 -0.0428 -0.0617 -0.6459 0.4689 -1.1181 -0.9913 0.4095 -0.1263 0.3023 1.4785 0.5703 -0.7917 -3.3304 0.3409 1.1411 1.7205 -0.9125 0.6827 -2.0154 0.5044 -2.5114 0.8834 -0.2470 -0.2070 -0.7261 1.1904 0.2669 0.9260 -0.0967 -0.8523 0.3347 -0.3108 -0.2475 -1.2659 -0.5649 0.9702 -2.6561 -1.4700 -0.7865 0.3552 -0.0169 0.7220 -0.7682 -0.0332 0.7386 1.4919 -0.0421 0.4807 -0.5827 0.6530 -0.6148 1.8151 0.0805 0.9687 -1.1628 -0.8824 0.1891 -0.2687 0.0761 -0.3378 -0.2707 0.0607 0.3859 0.9121 1.7400 -0.6343 -0.1967 0.0483 1.4781 -0.1933 -1.5997 -2.0123 -0.6449 0.2973 -0.6777 0.0763 -0.0975 -0.9487 -2.5080 0.5904 -3.7545 -1.0345 -0.2102 -1.6561 -0.0798 0.1051 -1.0269 1.4737 -0.5627 -1.5313 -0.4480 -1.3611 -0.1682 0.7965 1.1294 0.7729 0.2422 -0.0047 0.1422 -1.2963 0.2118 -1.4304 -1.1454 -0.8817 -0.8700 0.6171 -1.3359 -1.0507 -0.0996 0.7192 -1.1824 -0.5432 -0.4608 -0.4143 0.6875 -0.3891 -0.0383 0.0467 -0.0325 -1.5322 -1.4049 -1.5011 0.8193 -0.0675 0.4073 0.2557 -2.2547 -0.3263 0.1339 1.5674 -1.2361 1.1199 -1.3856 0.1057 1.5803 -0.3438 0.7387 0.2605 -0.6833 -1.1470 -0.1189 -0.3724 -0.6196 1.4644 0.8293 -0.2398 1.0818 0.2200 -1.6894 -1.7008 -1.1078 -0.1462 -0.0047 -0.2492 -1.4725 0.9906 -0.0763 -0.5087 0.1946 0.1404 0.3296 0.1344 0.5223 1.3480 0.6851 -0.2964 0.5514 1.0041 -0.5239 -1.0216 -1.4760 0.3647 -0.1521 -1.1383 0.0006 -0.4772 -0.2806 -0.4824 1.0401 0.4516 -2.7748 0.9965 0.8438 -0.9271 1.0771 0.9032 0.1716 -0.1064 -0.5452 0.3045 0.0316 -1.1678 1.2421 -1.4092 0.2673 -0.1945 -0.9412 1.4209 -2.2259 -0.0033 0.3489 0.0515 -1.9027 -2.8507 0.3171 -0.4392 0.1199 0.1603 0.8491 -0.2028 1.2441 -0.1344 0.1705 2.1644 -0.2069 -1.2248 0.1217 0.5291 -0.2840 0.7634 0.9557 0.6573 0.9974 -0.0350 -0.0268 1.1074 0.0606 1.1583 -0.7503 -1.1118 -0.2038 -0.2714 1.0385 0.7618 -1.0978 -1.0697 0.5659 -0.0283 0.6516 -0.1423 0.9661 -0.9847 -0.3435 0.9409 0.5394 1.5338 0.2522 -0.4601 0.7990 -0.4669 -1.6896 0.1709 -0.1719 -1.1400 0.7923 1.1510 0.2277 -0.6529 0.5904 -1.3497 0.8383 1.6626 0.7452 -0.1744 0.1108 -0.7332 0.6905 0.5898 -1.4069 1.0549 0.3786 -1.3548 -1.4043 0.6381 -4.3134 -0.8224 0.0625 0.1355 0.0394 0.4613 0.0838 -0.1948 0.6842 0.5141 1.4561 1.0164 1.8845 1.5812 0.6874 0.0278 0.2973 -0.3087 0.6307 -1.3618 0.7214 -0.7499 1.8650 1.4766 1.8404 1.2573 -0.0613 0.5487 -1.3180 0.0844 0.7999 0.8651 0.8283 -0.2411 0.0515 -0.5358 -0.1133 -1.9001 -0.0794 0.1564 -0.5021 0.3020 0.5147 0.3014 -1.6925 -0.6129 0.4493 0.2990 -0.1346 1.3241 1.6832 1.3357 0.0554 0.0891 -0.4294 1.3611 2.3642 1.3405 0.3837 0.9517 -0.6177 -1.1511 -0.1164 0.4502 0.4010 -1.3843 0.7300 0.7340 1.5876 0.8069 -0.1505 0.4595 -0.8646 1.7386 1.4632 0.0930 0.6962 -0.1669 0.3645 -0.6107 -0.5675 -0.9193 0.7429 -0.3980 -1.0868 0.2633 0.7179 2.0178 -0.2394 0.4325 0.0665 0.7862 0.0969 0.3936 0.9214 0.5444 0.5073 0.2001 1.0604 0.4320 0.9166 0.7029 1.4890 0.7270 -1.0635 -0.1080 0.5769 -0.6061 0.8469 2.1942 0.3386 -0.4107 pregnenetriol sulfate* 3.2499 -0.2018 1.9316 0.8719 1.2147 0.4898 -0.4563 0.3678 0.2705 3.0584 -0.8993 -1.4784 -1.4780 1.3754 -0.6582 -1.3486 -1.1373 2.7674 1.3026 -0.1186 0.5108 -0.3227 -3.0818 0.9820 1.2670 0.8870 -0.0473 1.0250 -0.8676 -0.8241 0.5558 1.4686 -1.0211 1.1931 0.6077 -0.1646 -0.6112 1.5720 2.1054 1.8721 0.0864 1.1748 -0.8323 0.5424 -1.8496 0.5602 1.2221 0.7853 -0.3870 0.5615 1.4369 1.1642 -0.5154 -0.5350 1.1860 0.5814 -0.4594 -0.8152 -0.1998 1.2206 -0.2782 0.1985 -1.3352 0.2444 -0.4129 0.5084 0.3403 0.3482 1.0579 1.5837 -0.2248 0.3412 0.3620 -0.5043 -0.0839 2.0095 0.4200 0.8007 -1.9048 -1.0457 0.9703 1.6814 0.5090 0.8888 -0.7159 0.1798 -0.0883 -0.5034 2.2841 -0.0716 0.1007 0.8106 1.2475 -0.3193 -1.2578 -0.4051 0.2594 -0.4697 0.4713 -0.1227 0.3706 -0.8283 -0.6509 0.4132 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1.0503 1.0242 -0.2857 0.9716 -0.8037 1.0841 0.2971 -0.9529 0.1863 0.1632 0.7881 0.5204 0.7914 -0.5283 0.6067 0.3512 -0.4081 -1.4698 -1.4110 0.0888 -2.0067 -1.4290 0.3566 0.5282 1.0854 0.8309 -0.7079 0.1634 1.7210 -0.2841 0.4317 0.1411 -1.0469 0.2167 -0.7745 0.9170 1.1360 0.4116 0.1668 0.7319 0.7710 -1.7629 -0.5236 -2.6249 0.4696 -1.8855 0.1451 -0.2966 -1.9497 0.6458 -0.6170 0.4378 -0.1993 -0.3744 0.0537 0.7225 0.0530 -0.4071 0.6394 -0.0416 0.2309 0.1244 0.5426 0.5677 -0.2446 -0.1044 -0.0692 0.1752 -0.1690 -1.5181 -0.4284 -1.8510 -0.4397 1.0788 -0.0478 -1.0029 0.3247 0.2315 -0.1141 -0.9975 prolylhydroxyproline -0.6656 1.1085 -0.9884 -0.0079 -0.5381 -0.7532 -0.5617 -0.4993 -0.5094 -0.9771 -4.5634 -0.0641 0.1846 -0.9270 -0.8337 0.1587 -0.1336 -0.1769 -0.3445 -0.6729 -1.4322 -0.3268 -0.0840 0.1616 0.0953 0.4913 -0.7342 -0.0485 -0.5939 -0.9331 0.5941 -0.9808 -0.2860 -0.0768 -0.3720 -2.9343 0.0381 -0.3284 0.1344 -0.8237 0.2510 -0.0613 -0.4169 0.1730 0.3086 0.0354 0.0712 0.6159 -0.6725 1.3189 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0.6392 0.1601 1.0745 0.3051 0.2451 1.1279 -0.1645 -0.1104 -0.3932 -0.9787 -1.2094 0.6689 0.1895 0.3037 0.1522 -0.6653 0.7544 0.2785 -0.4208 0.0600 0.4287 0.0056 1.0410 0.8366 1.8500 -0.0389 -0.6822 0.5267 0.5270 0.5496 0.5507 -0.1937 1.1816 -0.6278 -0.8257 0.0289 -0.8139 -0.2652 -1.3062 -0.7801 -0.7244 0.5351 -0.0505 0.3296 -1.6960 0.2304 0.5856 1.4524 -0.5174 -0.1545 0.3985 1.0437 -0.5690 0.6718 1.1613 0.4485 1.4509 0.2747 -1.3933 0.1504 -0.4296 0.9338 1.0260 -0.8805 0.0035 -0.9819 -0.2014 -0.7580 1.0238 -0.1910 -0.1173 0.6453 -0.0511 -0.1565 0.2448 0.9922 1.3877 -0.2947 0.9176 0.3962 -0.1180 0.1831 0.4183 1.0292 0.1813 0.0930 -1.1191 1.0629 0.4371 0.4240 0.7071 0.7194 0.5339 0.2445 -0.9188 1.1106 -0.6938 1.6116 -0.2299 -0.5036 -0.9901 0.8645 -0.6886 1.1333 1.7983 0.2873 -1.1653 -0.2973 -0.1654 -0.0087 0.4426 0.0982 -0.6031 -0.4057 -0.4381 1.8500 -0.3761 0.2740 -0.7006 0.2722 0.7760 0.4159 0.9030 0.1330 -1.1365 0.8409 -0.0501 0.4316 0.4792 1.1959 0.0190 -0.1311 -0.0466 0.0207 -0.0100 -0.1956 0.9694 0.2709 1.5212 0.8414 0.0646 0.3516 1.5633 0.1672 0.7947 0.1199 1.9911 0.9933 -0.4029 0.9750 0.9161 1.3664 1.3662 -0.1122 0.8290 0.4542 -0.2452 0.3064 -0.1961 -0.8645 0.9043 0.9543 -0.7452 1.6446 0.4483 0.3507 1.5944 1.1229 0.7361 1.5414 0.3889 1.2344 -0.0181 -0.2504 0.4359 -0.0306 -1.0753 0.2874 -0.3491 0.3653 0.6370 0.1223 1.0898 1.0011 0.6363 0.1263 -0.5089 0.7277 0.3628 2.4057 1.7189 0.2743 0.7358 -11.6451 -1.5271 -0.3704 0.7704 -0.3382 1.3136 -0.2841 -0.6424 -0.1678 -0.6233 1.1547 0.2397 -0.1406 -0.0815 -0.8020 0.5872 0.7953 0.1488 0.4946 0.6973 0.9794 -0.8088 0.3791 1.2599 1.2012 -0.3978 1.1777 -1.4503 0.4434 -0.2605 -0.3893 -0.3453 -0.4925 0.0038 -0.6519 propionylcarnitine (C3) 0.9468 -0.1410 0.8285 1.2793 -0.4069 0.8600 1.4524 1.1454 0.7861 0.9984 0.1403 -0.4343 -0.0004 1.6775 1.3977 -0.2442 0.1275 0.2375 0.1828 0.1579 -0.1627 -2.2293 -0.7934 -1.2384 -1.1100 0.2017 -0.9680 0.0388 -0.5676 0.6998 -1.5020 0.0875 -0.8550 -1.0557 0.4247 0.5219 -0.8438 0.9435 0.1510 0.6118 -0.6192 -1.1196 1.3893 0.0472 0.0464 1.7669 1.9555 0.5572 -1.8055 0.0707 0.3410 -1.4962 0.3937 1.5623 -0.5668 -0.9332 -2.0060 -1.2964 0.3874 -0.6978 -1.6450 0.4158 -0.2199 0.6948 2.4162 0.6315 1.6813 -0.2788 -1.1518 -0.0861 -0.2163 -0.3823 0.2331 0.4869 0.2127 0.1437 -0.8298 1.0955 -0.2001 0.9638 -0.2503 1.2336 2.3083 -1.0072 0.7554 -0.5771 -1.0167 0.3288 -0.4459 -0.8250 -1.0429 0.3596 -1.4315 -0.5999 0.5089 -0.2102 -0.5685 -0.1401 -0.9136 -0.9691 0.5516 -0.4194 0.8910 -0.6516 -0.7025 0.0579 0.4209 0.5601 0.1929 -0.3387 -0.7211 0.0834 -0.1597 0.1100 -0.1444 0.3440 0.3911 -0.0533 0.0479 -0.7649 0.3806 0.3905 -0.9783 -0.9353 -0.0217 -0.1203 0.4296 0.5022 -0.6184 -0.8644 0.9131 -0.2214 -1.0797 0.8117 -0.0256 1.2204 -1.8622 0.4648 0.1596 -0.7877 -0.2330 -0.1735 1.4231 -1.4168 -0.7207 -0.4389 -1.8685 0.2035 -0.0723 -1.4872 -0.4464 -0.5946 0.2622 0.7651 -0.4661 -1.2819 1.8029 0.8144 0.0617 -0.7423 1.1222 -1.2633 0.2441 -1.5613 -0.6917 -0.3854 0.0704 -0.9214 -0.8031 -1.0099 0.1394 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0.9441 1.3668 1.3739 0.2638 2.5731 -0.7120 0.3734 2.2393 -0.6147 -0.1328 -0.2829 -0.3874 0.5093 0.7253 -0.7719 -0.1756 0.1424 0.7396 -1.2409 0.3238 0.5402 1.8815 -0.7445 -0.7251 0.8429 0.0692 0.9332 -2.0034 0.5439 -0.8655 -0.6461 1.3967 -0.1729 -1.4748 0.4399 0.3473 -1.7852 -0.4414 -1.1464 0.1837 0.2029 -1.3544 -1.0112 -1.4571 -1.4848 -0.3770 -0.2183 0.8524 1.8164 0.2275 -0.4183 -1.8583 -0.5971 -1.3364 -0.0717 0.6312 -0.2378 0.2811 -0.8259 -0.0218 0.1087 -1.6642 -0.1249 -1.1812 -2.0558 1.9802 2.2415 -0.1928 1.9729 -1.6786 0.4276 -1.5670 -0.9618 -0.2107 0.5814 1.1266 0.0770 -1.0970 0.3680 -0.6410 0.6576 -1.0224 -1.6900 1.7245 -1.1378 -1.9755 0.9207 1.2959 1.4959 -0.0379 -1.7341 -0.7988 -0.1826 -0.4739 -1.7597 -0.0506 0.1771 0.8112 3.4237 -1.8556 0.3764 -0.6212 0.5270 -0.3204 -0.3380 propyl 4-hydroxybenzoate sulfate 2.3664 0.3584 0.9111 2.2928 2.0574 1.7531 0.1602 1.2468 -1.0379 -0.7940 1.8064 0.3121 -0.3916 -1.0365 1.1363 -1.0587 -1.1249 -0.9941 -0.9785 0.5727 1.4360 0.5417 1.4227 -0.0681 -0.0008 0.5760 0.0513 0.8049 2.4838 -1.0023 0.4751 0.5004 -0.7748 0.5363 1.2854 -0.0731 0.2454 0.1901 1.7196 -0.6457 0.5253 0.3884 -1.0069 -1.1210 0.9208 -0.2768 -1.0080 0.8347 0.4416 0.4748 0.0514 0.7058 -0.9565 2.0163 1.8148 -0.2193 -1.0102 0.8816 -0.0758 -1.0650 -0.9128 -1.1020 -0.4388 0.5049 0.7531 -1.1348 1.2008 1.7556 -1.1116 -0.0101 -1.0071 0.6645 -1.0381 1.9943 0.8361 -0.4953 1.1694 -0.9943 1.0496 -1.0331 1.0878 -0.2638 -0.2094 -0.0382 -0.9388 0.0558 1.9628 -0.9606 -0.7410 0.8463 -0.5220 -0.9628 2.1788 2.0126 0.9699 2.2757 1.1635 -0.9705 -0.1485 -0.1668 -0.0700 1.1473 0.1969 0.8770 1.9912 -0.9462 0.8920 0.7854 1.5358 -0.9391 -0.1286 -1.1086 -0.9056 -0.5573 -0.5324 0.0639 0.3640 -0.9655 -1.0628 2.1016 -0.3186 0.1701 -0.2810 0.9005 0.9987 -1.0482 -1.0916 -1.0355 -0.5609 0.4491 -0.3561 -0.9208 0.5348 0.8510 0.9094 1.2263 -0.7982 -0.8068 -1.0218 -0.7313 -0.8735 -1.0444 -0.9722 -1.0210 -0.9238 -0.0025 1.4056 0.7629 -0.9431 0.1226 1.5461 0.8318 0.2370 -0.3140 0.2094 -0.3867 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0.2423 -0.9142 -0.1224 -0.3739 2.0696 -1.5516 -0.0496 -0.2979 0.2594 -0.8811 -0.4750 1.4583 -0.2447 -2.0408 0.4503 0.5168 -0.2410 1.5440 -0.0279 -0.9695 0.2271 -0.5442 2.1797 0.2319 0.2041 0.0723 -0.1566 0.9311 0.5829 0.6808 -1.4803 -0.6407 1.7834 -0.2951 -0.4508 0.1743 0.7981 -3.3195 0.9576 0.2992 -0.4792 -0.2770 0.7376 0.6599 -0.1354 1.0962 -0.0436 0.2624 0.7416 0.9026 -0.0541 0.2844 0.6432 0.2733 2.0303 0.6912 0.9971 0.3584 0.4003 0.2772 0.7917 0.1652 0.5082 0.1035 -1.5530 -1.0794 0.2167 -0.7921 -1.8041 -0.5566 0.8618 -0.3539 -0.0298 2.0631 0.2001 0.9509 -5.1261 0.2593 -1.7267 2.1969 -1.2229 -0.9545 1.8314 -1.8656 -0.8776 -0.0694 0.5790 -0.1706 0.6646 0.2701 1.0965 -0.2433 -0.6936 -1.1096 -0.4651 0.9205 1.0328 0.8220 -1.8601 -0.2975 -0.4719 -1.1150 -0.3050 -0.0351 0.9032 1.7248 1.2420 0.9057 0.0445 -0.4436 0.4229 -1.6565 0.3988 -0.2591 -0.7298 -0.1142 2.3562 -5.8144 0.3113 -0.0389 -0.7044 -1.3001 -0.3037 0.1240 1.3032 -1.4470 0.5468 -0.0755 0.5606 -0.6732 1.5006 -0.2615 0.5108 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0.6174 -0.2027 2.0125 2.5545 -0.6443 0.0272 -0.0211 -0.9178 -0.0285 2.7278 1.1378 -0.2587 0.0775 0.1003 -0.1495 -0.7154 -0.4381 -0.5764 -0.5257 -0.1302 0.4857 0.1017 0.4505 0.6549 -1.8413 0.4453 2.2928 0.4862 0.9038 0.7472 1.4803 0.0616 -0.4774 -0.2598 -0.4651 1.5443 0.5212 -0.1117 -0.6353 -0.6354 -0.2697 0.2530 0.8674 4.9460 -0.4648 -0.7666 0.0240 -0.1466 0.0044 0.1218 0.2590 0.8905 -1.0991 0.7213 -0.2865 0.6554 -0.6864 0.1265 -0.3258 -0.3804 0.4296 -0.4169 -0.8463 0.9707 0.0578 0.0244 0.5564 -0.1218 -2.8381 -0.0227 0.1728 0.2465 0.3085 0.8166 0.3416 1.3010 0.1998 -0.3243 0.6864 -0.2641 0.3474 2.6278 1.3119 -0.0850 -0.0073 6.4265 0.6672 -1.1673 0.1171 -1.4938 -0.6839 -0.4684 -0.7922 0.0377 -0.7773 -0.2544 -0.4313 -0.1327 0.5784 0.7563 0.6794 -0.1544 -1.8382 1.5263 -0.1505 0.5176 -0.7384 -0.0707 1.2609 -0.2169 0.9754 0.4183 -1.5452 -1.1470 2.1876 0.6862 -0.7800 -0.1405 -0.7805 -0.3500 -0.2193 0.7404 0.3233 -0.4670 0.0220 -0.3205 1.0172 0.4779 0.5298 0.6425 -1.3095 -0.5419 -0.0490 0.2026 -0.3766 -0.0132 0.3851 0.1638 -0.6497 -0.6993 0.1714 -0.0273 0.8768 -0.8035 0.0929 0.2556 0.5405 1.1429 4.2223 -0.2294 -0.2555 0.1236 -0.4050 -1.0021 0.6893 -0.1277 -0.2101 -0.6090 -0.1103 -0.6175 -0.4584 -0.2724 -0.3585 1.1350 -0.6899 -0.7911 -0.1781 0.9889 -0.6023 -0.7518 -0.3465 -0.8198 0.1673 -0.2924 -0.2591 -0.2237 -0.3391 -1.1038 1.8102 -0.0176 0.5383 0.3703 -0.7335 -0.4345 -0.7508 -0.2838 -0.7807 0.4600 0.2039 -0.4030 -1.0401 -0.5902 -1.0593 -1.1925 -1.5470 -0.5862 -0.6258 -0.7511 -0.6665 -0.3362 -0.9190 -0.5046 -0.1524 -0.5389 -0.0114 -0.4759 -1.2020 -1.5100 -0.9151 0.1717 2.7645 -0.1755 1.9884 -1.1415 0.6692 -1.6434 -0.4780 0.0485 -0.4240 -0.3438 -0.4091 2.2208 0.8316 -0.5157 0.3286 -0.5075 -1.1812 -0.7996 -0.2468 1.3099 1.7653 -0.8185 -0.0865 -0.0294 -0.1027 0.3907 -0.9855 -0.2585 -0.7406 -1.3028 -1.2091 -0.6596 -0.5567 -0.2828 -0.7082 -0.7682 -0.3149 4.4090 -1.2466 -1.1390 -0.3475 -0.0557 -1.0346 1.7214 -0.7484 -0.6308 -1.5184 -0.6189 1.0615 -1.1939 -1.0388 0.3940 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0.5263 -1.1827 -0.6135 -1.4087 -0.3838 1.5241 -0.0174 0.9872 0.8076 -1.5282 -0.8162 0.5984 0.6566 -1.1245 1.1539 -0.1724 -0.9697 0.0365 0.1688 3.0107 1.8687 -0.4735 0.3884 -0.1079 0.2727 -0.7433 2.2946 0.6331 -0.3641 0.1933 -0.3737 0.4468 -0.8221 0.4815 -0.8591 -0.4158 -1.4839 0.0447 -0.3535 -0.0285 -0.0854 -1.2722 -0.0691 0.9920 -0.0692 0.3459 0.5605 0.6290 -0.7621 -0.9467 -0.5240 -0.0912 1.7707 -0.6680 0.3109 -0.9195 -0.2614 -0.6437 0.6302 1.4617 3.1967 -0.2332 0.1656 -1.5484 -1.5969 0.0814 -0.2687 -0.6733 0.4066 -0.4958 0.1177 -0.2070 -0.0039 -0.1524 0.5429 -0.9908 -1.6017 0.1176 1.1836 -0.0125 1.1891 0.2080 -1.7915 1.0278 0.0875 0.1597 -1.2514 -1.7185 0.6034 -0.3503 0.4832 -0.4846 0.2489 -0.3875 -0.1339 -0.0487 -0.6309 -0.3718 2.7311 -1.0672 1.3135 -0.7315 4.1030 0.3410 -0.5435 0.4950 -0.3703 -0.5422 -1.0885 -1.4702 -0.2882 -0.1999 0.3806 -1.0952 0.7608 0.9630 1.0139 1.1170 0.5667 0.7001 0.9103 -0.0302 0.7816 -1.0146 -0.3397 1.3478 -1.0195 0.3056 0.5944 -1.6963 -1.4573 1.1998 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2.2897 0.6434 0.8649 -0.7697 -0.9538 0.1689 0.0597 -1.2946 0.8016 0.8113 2.2817 0.5378 -0.4197 2.8512 1.8132 1.1129 1.8536 1.0098 1.0312 0.6169 0.1605 0.6078 0.1028 0.4144 -0.4656 -0.7467 -0.0193 1.8370 0.8466 0.0515 0.1557 1.4948 0.1524 -1.1244 -0.8010 -1.5092 0.9114 -0.1787 -0.4821 0.6016 2.0779 1.4100 -0.7108 1.2902 -0.5363 0.5312 1.5932 0.1729 0.3929 2.0729 -1.1839 -0.4537 1.5790 -1.0162 0.9226 0.2346 0.8245 0.6622 1.1037 1.4638 0.6959 -0.3265 -0.5204 -1.2106 0.2202 -0.1168 1.8851 0.6982 -0.2593 0.1330 0.9293 0.1980 0.2486 0.7386 -0.7711 2.9601 1.4881 0.5334 0.6167 1.0151 1.7199 -0.0242 -0.6069 0.2803 -0.4013 -0.0111 2.2992 2.8031 1.5876 0.0492 -0.0101 0.7168 -0.4227 0.2445 1.2943 -0.3959 0.7312 0.5691 0.9720 0.0938 0.8764 -0.3566 1.2867 0.9201 -0.4151 retinal -0.4470 -1.5613 1.1180 -0.7802 -0.1959 1.5230 0.4618 1.5496 -1.0174 -0.3569 -0.6601 -1.1586 1.2701 0.4037 0.4537 1.2456 0.8199 -0.8987 0.6766 1.6410 1.9893 -1.5732 -0.3537 -0.8964 0.5350 0.7857 -1.2189 -0.7498 1.8789 -0.9209 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0.9010 1.8200 1.3900 0.9310 0.7530 0.9160 0.2260 0.1250 0.3410 1.5100 0.6540 0.6820 1.0200 1.4900 1.0500 -0.9910 0.0882 -2.3700 1.0400 0.2590 -0.4600 0.1790 1.5000 1.8700 0.2590 0.2010 0.1500 -1.2300 1.1900 0.1340 0.8340 0.3040 0.3790 1.3000 0.7250 0.5880 0.9750 0.3160 1.8200 0.2350 1.0200 -0.5350 0.8440 0.6890 0.2170 -0.1680 0.9430 -0.0244 0.4760 0.4600 0.3850 -0.0347 0.6780 1.3100 1.1400 0.5140 0.1250 0.6820 0.3970 1.6200 0.4990 0.2250 0.6450 1.3100 0.4770 0.1110 0.7360 0.2620 0.6730 -0.3270 0.7610 0.3600 0.1630 0.0109 -0.0615 0.4500 1.3400 0.6150 0.2250 0.4040 1.0100 0.3330 1.2300 0.5940 0.7010 0.1340 0.2670 0.7970 -0.7320 -1.7700 0.2330 1.0500 0.4960 0.2230 0.8760 -0.6480 -0.5160 -0.4280 0.8960 -0.7010 -0.9180 0.3410 0.5520 0.2070 0.8830 -0.3350 0.3490 0.2670 -0.2260 0.4480 -1.0100 -1.0200 0.5530 -0.3300 0.7090 0.2450 -0.2670 -0.3310 -0.6710 -0.3180 0.5990 0.1000 -2.0300 0.5050 0.2380 0.7410 0.1620 -1.0200 0.4470 0.3430 -0.3960 0.0664 0.7200 -0.0162 1.1400 0.2730 0.0003 0.8550 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0.7303 1.4468 -0.3878 -1.3647 2.1591 -0.8680 -1.0265 2.1644 0.7102 -0.1284 0.1833 0.3291 -1.4190 0.5975 -0.4672 -1.1452 -0.4577 -0.6272 0.3382 0.3847 1.8040 -0.7795 -0.1679 -0.2090 0.0397 -0.6284 0.1511 -0.1854 0.6355 -0.5879 -0.9398 0.6121 -0.3881 -0.5460 -1.1151 -0.4157 -0.0506 -0.3948 0.6702 -0.8720 -0.5322 -0.0325 0.7202 -0.4652 1.1862 -0.8136 -0.7563 -0.2884 -1.1108 -0.3261 0.4522 -0.3669 -0.7078 -1.1297 2.3980 -0.4970 -1.1005 0.7191 -0.7115 -1.5411 0.5530 1.3660 0.1765 -0.2408 0.6422 -0.3229 -0.1142 -0.1040 -1.7416 1.1625 0.0993 -0.9946 2.5724 -0.4734 0.4763 0.3862 -0.1127 0.0976 0.1819 -0.1924 -2.2796 -1.3051 2.0191 -0.5537 0.0060 0.4085 -0.0857 -0.5398 0.7058 0.2329 -0.3988 -0.6757 0.4105 -1.4783 0.1625 -0.7882 1.5810 2.4484 -1.5594 -0.5457 1.4740 3.1612 0.6306 -0.9222 0.8544 0.1549 0.0875 0.5683 -0.3986 0.2246 -1.4112 -0.0373 0.0782 -1.3972 -0.4400 -0.5081 1.5458 -0.7455 -0.2558 -0.3721 -0.2976 0.6729 -0.1138 1.6009 -0.0713 0.0987 -0.1360 0.5561 -0.5185 -0.4528 -0.9058 0.4776 -0.7666 -0.5476 -0.2267 0.2072 -0.1178 -0.5030 1.3926 -0.4877 -1.6507 -0.4715 -1.1255 0.7702 -0.1394 -0.8625 0.2626 1.3650 0.0706 1.1468 -0.5699 3.2466 -1.1530 1.0243 -1.5652 -0.3901 -0.8251 1.4363 1.5122 -0.3798 -0.4622 -0.8878 0.0231 -0.6266 1.4721 0.8049 -0.3244 0.1261 0.0751 -0.5190 -0.9953 0.2507 -0.3750 0.2453 0.0367 0.3124 1.5183 0.9929 -0.5039 1.0135 0.6493 -0.5861 -0.1228 -0.2850 0.4423 -0.4989 -0.3982 0.5499 -0.9929 -0.3208 -0.2252 -0.8929 0.2342 2.6502 -0.0982 -0.1869 -0.4061 -0.3653 0.3479 0.2425 -0.3606 0.4202 -2.9241 -1.1297 0.2368 -1.0170 0.0046 -0.0794 -0.0301 -0.1489 0.1439 -0.5085 -0.8734 -0.1165 0.1927 -0.5917 -3.5147 0.1824 -0.6090 -0.4647 0.0363 0.5767 0.3314 -0.1479 -0.4373 -0.9687 0.8281 2.0859 0.9619 -0.7594 0.3144 2.1216 0.3682 0.4911 -1.7568 -1.1401 0.0799 -0.7614 0.1694 1.4129 1.1639 0.0645 -0.5294 -0.5301 -0.3083 -0.4486 0.2900 -0.5091 0.8685 -0.6689 -1.1616 -0.1909 1.3716 0.2958 -0.3748 -1.0098 -0.2575 0.0840 -0.7475 0.0017 -0.8339 -1.4440 0.2207 -0.3242 -0.3626 -0.3262 -0.3575 -1.0660 -0.7363 -0.2775 0.5565 -1.1081 -0.1699 -0.8781 -1.0570 -0.3224 -0.1838 -0.3502 -0.0331 0.4218 -1.0499 -0.9171 -1.4916 -0.9617 -0.0822 0.5003 -0.2655 1.7454 -1.0142 0.2411 0.1775 0.2038 0.4864 -0.7801 0.0388 -0.1187 -0.3593 0.4224 0.6503 0.1548 -0.7280 0.2739 -0.0919 -0.2427 -0.8249 -1.7465 -0.2804 0.4769 -0.8112 0.3665 1.4963 -0.8710 2.6517 -0.3488 0.0828 0.3520 0.3733 -0.2270 1.5023 1.3681 -0.5172 -0.1674 0.2232 0.0358 0.8959 -0.9287 -0.0414 1.6210 0.0465 -0.3661 1.1010 0.2682 -1.3866 -1.3430 -0.3352 0.3030 0.7067 1.0615 -0.2715 -0.2960 -0.3469 -0.6130 1.8972 3.5897 0.2734 3.6066 -0.0863 -0.2598 -0.3277 -0.2963 0.3490 0.2326 -1.7348 -0.9691 0.5930 0.5606 -0.0378 -0.0821 -0.4404 3.1036 -1.0456 2.2818 0.2034 -0.2142 2.0032 0.3790 2.4373 0.2565 2.3052 1.9345 -0.2944 0.0342 -0.2286 -0.3015 -0.3539 0.5261 -0.0285 -1.4249 0.0014 -1.5119 -3.8140 0.0222 0.3174 0.3940 -0.1249 -0.8858 -0.1550 0.6823 -0.2259 0.0877 -1.1293 0.6649 2.5853 -0.0538 0.2292 0.4442 -1.3640 -1.1113 1.4905 -0.7983 -1.9275 riboflavin (Vitamin B2) 1.2667 0.3433 0.2076 0.5679 -1.1077 0.6739 -1.9958 0.9878 0.8619 1.3044 0.7243 0.4632 0.4464 0.2821 0.6623 0.4331 0.5728 1.1753 0.8316 -0.1697 -0.1496 0.5541 -0.2563 -0.3259 -1.6715 0.0838 1.3151 1.8386 0.7988 0.8269 0.5030 -0.1929 1.4164 0.1244 0.8106 0.4712 0.3823 0.3391 0.7426 0.5167 -0.0709 -1.0965 1.1013 0.0778 0.1533 0.2408 0.0273 0.2045 0.4718 -0.0649 -1.6787 0.0426 -0.0985 0.0413 -0.1010 0.4285 -0.0519 -1.2866 -1.7803 0.0716 -1.5081 -1.1134 -1.9013 1.5591 -1.6703 -0.9085 -0.2221 0.1139 -0.0498 1.1097 0.5562 0.3633 0.1697 0.9001 0.1843 0.7226 1.2365 0.6963 0.1828 -1.7793 1.1857 -1.6238 -1.7045 -0.7212 0.6549 0.4018 0.8096 -1.6174 1.5104 -0.4900 0.3749 -1.6218 -0.1738 -1.2713 -1.6437 0.4991 -1.6783 0.0612 -0.4310 -1.8754 1.0563 0.4476 -0.1015 1.0561 -1.5659 1.5095 -0.6874 -1.7755 -0.1046 -1.5681 0.7403 0.0914 -1.4932 -0.4905 -0.4109 0.1586 -1.4760 0.7164 -0.0081 -0.3710 0.4336 0.4401 -0.5537 0.0355 -0.5057 -0.3020 -1.4811 -0.3116 -1.8550 -0.8536 0.9321 1.5990 1.2813 -1.9064 1.2537 0.5967 -1.6673 -0.1586 -0.1323 0.1651 1.2562 0.4511 -0.9486 1.0529 -0.3102 0.4392 0.3872 -0.1114 -0.1853 -0.6863 -1.4283 -0.0460 -1.5827 -2.3153 0.8247 0.7377 0.0853 -1.4665 1.0938 2.2327 2.1926 -2.0489 -0.1600 0.2504 0.0976 -0.2392 0.3088 0.2145 0.7510 -0.1013 0.7366 0.7601 2.1041 -1.4353 0.1700 -1.3481 0.7325 2.4330 -1.6365 0.6480 1.3869 0.8267 0.1894 0.8584 0.6377 0.9139 0.5815 -0.0721 -1.4498 0.9177 0.0999 0.6785 0.1645 0.7441 0.0350 -1.8445 -0.0935 -0.6797 -0.7402 -0.3452 1.1151 0.5018 1.2191 0.6550 1.1199 0.6373 1.3104 0.2123 0.3887 0.5219 0.7906 0.6768 0.4246 0.3039 -0.4383 -1.8144 -0.2921 -0.6348 -0.5600 0.3233 -0.5912 -1.8831 0.6992 -0.6717 -0.0316 -2.0810 0.8063 -0.5477 1.0162 1.2267 0.6630 0.8626 -0.3547 -0.2215 -0.1676 0.6654 0.9941 0.7974 -1.9721 0.5386 -1.8101 0.2366 -1.7816 -2.1557 -0.8219 0.1817 1.3352 -0.1145 0.8998 1.0385 0.4732 0.5563 -1.9699 0.4722 -1.8665 1.0681 0.2802 1.1773 0.2978 -1.9787 0.1393 0.8816 -0.1846 0.6649 -1.8874 0.7111 0.1663 -0.9159 0.1285 -0.2619 -0.1778 0.6538 -0.3229 0.9570 0.2198 -0.2408 -0.7965 1.7835 -0.2276 -1.4471 0.2773 0.5597 -0.7873 0.0808 0.0298 -0.1226 0.8745 1.6736 0.9311 -2.1050 -1.0761 -2.0414 0.8618 0.5305 -0.6830 0.3897 0.9443 -0.1422 -0.2188 0.4487 0.8884 0.7670 -1.8269 0.5539 -0.1710 0.4871 -0.5477 -0.6989 0.3802 0.9571 0.1758 0.6846 0.8016 0.6360 -1.3740 -1.8034 0.3249 -0.2017 0.7442 -1.9196 0.0118 0.8862 -0.4014 0.0122 0.5158 -0.2057 0.6992 0.3441 -0.5657 -2.0022 0.4225 -0.2824 0.1339 0.3990 -0.1884 -0.3871 0.5387 -0.2723 0.6612 1.0105 0.4449 1.1013 0.4999 1.0305 0.0962 0.9391 -0.0950 -1.9824 -1.9033 0.2750 1.2364 -1.0187 -0.9415 -1.0297 2.0740 0.7739 1.9249 -0.9356 1.0814 0.3076 -1.0684 -0.7124 0.3273 0.0309 -0.1016 0.7597 0.5055 0.3547 1.7557 0.5771 1.2107 0.3982 -1.7442 0.4904 -0.9105 1.1901 -0.3619 1.4399 0.3247 0.5284 -1.7886 -0.1495 1.3550 0.4786 0.5618 -2.2883 -0.5767 0.4514 0.4604 -2.1932 1.4385 0.2838 1.0991 -1.9183 0.2453 -0.1916 -2.2018 0.4812 -0.8005 -1.9540 -1.3705 0.9448 0.8357 -1.1809 -0.6009 0.8511 -0.9626 -1.8778 -0.3514 -2.1661 ribonate (ribonolactone) 0.5393 -0.2691 -3.0460 -0.9113 0.6568 -0.9880 -1.3604 -0.8128 -0.9815 -2.1318 -1.1059 0.8929 0.8763 0.1132 0.5596 1.6999 -1.5619 0.0192 1.0127 -0.1644 1.4830 1.3768 -0.3209 0.3920 0.7366 0.6436 -0.7594 0.6287 -1.7533 -1.7521 1.4439 0.0314 0.9129 -0.4821 0.9303 -2.2556 -1.8111 -0.1711 1.6087 -1.0132 -0.4051 2.7425 0.7100 0.2702 -0.1010 -0.5834 0.8742 0.2664 0.8129 0.4765 0.3723 0.2823 1.2333 -2.5400 0.2448 -0.4701 0.1817 0.6041 1.4329 -0.4791 0.2290 -0.5354 1.4890 -1.0117 0.9093 -0.0095 0.2532 0.4488 1.4769 0.2622 -0.8852 -0.4032 0.7235 -0.0650 1.8639 1.5888 0.8015 0.4585 -0.3564 -0.1925 1.7349 -0.7196 -2.4309 -1.0025 -1.9222 -1.0478 0.9859 1.1388 1.3708 0.1669 0.0576 0.1065 1.1632 1.2415 -0.3146 0.5501 -1.3815 0.4434 1.4192 1.1041 0.9940 -0.7411 -0.4613 1.6721 1.1507 -1.1504 -1.2257 0.3400 -0.8812 0.4117 -0.5459 0.5051 0.0820 -1.0218 -0.6641 -0.6953 1.0817 -0.6284 -1.9208 -0.8136 -0.5560 -0.1084 -0.3539 -0.6316 0.8520 0.6535 1.0561 -0.8083 -0.5492 0.1988 -0.5479 -1.7211 -1.1916 0.2800 -0.6703 -0.3845 0.7025 0.2142 1.7130 0.8215 -1.4152 0.8519 0.8382 -0.6274 0.7700 1.1968 0.6697 0.7641 2.2445 0.8749 1.1172 0.4882 1.6452 3.0169 1.8470 0.6326 -0.8872 -0.9545 1.4195 -0.2823 -0.8717 0.2375 0.6190 -0.4057 0.0367 -0.3213 -0.6559 -0.1967 -0.2031 0.3580 -0.4521 -0.1910 -0.7786 -0.4332 -0.9240 -0.1428 0.5768 1.6647 1.0775 1.0025 -0.1729 -1.7039 1.3690 0.8358 0.5939 -0.5770 -0.0513 1.0176 -0.1929 1.0079 -0.6943 -3.3271 0.2217 -0.5006 -0.7805 -0.5374 -1.2811 0.0080 0.8780 1.0170 -0.7565 0.5071 -1.5318 0.7940 -0.4411 0.0124 0.9604 1.0502 0.3234 -0.2387 -0.0770 0.5935 1.7191 1.8555 0.7611 -0.1417 -1.1891 -1.3951 -0.9488 -0.4022 -0.5097 -1.3382 1.8507 -0.8821 -0.6574 -1.4995 -0.4352 -0.8569 0.4997 0.9720 -0.1735 -0.8170 -0.0164 -0.1381 1.2124 -1.0283 -1.0743 0.3275 0.1287 0.8276 -1.0303 1.0713 -0.2525 -0.7641 0.0479 -0.7913 0.2643 0.2721 -0.5390 -0.4122 0.4852 -0.0313 0.9656 -0.4637 0.3219 0.8148 0.9117 0.3413 -0.8400 -0.8586 0.5692 -0.6092 -0.4165 0.6220 1.0437 0.3884 -0.1384 0.1574 -0.5275 -0.9018 -1.4124 0.5728 1.6025 1.9360 0.5609 0.0028 0.0444 0.0076 -0.6283 0.2034 -0.4956 -0.7786 0.6080 1.8904 0.2640 0.0097 -0.0293 1.7100 0.5493 -0.6908 -0.7691 0.7058 0.0565 2.5837 0.0721 0.6660 -1.1595 1.1895 -0.1362 0.1508 0.9883 -0.5561 -0.6343 0.2308 -0.7908 1.3544 -0.7623 1.4455 -0.8478 -1.3116 -1.1780 0.7198 -0.4699 -0.1148 -1.7829 -1.1696 0.0458 0.3050 0.5479 -0.5728 2.0369 -2.1259 1.0014 1.3603 -0.4768 -2.4490 0.8023 -0.2600 1.6381 0.0783 1.1008 0.2807 0.0354 -0.2382 0.7841 0.1771 -0.1571 -0.1762 -2.1448 -0.8285 0.0189 -0.8543 -0.3563 0.0351 0.6911 0.1876 0.5982 1.1569 0.0080 -0.7325 -0.2056 1.6002 -1.0307 -0.9720 -1.7871 -0.8754 0.1178 0.3831 -0.7779 0.2581 0.6470 0.0286 0.1972 0.1902 1.5727 -0.2522 0.0075 0.4700 -1.1385 -1.5716 -1.5318 0.5591 -1.5091 -2.1778 -0.3453 0.0053 -1.4281 -2.0278 -1.0135 0.3209 0.8255 0.3958 0.9832 -1.7935 0.4052 -0.7576 0.0540 -0.9800 0.1596 -0.5881 0.4086 -0.9333 0.4832 0.3078 0.5987 -0.7699 -0.6554 1.2305 1.6547 1.0263 -1.9430 -2.0776 -1.1880 -0.2882 -0.5408 -0.9750 -1.4201 0.5332 0.8415 -0.5161 ribose 1.2767 -0.1501 -0.1687 1.2452 -1.5618 -0.5457 -1.9630 -1.9298 1.1116 -1.6535 -0.9495 -1.9398 -0.1821 1.1966 -0.4322 0.3483 0.6369 0.6770 -0.4065 0.5052 0.7642 -2.0812 0.7134 -1.8144 0.4648 0.2564 0.7100 0.5717 0.4810 -1.8542 -0.2799 0.0799 0.1906 1.2659 1.1365 -1.1832 -1.5456 0.2827 0.3016 -1.9425 0.5426 -0.2639 0.1875 0.0399 -0.6153 1.1022 0.1675 -0.0003 -1.0168 0.5927 0.2617 0.6646 -0.2740 -1.2529 -0.0798 -0.4728 0.9297 -1.4449 0.2465 0.8890 0.2670 0.1564 -1.9280 -0.1850 0.6126 0.4168 1.3559 -1.2482 0.5382 -0.2362 0.4728 0.6003 0.0818 1.3948 -0.4093 -0.0897 0.9615 -1.3205 0.2496 0.0565 -1.8485 0.0225 0.6893 -1.9460 -1.1521 0.7976 0.7650 0.3920 -1.9471 0.5238 0.3688 -1.7984 0.6577 -1.6334 -1.8323 0.6440 -0.0182 1.2115 0.5775 0.8206 -0.4152 0.5073 -0.2117 0.4763 0.3370 -0.1070 -0.9948 0.4490 0.6887 0.8001 0.8817 1.6801 -1.7410 -0.7478 -1.8520 -1.8309 -1.7251 -0.6329 -0.7130 -0.7992 0.0051 0.2080 -0.8086 -0.3189 0.2961 -0.6104 0.4703 0.6950 0.0918 1.0731 0.8745 -0.8003 0.3585 1.1450 0.5500 -0.3991 0.5608 0.0443 0.7085 0.0196 -0.2033 -0.1335 -0.1940 0.5205 -0.2524 0.3752 0.5516 -0.6515 -0.1405 -1.7454 0.1267 0.2277 -0.3480 -0.2732 0.9805 1.1271 1.2705 0.2066 1.5287 0.8770 0.9436 1.1722 1.4721 0.2657 -0.1300 0.2175 0.8639 0.3243 -0.0342 0.9233 1.1067 -0.4258 -2.0198 1.0349 1.2099 0.1039 1.0249 0.0687 -0.3446 0.9490 0.6320 0.9669 1.4200 -0.0939 1.2760 0.8412 1.6080 0.1091 1.2195 1.3437 -0.8144 -0.5798 -0.6432 1.3954 0.5465 -0.9591 1.1340 0.7535 0.0710 0.2247 -0.3019 1.3116 0.5615 -1.7975 -0.4255 -0.2332 -0.6395 0.7078 0.5356 1.1213 0.9647 0.5088 -0.5479 -0.3217 0.2060 -0.2264 -2.0060 -1.9776 -2.0160 0.0460 -1.8888 -1.0050 0.6460 -0.3025 0.6471 -1.9878 -1.9619 0.8724 0.4082 0.7617 0.6232 0.4045 -0.5614 0.3367 -0.6285 -1.9712 1.0759 1.5538 0.8107 0.5523 0.5631 0.2730 -1.8676 -0.7146 0.4323 -0.3918 -0.2070 1.2906 -0.3321 0.6483 -1.8999 -1.9413 -1.9474 -0.5949 -1.8988 0.5446 0.0180 0.2303 0.4895 0.1080 0.8307 0.6413 0.9943 0.0970 0.7361 0.1348 0.0267 1.2996 -0.3590 0.7394 -1.9304 0.4627 0.6221 -0.8305 0.0997 -0.1469 -1.8862 -0.7242 -1.2313 -1.7113 0.5091 0.8541 0.5051 -0.7293 -0.3963 0.4914 1.6322 0.4917 -0.5303 -2.0016 -0.1942 -1.9736 -0.4349 0.4706 -0.2323 0.9660 -0.1907 -1.1298 0.4299 -1.9416 0.0836 1.1387 -1.8675 1.5829 1.0114 -2.0004 -0.7693 0.1427 -0.1831 -0.1237 0.7993 -1.9445 0.7963 0.1513 0.3135 0.1074 0.3164 0.6107 0.6250 -0.4904 0.0451 0.1997 -2.1378 -1.9796 1.2090 1.0843 0.7617 0.6005 0.7244 -1.9550 0.9910 -0.2629 0.1975 0.0725 -0.7939 0.2964 -1.9298 1.2635 0.3420 0.3963 1.5166 -2.0673 0.6812 1.0786 0.2482 1.2512 0.0042 -1.9521 -1.0626 1.1344 -0.6498 -0.9990 0.4341 1.4453 0.6835 0.7669 -2.0141 0.4082 -0.9304 0.4912 -0.7492 0.8484 0.0576 1.0119 -1.9159 1.1606 0.5402 0.9485 0.7934 -0.0910 0.8504 -0.0594 1.1650 1.4238 0.3564 -1.8147 1.8244 -0.4999 0.0507 0.2770 -0.3782 -2.0720 0.5953 0.7606 -2.1045 0.4240 0.5772 0.9047 0.2250 -2.0530 0.5140 1.0678 -0.0656 0.8557 -0.6393 1.3859 0.5146 0.6148 0.2410 0.5023 1.2357 1.4920 0.7515 0.8531 1.2346 -1.0980 -0.3281 0.6459 -1.8926 -2.0706 ribulonate/xylulonate/lyxonate* 0.4735 0.4337 1.0289 0.1211 -1.7766 0.5491 -2.2146 0.1104 0.6009 0.2490 0.6084 0.0820 0.3692 0.8353 0.4966 0.3707 0.4269 -0.2915 -0.2857 0.4860 0.5645 0.7672 0.4333 -2.0389 0.1272 0.1926 0.5040 0.4925 0.2154 0.4683 -2.1825 -1.9884 0.4990 0.6201 -0.0719 1.2688 0.6393 0.4693 0.4430 -2.1735 0.1784 0.7885 0.3801 0.3240 0.0559 -2.2300 0.6457 -2.0268 0.4706 0.7024 -2.0593 -2.2788 0.2524 0.7695 0.2098 0.4166 0.3993 0.6043 0.5772 0.0163 0.2220 0.6287 -2.1876 0.2401 -2.0364 0.8944 -2.0704 -0.3378 0.2875 -1.9710 0.3212 0.2819 0.4076 0.7002 0.4340 0.5188 0.4324 0.5376 0.5272 -2.1118 -2.0624 -0.2428 0.4107 0.1924 0.8786 0.3038 0.0511 -2.0468 0.5396 0.5863 0.2454 0.7009 0.8536 -1.8514 0.0736 0.6509 0.4178 -0.0602 0.4446 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1.2192 0.8019 -0.4382 0.5066 0.2712 -2.3494 0.5511 -0.1958 0.1918 0.4297 0.1291 0.5033 0.5075 0.0871 0.7570 0.6277 0.4355 -0.0362 0.4563 0.1667 0.2871 0.6621 0.6197 -2.1387 0.5426 0.2993 0.4462 0.4805 0.2944 0.7402 -2.1357 0.7564 -2.1647 0.1995 S-1-pyrroline-5-carboxylate 0.5432 -0.7956 -0.4017 -0.8877 1.3256 -1.1998 1.3270 -0.5486 -0.5505 0.5745 -1.6253 -0.3806 -0.0268 -0.0603 -0.7320 0.8865 -0.0695 0.8306 0.2695 -0.5733 -0.0465 -0.2747 -0.2959 0.1625 -0.2972 0.3956 -0.3213 0.5086 0.3401 0.0925 -0.9153 -0.5162 0.4151 -0.5449 -0.3782 -0.3692 -0.2445 0.7818 0.5725 0.6130 0.0939 0.9943 -0.0221 -0.5346 -1.1964 0.1017 0.1769 0.5079 0.1037 1.1129 0.2595 -1.6682 -1.6269 -1.2914 0.6856 -0.6428 -0.7726 1.5085 0.7812 -0.3977 0.4503 0.5063 0.6876 0.9097 -0.3790 1.0303 0.7800 -0.2315 -0.2902 -0.0968 -2.6090 -0.6344 -0.6341 0.2184 1.5027 -1.7547 0.8143 0.7561 -0.2418 0.1532 0.8240 -0.6577 1.7918 -0.4524 -0.8919 -0.1852 0.3906 0.5411 -0.4074 -0.0777 -0.7623 -0.4650 2.0462 -0.0425 -0.1302 -0.5900 -0.5366 0.2491 -2.2042 -0.7507 -3.9223 0.4683 1.9253 0.5015 1.3188 -0.1767 -1.5329 1.8995 -1.1132 -0.2728 0.1072 0.9280 0.6131 -1.2411 -1.7194 -0.0068 1.8041 -0.5583 -1.5750 -0.8796 -1.4422 -0.3724 -0.5694 -0.4042 2.4756 -0.7971 -0.9749 1.2702 1.4001 0.8024 -0.0350 -0.2484 -0.4341 0.1752 0.1115 1.0547 -0.1173 0.4806 -0.4972 1.2549 -1.4894 -0.1684 -0.1218 -0.2579 -3.3675 0.3017 -0.5060 -0.8457 0.8221 1.0961 0.1735 1.3069 1.9949 3.2391 0.0127 0.0837 -0.0242 0.4917 -0.3211 2.1397 1.1144 0.1710 0.8462 -0.9810 0.3681 -0.8897 0.9494 0.9993 -0.2156 -2.0261 0.3272 -1.3979 -0.7905 -1.0840 -0.7196 0.2661 2.2286 -0.4731 -0.5364 0.4237 1.3126 -0.2995 0.6082 -1.3585 0.1119 -0.1940 -0.1030 0.0852 -0.3897 1.8601 -0.3530 -2.3351 -1.1731 1.1420 1.3503 -0.9259 0.7542 -1.4664 0.1338 0.4889 -1.3466 1.0539 -0.3126 2.2229 0.2696 -1.3456 -0.6730 0.4817 0.9397 -0.4846 0.4245 2.7565 -0.9622 2.1819 1.1242 0.4283 -0.8431 -0.8331 -0.0870 -0.3058 -0.4343 0.2540 -0.0990 -1.1883 0.0099 0.9900 -1.0237 0.7367 -0.3431 1.1892 0.4568 1.6100 -0.0862 -0.4228 -0.6157 -0.4581 0.8086 -0.8891 -0.2631 -0.0699 -0.7622 -0.5350 -1.9160 3.4250 0.6332 -0.8216 -1.0845 -0.7581 -0.9160 -0.4365 -1.3984 0.1450 -0.6894 -0.1857 0.5887 0.1650 0.0932 0.3238 -1.2301 0.2541 0.6827 0.3159 0.4638 -0.1699 0.4141 0.5915 0.2271 -1.0399 1.0944 1.7475 0.4213 0.4971 0.9717 1.2075 -1.0073 0.2514 -0.0637 0.5000 -1.9323 -0.0625 0.2231 -1.5780 -0.6047 -0.7140 -0.3955 2.0058 1.5103 2.5999 0.3698 0.6289 -0.4633 0.3605 0.4368 1.4974 -0.0534 -0.7269 -0.4587 1.6350 -0.1497 0.4370 -0.4823 1.9352 0.1945 -0.7108 0.6009 0.6274 -0.3412 0.7107 -0.3743 -0.7583 -0.2906 1.1980 0.6066 -1.0146 -0.3502 -0.1288 0.1254 0.4625 1.7448 -0.4014 0.3832 0.7059 2.1659 -0.0867 -0.3853 -0.0528 -2.5002 -0.2896 -0.0337 1.0051 0.0230 1.5518 -0.2624 -0.7453 0.4442 -0.4476 -1.4474 -0.9382 0.1056 -0.4058 -0.7800 0.4512 0.8528 -0.9571 -0.6641 0.0580 0.1803 1.0956 0.2485 -0.4835 0.4380 0.7418 -0.2763 0.4074 -0.4787 -1.5961 -0.2198 -0.3982 -0.6433 -2.8528 -0.2212 -0.6198 1.0031 -0.5908 -0.9421 -0.7055 0.4387 0.0312 -0.5448 -1.8793 0.5058 2.1163 -0.4029 1.2975 0.4021 -0.7009 -1.3259 -0.9978 0.4662 0.3532 -1.3676 0.3371 -1.0602 -1.0667 1.7709 -0.0099 -0.5166 -0.4545 -1.1613 -1.0312 2.0541 -0.1114 2.3381 0.0577 -0.3547 -0.3348 -0.8214 -0.5627 -0.3527 1.9115 0.9939 0.7230 0.3505 -0.6136 -0.8749 -1.0860 -0.9309 1.2657 -0.8299 -1.1002 (S)-3-hydroxybutyrylcarnitine 0.8490 -1.1602 -5.2749 1.2159 -0.8889 0.8928 -0.2184 0.4279 0.3674 1.5288 1.9654 -0.5986 1.0424 0.9986 -0.4270 0.1108 1.8477 0.1434 -0.5321 1.5274 0.7808 -1.3150 -0.5278 -0.4964 -0.2525 -0.3705 -0.4283 -0.3801 0.1194 0.0996 -0.3686 -0.0058 0.8888 0.5771 0.0183 0.1625 0.4377 0.5275 -0.0312 -0.1894 -0.6571 0.1048 -0.2382 -0.3290 0.2338 0.3584 -0.6132 0.4645 -0.9610 0.2446 0.1533 0.3445 0.7772 1.1990 0.6021 0.2527 -0.9819 0.0141 0.3472 0.0827 -0.2696 0.2766 0.6646 0.8063 0.6318 -0.7655 0.4712 -1.0049 -0.7799 0.5436 0.2700 -0.9173 -0.0009 -0.0809 -0.4211 -0.1025 -0.1951 -0.3887 -0.6629 0.1673 0.3335 0.5576 0.7611 -1.0031 0.0017 -0.5668 -0.6422 0.9049 -0.4370 -0.7058 -0.9726 0.8437 -0.2843 0.5923 -0.0219 -0.9000 0.9559 0.2631 0.3672 -1.2179 0.3918 -0.1157 0.5305 -0.3590 -0.2685 -0.4460 1.1703 1.2409 0.7592 -4.9598 -0.5537 0.8758 -0.2032 1.2240 -0.1097 0.2972 -0.1932 -0.4451 1.8601 -0.0587 -0.2027 -1.6701 -0.1726 -0.1047 0.0663 0.5762 0.3623 0.8571 -0.5104 -0.6417 -0.0497 -1.0242 0.3888 -0.9052 -1.2045 -0.4661 -0.8294 1.0559 0.0377 0.7742 3.1910 -0.1923 1.1927 0.2659 0.7249 -1.0605 -1.0080 -5.2678 -0.1151 -1.2519 0.1218 1.3286 0.4329 -0.4806 -0.0494 -4.8508 1.3871 -0.7375 -0.0165 0.7533 0.6178 0.2091 -0.6406 1.0901 -0.2495 -0.7930 0.5478 -0.8110 0.4991 -0.0676 0.9110 -0.2598 0.3718 0.8375 1.0341 0.4669 1.3798 0.8067 0.3222 -0.3460 -0.4071 -0.0342 -0.6379 -1.0569 0.1372 -0.2243 0.9487 0.7949 1.1476 -0.2075 -0.1159 0.8554 -1.1287 0.3166 -0.2947 0.4551 1.0871 0.8468 0.3690 1.4858 -0.1758 0.0516 1.1471 -0.0056 -0.2593 -0.4074 0.2150 1.0148 0.5012 -0.7019 -0.0454 0.0330 -0.9350 -2.9191 -0.0918 -0.3324 0.5866 -0.3829 -0.8815 -0.0599 1.0650 0.5909 -2.8619 -0.0203 -0.5831 -0.3472 -0.2286 -0.1323 -0.6806 0.2431 -0.5705 -0.8884 0.0737 -0.1776 1.0564 -0.3046 -0.0895 1.5480 -0.7831 -0.6643 -1.1441 -2.6281 0.9100 0.8388 -0.4529 0.8023 0.0908 0.5939 -0.4275 -0.3429 0.7434 -1.1439 0.7069 0.4349 0.2091 0.2989 0.1779 0.0226 1.0056 0.1119 0.1492 0.3386 1.7884 0.3519 -0.5091 1.1839 0.1566 0.3601 -0.1987 -0.4666 0.2334 -0.8195 -0.2080 -2.4709 -0.6975 0.3016 -0.0534 -0.0033 0.8466 0.1340 -1.3910 -0.6739 -1.4301 -0.2186 0.6430 -0.7029 0.5978 -0.9944 -0.4218 -0.2486 0.7833 -0.8396 1.0299 0.5463 2.1900 -0.3545 -0.0470 0.6312 0.1770 -0.4751 1.1637 0.0825 -1.3992 0.6105 -0.2875 -0.9990 0.1731 1.0674 0.0280 -0.4230 1.4882 0.2169 -3.2265 -0.9425 0.3210 0.9834 -0.3275 0.6118 -0.0728 0.2532 -0.2852 1.7066 -1.8872 0.3433 0.9176 0.4268 -0.5092 0.2608 0.9226 -0.4554 -0.0590 0.0451 -0.3767 1.6084 -0.7492 0.0488 0.6478 0.8813 -0.9709 0.9339 0.0912 -0.6856 -0.3993 -0.7291 -0.2391 1.1852 -1.4018 -1.4882 -0.1365 -0.9319 1.1400 0.8835 1.2250 1.1275 2.1312 -0.4999 1.8167 -0.3846 -0.5628 -0.0093 0.4043 -0.2208 -0.7355 0.6921 0.6641 -0.0236 -0.8241 -0.7932 -0.2929 0.4525 0.5396 2.2544 0.8746 2.1912 -0.2855 1.2865 -0.1657 0.1532 0.0490 0.4762 1.3191 -0.3885 -0.5332 0.1369 -1.9762 -0.5268 -1.2554 -0.9608 0.6929 -0.3475 -1.8109 0.3938 -4.5395 0.2932 -0.3674 -0.3598 -0.6304 -0.5945 -1.0631 -1.1580 0.9758 1.0545 0.0527 1.0682 0.3263 1.1960 1.7882 -0.1177 0.2763 -0.3060 saccharopine 0.4571 0.5291 2.9822 -0.6585 0.3497 3.9653 -0.9646 3.3119 0.6918 3.3485 3.3933 -0.9031 0.0657 1.1322 -0.9770 0.3983 1.6767 0.8390 -0.7078 -0.5344 0.6931 -1.1585 -0.3986 0.0012 -0.7205 -0.7246 -0.9326 -0.6408 -0.5814 0.0962 -0.9482 -0.5933 -0.3627 -1.0224 0.3483 -0.7667 -0.6984 0.4151 0.0409 0.8521 -0.1798 -0.2889 -0.7572 0.7669 -0.5944 -0.9689 0.4179 -0.7301 0.3112 -0.7148 -0.7251 0.9929 0.7776 3.0334 -0.4386 0.4567 0.5199 -0.4296 -0.8024 -0.8606 -0.5957 -0.9195 0.1730 1.2872 -0.7171 -0.9662 -0.7776 0.4398 0.6532 0.2962 0.9132 -0.8822 -0.8114 0.8750 0.4948 0.8616 -0.5966 0.0450 -0.5826 0.4360 -0.8004 -0.6833 -0.7462 -0.9324 3.3408 -0.8735 -0.5958 1.7376 0.5383 -0.4594 0.5475 0.2247 -0.6906 -0.4168 1.2855 0.2370 -0.7273 -0.7001 -0.2488 0.5394 -0.9039 -1.0472 -0.6113 -0.9881 -0.6434 1.2208 3.1364 -0.7986 -1.1222 -0.6421 -0.9530 0.1259 -0.5859 -0.7566 2.0124 -0.7425 -0.5712 0.0631 3.4171 -0.9971 0.2928 0.5770 -0.7938 0.3178 0.6749 -0.8307 -0.8979 -0.8070 -0.8537 0.2338 -0.8924 3.0560 -0.4633 -0.8962 -0.8055 0.5601 -0.7171 -0.4233 0.4109 -0.2944 1.4171 0.6074 -0.0993 1.3519 -0.6232 0.6606 0.2620 -0.8135 -0.6521 -0.6080 -0.5379 0.3738 0.8299 -1.2074 0.0901 -0.5801 0.3756 -0.5649 -0.3818 -0.3352 -0.7176 -1.0014 -0.5957 -0.3723 -0.6818 -0.9446 -0.1888 -0.8555 -0.9097 0.7792 0.3034 -0.7756 -1.0600 0.7351 -0.9299 -0.4747 -0.5445 -0.5588 -0.6928 -0.5297 -0.6942 -1.0413 -0.8125 0.1123 -0.5792 -0.9998 -0.7859 -0.6812 -0.5550 0.1175 0.4861 2.8521 0.1054 0.2166 -0.5825 -0.8530 -0.0623 -1.0161 1.2200 -0.4749 -0.9002 1.2372 -0.6159 -0.7239 -0.8133 -0.4571 -0.8166 -0.0735 -0.7347 0.2750 0.9224 -0.7684 0.3476 -0.8280 -0.3048 0.0136 3.3049 2.0470 -1.0519 -0.0243 -0.8231 0.3709 0.6392 1.2097 -1.1058 0.6586 2.2195 -0.0125 0.7186 0.9205 -0.8211 -0.0381 -0.7179 0.2290 0.6917 -0.9827 -0.8247 -0.6878 -0.9439 0.7540 -0.8257 0.4034 -0.8030 -1.0841 0.1079 1.1099 -0.8218 0.2047 0.2953 -0.8650 -0.8555 0.1908 -0.9442 0.1428 -0.1891 -0.7191 1.3888 -0.8444 -0.7459 -0.9535 0.3302 -0.6377 -0.9642 0.8018 0.2659 -0.4661 0.0543 -0.0297 -0.7267 -0.8930 0.4328 0.9382 0.5470 0.5011 -0.8846 -0.8487 0.5467 -0.8507 -0.9518 -0.5492 0.5525 -0.9548 0.0853 0.8181 0.1673 -0.7477 -0.9018 -0.8016 1.9354 0.0353 0.8737 0.4973 -0.8755 1.2922 0.0787 -0.4822 -0.8826 0.7427 2.1464 -0.9199 -0.7641 -0.9216 0.6054 -0.0342 -0.7949 1.1915 1.8951 -0.5586 0.5254 -0.1477 0.9325 -0.9511 -0.8554 0.4064 0.6395 -0.8218 0.5602 -0.8085 -0.7162 -0.2900 -0.2091 1.7693 -1.2383 -1.0013 -0.8646 -1.1102 0.3797 -0.8008 0.0703 -0.9671 0.1380 -0.7004 1.1705 0.1370 0.6483 0.5603 3.6127 -0.8579 0.2013 0.3585 -0.7879 1.1069 0.7695 -0.9467 0.7647 -0.7263 -0.6437 -0.9534 1.4863 0.4744 -0.5875 -0.2251 0.8751 0.6150 1.2597 0.8145 -1.0252 -0.9213 0.3449 0.6624 0.9856 0.0161 -0.8182 -1.1510 1.2546 -0.9879 0.0201 -0.4462 -1.0231 -1.0406 0.2307 1.3934 -0.7767 -0.7715 -1.1655 3.4702 0.2531 2.1768 -0.9575 0.5665 -0.8113 0.0841 0.6208 0.5175 -1.2136 1.1391 -0.0071 0.7542 0.2567 0.7726 0.3593 0.2702 0.2368 1.1790 -0.9924 0.6174 0.9799 0.6728 -1.1825 0.2448 -0.3429 0.3589 -0.7391 0.9390 -1.0657 2.4665 0.4907 1.8699 0.8303 -1.0997 salicylate -0.4790 -0.8267 -0.4962 -0.1369 2.1615 -0.8624 -0.3478 -0.0455 0.0170 -0.5142 -0.1452 0.3296 -1.2837 -0.1779 0.4455 -0.3971 0.7337 0.4071 0.8720 -0.5217 0.1109 2.1924 1.9655 0.7862 -0.5013 1.0409 0.8896 -0.3512 4.1399 1.1387 0.0879 2.2916 0.8159 0.8146 -0.9033 -0.3368 1.0271 1.3298 0.0080 -0.9138 0.9095 0.7272 -1.7067 -0.1980 0.3336 -1.2236 0.3725 -0.4282 -0.2986 0.1554 1.8403 0.4525 0.5880 0.2809 1.0786 -1.1534 -0.0817 0.4090 0.1451 0.4059 2.4098 -1.1206 -0.9894 0.6780 0.4687 -0.4102 -0.3350 1.8620 -1.6393 -0.0660 -0.4574 -0.0664 -0.9347 1.7390 -0.0111 -0.0890 0.0639 1.8259 -0.0575 -0.6621 1.1365 0.7440 -0.1210 -1.2633 -0.8901 1.9420 -0.7951 -2.3288 -0.7501 -1.0622 -1.0258 0.0741 0.1882 0.8826 0.5402 0.6946 0.5144 1.0138 -0.1559 -0.4182 -0.4459 1.6252 0.7400 2.1336 0.2990 -0.6827 -0.9580 -0.0390 -0.6565 0.6128 -0.1574 -0.7386 -0.5265 -0.0731 -0.8987 -0.5542 2.8301 -0.7897 -0.1285 1.8170 -0.6810 0.7919 -0.2761 -1.1499 -0.7674 0.6741 -0.3956 -0.3867 -0.6925 2.9297 -1.0978 -0.8227 -0.8147 0.1845 0.6858 1.0872 0.1357 -0.5162 -0.3452 0.2577 -0.4736 -0.5485 1.1922 -0.4901 -0.2104 0.1284 0.2613 -0.6153 -0.3989 -0.8908 -0.0481 0.4620 -0.6669 -0.4514 -0.7344 -0.6260 0.5362 0.4981 -0.0005 0.1974 -0.5974 -0.2503 2.8216 -1.1886 0.8176 -0.2326 1.2863 0.0780 1.4316 0.5861 0.7237 -0.2874 -0.9681 0.6827 0.1805 -0.8769 -0.7828 0.8523 -0.1290 7.3585 1.2566 -0.3890 -0.5036 -0.5279 -0.5112 0.4383 0.0280 -0.2192 -0.5343 -0.2760 0.3917 -0.0797 0.0478 0.4544 -1.4396 -0.5596 -0.2816 0.6118 -1.7350 -1.2594 0.4230 -0.0394 0.1863 0.0349 -0.3696 0.7321 -0.7640 0.0559 -0.8283 -0.2159 -1.6664 1.6855 1.4255 -0.0639 2.6055 -1.1342 -1.1990 -0.5620 -0.5806 3.5296 -0.6516 -0.6704 -0.9216 0.6942 0.2922 -0.3473 0.6677 -0.3267 0.3092 1.0684 -0.6848 0.1147 -0.1442 -0.4325 0.0543 1.2475 0.8775 -0.8369 -0.8284 -0.3274 0.7193 -0.2470 0.2288 1.9730 -0.6364 -0.1926 -0.5106 0.6066 0.1004 -0.3744 -0.4612 -0.9786 -0.5418 0.3278 -1.3951 -0.9034 -0.3937 0.2815 -0.1106 -0.2708 2.3225 0.3696 0.1504 -1.0005 -1.1932 0.4104 0.1740 -0.0825 -1.2650 -1.2433 -0.5525 -0.5384 -0.4561 -0.3841 -0.8916 -1.0479 -0.5918 0.8568 -0.0902 -1.5022 -0.9311 0.5414 1.8947 0.2650 -1.4736 -1.9089 0.1216 -1.1204 1.4933 0.3890 -0.5099 1.3933 1.5982 -1.3727 -0.3896 -0.6538 0.4436 0.2075 -0.1897 0.4665 -1.3033 0.5506 0.6091 -0.7971 0.2889 -0.1851 0.5413 0.5562 -0.7447 -0.3803 -0.5888 1.8245 -0.4310 -0.9127 -0.1573 0.8655 2.3244 -0.2129 0.9044 -0.5323 0.7529 -1.0725 -0.2511 -0.9818 -0.4560 -0.7061 -0.8702 -1.2842 -0.0624 -0.4108 0.5028 0.1256 -0.7967 -0.5979 -0.1736 -0.3264 -1.2939 0.2277 -0.1606 -0.1741 0.4016 -0.3675 -0.7628 -0.3381 -0.5317 1.5093 0.8902 -0.1217 -1.0720 2.3479 -1.0581 -0.7114 -0.2934 -0.5348 -0.6920 -0.6940 -0.4672 0.3714 -0.8932 -0.3645 -0.1797 -0.3291 1.1413 1.0034 1.0686 -0.7752 -0.6809 -0.2863 0.4506 -0.9852 -0.5350 -0.3493 -0.1516 -1.5589 0.4244 0.1127 0.9334 -0.8772 3.1570 0.5602 -0.6467 -0.0455 -0.6361 -0.8451 -0.7906 -0.9764 -0.8370 -0.3121 -1.0383 0.1545 -0.2200 -0.3548 -0.5459 -0.8441 0.7296 -1.6270 0.6603 0.0294 -0.6793 -1.2128 0.2072 0.5605 0.3866 0.9642 -1.1930 0.6460 -0.5756 -0.9179 -0.2492 0.0488 S-allylcysteine 0.1149 0.0417 -1.9610 -0.2373 0.8853 0.9659 -0.1017 0.4166 -0.9378 0.0761 -1.8504 0.4500 -0.4259 0.5686 2.3383 -1.1435 -0.7658 0.4681 -1.8955 -0.9905 -0.3744 0.7904 0.0703 -0.7579 1.1845 -0.0482 -0.1430 -0.4798 -0.6895 0.2214 1.3202 0.9478 1.3717 1.1525 -0.5952 0.3889 1.5573 1.0578 0.8750 0.0214 -0.8582 0.5575 0.8702 0.0315 -1.4456 0.6328 -0.7170 0.5869 0.1338 -1.9086 -1.9072 0.0642 0.3536 0.3964 0.9729 0.5829 0.8873 -0.0092 0.5565 0.3530 -0.7132 1.0482 1.7804 0.8431 1.4672 1.0657 1.5567 0.2596 0.2737 -0.5753 -0.4916 -0.1225 1.5947 0.1334 -0.0898 0.2621 0.9739 -0.0331 1.1708 0.6073 1.1340 0.2730 -0.2527 -1.1913 -1.1672 0.4463 0.0032 -0.6589 0.8971 -1.1496 0.1348 0.9426 -0.4715 -0.3426 0.1310 2.2492 -1.9151 -0.4355 0.6661 1.4306 -0.2278 1.4589 0.9778 -0.4100 0.1778 -0.1926 0.6579 0.9937 0.4240 0.9761 0.2099 0.6332 1.0076 -1.9350 -0.6406 -1.9186 0.0224 -1.1129 0.2557 0.7841 -1.8506 -1.8989 0.7006 -0.4134 -0.4416 0.8628 -1.4625 2.5085 1.1228 0.1581 -1.0083 0.7372 0.3114 0.6553 0.5697 1.4973 -0.8316 0.7052 0.4671 1.2134 0.0408 -0.4996 0.8266 0.7580 -0.7281 1.8751 -0.3762 0.2804 0.8513 1.6408 -1.7921 0.8365 -1.0270 0.3598 -1.2783 -0.1242 0.0113 0.0575 -2.0019 -0.6326 -0.5355 -1.3221 1.2261 -0.5493 -1.6311 -0.9492 0.2931 1.1702 1.5489 -1.9203 -0.0540 -1.9430 0.4600 1.0050 0.9877 0.9927 0.7308 0.1162 -0.3924 -0.6454 0.9683 -0.6541 -1.9653 -1.9523 -1.0865 0.3949 -1.9515 0.8738 0.5692 0.9490 0.7584 0.8962 1.2708 0.5245 -1.0722 -1.1683 -0.2338 0.8923 -0.5328 -1.7483 0.8704 -0.5339 1.6031 0.3092 -0.9567 0.0555 0.1541 0.4107 0.5854 0.7024 -1.9036 0.8127 0.0003 1.1900 0.5642 -0.6560 -0.3035 1.6052 -2.1173 0.9359 -1.0130 -0.6770 -1.2296 0.5160 0.1240 1.5950 0.0261 0.1596 -1.3652 -1.4270 0.5013 0.5236 1.1393 0.9597 1.4547 -2.0707 0.5275 0.9896 1.6064 -0.7476 -1.7515 -0.8028 -1.9578 0.4845 0.4776 0.3509 -0.6260 -0.1765 1.4225 -0.2074 -0.9146 -0.8980 1.9173 0.0802 -1.9940 -1.9035 0.5030 -1.7687 -1.9269 1.2676 -0.0272 -1.8495 0.0262 0.5310 -0.9596 0.0694 0.6067 -0.5721 -0.0680 0.2968 -0.4747 1.9104 0.6021 -1.7468 -0.0189 0.9826 -1.4223 0.6264 0.3808 0.6234 0.0466 1.5765 -0.9131 1.6113 0.0859 0.8065 -0.3571 -1.9511 -0.3346 1.4918 -0.3354 -0.6417 0.3807 0.2391 0.4345 -2.1678 0.0606 1.0374 0.0866 0.5917 -1.9425 0.7123 -0.0083 -2.0463 -0.1928 -1.1081 0.4282 0.6859 -2.0517 -2.0947 -0.4658 -0.9916 1.0142 -0.9081 -1.4138 -1.9759 -0.1667 -1.9621 0.6580 0.1961 -0.2859 0.0642 0.9904 -0.3777 1.3810 0.5286 -1.9700 -0.7328 0.1159 0.2990 0.3438 -0.1424 1.2405 0.1055 1.1404 0.0342 -1.3047 -0.0990 0.3488 -1.8522 0.2612 0.0444 -2.0737 -0.1477 1.0069 0.4024 -1.6115 -0.8425 0.7744 -0.0517 0.5478 0.6006 0.7172 1.2802 -2.0223 0.4495 0.3730 0.4462 -1.3378 -0.1313 -0.0211 -0.4128 0.9902 0.1871 1.1137 0.7565 -0.2205 0.5955 1.0679 0.6409 0.5245 0.8900 -1.0076 1.2471 -0.0848 0.5068 -1.0344 0.7492 0.2838 1.3487 0.0089 -0.4298 -0.2719 1.0175 -0.2360 -2.2136 -0.3928 -1.1353 -0.0411 -0.2495 -0.8119 0.3221 -0.3772 0.8639 -0.1801 -1.3296 0.2558 -0.1485 -1.2085 0.2784 0.6617 0.1973 0.8124 -0.0039 0.0866 -0.4157 0.4590 -0.0354 -0.1499 -0.9937 sarcosine -0.9373 1.1140 0.9067 0.9460 0.6226 -1.2808 1.5336 1.0108 0.7618 -0.9077 -1.1282 0.3047 -1.1436 0.9366 0.3469 0.3322 -1.3650 -1.1277 0.7371 -0.9987 -1.0030 0.8375 0.3777 0.8262 -1.1440 1.3694 -1.3143 1.1943 0.7014 0.9280 -1.3263 -0.3318 0.9551 0.9994 0.5559 1.0787 -1.1303 0.9911 -1.0872 0.2898 0.7911 -0.7685 1.7781 0.3880 -1.0312 0.7636 0.7422 0.3533 -1.1550 1.5969 0.7121 0.4779 -1.1186 -0.0241 0.5957 -1.3034 1.2546 -0.8668 0.4074 -1.3057 -1.0103 -1.3338 0.8448 0.8421 -0.2858 -1.3135 -1.1639 0.7048 -0.5249 0.0340 0.8259 -1.2604 0.4213 -1.3855 -1.1565 -1.3196 -0.6740 -1.1684 1.3265 0.5575 -0.3957 0.7577 1.2150 -1.3405 1.4478 0.8207 0.0440 -1.1141 -1.3267 1.1844 -1.4926 0.7542 -1.1306 -0.8396 0.3605 0.5835 0.0244 -1.1552 -1.0849 1.0396 -1.3229 1.4277 1.5511 -0.7501 -1.1034 1.0327 -1.2514 1.2806 1.7656 -1.0662 -1.3482 -1.2943 -0.1712 -1.2036 0.2774 1.1005 -0.9842 0.7123 -0.0315 1.1969 0.7709 -1.1536 -1.1764 0.9167 0.9882 0.0939 -1.2856 1.0899 -0.2800 0.3834 -1.3179 0.4922 -0.9350 0.6125 1.1194 0.9449 -1.1384 0.1569 -0.0062 -0.7745 -1.0341 0.8850 -1.1087 0.7935 1.4183 0.6901 0.8222 -1.2191 1.2200 -1.0138 0.2613 -1.0076 0.1897 -1.6124 -0.7090 -1.0133 1.1745 -0.9882 0.0415 -0.7483 1.1621 1.0190 0.9791 -0.3103 -1.1572 -1.3270 1.0822 0.7064 -1.3602 -1.1460 0.2254 0.8224 0.6989 0.9564 0.7917 0.5589 1.8988 0.1982 0.6625 -0.9398 1.2421 0.9287 0.2134 0.2316 0.6936 0.8946 -1.2206 -1.1368 -1.0113 -1.0743 0.0068 1.0342 0.5334 0.1152 -1.0028 0.1154 -1.1300 0.8474 -1.1791 -0.0426 -1.2765 0.9668 1.1760 0.6904 -0.3060 -0.8807 -0.4298 1.0719 -1.1731 -1.1111 0.5575 1.0049 0.5458 -1.2297 0.9118 0.2230 0.6637 1.1669 -1.4493 -1.3397 -1.2608 1.0143 -1.0316 1.0298 -0.4316 1.4064 -1.3802 1.3155 0.2891 0.8777 0.0945 0.8861 0.8663 0.1751 1.0155 0.8174 0.8090 0.3769 1.0545 0.1623 0.5741 0.0100 0.0229 2.1979 -1.2827 -1.2218 0.6081 0.6809 0.8685 -1.2943 0.6642 -1.3381 0.4885 0.7780 -1.2561 0.1620 -1.2592 0.9594 -1.1878 0.3260 -1.2556 0.8853 0.0006 1.1875 -1.2836 0.1694 0.7064 -1.3683 -1.1751 0.4002 -1.3226 0.1862 -1.3730 0.6117 1.0012 0.2097 -1.2339 -1.2498 -1.3967 1.0427 0.9325 -0.1421 0.9268 0.8706 -1.4945 0.9874 -1.2948 0.7287 0.8332 0.6026 -1.3964 1.6627 1.0246 0.8113 -1.1815 0.8483 0.1623 -1.5305 1.4512 1.1961 0.6994 -1.3024 0.2276 -1.3620 -1.1886 0.6910 -1.3289 -0.9684 -1.3868 0.9281 -1.1613 0.5162 1.6286 -0.4902 0.3839 -1.2605 -0.2434 0.3375 0.6183 0.4141 -1.1729 0.5357 -1.6561 -0.4847 -1.2426 -1.4928 -1.2143 0.1515 -1.2533 -1.3390 0.2720 -1.1214 1.6222 0.8922 0.5197 -0.0691 0.9785 -1.3110 0.9106 1.1249 -1.1947 0.4781 0.4758 0.6527 -1.4223 0.0908 1.3864 0.5037 -1.3073 -1.3887 -0.1159 3.1636 -1.3108 -1.5176 0.1782 0.6287 0.4361 -1.2896 -1.5731 -1.4590 -1.3558 -1.3295 -1.2171 0.4237 0.9964 0.2844 0.7499 0.4419 0.3703 0.3811 -1.1053 0.0172 -1.2131 0.7138 -1.5406 1.1301 0.1637 0.8988 0.7411 0.9329 -0.0838 0.3761 0.8871 0.5308 0.4912 -0.0905 -1.5775 0.1856 0.9995 0.5166 -1.0303 0.2150 2.8076 0.6654 1.0651 -0.2143 0.6459 -1.2707 0.0624 0.6066 -1.5367 1.3190 0.9923 1.2896 -0.3591 0.8268 -1.2528 0.4386 -1.2746 0.3852 S-carboxymethyl-L-cysteine 1.1733 0.4551 -0.4685 -1.4051 1.0420 -1.6097 0.4339 0.0621 -1.5771 0.4251 1.2446 -1.6822 1.2373 -1.5732 0.7536 0.9314 0.2865 0.0319 0.0805 -1.2672 0.7633 1.6499 1.2680 1.3636 1.5079 -0.2481 0.5966 0.3421 0.6454 -1.5159 0.9248 0.9531 0.8336 -1.8154 -0.3626 1.2716 0.0749 1.5806 1.3692 0.6212 0.5683 1.9767 -0.2291 0.2979 0.6905 0.4521 0.8205 0.9743 0.4010 -1.4702 0.9130 0.7349 1.0548 -1.6183 0.6364 0.9362 -1.5231 -1.1481 0.5938 0.5069 -1.3347 0.6552 -1.6721 -1.3951 0.8341 0.9543 -0.1507 -0.2474 1.0705 0.4599 0.8298 1.4583 0.6966 0.6970 -0.0149 -0.0178 0.7841 -1.4951 0.5896 0.2986 0.8120 -0.3372 0.3221 0.8291 0.3249 0.6865 -1.3359 0.5795 0.4461 1.5248 0.2186 -1.4334 0.9483 1.1991 0.6174 1.1784 0.9337 0.4761 0.6744 0.9229 0.8748 -1.8418 1.0984 0.3379 0.4408 0.0077 1.0015 1.2388 0.5450 1.1103 -0.6851 0.9498 -1.3243 0.2442 -0.0682 -1.5002 0.8673 0.4211 0.5354 0.0805 -1.3702 -0.4888 0.9114 -1.5898 -1.7748 -1.6004 0.6196 1.5680 0.9625 0.3229 0.5119 -1.3634 -1.1873 0.7662 0.2793 0.5394 0.6059 0.7231 0.7146 1.5002 -1.2742 0.6857 -1.4488 0.0476 0.8891 0.4181 0.6684 -1.5799 0.5189 0.9495 0.5288 1.5816 0.9757 0.0894 0.6640 0.4877 0.7015 0.7484 0.4706 0.1947 0.3297 -1.7902 -1.3351 0.9419 -1.4338 0.7405 0.5413 -1.6271 -1.6899 0.8071 0.0880 1.3774 -1.8575 -1.2806 -1.7125 0.7440 -1.2776 1.0767 0.7940 -1.2601 -1.4452 -1.8358 -1.5792 0.6485 0.2273 0.8679 -1.5497 0.3048 1.1731 0.7534 0.3079 0.9448 0.3279 0.7359 -0.2455 0.1811 0.1440 -0.3957 0.6430 1.0868 -0.3835 1.0483 -1.3579 -0.2919 0.3240 0.7329 0.7795 1.1512 0.9305 0.7232 0.0844 0.4323 0.9928 0.5933 -1.7282 0.7705 0.8899 0.5947 0.3653 0.0186 0.4823 0.5456 -1.3116 -0.1202 -1.9085 0.1122 -1.7243 0.0281 0.6223 -1.4978 0.1072 0.1816 -1.4723 0.7128 0.5338 0.7791 0.5375 0.9748 -1.7258 0.4107 0.0634 -1.7861 0.0806 -0.1997 -1.6724 0.2644 -1.5899 -1.7705 -1.7490 0.1013 0.2936 0.7310 -1.7268 0.9348 0.7068 0.3363 0.5213 0.4304 -1.5049 0.6600 -1.6502 1.1518 -1.7494 -0.1298 0.8050 -1.1895 -0.2221 -1.7823 0.9790 -1.6701 0.1311 0.1253 0.7074 -0.5201 -1.6596 0.7138 1.1469 -1.6217 0.1307 0.8251 0.6270 0.3396 -0.2213 0.5991 -1.8627 -0.0574 -1.6791 0.4469 -1.7224 0.1115 0.5921 0.5552 -1.6497 0.3368 0.1893 -1.9398 -1.6586 -2.0059 -1.8330 0.3292 0.2523 -0.2744 0.6002 -1.7150 0.3107 -1.8297 0.0576 0.7842 0.2447 0.5193 -1.4928 0.1908 -0.4077 -1.7284 0.3515 -0.1867 0.5770 0.0589 0.9050 -1.6893 1.1405 -1.3434 2.0982 -1.7909 -1.6366 0.4068 -1.5993 -0.7870 -0.4534 0.4339 1.4724 0.2592 1.0749 -1.3484 -1.6069 0.7931 0.9595 -0.4009 0.1053 0.1496 0.7519 -0.2394 0.2823 0.2711 0.3219 0.6168 -1.3891 1.2518 -1.6724 0.1329 0.7207 -0.9172 -0.4702 -0.7606 -0.2825 -1.8647 0.0158 0.7980 0.1453 0.3048 0.4191 0.9921 0.1738 -0.1415 0.1545 -1.7753 0.7359 -0.0074 0.6512 -0.0335 -0.5405 0.0411 0.2417 0.0170 0.7449 1.2787 -2.0276 0.1224 -0.4908 -1.7039 -1.5789 0.2907 -1.9694 0.7408 0.1873 0.0561 0.6326 -1.6579 1.2775 0.3187 1.1376 0.1267 0.3534 0.3449 -1.7821 0.2258 -0.0524 0.5645 1.2743 0.0892 -0.9312 -1.6965 -0.5887 -0.2863 0.6666 0.2175 -1.6262 0.1635 -0.0507 -0.1775 sebacate (C10-DC) 1.2529 0.6980 0.9661 0.8969 -4.9136 1.5830 -0.7928 1.3133 1.0661 1.4951 1.5891 0.7894 -0.5587 0.9981 -0.2911 0.4608 0.9971 -0.1224 0.4526 0.2836 -0.3513 -1.2916 -0.2381 -0.5146 -0.8164 -0.3178 0.0956 -5.3272 0.4759 1.1380 0.1543 -0.2789 -1.2384 -0.7124 -0.0933 1.8202 0.1918 0.8221 0.4733 -0.9544 0.3608 -0.0704 -0.3668 -0.6947 -0.8766 -0.8153 0.1355 0.2994 -0.0272 1.2261 0.2705 0.5649 0.5470 1.1264 0.5502 -0.2641 0.0114 -1.0460 0.8348 0.0194 -0.5134 0.2014 0.4900 1.8214 -0.4158 -0.9765 0.3676 -0.7365 -0.6375 1.0877 0.2408 0.1225 0.9055 0.3583 -0.0525 -0.0006 -1.3123 -2.0727 0.3518 -0.2676 -1.0071 1.6226 1.2447 -0.1020 0.0336 -0.1142 0.5762 -0.3708 -0.2918 0.2032 -0.4617 0.5597 -0.3162 -0.5364 0.9574 0.0954 -0.8806 1.1583 -0.7636 0.2847 0.9696 0.3478 0.4752 -0.6860 -0.7912 -0.0279 1.4626 -0.2665 1.1234 0.7882 1.1284 0.5882 -0.4295 1.4273 0.6147 1.1874 -0.4667 -0.2265 1.2210 -0.6574 0.9918 0.0562 -0.3276 0.2559 0.4663 0.4416 -1.0788 -0.3686 -0.5347 -0.1942 0.3943 0.0073 -0.6200 0.2421 0.1680 -0.9666 -0.2939 0.2772 -0.5686 0.6107 1.2606 0.0376 -1.1031 0.3215 0.6547 0.5389 -0.6003 0.6515 -0.5264 -2.2657 -0.4341 -1.5889 -0.9336 -0.9839 0.3810 0.2250 0.4381 -0.3442 0.2292 -0.4877 1.2077 0.2823 0.0498 0.7346 1.5806 -0.2119 0.5695 0.1613 0.6362 0.6958 -0.3507 1.5141 -0.2549 1.7635 0.9475 -1.3262 -0.6517 1.1493 -0.2277 -0.4489 -0.3206 -0.1099 0.2694 -0.0062 -0.3001 0.7237 0.9585 -0.0888 1.4217 0.2796 0.7628 1.5964 0.1187 -0.0964 -0.5648 0.8773 1.4978 -0.8055 -0.3857 -0.5877 -0.2473 0.4224 0.4561 -1.2780 -0.4805 -5.1064 -0.8562 -0.2578 0.9973 -0.0546 -0.0506 -1.2785 0.3830 -1.1947 -1.2111 -0.2530 1.0063 0.6636 0.0119 0.8594 0.5219 0.3571 -0.3236 1.8889 -0.2718 -0.7287 1.0786 0.1820 -0.3356 -0.6480 0.2232 -0.6835 -1.0788 -0.3277 -0.6230 0.1251 0.6049 0.1435 -0.4472 -0.5387 1.0360 -0.6680 1.0374 -0.8546 -0.5766 1.4219 0.1517 1.2827 0.8191 0.0534 0.8480 0.1567 0.6562 -0.0161 0.0153 -0.3761 0.5437 -0.3621 -0.4592 0.9250 -0.1683 0.2126 0.5317 0.7107 -0.1974 -1.4730 0.0008 0.6131 0.2568 -0.7137 1.0172 -0.4627 -0.1125 -0.8555 -0.0315 1.0976 -1.2671 -1.0417 0.8357 -0.9281 -1.2120 0.4250 -0.9542 -0.8589 -0.8835 -0.8998 -0.4798 -0.7703 0.1541 -0.2166 -0.1124 -0.1525 0.6904 1.4044 1.3351 0.1505 0.6520 -2.5860 -0.5933 -0.0172 1.3932 0.2608 -0.9644 0.2270 -0.4114 -1.1530 0.5108 -0.5104 -0.0262 0.1873 0.2180 -0.3599 0.2760 -0.2960 -1.1835 0.8122 -0.5150 0.5218 -0.8728 0.1963 -0.6554 1.0238 -1.2619 -1.4831 0.3939 0.1185 -0.7716 0.5149 0.1696 -0.7505 -0.3369 -1.0313 -1.2751 1.5020 -1.2718 0.1630 1.8174 -0.2533 -0.0676 1.9040 -0.0118 -0.7203 0.2230 -0.2787 0.1559 1.1042 0.8551 -1.1426 -0.9994 -0.2279 -0.8842 -4.8167 1.7718 -0.0960 0.6826 -0.1933 0.4049 -0.6596 0.2431 0.6221 1.3210 -0.2233 -0.9873 -0.0452 -5.0337 0.0677 -0.7858 -0.3078 0.9148 1.2799 1.1675 0.3001 -0.2130 1.0223 -0.3565 1.7043 0.5030 0.4164 1.7375 -0.0239 1.6373 -0.0947 -0.6869 0.8441 -0.9104 -0.8205 -0.7829 -0.2802 0.5098 -0.9865 -1.0409 -0.1192 -4.6711 -0.5020 0.6837 0.0026 0.3208 -0.2557 -0.5540 -1.2248 0.4185 0.8767 1.7188 0.1718 0.4600 0.2953 -0.2007 -1.4656 1.2928 0.6206 sedoheptulose 1.5128 -0.4379 0.9598 1.0048 -2.0993 1.3069 -0.8527 1.0112 1.1876 0.9062 1.5593 -0.8964 -2.4934 0.7863 -0.2430 -0.5047 1.0149 0.1746 -0.8154 0.6167 0.4497 -2.8978 0.7778 -0.3489 -0.0003 -0.2982 0.6798 1.7409 0.8357 0.5311 -0.5473 0.7832 -0.5981 -0.4609 0.1556 1.0489 0.1948 0.5076 -0.3801 -0.3081 0.6193 -2.1280 -0.3067 -0.5710 -2.3884 1.2716 -0.2753 0.4765 -1.1861 -0.1705 0.9416 1.1973 -0.4058 0.9791 -0.4897 -0.3593 0.4480 -1.0561 -0.1541 0.6724 -0.5117 0.8809 -0.7738 1.8115 -2.4748 -2.6772 1.2328 -0.9252 -0.2287 0.6336 0.5663 0.5742 -0.0315 0.9825 -2.5157 -0.0453 0.3292 -2.5209 -0.0715 0.3034 -1.0203 0.5049 0.9749 0.0356 0.2349 1.0976 0.4155 0.6370 -0.7364 0.2499 -0.1520 0.5730 -0.6945 0.7586 0.8181 0.8442 0.5359 1.6492 0.1785 0.2944 -0.1190 1.0575 -0.9152 0.3454 -0.1855 0.1283 1.1616 -0.6548 0.3441 1.2667 1.9945 1.4214 -1.2924 0.2538 -0.0784 -0.2420 -0.6820 -0.8589 0.3258 -1.3919 -0.1066 0.1496 -0.9547 -0.2629 -0.2616 1.3673 0.0693 0.0248 -0.4127 0.6160 1.2557 -0.0372 1.0319 0.0759 0.3691 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1.7312 -2.6534 0.6508 -0.2274 -0.3458 -0.0118 0.7349 -0.5948 -1.6308 0.1286 2.5794 0.9017 0.8650 -1.4211 0.5090 0.8447 -1.0889 -0.7839 -1.8347 serotonin 0.4343 -0.1930 0.4490 0.3878 0.9232 0.7625 0.9245 -0.1155 0.4764 -0.6469 0.6907 -1.2316 -0.9335 -0.6252 -0.2442 0.8723 -0.7082 0.6381 -0.3160 0.2692 0.5074 1.0613 0.3385 0.4436 0.7180 0.3592 -0.3466 0.5500 1.0503 -0.1485 1.5277 0.7276 0.3496 0.4721 1.4437 -0.5254 0.9287 0.8909 1.3501 -0.2534 0.7741 0.8102 1.0180 -0.2017 0.3650 0.8076 0.8355 1.0685 -0.2429 0.1988 0.3791 -0.8438 -1.6313 0.4789 0.5912 -2.8244 0.0989 -0.1572 1.1963 0.7080 0.8485 0.5351 -0.4501 0.5417 0.1662 0.6274 1.0138 0.5086 -0.4151 -0.1120 0.3988 -1.8748 -0.8534 -0.0555 1.0685 0.2122 1.0696 1.0235 1.0056 0.1784 -0.2872 0.2887 0.4812 -1.2076 -0.2703 -0.0004 0.6637 1.1108 0.4532 -0.5915 -0.2471 -0.8821 1.0467 0.2223 -0.0104 1.0855 1.1727 0.5827 0.7351 -1.3940 -0.4287 -0.0411 1.7146 -0.7215 0.1307 -0.5845 -1.7080 -0.4689 -0.3118 1.2122 -0.4338 0.0247 0.8244 0.4610 -0.7885 1.5798 0.2529 0.6821 -2.3286 0.2475 -0.1499 -0.1573 0.3218 -0.8190 -0.7651 1.5549 0.3515 -3.3037 0.4719 -1.3202 -0.9282 -0.1269 0.5460 0.6675 0.2477 -1.2276 -0.1010 0.5110 0.2074 1.4921 0.1233 -0.3696 0.7567 0.1142 -0.0641 -3.0621 0.5713 -1.2204 0.7074 0.6612 0.2413 1.0705 0.7486 0.3977 0.9269 -0.0381 0.0395 -0.0679 0.5609 0.5614 -0.3601 0.6240 0.4167 0.4678 0.8978 -0.5107 0.4571 -0.4745 -0.1996 0.6696 1.6811 -0.2904 -0.0368 -0.7256 -0.3636 0.2953 0.4267 0.7212 0.0070 0.9297 0.3301 -0.5719 -0.0048 0.2628 0.9750 -0.4430 0.3174 0.1254 0.2884 -0.2226 -0.1148 -0.9280 0.0345 -2.1919 0.4031 0.5635 -0.1318 -0.4712 0.3465 -1.4526 0.1759 0.0640 0.2858 0.2284 0.3095 0.4565 -0.0712 1.5615 -0.4490 0.3851 -3.4465 0.5016 -0.3995 1.2058 1.0836 0.2726 -1.3919 -0.4153 0.0113 0.5291 0.3718 0.6880 -2.0558 -1.1301 0.0909 -0.3047 0.4211 -0.2108 0.4876 0.8528 1.4622 0.5242 1.2090 -0.2231 0.0982 1.3743 1.1790 0.7674 0.2437 0.5393 -0.4548 0.4932 -1.0244 0.8571 0.5197 -0.1038 0.6339 -1.1174 -0.6046 0.9286 1.3079 0.2579 -0.6540 0.1103 0.6450 -0.1691 0.2104 2.1212 -2.6153 -1.1163 0.6460 0.7888 -0.4200 -0.6734 0.4204 1.4106 0.6659 -0.3768 -0.8746 0.9061 -0.3647 -0.8230 0.6035 0.3348 1.2183 0.9598 0.5437 -3.2331 -0.8005 -1.9339 0.5881 -0.4373 0.8022 0.1870 0.5767 0.6614 0.9612 1.3336 -0.0796 -0.9439 0.2681 0.1993 -0.0720 0.5846 -0.7040 -0.3714 -1.1016 -0.0393 -1.8261 -4.6808 0.3900 0.4208 0.2363 -0.2488 -0.2016 0.5921 -0.2471 0.8838 0.5973 0.1578 -0.0906 0.1975 -0.3612 0.2670 0.2078 0.5388 -0.1384 0.1508 0.5302 0.4532 1.0087 -0.6310 -0.6030 0.3401 0.8693 -0.5836 0.0966 0.4443 0.5959 0.1468 0.9101 0.9333 0.4234 0.4306 0.8693 -3.3389 0.3873 -0.0723 -4.5954 0.2724 -0.1766 0.0117 0.1356 -0.1875 -0.2615 -0.4877 0.1565 1.2527 0.6100 -0.4136 0.4845 -2.0538 -0.7331 -0.0306 -0.1446 0.2011 -1.2450 1.0262 -0.5644 -0.4059 -0.7531 -0.7852 0.1627 -6.8497 -0.1476 -0.7545 -0.3357 -0.2511 -1.2002 -0.8667 0.2863 -0.6177 -0.0647 -0.1849 -1.0259 -2.4195 -0.2426 -0.2506 -0.1955 1.1730 -0.2289 -1.3086 -0.1807 0.5589 0.2191 0.0049 -0.0642 -1.4527 -1.1808 -0.4458 1.7575 -0.3270 -4.5509 0.4306 -1.2664 0.1044 -1.9256 -0.0916 -0.0835 1.3603 -0.9270 -0.1167 0.1246 0.3794 -0.5962 -0.5352 -0.5297 -0.8833 -0.3577 -0.6590 S-methylcysteine 0.3918 -0.4000 -0.7456 -0.0094 -0.8303 -0.4205 0.2446 1.4632 -1.0573 -0.2142 -0.3815 -0.6082 -0.2638 -0.0249 0.4878 1.5481 -0.5874 -0.1953 -0.4626 -0.2977 0.0974 0.2008 0.4277 0.2844 -0.0136 -0.3614 -0.0881 0.2202 -0.1930 -0.8497 2.1292 0.7644 0.4922 0.7374 0.3110 -0.3971 0.4298 1.0354 1.5685 -0.6973 1.1266 -0.1788 0.0769 0.5682 1.6510 -0.6446 -0.4982 -1.0591 1.0482 -0.2806 -1.4279 -0.6799 -1.0779 -0.6726 -0.2865 -0.4258 -1.1930 -0.4224 1.6896 -0.1194 -0.3035 -0.8772 -0.2903 -0.3777 -1.0805 -0.7375 2.9336 0.7348 -0.9247 0.1168 -0.8337 0.1547 1.3385 -0.5323 1.8719 0.6029 -0.3113 1.2771 -0.4300 0.4061 -0.9388 -0.9480 -1.0070 1.5753 -0.3581 -0.4211 0.1355 -0.2648 0.3004 -0.2449 -0.6973 0.6138 -0.3478 -0.6034 0.3063 -0.2899 -0.4926 -0.6404 -0.9877 -0.6284 0.3930 -0.4845 -0.0049 0.1759 -1.0555 1.0319 1.1396 -0.9505 -0.7798 1.4857 -0.0857 0.3737 -0.2157 -1.0132 0.1250 -0.4494 -0.2915 0.7532 0.0378 -0.8527 -0.3566 1.0683 0.4633 -1.3234 -0.5800 -0.5828 -0.9043 3.3265 -0.0677 2.4777 -0.4854 0.0558 -0.6804 0.1312 1.1496 0.7090 0.3253 0.8689 -0.5752 0.0793 1.9689 -0.1984 -0.7870 -0.9416 1.2769 -0.0405 -0.2601 -0.2763 0.7701 -0.7465 0.0109 -0.0812 -0.3783 0.6821 -0.7122 1.5221 0.5083 -0.2330 -0.2403 -0.3165 -0.5692 -0.9227 0.7567 -0.1157 2.1503 -0.4451 -0.7633 0.5605 2.9382 -0.7181 1.9711 -2.5190 -0.6384 0.2778 -1.0378 0.2992 0.5623 -0.5041 -0.3390 0.0652 0.6195 -0.1542 0.1633 -0.7455 -0.7496 -0.1862 -0.7531 0.5129 0.3850 -0.0745 -0.9813 -0.6608 0.2214 0.3187 0.1349 -0.8165 0.7708 -0.5488 2.8662 -0.4489 0.9608 -0.8742 0.6442 0.1577 -0.6068 0.3569 -0.4842 0.3736 -0.4058 -0.4013 0.0483 0.6128 -0.5440 0.2238 -1.1738 -1.6599 1.1918 -0.7805 1.0289 -1.0354 0.4710 0.5198 2.4458 -1.2966 -0.6382 2.6085 0.3808 -1.0774 -0.7352 -0.3054 -0.7795 -0.4564 3.6930 -0.4014 -0.3343 -0.1323 1.4065 -0.4991 -0.3507 0.5771 -0.6110 1.3217 -1.1654 2.8376 -0.9744 -0.2701 0.7826 -1.1826 1.0644 1.8736 0.5349 -0.5226 0.2137 1.0399 -0.1288 -1.0776 -0.0321 -0.5323 -0.4432 0.3787 -0.3131 0.3058 -0.3572 0.0926 -0.8709 1.8097 -0.9807 -1.6678 3.3732 -0.0578 -1.0681 -0.1569 2.7329 -0.5219 1.9123 -0.0463 0.6887 0.6601 -0.4483 0.8889 -0.8254 -0.6995 0.9688 1.5625 -1.2478 0.2761 0.3420 -1.0049 2.1073 -0.7736 0.2542 -1.9589 -0.9090 1.7289 1.8577 -1.6748 -0.8814 0.7204 -0.5421 0.0915 -0.8855 -1.4135 0.8310 0.3558 -0.3742 -1.4306 1.8841 -0.4700 0.8961 2.0369 0.6515 -0.9294 1.2383 -0.6110 -0.5636 -0.8789 -0.8392 -0.8669 -1.1952 1.6319 -0.5497 0.8556 1.5515 0.9655 -1.0918 -0.6902 -0.5651 -0.4835 -0.2462 -0.3461 0.9379 -0.3268 3.9125 0.5021 0.0800 -0.6530 -1.8832 -0.4553 0.8149 1.2448 -0.7353 -1.3508 -0.8765 1.0244 3.5907 -0.4876 0.3926 -0.0516 -1.0925 0.6979 0.6053 -0.3775 -0.3141 -1.0270 -2.1018 -0.0890 0.7345 -0.1466 1.4181 -0.2550 1.2346 -1.1378 0.0237 0.3760 -0.2795 0.8878 0.9876 -0.0507 -0.6690 -0.2928 0.0609 -0.1315 -1.1910 -0.6293 -0.5937 -0.6758 -0.7852 -0.4809 -1.0467 0.9475 1.3778 -1.4274 -1.3947 -0.6640 -0.7334 0.6942 -1.3106 -1.4410 0.0432 -1.2751 -0.7680 0.1062 0.0186 -0.8406 -0.5694 -0.2304 0.2834 -0.5833 -0.7093 0.3379 -0.8735 -0.0956 1.1708 -1.2790 -0.9725 -1.2832 -0.9349 -0.1541 0.4691 -1.4872 S-methylcysteine sulfoxide -0.7194 -0.5675 -0.9619 -0.1636 0.1084 -0.3635 2.7596 2.5734 -1.2506 -0.7169 -1.3447 -0.7325 -0.7116 -1.5499 0.8720 0.9691 -0.3786 0.4553 -0.8540 0.2830 -0.0787 0.4407 -0.7240 1.5985 0.0373 -0.4570 0.8300 0.7486 0.1571 -0.3360 2.4387 0.1409 0.1658 0.2283 1.2631 -0.8438 0.5358 0.2883 0.8908 0.0666 2.8051 -0.4846 0.0759 1.3828 0.5041 -0.3740 -1.1274 -1.0155 0.8430 0.3261 -1.0780 -1.8494 -0.6898 -0.6717 -0.3352 -0.5476 -0.6469 -0.6894 1.4076 0.2697 -0.4681 -1.0493 -0.6861 -1.3441 -1.0422 -0.4711 1.1444 0.3877 -0.5005 0.7941 -0.7425 0.4937 0.5116 0.0176 0.3765 -0.8401 -0.3206 2.9446 -0.2449 0.0855 0.1392 -1.4305 -0.4469 0.4086 -0.4165 0.7179 0.4272 -0.6672 0.0646 0.3109 -0.9244 1.0757 -0.5863 -0.8417 0.6101 -0.6039 -0.7649 -1.0593 -1.2481 -0.8508 1.2739 1.1823 0.8927 0.0054 -1.1062 0.1021 -0.4960 -0.7037 -1.3702 -0.1241 -0.0227 1.0094 1.4171 -0.4865 -0.2559 -1.1348 -0.6753 0.6966 -1.1343 -1.1561 -0.8162 1.5043 0.1391 -1.2157 1.9272 -0.9862 -1.6248 1.4379 -0.6787 0.7395 -0.4757 -1.3659 -0.0154 0.3570 1.3850 2.9881 -0.3593 1.2588 -0.3743 0.1087 0.2937 0.5057 -1.0199 0.1337 1.0664 -0.0779 -0.7280 -0.0564 0.1338 -0.4038 -0.7023 0.1100 -0.1413 -0.3067 -0.8169 1.2174 0.3086 -0.9744 -0.8253 0.3581 -0.9841 -1.2367 0.4935 -0.4283 0.7926 -0.2329 -0.7408 1.9625 1.5030 0.3266 2.7478 -1.1440 -0.2353 -0.1271 -0.5834 -0.3209 -0.8505 -0.5942 0.4602 0.0923 0.0765 -0.5744 1.1243 -0.7162 -0.2825 -0.4447 -1.3938 0.2011 -0.1735 -0.4585 -0.6137 -1.3381 -0.0930 0.7890 -0.1327 -0.3215 0.3033 1.1908 1.9070 -0.5385 2.1436 -0.3098 -0.1921 0.0585 -0.5191 0.6174 -0.4646 0.3052 -1.5165 -0.2480 0.6251 -0.3208 0.2870 0.0465 -1.5294 -0.0536 0.5786 -0.6897 1.4156 -1.2464 0.2836 1.4065 0.8327 -0.5598 -0.8164 1.9847 0.5179 -0.9683 -0.5586 0.3112 -0.3283 -0.5877 3.0789 -0.4852 0.7757 -0.2149 0.5599 -0.8168 -0.8974 0.4170 -1.1367 0.6911 -1.0713 3.8416 -0.5565 -1.4505 0.3238 -0.1643 0.4648 0.8974 -0.3186 -0.1495 0.2021 0.5206 -0.1660 -1.2782 -0.8562 -0.1117 -0.0961 0.3713 -0.7531 -0.0774 0.1578 2.4367 -0.8614 1.8944 -1.1886 -2.0660 1.5563 0.5044 -1.1560 3.0684 1.4034 -0.7801 1.0912 -0.0424 0.7160 2.0314 -0.4156 0.6352 -0.7020 0.5931 0.4434 0.4304 -1.4459 0.0023 0.6451 -0.5959 0.1153 0.7040 0.1249 -1.1563 -0.9456 0.6992 0.7898 -1.2976 -0.9598 1.6950 0.7304 0.3305 -1.2356 -0.8784 1.4908 1.3835 -0.6100 -0.8818 0.3856 -1.7161 -0.1323 2.2322 0.4083 -1.4507 1.3703 -1.0013 0.3953 -0.3188 -0.3773 -0.7543 -1.0795 0.5797 -1.1505 0.4683 1.0454 1.2715 -0.6340 -0.3699 1.1375 -0.3337 0.3406 0.0095 -0.3945 -1.1906 2.3900 -0.0843 0.4980 1.3424 -1.6640 -0.3680 1.9246 -0.4148 -1.0729 -0.3365 -0.2854 0.9628 0.9087 -0.2733 0.4958 -0.1922 -0.9625 1.6752 0.7081 -0.9248 -0.2205 -0.9798 -1.8262 -0.1152 2.3161 0.0890 0.5650 0.2404 3.8577 -0.5568 0.6883 2.2645 -0.0709 0.0181 -0.4601 0.4667 0.0606 -0.3113 -0.4479 -0.7880 -0.6955 -0.4649 0.1334 -1.5874 -0.2381 -0.3194 -0.8296 0.3516 1.3330 -0.9480 -0.3168 -0.7398 -1.5826 0.3267 -0.1678 -1.1749 0.7884 -1.1556 -1.4635 0.1860 -0.6711 -1.1622 -0.1123 0.5201 1.3646 -0.8562 -0.8964 0.2719 -1.1321 -0.4294 0.9147 -0.9356 -1.3280 -0.7810 -0.4068 0.0501 0.6314 -0.3311 spermidine 1.6928 0.1950 0.7182 1.3640 -0.4554 2.1349 0.0722 1.9282 0.6709 1.4607 2.5791 -0.4057 0.2810 1.6598 -0.2705 0.4221 1.5505 1.2529 0.1724 0.8312 -1.3860 0.1168 0.2831 -0.5030 0.6887 0.5224 0.5937 0.1968 0.1502 -1.5631 0.0859 0.6632 -1.1661 0.3722 1.2492 2.5733 -1.5020 -1.3062 -0.4717 -0.3366 0.0514 -0.0616 0.4595 0.4091 0.9268 -0.2517 0.1261 -0.5484 0.0359 0.7336 -0.5683 0.3358 0.3535 0.4143 -0.3827 -0.6794 0.7505 -0.1232 0.3359 -1.6668 -0.5504 -1.7211 0.3173 2.0089 -1.5152 -0.2786 2.5406 0.8918 0.1056 -1.3767 -1.5631 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-0.9692 1.8271 -1.2453 0.3525 -0.9148 -1.9696 1.2172 -0.8553 -1.6433 1.7832 0.5080 -1.4833 0.4652 0.9352 0.1666 0.2678 1.2088 0.2394 1.1217 1.1405 1.4441 0.3547 -1.8287 0.3463 1.1717 -0.4558 -0.9603 0.7975 0.5233 1.5538 1.4766 -0.7727 -2.1118 0.4730 0.4192 -0.6255 -2.4998 1.8943 1.1207 0.2848 -1.2216 -0.1634 -0.1960 -0.3396 -1.0429 0.7749 -0.7138 -0.1196 -1.0305 -0.3653 -0.1611 0.5945 -0.2753 -1.5066 0.0961 0.3293 1.6739 0.2550 1.8160 -1.2197 0.3026 -1.0514 0.3879 0.1493 0.4279 -0.1559 1.5247 -0.2854 -0.2526 0.0962 1.4010 -0.7592 0.1311 -0.0917 0.1836 0.2667 -0.8008 -0.9810 1.0495 -1.8344 1.2815 -0.1088 -2.1330 -1.3100 0.0053 0.2784 -0.9429 1.6566 0.4995 0.5497 -0.3200 -0.7029 -0.3060 -0.4599 -1.4885 -0.9493 -0.1209 2.0836 -1.3032 0.2403 -1.0675 -0.1982 -1.3368 -1.1676 -1.3616 -0.2874 0.6059 -2.0129 1.5825 -1.3458 -1.6514 0.1159 0.8972 0.2231 1.6979 0.1869 -1.8568 -0.1131 0.5529 0.6870 0.1351 -1.6600 0.8581 0.4382 0.6446 0.0738 1.7726 0.2230 -0.1584 -0.4723 0.9816 0.2736 1.1697 0.7344 -0.4891 -0.1437 0.0175 -0.2934 0.7553 -0.7387 -0.8589 1.1465 stearate (18:0) -0.8859 -0.0057 0.7091 1.6694 0.8114 1.6843 0.8331 -0.0020 0.3322 -0.1988 0.3728 -0.6661 1.5988 -1.3990 -1.4155 -0.9107 -0.0709 1.2156 -0.6971 0.0199 -0.9530 0.1309 -0.3759 -0.5041 0.2776 -0.6730 -0.3223 0.8134 -0.8197 -1.4016 -0.7515 -1.0895 -0.3563 2.5457 2.8592 0.0079 -1.2073 -1.3030 -1.1395 -0.2143 -1.2958 -1.5714 -0.5338 0.6796 1.1379 0.8074 0.1425 -0.4548 -0.9888 -0.4727 -0.8902 -0.2602 -1.7446 1.3247 -0.8208 0.3490 -1.1193 2.6339 -0.3491 1.4384 -0.4636 0.1008 -1.0907 -0.8781 -0.0781 0.9315 -0.1966 1.6135 -0.0382 -1.4660 1.5162 -0.8740 -0.5673 -1.5461 1.0456 0.3166 -1.4992 -2.2424 0.9070 -0.7390 1.0690 0.5993 0.3135 1.5519 -1.0999 -1.1399 -0.8731 0.9691 0.3572 -1.0044 0.8775 -0.7101 -1.0689 0.1069 -1.3738 -1.3185 0.7540 0.0969 -0.8211 1.8427 -1.5981 0.7380 -0.5474 -0.2522 -0.6895 -2.0162 0.2300 0.8513 1.6068 -1.2218 0.1020 -0.8735 -1.1852 2.4343 0.9316 -0.1905 0.4029 -0.3007 -0.1770 1.4680 -0.7166 0.9458 -0.7170 0.2565 0.3824 -0.3155 1.7760 -0.6474 0.8375 0.7436 -0.1659 -0.7352 -1.2279 -0.7788 -0.9320 -0.0655 0.5776 -0.7332 1.0133 -1.5560 0.8230 -0.0069 1.0798 -0.7110 0.1494 -1.6701 1.9510 0.9392 0.1894 0.2005 -0.1258 -0.1467 1.0349 -0.4732 0.7984 -0.1127 1.5797 0.5954 -1.0527 0.3057 -1.2390 1.2237 -0.4880 0.8134 -0.0880 1.2959 -1.0126 -0.8680 -0.0299 -0.0637 1.3554 -0.1087 0.4897 -2.1114 -1.1749 1.2138 1.7347 -2.4040 0.2210 -1.0948 0.2936 0.1919 -0.0184 -0.9787 -1.6240 0.5475 -1.8370 0.6743 -1.2527 -1.6363 1.0431 -0.2968 0.8415 -0.3143 0.4024 0.4227 0.8105 0.8030 1.7842 1.4017 -0.9073 -0.7381 -1.0502 -0.2024 0.5564 2.0399 0.7828 -0.6172 -0.4839 -0.6483 -1.0901 -0.4493 1.2492 -1.0399 1.6874 -0.2827 0.7925 0.2865 1.4840 0.2890 0.4327 1.8750 -0.7442 -0.2847 -0.3808 0.9828 -0.0604 0.4385 -1.2265 0.3403 0.3820 -1.1707 1.3330 0.5183 0.9062 -0.2657 -0.9143 0.7562 0.4377 -0.0651 0.7772 -0.1734 0.2497 -0.3857 0.0216 -1.3322 0.1094 -0.8855 -0.1449 -0.0900 1.5906 0.7506 -1.2117 0.6055 0.8625 -1.4827 -0.7670 0.9351 1.2093 -0.3916 1.1763 -0.5926 0.1179 0.4054 1.2827 1.3298 0.2666 0.6643 -0.7964 -0.2651 -0.4822 -1.2531 -0.6899 -0.4714 0.4976 -0.3376 2.7011 -0.3368 -0.5090 0.8373 -0.7339 -1.6292 0.9086 0.5244 1.1447 -0.8887 -0.5760 1.0867 -0.1086 -0.7974 -0.1462 0.5930 -1.7013 0.0930 0.3229 1.2419 -0.3569 1.5704 -0.3427 0.1917 -0.9170 -0.1552 1.0802 0.9438 -0.9554 -1.5419 -0.4199 -0.2027 0.9310 -0.2306 1.6871 -0.1420 0.6451 -0.5890 1.4176 -0.1775 -0.3448 -1.2298 -1.2514 -0.6869 0.3343 0.4391 1.4473 0.8178 0.6119 1.9696 0.5789 0.4946 -0.0960 0.5522 -0.2530 -0.1437 0.1323 0.0441 -0.7146 -0.4392 -1.0430 -0.9249 -0.9327 -1.6213 1.0551 1.2186 -0.7996 -1.4557 -0.0374 -0.7211 0.1237 -0.2959 1.3991 -2.3390 0.3073 -0.0400 -0.6225 0.0568 0.0121 -1.1990 0.8899 0.4783 0.4748 -0.6520 -0.8979 -1.8002 1.1147 0.8340 0.5006 -0.1873 -0.4187 0.4623 1.1900 -2.2920 0.0022 -0.5485 0.4488 0.3661 -0.3661 1.3327 0.2905 -1.5516 -1.8661 0.1527 1.4595 -2.4071 -0.2198 1.6185 1.2668 -0.5077 0.3403 0.6853 -0.4856 1.1864 1.2795 -0.3683 1.3601 -0.8498 -1.0355 1.1778 -2.0088 -0.0540 -1.5054 -1.0522 0.3333 0.2838 -1.1497 -0.5255 2.3122 1.7449 1.8120 -0.2606 0.3171 0.0466 stearidonate (18:4n3) 0.6045 0.7265 1.1851 1.6656 1.1900 1.2358 1.7041 0.7838 0.8652 -1.4974 1.2518 1.3105 1.1918 -0.4339 -0.9566 -1.9034 0.4755 0.7233 -0.1602 1.3624 0.5516 0.5793 -1.4753 -1.7896 0.2224 -1.8035 0.2451 0.4294 0.0309 -0.3064 -0.0528 -0.1192 -0.7267 0.3670 1.8215 0.8869 1.0230 0.0673 -1.7211 -0.1552 0.4695 0.5073 -1.0907 0.3871 1.3412 -0.1744 -0.0272 -0.8218 0.0950 1.5316 -0.4976 0.4286 0.9857 1.6341 -1.5189 0.2139 -0.6653 1.5815 0.3632 1.3499 0.2785 0.8380 -1.1320 0.0042 -0.6950 -0.8469 1.1455 0.0923 -0.3548 -1.6437 0.8823 0.1848 -1.8941 -0.0286 0.4547 -0.0461 -0.5463 -1.2364 -1.6493 -1.1964 1.0941 0.3644 -1.8286 1.1856 0.7423 -0.1055 -1.6752 0.3401 -0.1200 0.0061 0.7315 0.4967 -1.7731 0.0642 1.4202 -0.9869 0.6853 0.5270 0.1332 1.0559 0.2031 1.1667 -0.1921 -1.2132 -0.0118 0.3971 0.3697 -0.4277 0.8601 -1.2455 -2.0327 -0.1715 -0.7530 0.8570 0.7337 0.6761 -0.2493 -1.1700 -0.1348 1.2976 -0.4540 1.4504 -1.8555 2.8767 0.4186 1.4017 -0.1255 -1.8898 0.0903 -0.1605 0.4833 -1.7177 0.5618 -1.9709 0.6421 0.4986 0.7485 1.0761 0.0636 -1.3674 1.0363 -1.8944 -0.4436 -1.8663 -1.7183 0.4835 1.3029 -0.2112 -0.2532 -0.0220 0.2938 0.3700 -0.2774 -0.6274 0.1838 0.8037 1.3956 -0.1217 0.0486 0.7794 -1.7881 -0.5785 -1.6645 1.3180 1.3161 -0.0036 0.0713 -1.5685 0.3549 0.3501 0.1175 1.1868 -0.3858 -1.6370 1.9081 0.8848 0.7425 0.8619 0.2956 -1.5854 -1.7569 -0.3223 -0.0344 0.0667 -0.8331 0.0522 -1.8728 0.3984 0.5283 -0.4939 1.8257 0.5764 -1.7327 0.5930 -1.0383 0.6011 0.8730 0.5444 1.0493 0.2740 -0.4388 -1.6238 -0.2636 -1.1988 -1.8715 0.1841 0.8755 -1.1337 0.4050 -1.0916 -1.7934 -0.9335 -2.0811 -1.3935 0.5180 -0.6549 0.6530 0.2807 -0.0465 0.7014 0.7279 0.0777 0.5580 -2.1089 -0.0763 1.2292 1.8325 0.2848 -0.2191 0.9875 -0.2915 -1.7055 -0.1408 -0.2038 0.8724 0.2327 0.1673 0.8483 -0.7123 0.1169 0.3660 0.1986 0.2545 0.3972 -0.1678 -0.2043 -0.1112 -2.0668 -0.4879 -0.7752 0.7743 1.4203 -1.0324 0.4077 -1.9366 0.3459 0.1739 0.7228 0.2319 -0.3608 -0.7843 -0.6747 2.8167 0.0085 0.1902 1.3660 0.5440 -2.0663 -0.3647 -0.5835 -0.5984 -1.7683 -0.3357 -0.6918 -0.2360 -1.9235 1.4163 0.9241 0.9158 0.1720 -0.9404 0.0124 -0.4679 -2.0125 0.6360 -0.6092 0.5130 0.1052 0.8451 -0.4459 -0.7946 0.3489 -1.1204 1.0613 0.8942 -0.1121 1.7465 -0.9438 0.3299 1.5965 -1.8614 -0.4804 0.0035 -0.5564 -1.8622 -0.8775 -0.2754 0.4895 0.0415 -0.1687 0.8658 -0.6978 0.4605 -0.5620 -0.4120 0.8666 1.4272 0.1692 -0.5025 -0.7166 -0.4933 0.7929 0.5909 -0.8979 -1.9292 1.0676 -1.8960 0.2237 0.1474 -0.5536 0.0110 -1.7742 1.8684 0.6241 -0.5856 -0.1880 0.3565 0.8894 -0.5153 1.0238 -0.0261 0.8695 0.2576 0.9058 0.5977 -1.8143 -1.7142 -0.8374 0.3423 -0.6783 0.1808 0.5100 0.6307 0.4021 0.6164 -0.2536 1.1727 -0.4640 1.5040 0.7547 0.6365 0.2529 -0.8665 1.4036 -0.3010 -2.0563 1.5194 -1.1501 -0.1752 0.5402 0.4462 -0.5448 0.8605 1.1318 -0.6787 1.9159 0.1005 -0.0948 -2.0602 -0.2592 0.6038 -1.5072 -0.9147 0.1669 -0.4336 0.6177 1.5774 1.1591 0.7898 1.1528 0.2224 -1.8400 1.2281 -0.3573 0.4594 1.4197 0.8852 -0.9437 -1.8642 -1.9821 -0.0673 0.5865 1.2728 0.0670 -0.1952 0.4703 0.9250 0.1194 -0.0262 1.0823 stearoyl-arachidonoyl-glycerol (18:0/20:4) [1]* 1.0465 -0.0710 1.5246 1.1692 -1.5446 3.0458 -0.0391 0.7562 1.3536 2.7579 1.8382 0.6282 0.1525 0.2520 -1.2530 -0.8879 1.4379 0.0017 1.5606 1.6577 0.2690 -0.1881 2.0200 0.6701 0.2147 0.9777 -1.6653 0.4622 2.6619 0.7594 -0.6091 0.7898 -1.4619 0.3191 0.1600 -0.8279 0.5510 0.2395 -1.1093 0.4067 2.2437 -0.0909 0.2710 -1.2127 0.9985 -0.2709 0.3364 0.1891 0.6581 -1.8233 0.9749 0.7420 -0.4989 0.0432 -0.2442 0.8675 0.1087 0.1953 -0.2223 0.3398 -0.4049 0.8804 0.3093 2.5120 0.3933 -0.1033 -0.2430 -1.9166 -0.2008 -0.0494 1.3184 0.1129 1.2560 -0.6437 -3.1670 -0.1542 -0.5656 -0.4320 -1.0203 -1.0633 -0.7800 1.4692 0.0995 -0.1014 1.2839 0.7575 0.7352 -0.3552 -1.1440 0.5869 -0.8592 1.3751 -0.1260 -0.1005 1.6824 -0.4031 1.4852 1.0439 0.5523 -0.5360 0.9915 0.2034 -0.5211 -0.8088 0.7453 1.2205 1.1535 -0.7476 -0.4248 -0.5831 1.4003 0.1302 -0.6741 -0.3784 -0.9052 -0.2322 -0.5357 -0.7590 -0.8904 0.9163 0.5313 0.1925 0.0786 -0.1235 -1.0564 1.8143 -0.2669 0.1751 -0.8391 -0.8247 0.9716 0.7841 1.5746 1.0733 -0.0493 -0.7105 -0.3542 -1.2148 -0.6861 -1.4273 1.4261 -0.4782 0.0665 0.1768 1.2756 -0.8792 0.1547 -0.1628 -0.3809 0.4095 -0.6178 0.0741 -0.0661 -0.5078 0.0395 0.4229 1.2166 1.3744 0.9951 0.2390 1.7124 -1.2408 0.0916 -0.1219 0.1018 -0.3915 0.7798 -0.3795 0.2822 0.4457 -0.1574 0.4893 0.0719 1.4322 -0.7210 1.1856 -0.3063 0.6455 -0.7287 0.0005 0.1788 -0.6755 1.1500 -0.6176 -0.3550 0.4426 0.6602 0.2582 1.1694 0.1481 -0.1860 -0.4566 1.0696 0.7920 0.2290 0.2499 -0.1164 0.0360 0.1090 1.1244 -1.4337 0.1066 1.0315 -0.3612 -0.2035 0.3748 -0.6233 1.5368 0.3722 -0.6075 1.5404 -2.1239 -0.6043 -1.0828 -1.2030 0.8753 -0.1427 0.2113 -0.2177 0.6127 0.6835 -0.7568 0.1352 -0.8554 -0.1149 -2.4258 0.5744 -0.1014 -0.1220 0.2332 -0.3756 0.6676 0.0346 -0.6808 -0.5118 0.1534 0.8258 -0.3213 0.1417 -0.7553 0.9543 -0.1443 -0.4004 -2.9163 -0.5999 0.5656 -0.9758 -0.3415 0.3344 0.8107 -1.0856 0.9159 -0.8720 0.4478 -0.6572 -1.0211 0.0882 -0.4829 0.1170 0.0886 1.0728 -0.5281 -1.8388 -1.1167 0.2179 1.0432 -0.9177 0.4527 -0.4110 1.1471 -0.9698 -1.5162 0.3319 -2.2653 0.1046 -0.5085 0.7774 -0.5516 0.5510 0.8724 -0.4629 -0.4838 0.6580 -1.0288 -0.6786 0.8065 -0.1611 0.6390 -0.8761 -1.9794 -0.9105 -0.1804 -2.2975 -2.8576 -0.0518 -0.3002 -0.5669 -2.1184 -0.0011 -0.0565 2.2527 -0.7056 -0.1839 1.1168 0.4856 -0.4584 -0.2927 -1.9710 -0.1938 -0.3587 -0.3425 -0.9170 -2.2987 0.1202 -0.4210 0.2719 0.1391 0.2398 -0.8294 0.2579 -1.1752 1.2860 -0.5694 -0.6478 0.9431 -0.0729 -0.6292 1.1280 -0.7508 -1.5082 -0.6879 -1.1475 0.3506 0.6478 -0.9685 0.4150 0.3252 -0.0315 -0.0589 0.0651 -0.2311 0.3134 0.7053 -0.5011 -0.3232 -0.8821 -1.2196 -0.5026 -0.4641 -0.8979 -1.0878 -0.3541 0.6505 -0.2097 1.1024 -0.3174 -0.4000 -0.7201 1.2980 -0.2147 -0.2808 0.3063 -0.8012 -0.9415 -0.7500 -0.2005 -0.5727 -0.9488 1.2181 1.3409 1.2119 -1.1931 0.2141 2.6244 -0.2138 3.9698 -0.1611 1.0557 1.4908 -0.9195 -0.7563 -1.2753 -1.3428 -0.0051 -0.4427 -0.2100 -0.4834 0.6806 -1.9502 -0.6826 1.1675 0.1384 -3.5631 -0.2630 -1.2873 0.1640 -1.7007 -1.7374 -0.1572 0.3149 2.4859 3.1521 2.7580 0.4152 -0.0148 -1.3998 -0.5137 -1.1295 0.2894 0.7414 stearoyl-arachidonoyl-glycerol (18:0/20:4) [2]* 0.5121 0.0555 1.4989 1.0476 -1.2284 1.9350 -0.0774 0.9189 1.0179 1.7287 1.2843 0.7018 0.1318 0.7909 -0.4928 -0.3683 1.1237 0.0254 0.4720 1.0410 0.0557 0.1171 0.8813 0.4221 -0.0649 0.6271 -0.2983 0.5063 1.8740 0.5623 -0.4819 0.4876 -1.3379 0.4533 0.0489 0.0649 0.7093 -0.0098 -0.1261 0.4075 -3.2310 -0.5999 -3.6153 -0.1832 0.5947 0.1083 -1.9385 0.4731 0.0842 -1.6111 0.8191 0.7089 -0.1128 0.5280 -0.1030 1.2133 -0.1403 -0.1860 0.0932 0.6013 0.6210 0.7843 0.0827 1.6823 0.6413 -0.3042 0.5351 -0.7730 0.2266 0.4095 0.6073 -3.7817 0.7235 0.2784 -3.6018 0.3544 0.0801 -0.7490 -0.3328 0.0036 -0.4733 1.2266 0.1975 0.3184 0.9075 0.7139 0.5668 0.2052 -0.4214 0.4068 -0.3680 0.8026 0.2449 0.2915 1.1097 0.1483 -3.5875 0.9519 0.1949 -3.7687 0.9687 0.2685 -1.4420 -0.4481 0.4546 0.8758 0.7965 -0.4052 -0.2545 0.1909 1.1231 0.2185 -0.5097 0.1545 0.3487 0.5199 -0.2358 -0.7401 -0.2350 0.6564 0.2608 1.0431 -3.6486 0.2563 -0.4649 1.1650 -0.5371 0.2661 -0.1432 -0.1819 0.7939 0.9468 1.2880 0.9072 0.4731 -0.1569 -0.3013 -0.1812 -0.4650 -2.9458 1.0146 -0.4435 -0.0815 0.7056 0.4986 -0.7993 0.6704 0.0536 -0.1423 0.2785 -0.0026 -2.8316 -0.8051 -0.1398 0.5138 0.4305 0.7201 1.2403 0.6008 0.2100 1.0089 -0.3739 0.2130 -0.6214 0.2191 -0.2337 0.5533 0.3483 0.1780 0.4790 -0.2438 0.3774 0.3953 1.0817 -0.0314 0.6780 -0.0042 0.0852 -0.0422 0.1374 0.0454 -0.8275 -0.0245 -0.1264 -0.9876 0.3951 0.6221 0.0411 1.3450 0.3202 0.0974 0.0463 0.7666 1.1604 0.2744 0.4472 0.3149 -0.2093 0.1284 0.2606 -0.3877 0.3565 0.8154 -0.6037 0.5284 0.1245 -3.6978 -0.1784 0.8003 -0.6593 1.2306 -0.8806 -0.7902 -0.2929 -0.5535 0.8995 0.3778 0.3786 0.3197 0.5924 0.6103 -0.0084 0.0764 -0.0489 0.2052 -1.4455 0.9126 0.0699 0.0313 -3.6038 -0.3697 0.8473 -0.0449 -0.6348 -0.0297 0.5943 0.7382 0.2022 0.0602 -0.1533 0.8522 0.6275 0.3029 -1.5465 0.3368 0.6391 -1.0199 -0.2728 0.3107 0.9013 -0.4839 1.0438 -0.1430 0.5510 -0.1141 0.1386 -0.2988 -0.6827 0.2732 -0.1847 0.8559 -0.0231 -0.2551 -0.0971 0.5706 0.3817 -0.4402 0.2818 0.1471 0.8109 -0.3343 -1.2192 -0.4237 -0.8069 0.4493 -0.4228 0.6034 -0.3931 0.7500 0.4984 -0.1127 0.3315 0.2222 -1.1458 -0.1560 0.8793 0.0538 0.3812 -0.0318 -0.8603 0.2241 0.3039 -1.6516 -1.0831 0.3143 -0.1049 0.3674 -1.2952 -0.4509 0.2331 1.2865 0.2517 0.2268 0.8392 0.2853 -0.2244 0.3017 -3.3050 0.1110 0.1650 0.0086 -0.2741 -1.0890 0.0267 0.0220 0.2374 0.1001 0.5313 -1.1898 0.4160 -0.7333 1.1729 0.3819 -0.0622 0.0961 0.0229 -0.3705 0.1762 0.2322 -0.1654 0.2063 -2.2476 0.2898 0.3727 -3.7328 -0.0991 0.5122 -0.1587 -0.4190 0.7218 0.5817 0.0940 0.1554 -3.9117 0.1403 -0.6559 -0.1380 -0.4217 -0.1021 -0.0689 -0.6064 -2.8013 0.8121 0.3046 1.3977 0.0346 -0.1526 -0.0189 1.2245 0.2455 -0.3546 -0.4726 -0.4938 -0.4848 -0.3165 -0.2064 -0.2810 -0.9366 0.9833 0.4366 1.1148 -3.8352 0.3538 1.6847 -0.0608 2.2683 0.1624 1.0909 1.4254 -0.4241 -0.2668 -0.5636 -0.6198 0.0166 -4.2830 0.2664 -0.0593 0.5070 -1.4742 -0.2782 0.4685 -0.1588 -3.0972 0.2631 -2.0404 0.1036 -0.6422 -0.5497 0.0611 0.4161 2.1270 2.0763 1.9701 0.3746 -0.0027 -0.5051 0.2371 -1.0967 0.3303 0.4181 stearoylcarnitine (C18) 0.1731 -1.3642 0.4910 0.5802 0.2317 0.3222 0.9103 0.0078 0.0940 1.3018 1.8176 0.1309 1.0535 -1.5590 -0.2428 -0.7238 -0.2269 0.4059 1.7340 0.0610 0.9240 -2.0191 1.6540 -1.2134 1.1346 0.9680 -0.0553 1.5093 0.2258 0.4467 -0.1552 0.2791 0.4831 2.1024 -0.1510 3.0141 0.9185 -0.7468 -1.3811 0.1381 -0.0712 0.3822 1.8664 -0.5256 1.4086 0.8199 0.1416 0.8159 -0.4388 0.4068 -0.4026 -0.0409 -1.2697 0.9463 0.2830 2.1599 0.5765 0.8070 -0.2306 0.7155 0.8937 0.0262 -1.0476 -1.6378 -0.1117 -0.1722 -1.0855 0.3938 0.4229 0.7089 0.1025 0.6753 1.6561 -0.1975 -1.3192 -0.7056 0.3097 -0.8126 0.2085 0.1222 -0.1803 0.9445 0.1168 0.4245 0.6162 0.0526 0.1737 0.7977 0.5092 0.8551 0.1096 -0.2769 -1.3844 0.0353 1.1378 0.4590 0.6504 0.6291 0.2909 1.3299 1.5049 0.1174 0.1357 -0.1699 1.1549 0.0036 1.4040 0.4317 -0.6048 -1.7813 -0.2244 -1.0584 0.2770 1.9427 0.6457 0.0111 -0.6865 1.0235 3.3644 1.5601 1.4326 0.4199 1.0476 -2.4593 -1.1558 1.0168 2.2455 1.1333 0.8115 -0.9228 1.1178 1.3262 -0.0573 0.0760 -1.9235 -0.6796 -0.3040 -0.4014 0.6194 0.1314 1.2766 0.4906 0.6185 -0.0354 1.1988 -0.9673 -0.8479 1.1065 1.2892 0.1324 0.4320 -0.0269 2.0202 -0.0950 -0.5100 -0.5240 0.5970 2.2471 -0.2944 -0.9214 0.0451 0.5473 -0.0957 1.0126 -0.1119 0.9835 -1.4233 -0.7124 -0.7191 -0.5628 -0.8837 0.0205 1.3396 -0.4390 -0.8177 1.6404 0.7935 0.3136 1.4651 0.4197 -0.3280 0.3241 1.0891 -1.3462 0.5029 1.2371 0.1334 1.4298 -0.2444 -2.3575 -0.7823 3.0092 0.4869 1.4332 0.4463 -0.5029 0.2520 0.7560 -0.8118 0.1201 0.3467 -0.1525 -0.1528 0.2917 0.9516 2.1128 1.2990 1.0865 -0.1319 -0.8599 0.8349 -1.2433 1.3668 -0.8340 -0.8269 1.4519 2.0183 -0.0247 0.5551 -0.7020 0.0142 -0.0360 -0.4506 -1.5108 0.2840 -1.0440 -0.5333 -0.1907 -1.1179 -1.3969 1.0519 0.0098 0.1187 -0.2276 -0.0972 -0.3950 -1.6218 -0.4340 -0.3836 0.2782 0.1946 -0.2240 2.4013 1.5082 -0.4292 0.1121 0.4603 -0.3993 0.4709 0.4705 -1.3572 -1.7867 0.7804 1.7875 0.1050 -0.4016 -0.6307 -0.5824 1.0493 -0.4133 0.0242 -0.3833 -2.4896 -0.2093 -0.4574 0.3172 -1.2696 -0.2480 1.3529 0.0609 -0.2171 -0.7742 0.6919 -0.6672 -0.9845 -0.3204 -0.0895 -1.6766 -0.4032 0.3277 -0.2458 -0.9661 0.8022 -1.4113 -0.1215 0.3156 -1.8534 -1.3023 -0.0217 -2.3109 -0.4282 -0.7106 -0.4832 -1.7762 -1.4287 -0.0770 0.3306 -1.2372 -0.8370 -0.2591 -0.1305 -0.3195 0.7322 1.8065 0.5888 -1.3135 0.5549 0.7114 0.6936 1.2189 0.8749 -1.3547 -0.8669 0.6579 0.8058 -1.2377 -0.0038 -1.2495 -0.2151 -0.4272 0.2578 0.6977 -1.2136 -1.2502 -0.3143 0.6574 0.7472 -1.3038 -1.3404 -0.0514 0.6984 0.7460 -1.0501 -1.0048 -0.0745 -0.8380 -0.2186 -1.9447 -0.9479 -0.7265 1.6295 -1.1441 0.1556 -2.9034 -0.1782 0.2402 -1.0720 0.1568 -1.4860 -1.2018 -0.2311 -0.0537 -1.7500 -0.0804 -0.2369 0.3500 -0.1710 -0.2228 -0.4462 -1.1170 -1.8482 -1.5083 0.4134 -2.5126 -0.1019 0.3496 -1.0345 -1.1428 1.1346 -1.6977 0.4901 -1.2298 -0.0619 0.2402 -0.5751 1.4331 -1.0105 0.0566 -0.1411 1.0985 -0.2161 -1.2707 -1.0781 0.0068 1.6216 -1.3215 -1.0881 -0.2796 -1.4300 -0.6768 -0.6428 0.7542 1.3929 -1.5220 -1.1338 -1.1856 -1.4827 -0.3351 -0.1009 -1.0398 0.5795 -0.8539 -0.9000 -0.2384 1.7611 1.1599 -0.1758 -1.0303 -1.3425 0.3237 stearoylcholine* -0.1595 0.1340 -0.3096 0.4053 0.5065 -1.9913 0.1100 -0.6760 0.2059 -2.0149 -2.8711 0.9039 1.1804 -0.6815 -2.2490 0.1037 -1.4530 0.3149 1.4786 1.1617 -0.4204 0.3173 1.8530 1.4280 -0.2233 0.3128 1.1416 -0.4384 1.2235 -0.5005 1.3566 1.3776 -0.2660 -0.1958 0.3072 -2.2297 1.8111 0.9864 -0.1005 1.6524 1.2097 0.5026 0.1736 0.6480 0.9694 -0.1117 0.1350 -0.2202 1.4975 -0.2789 0.7501 0.7145 -0.6361 -3.0541 0.8070 -0.2521 0.7926 0.8951 -0.4004 1.1825 1.6022 0.3782 -0.5531 -1.1297 0.9437 0.4764 0.1550 -0.2775 1.1039 0.3374 0.4444 0.7056 0.7061 0.4509 -1.3160 -0.4762 1.2716 1.1655 0.4736 -0.3912 0.3651 -0.3542 -0.7304 0.4151 0.3529 0.5844 0.8194 -1.7311 0.6173 0.6139 0.6696 0.3098 0.5772 0.8185 0.2558 0.2849 1.3165 0.8969 -0.0115 -0.1063 0.0122 0.0418 0.9826 -0.1094 0.7661 1.3452 -2.2661 0.2827 -0.3444 -0.2341 -0.1580 -1.0684 0.3640 0.3704 -1.6142 0.5712 -0.0230 1.0532 -1.5032 0.8547 1.5907 -0.9745 0.6222 -0.1608 -1.0970 -0.3943 1.2237 0.0708 0.6150 0.0455 0.6772 0.0185 0.0701 0.6521 0.0648 0.0795 -0.1606 -1.0096 -0.7954 0.7096 -0.8748 -0.1983 -0.3835 -0.3990 0.4703 0.2150 -0.5335 -1.2107 0.1982 1.2627 0.9074 0.6735 0.3343 -2.5669 -0.4529 1.9527 -0.8104 0.5446 0.7198 1.2752 0.2811 -0.4349 0.0003 0.7395 1.2376 0.3306 0.7532 -0.4323 0.0566 -0.7927 0.1125 1.1801 0.0368 0.7005 0.4443 0.9485 -0.1554 0.4652 -0.7242 0.5835 0.7203 -1.2437 1.3580 0.2854 0.5374 0.1778 0.5941 1.0234 0.4102 0.2333 0.8107 -3.0219 1.9955 0.7501 0.1362 0.7427 -0.0999 -0.3175 0.5992 0.4744 0.3790 1.1414 -0.1761 -0.7241 -0.6614 0.3580 -0.8797 0.4365 0.4420 0.2813 0.5066 -2.1355 -0.0228 -0.2376 -0.1167 0.9205 -2.3915 -0.0716 1.0549 -0.1282 0.8872 -0.1680 0.2715 -0.0821 0.0646 -1.9646 0.2852 -0.2402 0.6081 -1.1621 0.9137 1.1719 0.3010 0.1768 -2.5950 -0.6513 -0.3853 -1.1026 0.6364 0.4889 0.1645 -1.8598 -0.1389 -0.3934 -0.9527 0.0647 -0.2345 -1.3216 -0.3854 0.2887 -0.4293 0.5079 -0.4610 1.1758 -0.2647 -0.0227 0.3812 -1.0300 -0.4315 0.3816 -1.0701 0.2273 -1.3387 -0.7014 0.2458 0.5855 0.3712 0.0073 1.0787 1.1288 -0.3316 -0.1332 0.5525 -0.6193 -0.3054 -1.0295 1.2223 0.0714 0.2646 0.4670 0.6450 0.8366 0.7383 -1.4241 -0.3625 1.3987 -0.7835 1.0359 -1.4253 0.4908 0.1852 1.9804 -0.4899 -0.5808 -0.5513 0.0675 -0.8497 -1.7618 -1.6848 0.7610 0.1036 -1.1927 1.4227 0.0605 1.0032 0.5132 -0.6782 -0.0243 1.0488 -1.1179 0.4394 -0.5221 -1.0741 1.7984 1.2816 1.4243 0.7228 0.8316 -0.3024 -0.7493 -1.5097 -1.4550 0.0676 0.1145 0.4761 -0.5788 -1.5465 -1.4385 -1.0113 -0.7314 0.4109 0.0323 -0.0041 -0.3625 0.6467 1.0305 -3.7897 -0.7027 0.7835 0.0311 0.0573 1.0378 -0.9125 0.1371 0.4514 -1.2971 0.1119 0.2004 0.3757 0.5967 -0.6444 -5.2550 -3.0109 -0.8403 -1.9706 1.3571 0.6391 0.9261 1.1631 -0.5028 -0.3182 -0.0967 0.5547 -0.7124 -0.4075 -1.9381 1.0337 -0.5834 0.9557 0.7858 -0.5669 -1.0185 -0.2921 -0.4050 -0.6033 -0.2190 0.9307 0.3164 -0.9782 -0.8711 1.0504 -0.2455 0.4883 -0.4033 1.0399 -0.0479 -0.4411 1.3807 -0.1947 -0.0785 1.4509 0.0792 -4.9121 0.0735 -1.9221 0.6597 -1.4085 -0.7126 -0.0110 0.6376 -0.2796 -1.4902 -0.4499 -1.0003 0.3972 -1.6768 -0.1444 0.3687 0.9962 -0.8702 stearoyl sphingomyelin (d18:1/18:0) 0.2189 -0.4716 -0.0934 -0.1228 0.3734 -0.4997 -0.6940 -1.1881 -0.2347 0.2599 -0.5211 -1.2888 0.8246 0.3534 -0.5146 -1.0659 -0.1074 0.0712 0.5510 0.2981 -0.5202 -0.5594 -0.5703 0.1542 0.7877 -0.2467 -0.5606 0.6079 0.9101 -1.4869 -0.2346 -0.5363 0.0813 0.2617 -1.5391 1.1659 -0.1111 -0.8281 0.8738 0.3681 -0.7571 0.4918 0.7134 0.6160 0.3984 0.7519 2.4319 0.9396 -1.1553 -2.1814 0.1401 -0.9426 -0.4021 -0.9825 1.0269 1.9465 0.2197 1.4505 0.1921 -1.5404 -0.7169 0.1564 0.4949 0.0064 1.1084 0.3508 0.2902 -0.0028 1.0003 0.7156 -0.3511 0.4985 0.5028 -1.2683 -0.9441 -1.3210 0.4773 -0.8667 1.3169 0.1215 0.9348 0.0814 -0.3292 0.9665 -0.2940 -0.8548 -0.4335 1.7338 0.0567 1.1694 -0.8621 -0.9209 -0.5399 0.3505 -2.2530 -0.0048 -0.8407 0.0677 0.6243 0.1849 0.6453 -2.0471 0.0010 0.4776 0.4320 -0.4186 1.5118 -0.4735 0.9079 1.5941 -0.7488 0.8487 -0.0560 1.0187 0.1268 -0.4860 0.1381 0.9775 -1.1409 -0.3642 -0.4320 0.4156 1.2170 -1.6593 0.8204 0.2476 0.2356 -0.6413 1.6326 -0.4427 -1.5263 -0.5940 0.0685 -0.1424 -2.0464 -1.1593 0.2393 -0.5038 -0.2011 0.8668 -0.9394 -0.0353 1.4207 0.5357 -0.6882 -0.9305 1.8915 -0.1139 -0.3918 1.3635 0.8575 -0.1909 1.9687 0.1887 -0.3297 0.1159 -0.5173 1.9953 -0.1098 1.5316 0.3227 1.8764 0.5260 0.9979 -1.3673 0.4632 -0.0991 1.4238 -1.7061 1.2963 -1.3542 -0.6788 -0.9149 -1.1254 -0.2255 1.9750 0.5778 0.5996 0.2768 1.6256 -1.0165 -0.6491 0.2885 -0.1623 1.0465 -0.0756 -0.9543 2.4372 0.2697 1.4799 -0.3800 -0.4001 -1.2024 -1.0358 1.1135 0.2598 0.6463 0.0185 -0.5286 1.0503 -1.1724 2.0039 -0.5708 1.3185 0.5010 0.7252 1.0059 1.5728 -1.5072 0.3455 1.2825 0.7081 -0.0383 0.8344 -1.0498 -0.0304 -0.6140 0.7288 -1.4255 -1.2337 -1.4096 -1.4930 0.3206 -0.0556 -0.9145 -0.3145 -2.7474 -0.4294 0.5131 -0.9885 1.0900 0.1245 -3.0337 1.3024 0.1874 -1.2329 1.0525 0.9634 0.7732 -0.4624 -0.0831 -1.1763 0.7669 -0.7683 0.5444 -0.8706 -0.5761 -0.0861 -0.5987 -0.8481 -0.3170 -0.5449 -0.6095 0.9511 1.3730 -0.1007 -0.2887 -1.5119 1.8779 0.3739 1.6323 0.9710 -0.1269 0.3247 -0.8136 1.8711 -0.0915 1.4708 -0.5292 1.2491 0.4492 1.4932 -1.0458 -0.0579 -0.0224 1.0570 0.9802 0.0807 -0.3065 1.6439 -0.7294 -0.7629 -0.1724 -0.1305 1.2520 2.3780 0.6826 -0.2789 -0.6282 -0.1019 0.3317 0.0673 -0.8221 -1.5403 -0.5815 -0.7686 -1.6867 1.0700 -1.0353 -1.5382 -0.3753 -0.6029 1.3753 0.7851 1.4770 -1.0166 -1.0768 0.2610 -0.5394 0.6556 0.4153 0.5587 -0.7049 0.3950 0.2963 -0.7662 0.2394 0.0126 0.5451 0.2813 1.8517 1.5720 -0.2907 -0.5363 0.3485 0.1994 0.2244 -0.5515 -0.0195 0.6976 -1.0788 1.2324 -0.2018 1.0073 0.7138 -0.2193 0.9507 0.0926 -0.6997 -1.8516 0.0809 -0.8079 -1.0556 -0.7877 -1.9423 0.5086 0.6218 0.8983 2.0124 -0.4321 2.0996 1.9478 -0.2493 -0.7362 0.8222 -0.5245 -1.3638 0.9531 -2.2402 -2.3963 -2.5181 -0.0821 -0.1578 -2.5058 0.3246 0.9103 -0.5028 -0.8376 0.3091 -1.1332 0.3932 0.3738 1.5416 -0.4849 -0.5101 -0.9586 -0.1958 0.1846 0.3507 0.6897 -1.3332 -1.1827 0.4022 -0.0308 0.3854 -0.2406 -1.5035 0.2441 -1.4806 -1.5626 1.4583 1.8207 1.1900 0.7776 -0.9296 -0.0979 -2.5888 1.3772 -0.1168 2.4042 -0.5592 0.2354 -0.9921 -1.6558 -0.5605 -1.0157 0.6640 -0.4956 -1.8748 -1.9524 suberate (C8-DC) 1.0914 0.5140 1.1413 0.9808 -4.9441 1.8905 -0.9667 1.2303 1.2016 1.7597 2.0061 0.4953 -0.8658 0.9731 -0.2054 0.3281 1.3200 -0.3401 0.2456 0.2423 0.0833 -1.2490 -0.2221 -0.4373 -0.7083 -0.4117 0.0864 -5.3449 0.8020 1.0720 0.3261 -0.1961 -1.2364 -0.4628 -0.0505 1.7655 0.2407 0.2787 0.1997 -0.9032 0.1652 -0.0859 -0.2440 -0.8958 -0.9925 -0.7608 0.0920 0.3308 -0.2265 0.9962 0.2561 0.6367 0.4207 1.2589 0.5662 -0.1575 -0.0394 -1.0924 0.7321 0.0338 -0.4252 0.5462 0.5985 2.0382 -0.3972 -0.8469 0.4023 -0.7970 -0.9038 1.0159 0.0411 0.2362 0.5055 0.3359 -0.3083 0.0195 -1.1640 -2.1029 0.3164 -0.1553 -1.1438 1.3152 0.7838 -0.1703 0.1609 -0.1301 0.4489 -0.2786 -0.8020 -0.1139 -0.6074 0.7372 -0.2160 -0.2718 1.1667 0.0691 -0.5412 0.9002 -0.5436 0.2584 0.6866 0.3039 0.4299 -0.4196 -0.5848 0.2507 1.7599 -0.2897 1.0319 1.1043 1.6284 0.3567 -0.7206 1.2921 0.5071 0.8146 -0.5787 -0.4235 1.1720 -0.8717 0.5865 0.0144 -0.4484 -0.2448 0.1404 0.6541 -0.9912 -0.5055 -0.4877 -0.2591 0.3576 0.1336 -0.1564 0.0652 0.1001 -0.7735 -0.1210 0.0957 -0.2941 0.4895 1.6691 0.0984 -1.0759 0.4420 0.6151 0.4465 -0.8484 0.6798 -0.7464 -2.1191 -0.2664 -1.5275 -0.7901 -0.6747 0.1983 -0.0020 0.6157 -0.3474 0.3644 -0.7504 1.4732 0.6615 0.1032 0.3836 1.5613 -0.4729 0.6069 0.1804 0.4709 0.5979 -0.4860 1.7395 -0.1192 2.0163 1.3024 -1.0395 -0.3306 1.2050 -0.0296 -0.2285 -0.0698 0.2062 0.2174 -0.0217 -0.2638 0.7987 0.9157 0.2219 1.3746 0.1694 0.6791 1.9178 0.1242 -0.2318 -0.7596 0.5004 1.3381 -0.7528 -0.4990 -0.7626 -0.2786 0.2552 0.9340 -1.5843 -0.4867 -3.8462 -0.9684 0.0420 0.8248 -0.0290 -0.0447 -1.5040 0.2568 -1.1478 -1.1475 -0.3582 0.6943 0.5054 -0.0629 0.9081 0.2110 0.1966 -0.4429 1.9375 -0.4776 -0.9691 0.9903 0.5533 -0.0378 -0.7322 0.3909 -0.7473 -0.9960 -0.2335 -0.3517 0.4890 0.5782 0.0864 -0.5848 -0.3311 1.3594 -0.5180 0.9593 -0.7800 -0.6475 1.2847 -0.2404 1.2643 0.8065 -0.1108 0.6190 0.0644 0.4908 -0.1274 0.1625 -0.4850 0.4666 -0.2874 -0.3116 0.7935 -0.1542 0.2834 0.7297 0.6473 -0.4159 -1.3181 0.1356 0.5073 0.1228 -0.6108 0.4528 -0.5739 -0.1498 -0.8086 -0.0047 1.2254 -1.4174 -1.1359 0.9606 -0.8065 -1.1203 0.3522 -0.9649 -1.3312 -1.0913 -0.6405 -0.7276 -1.0258 0.3441 -0.6163 0.0304 -0.4901 0.3674 1.1148 1.3550 0.0924 0.9934 -2.5651 -0.4247 -0.0908 1.6501 0.5201 -1.1108 0.3602 -0.1826 -0.9443 0.5122 -0.4382 -0.2442 0.1377 0.1242 -0.3071 0.4303 -0.3773 -1.6346 1.0367 -0.4421 0.3878 -1.0762 0.4325 -0.6247 1.2856 -1.2519 -1.2703 0.6420 0.0443 -1.2068 0.5055 0.1027 -0.8838 -0.0554 -0.7512 -1.0190 1.6500 -1.1030 0.3065 2.2236 -0.4285 -0.4728 1.8288 0.0565 -0.4964 -0.1677 -0.1739 0.3805 1.5824 0.7863 -0.8321 -0.9137 -0.4289 -0.9613 -3.9089 2.0816 -0.1685 0.9754 -0.2228 -0.2323 -0.7268 0.1438 0.4794 1.2725 -0.5833 -1.0317 0.1091 -5.6378 0.0778 -0.6865 -0.3380 0.9050 1.5058 1.2366 0.3332 -0.5532 1.0219 -0.6854 2.2525 0.6225 0.5879 2.0581 -0.1438 1.2975 -0.2928 -0.7808 0.8092 -0.6715 -0.8099 -0.6873 -0.5246 0.5059 -1.3443 -1.0618 0.0143 -4.1390 -0.5914 0.5669 -0.1438 0.0815 -0.1039 -0.5286 -1.1610 0.4114 1.1930 1.7072 0.3764 0.2578 0.0285 -0.0153 -1.4628 1.4220 0.0464 succinate 1.3394 -1.4772 1.1633 0.4924 -0.4399 2.1797 -0.6294 2.2418 1.2876 2.2526 1.7082 -1.1094 -1.5381 0.0643 -0.2307 -0.1579 0.7077 0.2039 0.4870 1.1590 -0.0207 -0.4102 0.4726 0.6322 0.1472 1.1935 0.2929 1.6747 1.2181 -0.0258 -0.2033 1.7269 -0.8223 -1.9747 -0.4055 3.4274 1.9990 1.3013 -0.6383 0.6005 0.0455 -0.7401 -0.3037 -0.1585 -1.4165 -0.6704 -0.6705 1.2901 0.1884 -1.6919 0.9779 0.7476 -1.6237 -0.1318 -0.3871 1.3885 0.3518 -0.8884 -0.4465 0.0072 -0.7779 -0.1939 -1.7794 1.4970 -1.7846 -0.6179 0.9003 -0.8517 -0.0432 0.9731 0.8922 -0.0967 0.2230 -0.8920 -1.4431 -0.1774 -0.0952 -0.7352 0.4629 -0.1877 -1.5972 1.2713 -0.8875 0.5078 0.6723 0.6599 0.6646 1.0731 0.1868 0.6993 -0.5259 0.5671 -1.0037 0.6977 1.1172 0.1064 1.9584 2.0040 0.7930 -0.5975 0.1719 0.7235 -0.0208 -0.2560 -0.6758 0.6305 0.9388 -1.2326 -0.2836 0.7833 0.7123 -0.2813 -0.2198 0.6557 0.2787 -0.2984 -0.3707 0.0105 1.2993 -1.4440 0.7259 -0.0720 0.3959 -0.4992 -0.4924 -0.0686 -0.1765 0.3119 -0.4300 -0.6042 -0.2999 1.5065 1.3952 -0.2131 0.3054 0.2017 -0.4132 -0.8112 0.0253 -0.5149 -0.9264 -0.2890 -0.5774 1.3839 0.9708 -0.7686 -1.8103 0.7676 -0.9891 -0.8554 -0.4356 -0.1960 -1.0642 -0.6220 0.0827 0.2634 0.9854 0.7058 0.7070 0.0784 2.1087 0.4307 0.9014 -1.5078 -0.3206 0.1267 -0.0094 -0.3466 -1.0134 0.0260 0.9457 0.1288 -0.8888 0.3469 -0.9265 0.1903 -0.0124 -0.2325 -0.1248 0.1737 1.2197 0.0307 -0.2914 1.3282 -0.2669 1.2923 1.4983 -1.1408 0.3223 -0.7552 0.1454 3.7121 2.5066 0.8529 -0.8625 -0.5862 -0.1754 -0.5941 0.4361 -0.4141 -0.0058 1.1869 0.9559 -2.1801 0.8138 -0.5846 -1.1884 2.4842 -0.2249 -0.2780 0.6833 -1.9949 -0.0950 -2.4124 -1.5434 0.8593 2.1802 0.1062 0.2861 2.0199 -1.1682 -0.1851 -0.0691 0.4920 -0.2681 -2.3560 0.2537 -0.5433 0.0197 -0.2870 0.9777 -0.0087 -0.3182 0.3553 -0.1363 0.6475 -0.0690 -0.6128 -1.5190 1.3313 0.8487 -0.9859 -0.2018 -0.0037 -1.4012 -0.3414 -1.0703 -0.4031 0.4113 1.6727 -0.2320 0.5423 -1.7099 -0.0435 0.6653 -0.8060 -1.0538 0.7667 -0.3160 -1.3991 -0.5605 1.1794 -0.3277 1.3928 -0.0163 1.2139 -1.5962 -0.1810 0.1136 -0.6342 -0.3175 -0.1770 -0.1063 -1.3582 0.7160 -0.2879 -0.7427 -1.7303 -0.7184 -0.0429 -1.1983 0.2208 -0.6229 -1.1954 -0.8947 -0.7653 -0.9105 -0.3065 0.8404 -1.9460 -1.0523 0.5491 -1.0640 -1.1615 -0.2269 -0.8434 0.4893 -2.3328 -1.1895 -0.2037 0.6412 -0.5208 0.0592 -0.5253 -0.2377 -1.6091 1.6599 0.2002 0.0457 0.1514 0.0867 0.3159 -0.8307 -0.8653 -0.8879 -0.0625 -0.7076 0.1479 1.1347 0.6421 -0.4139 0.7685 -1.4075 -0.7935 0.0934 1.3338 1.6823 0.0942 -0.4328 0.2203 0.6178 -0.2444 0.4016 0.0127 -1.2484 0.4376 1.6147 -0.6454 0.3416 0.0229 -0.7786 -0.0409 -0.3310 -0.7453 -0.7837 -0.1721 -1.6661 0.0102 -0.3818 0.7300 -1.1807 2.3250 0.8261 0.5494 2.0191 0.1070 -0.1625 -0.5727 0.3295 -0.3333 -1.3086 -1.4239 0.1720 -1.2555 -0.7481 1.7296 -1.1484 0.4778 -0.4461 -0.2502 0.8153 -1.5616 -0.8752 1.7642 0.8270 4.6393 -0.3550 0.5485 0.5484 -0.2113 -0.0863 -1.4259 -0.7535 -0.3088 -0.2385 -0.0174 -0.5616 -0.6150 -1.7400 -0.7464 -0.0908 1.7698 2.1132 -0.9780 -0.6113 -0.3740 0.0483 0.0995 -0.5292 -0.2574 0.9398 2.3391 1.0740 0.7009 -0.5197 -0.9585 -0.3393 -1.0434 0.5970 -1.4711 succinimide 1.5342 -0.0305 -0.0585 1.3782 0.9707 1.6142 0.0456 0.7604 0.0550 1.9592 1.0387 -2.0328 0.9307 0.2625 -0.3802 1.1474 0.5439 -1.6831 0.8295 0.4766 0.3266 0.7540 0.1534 0.5310 -0.0896 1.6766 0.5119 1.8052 0.3349 -1.8039 0.0228 0.8006 1.0335 0.2042 0.3399 0.6107 0.2567 1.2409 0.6838 -0.2295 0.7071 2.0712 0.3294 -2.0524 -0.1187 -0.1734 0.0902 -0.3785 1.0320 0.9228 0.4532 -0.0434 -0.0135 0.9607 -1.2881 0.6004 0.6050 0.3775 -0.1284 0.2215 0.6894 -0.4252 1.4306 0.5543 0.1298 0.7674 0.9004 -2.1595 0.6761 0.4169 0.2444 0.1967 -0.2357 -2.1009 -1.7295 0.2197 0.4904 0.8235 0.8798 0.2653 0.0830 0.4305 -1.7534 0.0372 -0.1446 0.0057 1.2602 -0.2536 0.1852 -1.3122 -0.4796 -1.6392 0.8162 0.2662 0.6366 0.6980 0.9048 0.1078 0.0758 1.3973 0.0682 0.4547 0.7082 -2.0841 3.9989 0.4671 -0.0892 0.9752 0.0279 0.5691 0.9187 0.0149 -0.2339 0.1883 -0.0353 0.0672 1.2165 0.4747 -1.9548 0.2128 -1.5761 0.5736 0.6520 0.2465 0.2737 0.0386 0.7541 0.2873 0.9793 0.0327 0.0509 -1.6057 -1.3279 0.1500 0.2543 -0.2215 1.4879 1.6489 0.0753 1.2560 0.6847 0.3542 -1.6447 0.0014 -0.0263 0.5942 -0.2134 0.2568 0.1609 0.8886 1.3109 0.9146 0.1865 -2.4977 -0.1445 0.4298 -1.7047 -1.4366 -0.0642 1.4050 -0.1376 0.0160 0.6893 -0.1116 0.5566 -0.6613 -0.5586 0.3599 0.1195 -1.7145 0.2323 1.4600 0.0210 0.2782 -0.1245 -1.2796 0.0424 2.5391 -0.0937 0.5633 1.2695 0.2146 0.0830 -0.9089 0.3552 1.4787 0.7217 0.3271 0.2437 -0.0413 -2.1508 0.0810 1.0375 0.9919 -1.4626 0.2623 0.2875 0.0084 -0.0241 0.6717 0.1784 0.8653 0.9346 0.5348 0.8107 -1.2551 0.1155 0.5118 -0.0309 -0.1650 -0.1170 -1.7444 0.4701 -1.8529 -2.0208 0.3324 -1.1296 -0.6295 0.3132 0.2402 -0.2502 0.1095 -1.4965 0.4358 -0.1046 -2.1356 -1.3357 0.6896 0.2593 0.5556 -0.0216 0.3664 0.3706 1.1485 0.1210 -2.1005 -0.3600 -0.8609 0.9870 0.5325 0.5837 -0.0287 0.2239 0.9150 -1.9484 -0.2567 0.3023 0.1220 -0.0435 -0.4894 -0.5611 -0.0205 0.9509 0.4779 0.4459 -0.4978 -0.4272 -0.0794 0.1346 -0.1765 -1.9056 0.3323 0.1443 0.1598 -0.7057 0.1510 0.5408 -0.7562 0.2233 -0.3817 -2.0006 1.5368 0.0337 0.4197 0.9361 -1.8867 0.8176 0.0940 -0.5996 -1.3958 0.0029 -0.5841 -2.0961 -1.9945 -0.1143 0.3409 0.4979 -1.7872 -0.0808 -0.1259 0.0542 -2.1006 -0.6109 0.9121 -0.0136 -0.1828 0.6766 -2.3861 -0.2315 0.1394 0.3012 -0.3710 -1.8046 -0.6530 0.5497 -2.1768 -0.1391 1.0459 -0.4136 -0.1548 -1.1594 0.1049 -1.9481 -0.7774 -2.2686 -0.2389 -0.6797 -0.2630 0.5696 -0.8635 0.4163 1.6355 -0.0226 1.0638 0.2683 0.2702 0.1090 -0.4400 -0.5859 1.2617 0.3223 1.5928 -0.2568 0.4350 0.6408 0.0742 -2.0084 -0.3968 0.0050 -0.3700 -0.9508 -0.1404 -2.1270 0.0773 0.5011 0.6863 -1.5692 0.9784 0.3375 -2.1261 0.3321 -0.8640 0.7018 0.8516 0.8400 -0.7345 -2.2353 0.3893 -0.7012 0.4631 -2.0512 -2.0032 0.5860 -0.5223 -1.9623 0.5167 -0.0254 0.6021 -0.5524 -0.4540 1.3791 -0.4647 1.1211 1.0749 -2.3883 2.6031 0.0803 0.2364 1.4828 0.6491 0.1212 -0.3588 1.3753 -0.2858 -0.6168 0.0437 -0.0879 0.1502 -0.5391 -2.3257 0.5151 0.0346 0.3280 -0.3981 3.0767 0.0368 -2.3431 -1.9310 0.0822 -0.0619 1.7241 1.2531 -0.0909 -2.1334 0.0140 -0.2967 -1.8934 0.1431 -0.5484 -2.4010 succinylcarnitine (C4) 2.5694 -0.6892 -3.2664 0.5181 0.4750 1.0543 0.2501 2.3166 0.0316 3.1758 1.2661 0.8868 0.5148 0.1434 -0.5849 0.7347 -1.1558 -0.3673 0.6075 -0.1181 0.8118 -0.1579 0.9320 -0.5523 0.1941 0.2208 0.2168 0.7146 0.8832 0.0568 -3.4117 0.9482 -0.3873 0.0804 -0.4428 1.1624 0.7266 0.7928 0.1669 -2.4237 0.1204 0.9357 -0.5790 -1.2051 -0.0709 -0.1164 0.7786 1.6499 0.6718 0.6626 0.3403 -0.0351 0.2322 -0.5811 -0.5023 0.4416 1.3148 0.7879 0.4676 -0.8047 0.9517 0.2676 -0.7720 1.1997 -0.2935 -1.1447 0.5054 -0.7194 -0.0268 -0.0309 -0.2469 0.2518 -0.6198 -0.1485 -0.5707 -0.5836 1.7127 0.4879 -0.8737 -0.3595 -0.5586 0.0222 -0.9937 -1.5036 0.2947 -0.2245 0.6316 -0.0608 -1.6709 0.6012 -0.1623 1.4548 0.1843 -0.1008 1.2580 0.4304 0.2296 0.0059 -0.9994 2.4193 -0.3137 0.7145 0.4242 0.2317 0.5530 -0.5626 0.7128 0.9789 0.1501 1.1960 -3.4890 1.0622 0.5503 -0.1929 -0.3811 -0.4471 -1.4998 0.5483 0.9127 -0.3660 1.0042 -3.0503 -0.8015 -0.2078 -0.0928 -0.4437 0.4659 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-1.1510 -1.2647 0.3156 1.6162 0.3736 -1.3642 1.4949 -1.1439 0.2007 -0.9055 0.9966 -0.2485 1.1166 -1.2554 0.9017 -1.1927 -1.0643 0.5544 -0.4035 -1.0455 1.8199 0.6451 -0.4833 0.8156 1.4738 1.5243 -0.9847 0.1197 0.4127 -1.1265 1.3067 1.2627 -1.0979 -1.1436 0.2803 0.4683 -1.1843 -1.1764 -1.2355 0.0785 -0.3592 -1.1875 0.7342 0.3780 0.8261 -0.2908 -1.2689 0.8455 -0.9694 -1.2812 -0.2922 -1.2028 -0.8039 0.2355 0.2628 -1.0514 -1.2116 -1.2156 -1.0251 -1.2595 -1.2114 1.0689 0.5790 -1.1705 1.2892 0.8378 -0.5830 -1.3003 0.8405 -1.3092 -1.2814 1.5935 -1.0729 1.0449 0.0488 -1.2527 1.2165 -1.3090 0.4365 -1.1960 0.5320 0.3445 -1.4426 -1.2011 2.3598 -0.4432 1.1863 -1.0863 -1.2415 0.4601 0.6222 -1.1201 -1.3500 -1.2135 1.1859 -1.2469 -1.3325 0.1126 1.5784 -1.1745 -1.2635 0.3165 -1.1425 0.5341 0.0383 0.8813 -0.6321 0.0718 -1.2406 -1.5402 -0.5152 0.9880 0.0516 -0.3906 -1.1228 -1.1836 0.0250 0.1008 1.1362 1.2619 0.9431 1.3904 0.4805 -0.1227 0.7589 -1.3233 -0.9406 0.7861 0.9744 0.9814 0.6831 -1.2574 -1.0512 -0.9742 -0.3892 -1.2143 -1.3146 0.6409 -0.5760 0.4428 -0.4045 -1.2134 1.1520 -1.3359 0.1339 -1.4524 0.2029 0.3172 -0.4467 -1.1419 0.3227 0.2457 0.2481 -1.3224 0.3243 0.2867 0.3824 -1.0126 -0.0374 0.1371 1.8203 0.8649 -0.0395 1.7997 0.4474 -0.0918 0.7982 -1.1319 0.5475 0.9822 1.3692 1.5610 -1.4924 0.5807 -1.2015 0.5740 2.3124 0.2362 1.8102 0.8903 1.6299 0.7311 -1.3151 0.0504 0.6646 0.6292 0.3612 0.4503 -1.2365 1.0970 0.9163 0.2629 -1.4913 0.3070 -1.1959 -1.1392 -1.4046 tartarate -0.0067 -0.6813 0.1587 -0.9443 0.7192 -2.4570 0.0319 2.8798 -0.5092 2.3043 -2.2197 0.1906 -0.1632 1.1326 -1.0622 0.0291 -0.0343 -2.3369 -0.1539 0.0481 0.1348 0.1525 0.2507 0.3478 0.3639 0.0500 -0.0417 0.1242 -0.0676 -0.6952 0.0385 0.6222 0.2914 1.0269 -0.0283 0.2722 0.5749 -0.1673 0.3928 0.1378 0.3552 0.5922 0.3847 -0.0681 -0.1002 -0.1526 0.2667 -0.0687 0.5242 0.1135 0.1992 -0.8602 -0.1488 -2.4648 0.5563 0.0504 0.2191 0.4788 0.1147 0.0170 0.2898 -0.0114 0.5236 1.1949 0.0045 0.3522 -2.3832 -0.2883 -0.0403 0.7846 -0.4650 -0.0104 0.1543 2.9523 0.0131 -0.2758 0.3799 0.0381 1.6112 -0.2846 0.0849 -0.8291 0.0222 0.2548 -2.2612 0.1462 0.6989 -0.9767 0.2381 0.3228 -0.3111 -0.5158 0.3236 0.4665 -2.3228 0.0440 3.1213 0.0263 0.0629 -0.0589 -0.4468 0.2138 0.4325 -0.9328 -0.0289 1.8442 -2.4269 0.4529 -0.3957 1.6806 1.7470 0.9323 0.8772 -0.8280 -2.3726 0.2321 0.3571 0.4738 -2.4759 -0.2023 -0.5776 -1.3910 -0.5756 0.2109 0.0653 -0.7306 0.2677 2.6688 0.8581 0.0309 -0.4324 2.5789 1.1553 0.0900 0.4465 0.8247 2.0276 0.4498 -0.0938 0.7259 -2.1505 0.2142 -0.4926 -0.4850 0.3585 -0.0754 0.1526 -0.9048 -0.8314 0.4158 0.3874 0.4641 0.7039 -0.7270 0.0549 0.6661 -0.7950 0.0509 0.2362 0.4718 1.6076 0.2141 1.1834 0.2853 -0.4151 -0.0050 1.1741 -0.9134 0.2244 0.0125 -0.1532 0.3025 0.7847 0.1324 -0.4045 0.0014 -0.4115 0.3586 0.0788 0.3517 0.3849 3.4109 0.2715 0.1826 0.3759 0.2899 -0.2112 -1.2456 0.0922 0.2229 1.7104 1.5141 0.3433 -0.4677 -0.3641 0.3170 0.1680 0.2694 -0.0727 -0.3012 0.1489 0.2945 -0.6420 -0.0294 -0.8371 -0.0427 1.0138 0.6263 -0.3493 1.2044 -0.3591 -0.3691 0.5298 0.3924 0.1569 -0.4545 -1.0534 -2.6139 0.0520 -0.5582 -0.0294 -0.4652 0.3970 -1.7783 0.2128 0.4580 0.0660 -0.3489 -0.0429 0.1681 0.1799 3.5934 0.8498 -0.2734 -0.3780 -0.3469 1.3037 0.0403 0.3157 -0.1265 0.1483 2.2027 -2.4143 -0.2846 -0.4247 -0.2471 0.0849 -2.6017 0.1824 -0.2955 -0.2839 -0.1272 0.1665 -0.3929 0.0665 1.5068 0.0075 -0.2827 -0.7822 0.1095 -0.9594 0.4264 0.7923 -0.0748 -0.1616 0.6711 -0.2877 0.0147 1.2529 0.1895 0.5890 2.3353 -0.0628 2.2219 -0.1378 -0.1715 -0.0235 0.7657 0.4810 -0.2133 -0.2659 0.5587 -0.1490 0.2174 -0.5511 -0.0615 1.4103 0.0771 -0.4711 0.2509 -0.9370 0.0580 0.3714 -0.3833 0.2670 -0.2459 2.3937 0.5418 2.1719 0.2989 -0.3796 0.0588 -0.2082 0.1262 4.6700 0.1830 -2.5157 0.3411 -0.3453 -0.3579 -0.0783 -0.6122 -1.0456 0.7692 -0.6950 0.3418 0.0568 0.1388 0.0091 1.1995 0.3562 -2.5452 -0.1792 -0.7790 0.1743 -0.6105 -0.1752 -0.5792 -0.8126 -0.1090 0.0818 0.1695 -0.3178 -0.5512 -0.0537 0.0771 -2.5042 -0.1124 0.1704 0.2914 0.1446 2.4798 0.1909 0.4779 -0.2815 -0.3570 0.2199 0.2588 0.3787 -0.3320 0.2820 -1.8072 -0.9015 -0.5371 -2.5150 -0.1528 -0.2182 -0.1772 -0.4177 0.4449 0.3803 -0.6363 0.1305 0.5981 -0.1438 -0.6889 1.1473 1.4395 1.1158 -0.3234 -0.7804 -0.2416 0.1560 -0.2769 -0.0157 -2.2528 -0.7738 -1.1437 -2.5820 -0.8170 -0.4251 0.6801 -0.1769 -0.3203 -0.2532 -0.6766 -0.4827 -0.8150 -0.5314 -0.5425 0.5030 3.5322 -1.9952 -0.8536 -1.3823 -0.2449 -0.3118 -0.0107 -0.2175 -0.0015 1.0980 -2.5316 -2.0167 -1.4673 -0.0087 -2.8111 -1.0136 0.0018 -0.0890 -2.7368 tartronate (hydroxymalonate) 1.0250 -1.2331 1.2310 0.1271 1.2656 -0.1697 -0.3700 -1.1827 -0.2341 -1.6233 -1.9812 0.2335 0.4864 1.0610 -1.5058 0.2773 1.6811 -3.7986 0.2614 0.7262 0.9269 0.4566 1.0157 0.2481 0.9407 0.2132 0.2099 1.2155 0.5176 -0.6277 0.0549 1.2273 0.9319 1.4431 0.6827 -2.6974 1.0762 -0.4212 0.9565 0.4545 0.6815 1.4057 0.1858 0.3980 -0.1065 -0.0150 1.0189 0.7055 0.5862 1.2280 0.1957 -0.6344 -0.6353 -0.6993 0.5673 0.8787 1.2398 0.7308 0.3355 -0.0872 1.0973 1.0597 0.4075 -1.5570 -0.9270 1.4470 -0.2033 -0.7995 -0.0447 0.3708 0.9884 0.3690 -0.2054 1.0171 0.1282 -0.1906 1.0611 -0.0345 0.3114 0.3212 0.0322 -0.4394 -0.1927 1.3127 -1.7717 0.7932 1.3424 -0.9532 0.3095 0.8203 -0.4789 0.6449 0.7270 0.9148 -0.6264 0.7977 -0.3562 0.3016 0.4729 0.2891 -0.2580 0.3451 0.9563 -1.0988 0.5559 0.4800 -2.0682 0.3040 -0.1429 1.7767 1.8993 -0.7311 1.8080 -0.2881 -3.2369 -0.0433 0.6606 0.6613 -1.6682 -0.5833 0.1976 -2.0562 -0.4564 0.2558 0.0648 -0.4483 -0.0537 -0.5868 0.6054 0.1126 -0.6906 -1.5144 -1.1765 0.6649 0.2050 -1.9014 0.6936 -0.0662 -0.0815 1.5951 -0.2972 0.0452 -1.1370 -0.1825 0.9646 0.5342 0.7795 0.7501 -1.8799 0.7230 1.5044 0.8852 1.1468 -0.9207 0.6444 1.3891 1.1393 0.2350 1.4639 0.7835 -0.0667 1.9852 2.8135 0.1817 -0.0309 -0.1765 0.6058 -0.1535 0.0093 0.0476 -0.2440 1.4801 0.3096 0.5615 -0.1666 -0.3710 -0.4213 0.3738 0.5776 1.2898 0.6691 -0.0057 1.3864 0.9291 1.2888 1.0518 0.6444 -1.9384 0.1702 0.1838 0.0341 -3.9627 1.1772 -0.4334 -0.5184 0.2768 1.3465 -0.2908 -0.1264 -1.3639 0.2537 0.7588 0.2184 -0.4031 -1.8530 0.2255 -0.5333 1.9275 -1.1299 2.4335 0.5548 -0.3328 1.2108 0.2520 -0.1076 -0.2947 -3.9880 -2.3998 -0.0403 -1.4098 -0.3597 -1.1126 0.7001 -1.4417 0.1491 -1.1052 -0.5740 -0.3368 0.1014 0.3753 0.2515 0.4458 0.2227 0.3118 0.0482 -0.0376 -0.4097 0.6674 0.6476 0.2310 0.7692 -0.7140 -3.1147 -0.7487 0.5050 -0.0904 -0.4115 -1.0378 1.2267 0.5056 -0.4608 -0.0224 -0.2051 -0.1736 0.7133 0.3471 -0.2439 -0.1095 -0.6921 -0.0825 -0.5854 0.6092 0.3896 0.4633 -0.0252 1.7424 -0.4053 -0.3808 -0.4672 0.4099 0.4111 0.0830 -0.2340 -0.0176 0.3007 0.0197 -0.0220 0.4213 1.1167 -0.0560 -0.7560 0.2947 0.4748 0.5421 0.3832 3.3446 0.8937 0.5125 -0.6813 -0.4304 -1.0025 0.8615 -0.0126 -0.2453 0.2855 0.1520 -1.2611 -0.1101 -1.5235 0.5764 0.2184 0.6501 1.0132 3.8311 -1.3028 -0.0272 -3.2245 0.7912 0.1444 -0.1570 0.6195 -1.4480 -0.4493 -1.2611 -1.5693 0.1865 -0.0980 0.5139 -0.1044 -0.8690 1.0580 -1.9830 0.0978 -0.4158 1.2814 0.0065 -0.0476 0.9543 -0.2753 0.3110 -0.0278 -0.6752 -0.6034 0.0858 -0.1857 0.1089 -1.9959 -0.0350 -0.0852 0.8889 -0.4138 -0.6163 -0.8456 -0.2360 -1.0667 -0.7040 0.2913 1.9994 0.9720 -0.3174 1.1934 -0.9599 -0.7744 0.0398 -0.8546 0.5183 -0.3046 0.2563 -1.0022 -0.1529 1.2665 -0.9329 0.7522 -0.2453 -0.3527 -0.4796 -0.4602 -0.7755 -0.4119 -0.1952 -0.6623 -0.8153 0.4244 -0.3165 0.2541 -1.8906 1.2604 -0.2535 -0.8750 -1.8451 0.4403 -0.9969 -0.1099 -0.1409 0.2265 -0.7300 -0.4817 -0.4596 -0.7515 -0.8684 1.1503 0.7071 -1.9397 -1.5444 -1.1023 -0.2662 -0.6644 0.1400 0.1668 -0.3763 -0.1768 -1.9250 -0.6841 -0.0863 -0.2421 -2.3731 -1.5614 0.0709 -0.0122 -1.9708 taurine 0.9117 -1.2527 1.5427 1.5029 -0.6576 1.6845 0.5126 1.7931 1.5038 1.2765 0.2138 -0.5897 -2.9776 0.2449 0.3695 -0.3175 1.1132 1.5442 -0.9157 0.2428 0.6954 -1.1148 0.4268 0.9210 -0.2361 0.2641 0.2177 1.2477 0.8101 -0.0520 0.2571 0.3261 -1.4028 -0.0624 1.4724 -0.5998 0.9022 1.2375 -0.9611 0.6434 0.6280 -1.0976 0.9500 -0.2802 0.9818 1.1836 0.3375 1.3889 -1.1535 0.1488 0.8871 -0.0989 -1.1156 0.1604 -0.2949 0.8068 -0.6075 0.4806 0.4242 -1.0034 -0.3641 0.3918 -2.9025 1.6491 0.3745 -0.3935 2.7344 0.7533 -0.1034 0.1463 -0.0144 0.2466 -0.4999 -0.5488 0.5690 0.6353 0.3637 -0.6373 -0.0205 0.5115 -0.5238 0.6975 -0.2599 -0.2953 0.3227 0.0664 -0.0769 1.7825 1.5286 -0.0259 -0.2510 0.6986 -1.0749 2.1302 0.7911 -0.9421 1.1020 0.3408 1.0548 -1.6030 -0.0118 0.0175 -0.1263 0.2968 -0.3918 0.5247 0.7177 -4.8020 -0.9244 1.0513 0.0637 1.6236 -0.3117 1.0460 0.6266 0.4896 0.4923 0.3330 -0.2537 -0.8532 1.1836 -0.0593 -0.6095 -1.7467 -1.4956 0.6066 -0.1658 0.5364 0.9824 0.0702 0.3389 0.0224 0.9145 1.2537 0.3118 0.3386 -1.4318 -0.7662 -0.0741 -0.3062 0.5214 -0.4369 1.3843 0.0652 -1.0325 -0.3250 0.3189 0.3684 -0.5532 -0.9096 -0.5622 -0.3779 -0.8936 -3.4055 -0.2946 0.3233 1.5476 0.4148 0.9209 -0.5000 1.8273 -0.2058 0.4462 -0.9070 -0.3775 -0.3029 0.0668 0.1522 -0.3008 0.7365 1.5329 -0.4508 -0.1702 0.9376 -0.7624 0.6311 1.5792 -0.7381 -0.9740 0.4322 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-0.2801 0.4141 -1.1705 -0.8731 0.1679 1.1281 -1.2100 0.5265 -2.6522 -1.1844 0.4763 0.8404 -0.2900 0.3023 0.2449 1.4430 0.6336 0.6854 0.3212 -0.1707 -0.7507 -0.1270 0.8890 -1.1988 -0.1788 -0.7548 -0.0237 1.2984 0.6719 0.1040 -0.8468 1.0111 -1.2790 -1.3046 -3.4033 0.2002 -2.1797 -4.6289 0.8113 0.8685 1.6250 0.4129 -1.1484 1.4448 -0.7854 -0.4765 -1.8992 -1.4883 0.0001 -1.0035 -0.1134 0.5233 -0.7753 -0.4112 -0.5106 0.1920 0.6152 -1.8904 -0.9585 2.0248 0.2620 -1.3259 -1.0574 0.0457 1.0886 -0.0773 -0.5917 -1.3886 -0.9492 0.8325 0.3671 -0.1974 -0.5160 -0.3585 -1.7860 0.3696 0.6154 1.1880 -2.5038 0.9615 -1.5377 -0.5637 -0.6915 0.1331 -2.0288 -1.7050 -0.2268 2.4361 0.7877 0.2800 -0.6456 0.3083 0.9382 -1.0225 0.6289 -0.3969 tauro-beta-muricholate -1.5194 1.3748 -1.8250 0.5931 -1.3772 -0.2779 1.6215 0.1622 0.0483 -1.4690 0.4331 -0.5444 1.2400 -0.6796 0.0032 0.1254 -0.2266 0.5256 0.1374 -1.5885 -1.6386 -0.3512 -1.4667 -0.3859 1.4075 0.3928 -0.1196 -1.6888 0.6480 -0.2044 0.2951 0.3441 -1.4385 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1.1365 -1.1676 0.1894 taurocholate -0.4266 1.2615 -0.6980 -1.1806 -0.7802 -1.0254 0.8039 -0.9592 -0.7855 -1.8911 -0.8666 -0.6409 -0.5046 0.3399 1.2634 -2.3659 -0.2718 -1.4024 -0.6849 -2.4985 -0.9870 -0.3739 -1.7156 -1.0791 0.2557 1.4032 0.0804 0.2117 0.1802 -0.6496 -1.5738 -0.6135 -1.0689 1.2754 0.4228 -1.1274 -0.5403 -1.7519 0.6815 -0.2029 0.0679 0.1116 -0.7426 -0.8346 -1.8756 0.7396 -1.1293 -0.1827 0.4778 -2.3617 0.0869 -1.1416 1.6411 -1.1575 -0.4937 -0.1812 -1.3732 -1.1498 1.1535 -1.4802 -0.6619 -2.8475 -0.0779 0.5079 -0.2386 0.8808 -2.0141 -0.2726 -0.8512 -1.4228 -0.2918 -0.3291 -2.0515 0.0892 -0.9763 1.8306 0.3394 -0.2497 -0.4206 -0.6584 -0.7333 -1.2707 0.1606 -1.9944 -0.2892 0.5846 0.1258 0.3369 1.0534 -1.6583 -2.1793 -0.4524 1.7114 0.6760 -1.3500 0.7614 -0.5631 -0.7134 -0.2226 -2.2009 -1.0165 1.2627 -0.8419 0.0139 0.0664 -0.2264 -0.1507 1.3807 -0.0835 0.4204 -0.0789 0.5175 0.3043 -1.1418 0.0237 0.7869 -1.1851 -0.1344 0.3874 -0.9452 -0.4144 -0.7054 -0.8208 -0.0760 -0.0786 -0.8975 0.2501 0.3003 -0.2182 0.0288 -1.3880 0.0430 0.2861 0.3689 1.2216 -0.2593 -1.1504 -1.1792 -0.1388 -0.1049 -1.7430 0.5439 -0.2639 -0.1106 -1.1829 -1.1779 0.4895 -1.5215 0.3436 -0.7293 0.1585 -1.6680 -1.0316 -0.9353 0.1707 -0.9849 -0.3582 0.1968 0.2046 0.0935 1.5486 1.5326 -0.9995 -1.1949 0.3049 -0.1862 0.1750 0.9936 0.6837 -0.3891 1.2035 -1.7504 1.6474 0.4388 0.5946 -1.8675 -0.9583 -0.5117 -0.2528 -0.9198 1.0066 -0.5108 0.8902 -2.0114 -0.0716 -1.3439 0.3413 0.2338 1.3581 1.5542 0.8020 0.3683 -0.8987 -0.1119 0.4930 -0.0709 -0.4336 0.4425 -1.2131 -2.4344 -1.7571 -0.7463 -0.1794 1.2451 -0.6571 -2.4145 -0.6515 0.5981 0.2876 -0.6332 0.9305 -0.0279 0.8621 0.9912 -0.3655 -0.8616 0.3263 0.6527 1.3045 -0.4220 -0.5671 0.6204 1.6614 0.1846 -2.0249 1.6967 -0.4402 0.1040 0.6232 2.3679 1.1686 1.2553 0.0905 0.2907 -0.0211 -1.2272 -0.2421 0.8482 -0.6630 -0.1563 2.0134 -0.0480 -2.7372 0.4567 0.5126 0.7674 1.9523 -0.2092 0.5031 0.7831 0.5891 0.7340 0.1976 0.6810 -0.3630 0.5402 -0.4790 2.1113 -0.4264 -1.3689 -0.0036 1.5404 0.2754 0.2453 -0.7854 -0.0941 -0.9242 0.3048 -0.1622 1.2231 0.6218 0.7525 0.9029 1.8408 -0.3584 0.0397 -1.0508 0.4538 -0.3473 0.4054 -0.5425 0.2928 0.0697 1.0437 0.1678 0.3486 -0.9774 1.8511 0.0569 1.9539 0.5507 1.0714 0.0849 1.3071 0.8388 0.0802 0.4314 -0.3684 1.2274 -0.2115 -0.1145 0.0244 -1.4757 -0.0481 1.1710 -0.0025 0.7814 0.2086 -0.0854 0.8274 -2.6775 0.5005 0.3856 0.1244 0.0264 0.5943 3.1875 0.0161 0.2745 0.6216 0.9784 -0.2654 -0.2432 1.2851 0.1150 -1.1911 0.7655 0.0447 -0.1561 -1.0355 -0.3834 0.3829 1.9865 0.4457 -0.4218 0.5419 0.9347 1.5869 -1.0180 0.5753 1.3225 0.2934 0.1873 0.6089 1.9287 0.3147 0.5163 2.3460 0.3487 1.7726 0.7981 -1.1251 0.0055 0.9611 1.3920 1.7485 -0.8651 0.7798 -0.2418 1.6583 -0.9014 0.2123 0.5108 0.3160 0.2090 0.0495 0.6078 0.3106 0.9838 -0.5799 -2.6276 0.9084 0.5305 1.4421 1.1945 0.5993 0.9737 0.8240 0.1023 0.5227 0.0159 -0.5012 0.4262 -0.9094 0.1230 1.3132 0.8736 -0.2093 1.8590 -0.3658 -0.7805 0.2767 2.4473 0.5726 0.1713 0.9604 1.3866 -0.1870 1.4608 -0.8220 0.8114 -0.7586 -0.9594 1.0261 -0.2839 -0.4822 1.4404 1.1320 -0.2483 0.4276 taurocholenate sulfate* 0.5542 1.1594 0.1330 -0.0883 0.6297 -0.8135 0.7015 -0.1579 0.2059 1.2431 1.0081 -1.1474 0.3140 0.2445 -0.2675 -0.9668 0.4352 1.9109 0.6663 -0.7162 -1.1018 0.3794 -0.3034 -0.6928 0.8838 1.0993 0.2925 0.1704 0.0596 -0.4042 -1.8520 -0.3161 -1.1161 1.8878 -1.8316 -0.4861 0.3268 0.7787 2.0759 0.0463 0.7694 0.6509 0.2589 -1.2744 -0.5315 0.0632 -0.8013 -0.1180 -0.2273 -2.4614 0.3106 -1.4368 0.7103 -1.1991 -2.1041 0.3926 -0.9975 -0.1418 0.7723 -0.0411 -3.8402 -1.9241 0.6340 0.5641 0.5293 0.9872 -0.1204 -0.5874 -0.4257 -0.6400 -0.1605 -0.1664 -0.4152 -0.1077 -0.7339 -0.6833 0.2084 0.6627 -0.7349 -1.1721 -0.0316 -1.0855 0.3496 -0.1349 -0.6779 0.8525 0.3946 0.7300 0.5367 0.4122 -1.2029 -0.2448 1.2236 0.5063 -0.6911 1.5510 1.2592 -0.4735 -0.4309 -1.5266 -0.9151 0.3787 -1.8103 -1.3263 0.3465 -3.0831 0.7942 0.4899 -0.2822 -0.0178 -0.5610 1.3454 -0.0536 0.5078 -0.0197 -0.4625 -1.4759 0.7462 -1.3364 0.1075 -0.6371 -1.2868 -0.1541 -0.7621 0.2695 -2.5831 0.3911 0.0148 0.6825 -0.3156 -1.4837 -0.2870 0.1071 -0.7875 -0.3546 -1.1215 -0.1904 -0.1191 0.7152 -0.4289 1.5809 -0.2965 0.7144 -0.8923 0.2961 -0.2563 0.6140 -1.4057 0.9630 -0.3528 0.3960 -0.1062 0.3879 0.8146 0.3912 -0.5021 -0.1811 -0.6215 -0.8586 0.4349 -0.2231 2.4232 -0.5633 -0.9796 0.0838 -1.6331 -0.5314 -0.3789 1.0742 1.1293 0.7067 -1.3280 -0.2003 0.7933 1.6231 -0.7543 2.8615 -1.3071 -0.5203 -0.8371 0.6493 0.9974 -0.2024 -0.6300 -0.9866 -0.9858 1.0431 0.8098 0.7360 0.0202 -0.6801 2.1758 0.4477 -0.3958 -0.2510 0.7859 -0.9701 -0.6928 -0.0157 -0.5560 0.9950 -1.1871 0.1876 0.5986 0.0082 -0.4184 1.0113 0.8670 -0.6729 -0.0227 0.1966 0.0074 -0.7272 0.5818 -0.7203 -1.1269 0.1995 -0.0641 0.0901 -1.0190 -1.1486 0.5674 -1.7418 1.1874 -0.0252 -0.1512 -1.1872 0.4484 0.8026 -1.2608 1.0330 0.3529 -0.0828 0.0952 -0.7406 0.5836 0.6647 1.9289 -0.2865 -2.8314 1.2327 -0.6816 -2.8914 0.3624 1.8066 0.5328 1.5043 -1.3712 -0.3646 -0.9107 0.2890 0.1166 -1.4672 1.5721 -1.3344 -0.4053 -0.3685 1.1876 -1.3391 -0.9153 0.5870 0.4227 0.9624 0.6097 -0.4580 0.1199 0.2392 1.0704 -0.7269 0.9951 -1.7146 1.1961 0.8916 0.6447 -1.3918 -0.0584 -0.3890 -0.5793 -0.9806 0.5924 1.2964 0.9876 1.0902 2.0810 1.8825 -0.2040 0.3447 0.4746 -0.2124 1.1556 -0.7713 -0.6955 -1.6032 0.8163 -0.6178 -0.8606 -1.7217 1.1000 -1.6381 -0.4548 -1.2945 -0.7487 -0.8358 0.9136 0.0708 -0.3463 1.0767 1.9002 0.7006 1.5553 0.0537 0.0156 -1.2011 -0.5140 0.2782 0.8829 0.1712 -1.1585 1.4893 0.5821 2.0292 0.1840 1.6204 1.5581 0.2919 -0.7584 0.8772 -0.7403 1.7926 -0.6538 -0.6354 0.6541 0.5646 0.9247 0.6425 -1.1630 -0.0537 1.6662 -0.9521 -0.1452 -1.4991 0.3083 0.0204 0.0318 -0.9672 -0.3977 0.6135 0.7634 -0.8000 1.5900 1.2945 -0.3088 -0.0417 1.1834 1.7602 -0.1472 -0.5018 1.6243 -0.8319 -0.6230 -2.0061 -0.1546 0.4266 -2.1315 0.3578 0.4689 0.1305 0.2704 -1.2842 -0.8416 -2.8752 1.6538 0.9778 1.1090 1.3502 0.2445 0.2180 -0.0361 0.7086 -1.7764 1.1962 -0.2029 -1.4766 0.5593 -0.1983 1.2224 -0.5874 0.2621 0.8674 1.9078 0.1163 1.9399 1.2657 1.0164 1.3010 0.1985 0.9126 0.2253 1.6007 1.5537 0.0356 0.3761 -0.7650 1.1310 -0.0726 -1.1849 0.4537 -0.9633 -1.3721 -0.1519 taurodeoxycholate -2.1965 0.5149 -1.1537 -0.0767 -2.0701 -0.2036 1.2386 -0.0600 0.0673 -2.1610 -0.8717 0.3455 -0.5506 -2.4410 1.6823 -1.0915 -0.4113 -2.3837 0.3510 -0.9478 0.2011 0.3656 0.2862 0.4338 1.7528 1.3288 0.4876 -1.0735 0.3599 0.4059 -0.7270 0.5089 -0.6938 0.3114 0.2613 0.2595 0.5253 -0.8222 -2.3228 0.9005 0.8532 0.6321 -2.4050 -1.1108 -0.1232 0.1835 -0.0993 0.4640 0.9869 -0.5363 -0.2493 -0.4178 1.3237 0.0213 -0.3343 -0.0517 -0.1503 -0.3882 0.8949 -1.5786 0.1793 -0.2947 0.4722 0.7025 0.8701 0.7185 -0.3101 0.2085 -0.1818 -0.2591 -0.1927 0.3320 -0.4851 0.1624 -0.0655 1.2425 0.7377 0.1249 -2.2789 -0.1248 0.4185 -0.3335 1.4473 -0.9960 0.1072 0.8571 -0.5701 0.0891 -0.4084 -0.4542 -1.1939 0.6530 1.5348 1.2443 0.3124 0.3198 0.1842 -0.8290 0.5601 -0.6600 -0.2159 1.0937 -0.7173 0.0027 -2.3284 0.1623 0.3485 0.2192 0.5719 -2.3222 0.5280 1.2541 0.4474 -1.1494 -0.1918 0.7894 -0.2666 0.3921 0.1772 -0.1687 0.0293 0.0881 -0.4330 0.7589 -0.0887 0.3425 1.2722 0.5766 0.3116 0.7527 -2.5047 -0.4035 0.5538 0.5574 1.4517 -2.5120 -0.4338 -0.2475 0.2298 -0.3841 -2.2579 -0.4246 0.4458 0.3170 -2.3159 -0.4330 0.0911 -0.6996 -2.3329 0.1227 0.6533 -1.1644 -0.9028 -0.1505 -0.3271 -0.2062 0.5204 0.0661 0.1704 0.4926 -2.3755 1.0058 -2.2888 -0.5127 0.6403 0.7828 1.0271 0.5159 0.8707 0.0136 0.1657 0.1635 1.3789 1.2045 0.5795 -2.1997 -2.2524 0.1469 0.3362 -0.6270 -2.3566 0.4798 1.6059 -0.3039 0.3912 0.2152 0.0101 0.4659 1.3415 -2.3265 1.4176 0.3495 -0.1216 -0.4034 0.9411 -0.2395 -0.1247 1.1263 -0.0577 -1.9694 -0.5983 0.0890 -0.0801 0.0676 1.3187 -2.1875 -2.4463 0.0867 -0.1417 -0.1623 -2.3756 -0.5766 1.5983 0.9435 0.3998 -0.3210 -0.1486 1.1756 0.6441 -0.0492 0.0552 0.6191 1.2272 -0.3361 -0.6787 1.4004 0.6862 0.7922 -0.4266 1.1476 0.6316 1.0921 0.4809 0.7188 0.2460 -0.3231 0.4688 -2.3619 -0.0096 0.2526 -2.4560 -0.8654 -1.5125 0.0180 0.6709 0.4692 -2.4530 0.6093 0.9408 0.1303 -0.6091 0.8949 0.7722 0.6771 -0.0018 0.8156 0.3007 -2.4677 0.6186 -0.1988 0.1925 0.2595 0.6407 0.4016 -0.2120 -0.4465 -0.2202 0.2589 -0.2067 0.8867 0.5464 0.7390 0.5963 -2.5014 0.4375 1.0314 -0.5941 1.2915 0.5181 0.4305 0.6993 0.5805 -0.1852 1.0665 -0.2621 0.4210 -0.8223 0.8709 0.2362 0.2470 0.5203 0.9157 0.2504 0.5011 0.8767 1.0963 0.6397 -0.0338 1.1986 0.0689 0.8362 -0.2961 -0.9288 -2.5346 -2.4291 0.0871 0.8829 -2.2594 0.0566 0.5533 -1.4477 -0.2501 1.0192 0.6290 -0.7360 0.9910 1.8708 0.6300 0.2222 0.5584 1.1771 -0.0984 0.0553 0.1627 0.4661 -0.4878 1.1032 -2.4393 -2.4773 0.1199 0.7070 -2.3642 -2.4294 -2.3038 -2.4621 0.5203 0.1499 -2.4836 -0.1020 0.1803 0.5962 -0.0381 0.1543 0.9855 1.2622 -0.0014 0.9210 1.5088 0.4186 1.1111 0.3921 -0.1668 -1.1103 0.4739 0.5963 0.4618 -0.3760 0.9254 0.4729 1.2008 -0.1685 1.0028 -0.3594 0.3493 1.2518 -2.5658 0.3223 -0.0828 0.8959 0.5125 -1.0187 0.5836 0.1038 1.2915 0.8735 0.4431 -0.3198 0.5392 0.4264 1.0720 -0.4627 0.2275 0.9588 -0.3124 0.2499 0.9085 0.4450 -0.2629 0.9629 -0.3805 0.1205 -0.3864 -2.1500 0.2900 0.5220 0.4271 1.3065 0.3135 1.8510 -0.0914 -0.1193 -0.2596 -0.1407 1.5593 0.5168 -0.3762 0.8449 0.0875 0.2534 0.1905 taurodeoxycholic acid 3-sulfate -1.8759 0.3146 -0.8236 -0.9551 -1.7186 -0.5533 0.6775 -0.2032 -0.0651 -1.8245 -0.1505 0.2433 0.2950 -1.4619 -0.3824 -0.2256 -2.3537 -0.4642 0.0488 0.0398 -0.1099 0.2673 -0.9363 0.0467 0.7486 0.2272 0.1902 -0.9610 -0.3674 -0.0905 0.1344 -0.6122 -0.2402 0.2582 -0.0703 -0.0983 -0.6355 -1.9187 -2.0475 0.4773 0.5469 0.0287 -1.2253 -2.3460 -2.0061 0.3541 -0.5744 0.4833 0.3156 -2.1211 -1.8245 -0.2734 1.3047 -0.2816 -0.1368 0.5244 0.2467 -1.8485 0.1297 -1.2808 -1.3591 -2.3170 1.0488 0.5030 0.8677 1.2256 -0.6618 0.0011 -0.7310 0.2085 -0.9209 0.2838 -1.2649 0.1592 -1.1868 0.6872 0.0755 0.6004 -1.9949 -1.0344 -0.3452 -0.0995 1.4964 -2.3294 0.0973 1.0925 -2.0074 1.0321 -0.7011 -0.5116 -0.2910 0.7321 0.8121 1.1043 0.0879 -0.3202 -0.0467 -0.7091 0.1665 -1.3311 0.2150 0.2289 -2.0225 -0.2005 -2.0528 0.0565 0.5744 -0.1676 -0.3262 -2.0517 -0.0556 1.8123 0.0718 -1.0146 -0.3577 0.1028 -1.9841 -0.2391 -0.2837 0.6213 -0.5966 -0.0943 0.0448 -0.2315 0.4799 -0.2989 -0.3714 0.6151 -0.0259 0.4274 -2.2911 -2.0294 0.8509 0.2778 1.5584 -2.3055 0.7557 -0.6371 0.3060 0.1339 -1.9534 -0.3963 0.8601 -0.0218 -2.0334 -0.0473 1.2193 -2.2157 -0.0517 0.7608 -0.0480 -0.7433 -1.1725 0.5541 -0.0804 0.1227 -0.7948 -0.6238 -0.0711 0.6376 -2.1241 2.2753 -2.0074 -1.5310 -0.3110 -0.1447 0.5018 0.2627 0.9464 0.4771 0.3272 -0.2090 0.1103 0.5806 0.5626 -1.8918 -0.0813 -1.2354 -1.0034 -1.0646 -0.8888 0.9767 1.3315 0.1441 -0.3346 0.9111 0.2970 1.2153 1.2379 -2.0568 0.9510 -0.0845 0.4302 -0.6567 0.5739 0.6762 -1.1509 0.0604 -0.3801 -1.8919 -1.0563 -0.0299 0.7718 0.8073 0.6037 -0.5889 -0.0476 -1.5077 -2.1402 0.4235 -2.1207 -0.9287 1.3716 0.4438 0.2853 -0.7560 1.1844 0.1441 0.8352 0.1682 0.2037 1.2509 -0.0610 0.3130 0.9925 0.6433 -0.3994 0.0184 -2.2714 -0.5631 -0.3579 0.8869 1.0731 1.2509 0.2346 -0.2294 0.5894 1.1878 -0.3746 -0.0830 -1.3854 -1.3193 -1.2472 0.7295 1.1925 0.5405 -1.1936 0.3483 0.8855 0.2942 0.1932 0.4177 0.5205 0.8410 -2.2657 0.1148 0.6706 -2.2452 -0.3729 0.3994 0.7573 0.5838 0.5299 0.7524 0.9340 -0.0989 -2.3133 0.8103 -0.1346 0.3835 0.5462 1.7871 0.6215 0.0649 -0.4198 0.8223 -0.4625 0.8681 0.1378 -0.3751 1.9389 0.8186 0.1359 0.1585 1.4003 0.6870 -2.3003 0.3866 0.9415 -0.2811 0.7800 0.5490 -0.0122 0.4462 0.7823 -0.6987 -0.3998 0.9444 -0.2792 -0.7451 0.4798 -0.1740 -0.3142 0.9066 -1.3528 0.2220 1.5094 -0.0140 1.5466 1.6318 -1.1094 0.5769 1.1930 -2.3421 0.7185 0.8833 0.4672 0.2376 0.0706 0.3711 1.6866 0.8645 1.1130 1.3442 1.3177 -0.1195 1.2697 -1.2609 -0.8816 0.3332 0.4462 -2.1075 -0.3589 -2.0169 -1.1598 0.2746 0.1097 0.0473 -0.2352 -0.1871 -0.4562 -0.4320 0.4893 0.9788 -0.0762 0.6341 1.0442 0.4589 0.7683 1.1695 0.9971 0.5362 -0.9051 1.6191 2.5566 0.9356 0.8551 1.2947 0.9187 0.2453 0.0736 0.5726 -0.4699 -0.4372 1.8004 -0.3324 1.4383 0.8104 0.0567 0.0319 -0.2410 0.8872 0.9337 0.7708 1.6583 0.7511 0.0776 1.1381 0.4632 0.5662 0.0201 0.9860 0.5115 0.9421 0.7832 1.4757 0.6504 0.3494 0.7551 1.0821 0.4038 0.6637 -1.8161 1.3838 0.9686 0.3472 1.8817 0.5789 2.1017 0.9441 0.6147 0.8450 -0.3835 1.3710 0.9750 -2.5704 -0.2105 0.1768 -0.2769 -0.2120 taurolithocholate 3-sulfate -2.9499 0.5478 0.5625 0.4022 -2.7876 -0.0439 1.6934 0.3536 0.2530 -1.1102 1.2319 -0.7685 0.9669 -0.4999 0.7856 0.1835 0.8610 0.3773 0.4624 -0.0423 -0.6510 0.3158 0.3766 0.2292 1.3561 0.7165 0.8968 -3.1430 -0.1752 -0.1113 0.4110 -0.2357 0.0193 0.0633 -1.0150 0.4103 0.5169 -1.8511 -0.3981 0.2764 0.4082 -0.2150 -0.7554 -1.9669 0.3254 0.7252 -1.8011 -0.0396 0.9507 -2.1454 -0.0907 -1.4191 0.7013 -0.3586 -1.6179 0.3553 -0.7003 -1.2670 0.3740 -2.5107 -1.5463 -0.9437 1.0188 0.9381 0.6558 0.4806 -0.3111 0.3590 -0.5025 0.2098 -0.1783 -0.2077 -0.2500 0.0857 -0.5830 -0.0627 0.4325 1.7599 -3.0827 -0.4473 0.3765 -0.1763 1.4215 -2.6129 -1.5012 1.5388 -1.8263 0.8486 0.1373 -0.4107 0.4361 0.8876 -0.0862 0.7519 0.1101 1.5680 1.5242 -0.6484 0.2259 -0.5464 0.2565 0.6007 0.0689 -0.5755 0.2098 -0.9134 0.6600 0.1354 -0.4546 -3.1432 0.8273 1.8102 0.3695 -0.1408 -0.3912 0.0396 -2.7506 1.2693 -0.3198 -0.0013 -1.3071 -1.0874 -0.0650 0.4285 0.2709 -0.1536 1.2712 0.6760 0.9587 0.7056 -3.3975 -3.1127 0.3643 0.3369 0.9941 -0.8864 0.7744 0.4145 0.1945 -0.5901 0.5007 0.7159 0.2176 0.3453 -1.8890 0.6789 0.7277 -0.9547 -0.3404 0.4292 -0.8519 -0.4335 -1.2939 0.3588 0.0194 -0.5232 0.1078 -0.1280 -1.2583 -0.3799 -3.2215 2.2532 -2.3470 -0.7993 -0.2967 -0.9807 0.5168 0.4273 1.5883 0.0436 0.0250 -0.2294 0.9336 0.6101 1.3259 -1.2523 0.4063 -0.9708 0.0074 -1.0778 -0.5978 0.4843 0.5556 -0.4687 -0.8968 0.0273 0.1639 1.1186 0.8309 -3.1482 0.2273 0.6609 -0.0334 -1.9437 0.2715 0.4789 -2.0483 0.0051 -0.1172 -1.6891 0.5283 -0.3122 0.0818 1.0801 1.0007 -0.3189 -0.4648 0.0227 -3.2356 0.7382 -1.8487 -0.7922 1.6384 0.9560 0.2899 -0.8374 0.4681 0.2009 0.8952 0.4727 0.5920 0.6096 -0.1522 0.2418 0.4303 0.4407 -0.3975 0.0584 0.7797 0.1933 -0.2655 0.4653 0.3746 0.1653 -0.3769 0.3434 0.6799 0.6601 -0.2272 -0.0420 -0.2214 -1.1356 -1.2509 1.0272 1.5480 0.2942 -0.1745 -0.7075 0.4511 -0.9843 -0.3908 0.0264 -0.1719 1.7182 0.0308 -0.0512 0.0313 0.6137 0.5172 0.2160 0.5373 0.5677 0.8576 -0.0007 0.3350 -0.0325 0.0433 1.1841 -0.7301 0.1668 -1.6077 0.4771 0.7221 0.5486 -0.4261 0.4223 -0.3978 0.5839 -0.0624 -1.3683 2.0630 1.5128 0.8739 1.1827 1.2468 0.1883 -0.4476 1.1162 -0.8574 0.5523 -0.6309 -0.8289 -0.3917 0.5770 0.0340 -0.1579 -0.7026 1.3477 -0.4603 -1.2820 0.0161 -1.8288 -0.7499 0.7660 0.3681 -0.7275 1.5891 -0.1340 1.3290 1.3873 -1.6881 0.2767 0.1668 -0.4454 -0.7173 1.1442 -0.1379 -0.3547 0.2687 0.7787 1.4329 -0.3873 0.5830 2.3856 0.5384 -0.4255 1.1216 -1.5215 1.5170 -0.4269 0.0639 0.3513 -0.2192 1.3967 -0.1008 -0.7235 -0.3183 0.6011 0.0145 -0.0109 -0.3314 -0.8566 0.9861 1.0241 -1.1782 -1.1479 0.5132 -0.1717 -0.7043 -0.3144 0.5849 -0.7032 -1.6630 0.6034 1.3294 0.2276 0.5979 0.8526 0.1904 0.8582 -0.0710 0.0822 -0.0993 -1.2833 0.9203 0.2448 -0.2297 0.2185 -0.1290 0.0282 -0.7454 0.4091 -0.0822 1.0091 1.3012 0.1982 0.2691 0.3747 0.8278 -0.4246 1.2089 0.4742 -0.5324 1.2998 -0.9523 0.4893 0.3799 -0.5640 1.1487 1.0793 0.5672 1.9294 -0.4790 0.1290 1.1647 -0.1147 0.9683 -0.3325 1.6217 1.7281 -0.7106 0.7170 -0.1637 1.1571 1.1366 -3.6997 -0.0601 -1.2714 -1.0547 0.2434 tetradecadienoate (14:2)* 0.8971 1.2708 1.0364 1.6903 0.8046 1.7929 -1.2442 0.7773 1.6794 0.7518 1.4322 1.0163 1.4593 -0.8381 -1.2295 -1.0600 1.0610 1.3582 0.2447 0.1088 -1.6295 0.8292 -2.6696 -0.8128 0.3044 -0.2434 0.9134 0.2780 -0.5646 -0.7845 -0.4491 -1.4038 0.0045 0.2961 0.8433 0.5912 -0.3143 -0.7258 0.3016 0.4660 -1.4662 -0.7686 -0.0496 1.6810 1.5098 -0.3294 -0.5639 -0.6652 -1.7706 -0.7255 -0.0258 0.9140 -0.9935 1.7752 -1.2340 0.4136 -1.8523 1.2894 -0.4816 1.5479 -0.9380 0.8676 -0.9250 0.4744 -1.0466 -1.0103 1.5200 0.6948 -0.2550 -1.2003 0.7129 0.4015 0.0281 0.0463 0.7770 0.5282 -0.0412 -1.6698 0.5696 -1.3189 0.1869 0.4571 -0.5513 1.3576 0.1465 -0.9111 -0.8570 1.4032 0.7756 -0.0810 0.7880 -0.8951 -1.3380 -0.9538 -0.2847 -1.2985 0.6461 -0.6444 -0.0251 -0.9968 -1.1346 -0.3700 -0.8884 0.5693 -1.3142 -0.0232 1.1347 0.7012 1.6802 -1.5553 -0.0724 -1.1681 0.0486 1.8281 0.9585 -1.2373 -1.3890 -3.0081 0.7809 0.7969 -1.2873 0.3796 -1.4625 0.6137 -0.5895 -0.5486 0.6658 -1.8734 -0.4275 0.3459 -0.8937 0.0966 -0.8286 0.5490 -0.2463 0.4690 -0.4156 -0.6068 -1.2898 -1.0986 1.1275 -3.1637 0.3215 0.1721 0.6832 0.6703 0.9246 0.2408 0.9895 -1.0085 -0.1223 1.3122 -0.3147 0.7258 0.9262 -0.0328 1.3645 -0.3925 -1.3724 1.0710 -0.8471 0.0067 0.3486 1.1100 0.7800 0.1829 -2.0722 -1.1141 -0.4061 0.4065 0.3608 0.8689 0.1891 -1.2307 0.7327 1.9405 0.8591 -2.4483 0.1326 -0.3483 -0.0835 -0.4387 -1.0954 0.2819 -2.8483 0.5635 -3.1552 -0.3723 -2.8648 -1.2849 -0.2706 1.2892 -0.3924 -0.2747 -0.6067 1.2818 0.4304 -1.3259 0.7139 0.7789 -0.5509 -0.4280 0.1027 -1.4679 0.6769 1.4405 -0.0202 -1.7305 -0.0217 -1.3155 -1.0931 0.2697 0.0491 0.5288 0.3070 -2.1063 0.2925 -0.3157 1.1718 -0.1005 1.5844 0.8045 0.6366 -1.2029 -1.0140 -0.2682 0.5384 -0.1980 -1.1479 -0.5417 0.1853 0.3948 0.9938 -0.5970 0.4802 0.5192 -1.0888 1.0711 -0.7271 -1.0755 1.6102 0.4057 0.8871 -0.9068 -0.2075 0.3983 0.7815 -1.4013 0.1855 0.2910 0.5582 1.0166 -2.1690 1.4098 1.2866 -0.7466 -0.0697 0.3248 1.0533 -0.0021 0.8562 -0.1873 -0.2864 0.4388 1.2234 0.7861 -0.7487 -0.9745 -0.7104 -0.4090 0.4610 -1.5009 -0.2229 0.8000 0.6418 -0.9629 2.0807 -0.8641 0.4361 1.1832 -0.1854 -0.0661 -0.0396 -0.4391 1.2442 -1.3314 0.5660 0.8372 -0.5348 -0.4038 -0.1236 0.0948 -1.0332 -0.2863 -0.1887 -0.4709 -0.5834 -0.7750 -0.3770 1.0439 -0.1798 -1.4798 -0.1050 -0.0014 -1.2488 -1.3646 0.3000 0.7269 1.3877 0.3015 1.2203 -0.1122 0.3506 -0.0544 0.6436 -1.4644 -0.5020 -1.5784 -0.3058 -0.4444 0.4570 1.1992 0.6229 0.5223 -1.0438 0.4168 1.2556 -0.0155 0.4681 0.1310 -0.4790 0.4364 0.8815 1.0328 0.4428 -2.5217 0.6023 2.5295 -0.8741 -0.1669 0.2213 1.2641 -0.8102 0.5398 0.3888 -0.2961 0.3630 -0.2714 1.4960 -1.0670 0.6095 1.5022 0.2641 0.5622 1.4542 -0.5571 1.7406 0.2350 1.0067 -0.6914 -0.9000 0.0868 -0.1476 0.9465 1.7336 0.5402 0.4150 -0.2286 0.0024 -0.5868 0.6547 0.4757 1.1250 1.1079 0.6049 1.5638 -0.6300 0.3280 -1.0618 -0.2562 0.6607 -2.4687 -1.9004 1.0807 -0.6825 0.4672 -0.8014 0.9128 0.5853 1.8834 1.2378 -0.3793 1.0746 -0.0822 -0.1322 1.7849 -1.3327 0.5509 -0.6650 -1.0370 -0.1787 1.1396 -0.3184 -0.3844 -0.2400 1.2632 1.7707 -1.8768 0.5296 -0.2798 tetradecanedioate (C14) 1.2739 -0.1664 1.0340 2.1409 -1.1671 1.9633 0.4081 1.6190 0.6590 0.8063 2.0160 -0.0051 1.5317 1.1395 -0.5535 -0.1535 2.2364 -0.5977 -0.9410 -0.0719 -0.1731 -0.7012 -1.1477 -0.8313 1.5013 -0.6442 -0.0363 -1.1257 -0.6400 -0.4824 0.2583 -0.2926 -1.2904 -0.4335 -0.2839 1.3821 0.1637 -0.8899 0.1559 0.0578 -0.0553 -0.5806 0.4440 -0.8066 0.5853 0.6272 -1.2172 -1.1494 -0.6515 0.7066 -0.8273 -1.0550 -0.4442 0.9044 0.3945 -0.2134 -0.4525 -0.0308 -0.5529 0.5427 -0.3037 -1.7357 0.5129 2.1436 0.3220 1.0889 -0.7797 -0.0959 -0.6000 -0.8871 -0.9528 -1.1493 -0.7322 -0.0960 -0.3453 -0.1994 -1.9232 -0.1024 -0.5536 -1.2556 -0.7324 1.2806 0.6057 0.8443 -0.1086 -0.5188 -0.2842 0.2690 -0.6248 -1.5559 0.4809 -0.0069 -0.4063 -0.7973 0.3454 -2.2572 -1.1098 -0.5366 0.2689 -0.1011 -0.1045 -1.4174 -0.1278 0.4780 0.2950 -0.3975 1.2453 -0.4524 1.3054 -0.2373 1.1676 -1.1571 -0.0162 2.2166 2.0537 1.7301 -0.7126 -1.3972 0.8238 -1.1898 1.4250 0.3551 -0.1709 0.1109 0.3753 0.4325 -0.2566 1.7773 -0.7711 -0.0783 2.0579 0.4367 -0.8883 -0.4889 0.3569 -0.3996 -0.4317 -0.4558 -1.3969 -1.1217 1.5808 -0.1570 -1.2652 -0.6763 0.1638 0.0057 -1.1038 -0.4655 -0.6300 -1.1059 -1.1363 -0.4866 -0.2263 -1.4762 -0.7541 0.2168 0.9014 -1.4796 -0.2514 -0.0592 3.6792 0.5272 -3.2725 0.6937 1.0040 0.7816 -0.0091 -0.5231 -0.5312 -0.4671 -1.7271 1.2318 0.5958 0.5092 0.1325 1.3910 0.4131 0.6179 -1.4053 -1.9738 -0.2812 0.6087 2.1133 0.1176 -0.0871 -0.3193 0.0757 -0.2549 0.0200 -0.0982 -0.2703 1.3055 -1.2121 -1.2331 1.5374 1.1681 1.4778 0.7771 0.6251 0.1632 -1.0474 -0.8208 0.8368 -0.1198 1.1438 0.7426 -1.0797 -0.5721 0.5434 -0.3959 -1.8396 -2.1951 -1.5867 1.6133 -0.4297 0.0670 0.0169 0.6176 1.8613 -0.5984 1.2999 -0.3232 0.4149 0.6795 0.9963 -0.4064 0.3764 0.0336 0.9416 0.3587 -0.9735 -0.8317 -0.8093 -1.4501 -1.1512 -0.6190 0.0558 0.2523 -0.5167 0.6552 -0.8490 1.3007 0.2806 2.1852 -2.6838 0.2986 0.9926 0.5768 -0.0105 -0.8228 1.0250 0.2022 1.3938 -0.0142 -0.4481 1.6641 -0.6290 1.5026 -0.2666 0.0079 -1.6488 -0.5599 0.6048 -0.5870 0.2810 0.6237 0.1891 1.0584 0.2315 1.3397 -0.5080 -0.7915 0.4482 2.1555 -0.4812 1.1028 0.8173 -0.5477 -0.0882 -0.4709 0.6848 -0.3608 -0.7592 0.3583 -0.8925 -1.2095 -0.0397 0.8069 0.5482 -0.5113 0.0448 0.6050 0.4297 2.0364 0.4928 1.6717 0.2077 0.4358 -0.7975 -1.6821 0.7573 -0.2508 -1.3660 0.7581 -0.4552 -0.5600 0.4159 -1.6795 0.8899 -0.6284 1.1971 -1.2518 1.6325 -1.2602 -0.7542 1.4792 0.1984 0.4548 -2.7628 0.7844 -0.4701 1.0440 -0.4154 0.8940 0.5123 0.1257 -0.3877 0.4082 0.6572 1.9267 -0.6875 -0.0214 -0.7854 1.9920 -1.0705 -0.4379 1.3206 -0.2319 -2.1563 1.4187 -0.0246 -0.8173 0.4067 -0.5696 0.0393 -0.0643 0.2789 -0.5387 -1.0232 0.1698 0.4065 -0.2974 1.6562 -0.0975 0.5021 -0.5496 -0.3843 -1.5044 0.4697 -0.5095 0.7033 -1.9453 -1.7682 -1.6421 0.3856 0.0135 -0.8383 0.2042 1.2163 0.5956 0.6704 -0.3750 0.5873 0.4747 -0.6657 3.5019 0.1322 -0.8184 0.9499 -1.3298 0.9173 0.1319 0.4912 -0.6648 -1.9410 -1.6266 1.7696 -1.1091 0.7742 -0.2263 -1.2860 -1.1958 1.0127 -1.3261 -1.2563 0.8335 0.1535 -0.9414 -0.5410 -0.2571 0.7967 0.6431 1.2487 -0.3714 0.5526 -0.6338 1.5006 0.8857 0.4809 -0.1025 theobromine -0.9740 0.8080 0.4260 -2.2100 -0.2170 0.5970 0.7110 0.1670 -0.3360 -0.5870 -0.8500 0.5650 0.6390 -0.3880 0.5150 0.9070 -0.1550 -0.7150 0.7880 -0.0038 0.1040 1.0800 -0.2540 -0.1380 0.0365 0.8990 -0.0272 -0.2690 -0.1880 -0.4970 1.5600 -0.3880 -0.3190 -1.3100 0.9830 -0.1380 0.6100 -1.9300 -1.9400 0.6570 0.9140 0.2950 -0.9900 0.2170 -0.4250 -1.1300 0.7500 -1.2800 0.0847 0.6730 0.1720 0.6980 0.1120 0.4030 -2.6200 1.4100 0.0623 -0.4230 -0.3360 -0.3770 1.3500 -0.2220 1.0800 -1.0500 0.6660 1.0200 -2.7900 0.9900 0.5560 -0.2070 -0.0809 -0.2950 -0.5360 -2.3900 -0.5150 -0.1920 0.5240 -0.3890 -0.3300 -2.2400 1.0600 0.0061 1.2500 0.3830 0.7410 0.3960 -1.3200 -1.5000 0.9540 1.3600 0.7490 -0.2260 0.2990 0.5110 0.8780 -0.5300 -2.0700 -1.3800 1.4200 1.6600 -0.4440 0.7260 -0.5250 0.3770 1.1400 -0.2770 -0.6330 0.3680 -0.4900 0.3180 1.2200 -0.3540 0.8130 -0.6410 0.8150 -0.0770 1.1700 -0.5340 -0.6600 0.1730 -0.4790 0.5180 0.5600 -0.6770 -0.2330 0.2620 1.4500 0.9280 1.5700 1.4500 0.4160 -0.0372 -0.4270 -0.5070 -0.0364 0.7440 -0.6780 0.4040 1.0900 0.0966 -0.4670 1.6000 -0.0156 0.4250 -0.5940 0.9550 -0.1560 0.1640 1.2300 1.2800 -2.6700 -1.2900 -1.1700 0.0000 0.7680 -1.2000 0.1450 0.5110 0.8100 1.1700 1.6500 -1.2000 0.2540 -0.3600 -2.7900 1.7900 0.6640 0.9810 0.0015 0.1210 -0.7850 0.7320 0.1800 -0.7020 -0.9230 1.0500 -1.0300 0.4650 -0.2290 0.4390 0.5270 0.5360 0.9160 -0.1270 0.8340 0.5980 0.8330 0.5930 0.9760 0.5560 0.3540 -0.3390 1.0100 -2.0200 0.4820 -1.8800 -0.8220 1.4500 -0.7080 0.5830 -0.0068 1.3500 -0.4800 0.9690 -0.2280 -0.7430 0.5800 -0.4180 0.9720 1.0500 -0.6380 0.4020 1.2700 1.4300 1.1600 -0.1180 0.6380 -0.9210 -1.7300 0.2600 -0.5380 -0.3050 0.1250 0.6060 0.3250 -0.2670 -0.3690 0.3470 1.3900 -2.8000 0.8010 -2.5100 1.6200 -0.4120 -0.6220 0.8360 -0.9130 -0.9730 0.1060 -2.4600 0.2900 0.0355 -0.6510 -0.6380 0.6830 -0.9760 0.7410 0.7510 -1.3700 -0.5000 0.0849 -0.1910 1.4700 -1.3300 -2.8600 0.9980 0.3920 0.5090 -1.6700 0.9200 0.3290 0.7110 -0.7500 0.2470 -0.6310 0.5690 1.1000 0.7410 -0.8400 -1.7200 -0.0543 -1.4800 -2.6400 -0.2420 -1.1300 1.0200 0.2390 -0.1690 -0.8480 -0.5880 0.8380 -0.9500 0.6730 0.1660 -0.3660 -1.4900 -0.4100 0.1430 -2.9400 0.8080 -1.4700 -0.5010 0.9980 -1.1500 0.0688 0.7840 1.1300 1.2700 0.8740 0.6460 1.8200 0.2420 0.9910 1.5100 0.5090 -0.0420 -1.3100 -1.7100 0.0089 -2.9600 -0.7340 -0.9160 1.0500 0.7630 -0.6230 0.0624 0.9270 0.1410 -2.7700 -1.3100 -0.8850 0.6900 -0.8140 -0.7380 -1.0800 1.1800 0.4140 -1.3200 0.5510 0.9020 0.5810 1.1800 0.6220 -0.2710 -0.3180 0.0770 0.2890 -1.0800 1.0300 -2.0600 0.7230 1.2100 1.1500 0.3750 -0.9130 0.7550 0.1640 1.3800 -1.0700 0.4070 -0.8560 0.6880 0.2250 -3.0300 -0.3020 -0.0869 1.1900 -1.7000 -1.2800 0.9390 -1.5800 -0.0914 1.1100 1.0200 0.3450 0.8570 -0.2560 0.2890 0.9960 -0.3860 0.7370 -0.6150 -2.8300 -0.5170 0.3600 -0.4130 1.1900 1.3700 0.1790 0.4770 0.0335 1.1400 1.4200 0.0523 -1.2200 -1.9500 1.4500 0.7420 -0.2090 1.5100 0.1210 -0.7060 -0.0895 -1.0900 0.8270 -0.5300 -0.5640 -0.0363 -0.5490 1.2200 0.3950 0.6470 0.6650 0.7950 1.2700 -0.4620 -0.0167 -0.0343 -1.6200 0.4560 theophylline -0.1807 -0.5931 0.8420 -2.8794 -2.5772 -0.8035 0.4883 -1.0981 -1.3497 -2.2391 -1.2049 0.2751 0.5151 0.1847 0.5646 0.8674 -0.0958 -0.5531 -0.4154 0.1490 1.5799 -0.6812 -0.4057 0.2335 -1.4669 -0.9988 1.5488 0.4969 0.4007 -0.0733 0.0245 -0.4702 0.1583 -0.4026 -0.6401 -0.4563 -0.2443 -1.6967 -2.8902 1.4843 -0.7109 -1.0483 0.3466 0.5769 -0.3382 0.5080 -0.7155 -1.1142 0.8895 0.1802 -2.9443 -0.1422 0.6359 1.4120 0.4245 0.1195 -1.6447 0.0838 -0.2368 0.6967 1.7717 -0.0619 0.6461 0.1546 1.3017 0.1336 -2.9731 0.8115 0.7673 -1.1293 0.3114 1.1523 0.0467 -3.1558 -0.0249 1.1592 1.0806 0.0353 0.3643 -0.5645 0.4754 -1.7003 0.2793 1.4941 -0.5356 0.8518 -0.7134 -0.4614 1.2148 0.1943 0.1807 -0.1553 -1.0967 1.6773 -0.3949 0.1234 -2.6714 -1.3827 -0.0720 0.6045 -0.2542 -0.2900 -0.1940 1.2348 1.2871 0.4527 -0.1428 -0.1419 0.5967 -0.1960 0.1471 0.1838 0.0355 0.3431 0.1786 -0.2973 -1.3416 0.8918 1.0775 0.4913 -2.8809 0.3634 -0.1805 -0.1287 0.7482 -0.2067 1.7601 0.6379 -0.4288 0.7279 0.7961 1.0662 -0.2329 0.9074 -0.7442 -0.7465 0.6359 -0.6082 -0.4559 0.0492 0.9384 0.5415 0.8952 0.9789 -0.9743 0.3696 0.3887 0.9309 0.9614 0.4896 -2.8004 -1.0245 -0.6447 -0.5603 -0.3604 -0.5014 0.6010 0.2059 0.4194 -1.0603 1.2343 -0.2318 -1.4740 0.9419 -2.9457 0.8738 1.1062 -1.1546 -1.2658 0.1881 0.0511 0.9810 1.7218 -0.1996 0.6471 -0.4298 -0.4447 0.5427 1.2177 0.9080 0.3378 1.3569 0.3902 0.7905 -0.4350 -1.4460 0.0247 -0.8787 0.3312 -1.4286 -1.1947 -0.3369 -0.9670 -2.8724 0.8369 -1.5976 0.2381 1.7395 -0.0881 0.2027 -0.8998 -0.0768 0.7363 0.3531 0.0235 1.0641 -1.0937 0.6721 -0.1482 -0.7809 0.4914 1.1054 0.8126 -0.1058 0.3986 -0.8103 0.4872 -1.1830 -1.1191 1.0106 0.6294 0.3023 0.7333 0.6161 0.2092 0.9153 0.6836 0.7474 -0.3023 -2.0234 0.8034 -2.8789 0.4380 0.3118 0.7169 0.6707 -0.3960 0.2880 -0.4665 -1.3244 -0.7003 -0.6797 0.0485 -0.8732 0.6362 0.4390 1.3444 1.3350 0.2773 0.7862 1.3595 0.9248 0.9214 -0.8217 0.9574 -0.1572 0.4575 -1.3192 -0.1098 0.7372 1.0296 -1.1751 0.5030 -1.1764 0.4675 0.5204 -0.3521 -1.0950 0.1881 -0.7953 0.5678 -1.6456 -2.7072 1.0015 -0.1347 0.0122 1.0528 0.7332 -0.2454 0.6903 -0.3341 -1.0955 1.3325 -0.0996 0.5451 -2.9723 0.5072 -1.4069 -0.0024 0.5472 0.6364 0.1365 -0.5698 0.0698 -0.1794 0.2467 0.2465 -0.2155 1.6246 -1.7153 0.6400 1.2166 1.6002 1.4326 0.1316 -0.1805 -0.5590 -0.5533 0.1480 -3.1908 0.7342 0.6683 0.5374 0.7807 0.2934 0.4107 -0.2552 -0.0307 -0.6876 -0.0894 0.0473 0.2054 -0.3652 1.2016 -0.6153 0.1309 0.0664 0.3219 -0.5969 1.0977 -0.4885 0.7245 0.7720 -1.7806 0.4348 1.4120 1.2974 -0.0752 0.8476 -0.6632 0.8356 1.3854 -1.0750 -1.7689 0.6035 0.8984 -0.2422 0.9817 -0.0654 1.1678 0.3576 1.2618 0.6255 -1.5645 -1.3281 -0.6483 2.2078 -1.3335 0.7777 1.3651 -0.0431 -0.0456 -0.6661 0.9067 0.8862 1.2975 0.5508 0.8703 0.6578 0.8780 0.4023 0.6858 -0.8199 -0.4265 1.3687 0.7103 1.0890 0.4683 1.1040 0.0614 -0.5003 1.0050 0.7287 -0.7990 -1.0640 -1.4029 0.2167 -0.0901 1.2492 -0.6254 -0.8838 -2.9684 -1.8226 -1.3884 -0.4709 0.4627 -0.1117 0.1363 -1.3144 -0.5003 0.3945 -0.4551 0.6666 0.5373 1.5523 0.2413 0.4225 0.3556 -0.9565 -0.2518 thioproline 1.3858 -0.3565 -0.4333 -2.5293 1.7417 -1.1417 0.7319 -2.4584 -1.0174 -0.8912 -0.3341 -0.5804 0.2073 -0.1919 -0.4901 1.8731 0.4564 -0.8482 0.1684 1.3627 1.6481 0.3075 0.4437 1.0558 0.8267 0.1681 -0.0914 0.9467 1.6200 -1.5330 1.1151 1.0765 1.3718 -0.3022 -0.7615 2.7348 0.8263 0.7190 0.7652 0.3396 0.8746 1.2014 0.3710 0.6048 1.8220 -0.4269 0.8340 0.5639 1.3631 0.3013 0.8347 -0.8733 0.2146 -0.1893 1.2860 0.5354 0.5832 1.4007 0.3670 0.4347 0.8380 0.2520 -0.4363 -1.7196 -0.0904 -0.0230 -1.4330 0.5707 0.8236 1.1045 0.6041 0.1244 0.0453 -0.3129 -0.0443 -0.3770 0.0974 1.0083 0.7149 0.1798 1.3250 -1.5066 -0.8946 0.1418 -0.9457 0.0746 0.3296 0.8864 0.2203 0.2329 0.1081 1.1038 0.8429 1.1902 0.3318 1.6607 0.5358 -0.0367 0.4277 -0.3509 0.6446 0.5807 1.4633 0.0625 0.2938 0.2446 -2.0533 -0.3261 -0.8336 0.3817 -0.2326 0.1878 0.8822 -0.1408 -2.4851 0.6477 1.3826 0.0338 -0.2655 0.1986 -1.7993 -0.8284 0.6051 -0.5610 0.5982 -0.1845 -0.0327 1.3993 0.7821 0.3013 -0.5609 -0.8572 1.2958 -0.0640 0.1329 0.7288 0.4435 1.2995 0.0397 1.4035 -0.4931 0.7201 -0.0257 -0.2468 0.7919 0.0869 0.7759 0.0131 0.1012 1.5763 0.0490 2.4430 0.7972 -3.4269 0.8805 -0.0841 0.5228 0.3526 -1.2550 0.9348 0.8622 -0.7223 -0.5181 0.2569 -0.1460 0.4895 0.5314 0.9531 0.0710 0.9195 -0.8016 0.5872 -0.2370 -0.1464 -0.3559 0.7143 0.5683 1.2266 1.7652 -0.0057 -0.5963 -0.6588 -1.2185 0.1431 -0.4191 0.3313 0.0273 0.7538 0.5214 -0.2365 0.8583 -0.5328 0.0360 0.9832 -0.4732 0.1097 0.5270 -0.4545 0.4480 1.4991 0.8462 0.7860 1.3922 1.5456 1.1088 0.9530 1.1636 0.5642 0.5329 0.5636 0.1503 0.3987 0.7381 0.3798 0.0648 0.8535 -1.6775 -1.2077 0.5737 -0.0886 0.1922 0.0103 -0.1654 -1.4890 -0.2742 0.1284 1.0605 -0.2495 0.1587 -0.9957 -0.5212 -0.0675 0.9648 0.8087 1.2047 0.5892 0.2615 0.7917 -0.4596 0.6353 0.1917 -0.4402 -1.0138 1.3473 0.6221 -0.0793 0.7446 -0.4528 -0.8962 -3.1339 0.3718 -0.6429 -0.2220 -0.6676 0.4932 -0.2137 1.0417 1.3557 -1.2025 -0.0501 0.1545 1.0479 0.5307 -0.9909 0.3202 0.5393 0.4830 0.1546 0.9184 1.0481 -0.1921 0.1685 -0.4771 0.2824 -1.2151 1.1381 0.3802 0.7733 0.0671 0.5477 -0.0670 -0.3631 -0.0965 0.5584 -0.6112 -3.4149 0.4518 0.0772 0.0258 -2.0976 1.6583 -0.0853 0.3201 -0.1686 0.5364 -1.4522 -0.9089 -0.7720 -0.1803 -0.5622 -1.0227 -0.2035 0.0074 -2.6009 -0.3593 0.2081 -3.5871 0.8626 -0.6406 0.2749 -1.2630 -0.5403 0.1349 -0.1766 -0.8989 1.0390 0.2839 -0.4605 0.1092 -1.3027 0.5227 -1.7660 0.3747 -3.6890 0.1324 0.4515 0.3653 -2.5763 0.1110 0.0267 1.5360 0.5983 1.9692 -0.1492 1.4687 -0.4457 -2.3434 -1.0611 0.0935 -0.6718 -0.8922 -0.2643 0.5505 -0.1707 -0.5690 0.5638 0.1870 0.0462 -0.3941 0.4008 0.9335 -0.6760 -0.6720 -2.0187 -3.3460 -0.9382 -0.7762 0.1064 -0.4620 -0.1759 -0.5827 -0.3269 -0.2684 -0.3741 -0.6806 -0.3063 0.1427 -0.0432 -1.3495 -1.0874 -0.9573 0.5332 -0.0568 -1.6648 -0.1829 2.4903 -1.2820 -2.5159 -1.7287 -0.9470 -1.8911 -0.9449 -1.0271 0.1359 -1.1900 1.1429 0.1323 0.0400 -0.7908 -0.1110 0.0830 0.5581 -2.1214 0.0042 -0.8725 -1.1380 -0.4530 0.3600 -0.3239 0.8378 -1.3502 -2.2141 -0.0835 -3.8822 -1.0338 -0.4421 -0.8768 -0.7618 -0.1473 -1.2205 threonate 0.0297 -0.3423 -0.9460 -0.0246 1.3123 -2.8002 0.4673 -2.5204 -2.3003 -2.9782 -4.4150 0.1510 -1.7388 0.4417 0.2993 0.6830 -1.8108 -1.8410 0.3398 0.8255 1.0856 1.7010 0.0874 0.3072 1.0308 0.3596 0.1181 0.8578 0.5573 -0.3057 0.7395 0.9974 -0.8062 -0.0704 0.8337 -2.8448 1.4301 -0.9936 1.0751 1.2287 0.3513 0.6917 0.3757 0.6645 0.1527 -0.1607 1.4254 1.2361 0.6750 0.4026 -0.3896 -0.5958 -0.2967 -1.2197 0.3845 0.5989 1.4134 0.7386 0.7210 -0.3210 0.3548 0.5459 0.6411 -3.8790 -1.0992 -0.1681 -1.1252 0.8486 0.2760 0.1589 1.2731 0.6935 -0.3219 -0.1560 0.7124 0.0853 0.6947 0.9487 0.4550 0.6942 0.5940 -0.8160 -0.5091 1.0724 -0.8308 0.0807 0.7607 -1.1351 0.5619 1.0649 0.2250 -0.3552 1.1309 0.5483 -0.6575 0.3122 -0.0780 0.1033 1.0653 0.6409 0.3042 0.6032 0.6935 -0.5346 0.5470 -0.5152 -5.1866 0.0466 0.1324 0.4368 0.2195 -0.8670 0.2448 -0.9696 0.0517 0.3782 0.9016 0.5130 -1.0289 -0.0223 0.2915 -0.2217 0.0089 0.3516 0.2745 -0.4271 0.4544 0.1893 1.0661 0.5843 -0.3561 -0.1908 -0.5781 0.4173 0.1900 0.3495 1.5285 0.5904 1.0633 -0.1632 -0.4546 0.7264 0.2443 -0.3223 0.7826 0.6490 0.5537 -0.1261 -1.6592 0.5504 -1.2458 0.1829 0.6823 -1.1915 1.3233 0.9793 0.4700 0.5339 1.0354 0.5995 -0.1711 -0.7481 -1.3418 0.1390 -0.3301 0.5367 0.3345 0.2875 -0.1171 0.1194 0.0161 -0.6482 0.7161 -0.6887 -0.8263 0.3979 0.3223 0.2222 1.5218 1.0395 0.6476 0.4570 -0.0762 0.8131 -0.2757 0.4769 0.6054 -2.7133 -0.5970 0.5093 0.5184 -0.7448 0.2412 -0.7779 -1.1633 -0.5686 0.2936 0.3470 0.4735 -0.3431 0.8325 1.1867 -0.2465 0.9243 0.1899 0.3554 0.3071 1.1804 -0.0650 0.8006 -0.1138 1.0070 0.0288 0.8055 1.0040 -0.3182 -2.3059 -0.9814 0.5449 -0.5679 -1.3397 -1.7911 0.9895 -0.6171 0.4292 0.0875 0.4398 0.0349 0.5215 0.4003 -0.5039 0.5987 1.3876 0.7618 1.0080 0.3814 -0.0792 0.7851 0.6190 1.2136 -1.3373 0.2268 -0.4692 1.1712 1.0393 -0.2274 0.3464 -0.7040 -0.2219 -0.1633 -0.0788 0.0337 0.3280 0.1548 1.2410 0.6484 0.1928 0.6205 -0.0104 0.1700 0.3194 0.4455 0.9079 0.6722 0.1994 1.6047 -0.1417 -0.4013 -0.1025 1.1287 0.1425 0.4140 -0.3933 0.3112 0.6570 -0.6262 0.1555 1.3449 0.1007 -0.3927 0.4274 0.2357 0.9288 1.8600 0.8779 -0.5013 1.1836 1.3542 -0.1318 -0.3247 -0.8668 1.0472 0.8968 -0.2474 0.3671 -0.0424 -0.7921 1.3573 -0.4733 0.7316 -0.9468 0.1702 -0.2578 -1.8631 -0.6450 0.4638 -0.2001 1.4693 0.3423 0.5042 0.8434 -0.8546 -0.0391 -0.2024 -0.3454 -0.0913 -0.0338 0.6513 0.1754 -1.2503 0.3087 -3.0221 0.8856 -2.8532 0.0809 0.0310 0.5881 -0.8034 -0.1816 0.7241 0.3771 0.4814 0.3165 -0.2623 1.1855 0.4013 -3.4673 0.5254 0.2628 -0.7815 -0.9403 -0.1873 0.5341 0.3914 -1.2147 -0.6932 1.0459 1.4616 0.8008 0.6442 1.4157 -0.2465 -1.7499 -0.8145 -1.4973 0.1528 -0.6427 0.2541 -0.9429 0.0363 -0.5148 -0.2273 1.0824 0.4719 -0.0440 -0.4931 -0.3618 -0.1621 -0.7378 -0.9685 -2.4180 -0.7507 0.7385 -1.0191 0.8549 -5.2862 -1.7950 -3.4105 -2.5529 -0.2652 -0.5214 -0.4909 0.1946 -1.3363 0.9611 -0.0023 0.4358 0.0011 -0.3866 0.0601 0.1658 0.7000 -1.1207 -1.4698 0.5222 -0.2179 -0.5722 0.5391 0.7159 0.5427 -1.2181 0.2399 -0.3745 -1.5315 -0.5009 -0.6986 -0.0124 0.7207 -0.8515 -1.2877 threonine -1.1698 -0.9632 -0.4461 -0.9185 1.1776 0.0087 0.9857 -0.1736 -0.3709 0.2147 -0.8110 -1.7054 -1.3229 -0.7057 1.2095 -0.3030 0.5774 0.2493 -0.9010 -0.2283 -0.4943 -0.9712 -0.6273 0.1544 0.1671 -0.7766 0.3096 0.4259 0.2395 -0.0487 -1.5284 -0.5587 1.3266 1.1331 0.0432 1.2678 0.3688 1.8742 -1.0723 -0.5429 -0.8246 -2.5284 1.0512 0.2846 -0.0383 0.7286 -1.0556 0.2082 -0.9737 -0.5727 -0.1573 -1.0682 -1.2781 -0.2159 -0.1715 0.5168 -1.2056 -0.0253 -0.4894 -2.4676 -0.5986 1.1114 -0.2352 0.2959 0.0149 2.3778 1.7817 0.1091 -0.2555 -0.7669 -1.1438 0.6623 -0.2898 -1.5377 0.5677 1.3780 -0.6257 -1.0204 -0.4625 0.5756 1.5185 -0.2024 0.8985 0.1013 0.9375 -0.5433 -0.1274 -0.8489 0.2614 -0.4531 -0.6054 -0.7997 -1.2578 0.4811 -0.0479 -1.3571 0.3450 -1.3097 1.2706 -0.3669 0.4682 1.6276 -0.1126 0.1263 0.3522 0.1088 0.5666 -1.0221 -2.0172 -0.1464 0.0973 0.7224 -1.1963 -0.2874 -0.1144 1.1411 -0.0458 0.3758 -0.3821 0.4868 1.1505 0.7260 0.4957 -2.1482 -1.0552 1.0549 -0.3910 -0.8105 2.0306 0.5581 0.1131 -1.0245 -0.3162 0.5375 -0.3469 1.6276 -1.5288 -2.3314 0.2223 -0.3323 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-0.4896 -0.4107 -1.2188 -0.1181 1.0782 -0.1855 -1.9889 -1.8163 -2.8257 -1.5238 -3.2618 -1.3131 -0.2142 -2.2624 -0.0627 2.3123 0.2038 0.9061 0.7948 -0.0349 -0.6432 -0.0395 -1.4804 -0.5912 -0.0289 -0.2022 -0.4208 0.7218 -1.6766 -0.4617 -0.0181 0.3486 0.2884 -0.0064 -2.0124 tigloylglycine -0.8920 0.3001 -1.1290 0.1135 1.3478 0.3746 -1.2486 -1.1994 0.6457 -0.8528 -0.9850 0.8534 1.1958 -1.1388 1.4161 -1.1650 1.0426 0.5801 -1.0704 0.5756 0.8002 0.8928 -0.8513 0.5939 -1.0780 -1.0804 -1.2283 -1.0239 -0.3619 0.6810 -1.2394 -0.9891 1.6294 -1.2881 0.9373 -1.1099 0.1146 -0.9269 -1.0185 0.7663 -0.9182 -0.7749 -1.1039 0.7363 0.6639 -1.2503 -1.1051 -1.0892 0.4608 -1.0715 -1.0821 -1.2380 -1.0444 -1.1634 -0.8788 0.4607 0.8472 1.0088 -1.1351 0.6427 -0.9928 0.6511 1.1388 -1.0259 0.6563 1.0514 -1.1209 -1.3048 -0.0363 -0.9756 0.5466 -1.1938 -1.1408 -1.2316 1.0115 0.6514 -0.9929 1.1818 -0.9828 -1.1348 -1.1391 0.2069 0.2911 0.4600 0.0370 -1.1827 -0.9897 -1.0493 -1.2438 -0.8940 0.7715 0.1322 -1.0558 1.0383 0.6796 0.1408 -1.0808 -1.0610 -1.0523 0.5807 -1.2049 -0.0385 -1.0055 -1.2676 -1.0213 1.2213 -1.1383 0.6384 0.7887 -1.0238 0.5246 -1.2238 0.7701 -1.1007 -1.1015 -1.0942 0.5583 -1.0551 -1.1699 0.7046 0.8994 0.4040 -1.1325 -1.1389 0.6439 0.2755 -1.2038 1.5518 -1.1767 0.9290 0.1100 0.7614 -0.8960 -1.2020 0.6519 1.1534 -1.0759 -0.8677 0.7396 -0.7786 -0.9465 0.2643 -1.0629 1.0457 -1.0060 1.1621 1.0726 -1.1438 -1.0286 0.7877 -0.9498 -0.9619 0.7409 -1.4156 0.7121 -0.9802 -0.2396 -0.9707 -1.1896 -0.8132 0.8739 0.1577 -0.9916 -1.0980 -1.0464 1.1404 0.8736 1.0818 -1.2060 -1.1022 1.0515 0.9951 -1.3150 0.6911 -1.2201 1.5116 -0.9558 -0.9609 -1.0601 0.5717 0.4918 0.8743 -1.1419 -0.2545 0.8430 -1.2730 -1.1220 -1.0478 -0.9607 -1.0272 -1.3111 -0.9732 -1.0363 0.6083 1.3799 0.5259 -1.0523 0.6359 0.3798 -0.9075 -1.2065 -0.9725 -1.0054 0.9993 -1.1469 0.6035 -1.1462 -0.6256 -1.0864 0.1268 0.5446 1.1977 0.9624 0.8955 1.8743 -1.1545 0.4118 0.5311 0.7671 0.8500 0.7440 0.7613 1.1172 0.8944 1.4144 2.0853 0.5308 0.8106 0.8330 1.0269 0.6203 -1.0059 -1.0773 0.9346 0.7136 -1.2620 -1.1508 -1.0513 1.7644 0.9595 1.0228 0.7036 -1.1360 1.3084 0.8676 -1.1137 0.9612 1.0440 0.5018 -1.1771 -1.1722 0.6317 1.5452 0.7582 -1.1813 -1.0779 -1.1702 -1.1646 0.3590 -1.2388 -1.1900 -1.0221 0.8701 1.2434 1.4775 0.9791 -1.2160 0.6241 -1.0799 0.8773 1.2066 1.1810 0.5601 1.1488 -1.1942 0.7640 1.0831 0.8017 0.7573 -0.9610 1.4228 0.6704 -1.2702 0.4929 -1.3139 1.1565 -1.2060 1.4986 0.3711 1.0352 0.8017 -1.2735 1.9946 0.3322 0.7062 1.3967 -1.1894 0.8437 0.7372 1.2317 0.7432 0.6912 1.0933 0.3615 1.1110 0.8540 -0.0832 -0.9676 0.6950 -1.2862 1.1118 -1.2422 1.1990 -1.2363 1.3253 0.9809 -1.0991 1.0051 1.3502 0.2340 -1.1284 0.6941 -1.4358 -1.2756 -1.1817 0.9050 0.9906 0.9171 0.6922 1.1632 -0.0184 -1.0644 0.7931 -0.9939 0.5747 0.7337 -1.1869 1.0347 0.9407 -0.9973 0.1207 0.4894 1.4093 0.9880 -1.2280 -1.0799 0.7301 0.1826 0.6695 0.6071 -0.9845 1.1908 0.6390 1.3867 0.2737 1.1940 0.3137 -1.2218 -1.3717 1.3000 -0.1291 -1.1868 1.0908 0.9941 1.1125 -1.2679 0.9338 0.7049 0.6781 0.5050 0.7537 -1.2083 1.2136 -1.1100 1.0080 -0.9960 -1.4159 -1.2670 0.5956 -1.2198 0.9952 1.4082 0.8694 0.8338 -1.4237 0.2737 1.4524 0.9596 0.9800 1.1459 -0.9909 0.4383 0.6490 0.7367 1.2560 1.0030 0.6666 0.1877 -1.1750 0.8934 -1.3493 0.3162 -1.0883 1.6482 -1.3162 1.3825 0.6455 1.1666 0.8935 1.0376 tiglyl carnitine (C5) 0.7203 0.3633 0.7933 0.7048 0.1925 -0.0211 1.5944 -0.4980 0.2882 0.5681 1.0540 -0.4247 0.8195 0.9985 -0.4095 0.2366 0.0685 -0.1412 1.0118 -3.2347 -3.2844 -1.1863 0.5923 0.1342 0.5503 1.0042 0.2976 -0.0040 -0.7174 -0.6277 0.2017 0.6946 1.1107 -0.3476 -0.6334 0.3324 -0.5645 0.9432 0.0019 -0.0156 -0.3336 0.3864 1.3061 0.2849 0.5218 0.3847 0.1041 0.5405 -0.3146 1.9482 0.2257 0.2632 0.5428 1.4421 -0.2969 0.1981 1.2128 -0.8079 0.4854 0.1795 0.3873 0.3661 -0.2121 0.6800 0.3651 -0.2176 -3.5979 -0.3686 -0.0419 0.2139 0.5553 0.5126 0.6053 0.2068 -0.4310 -0.6762 0.4734 0.7064 0.8752 0.5602 -0.5127 0.8747 0.9429 0.0992 0.4067 0.3590 0.6486 -0.7941 -1.2804 1.0728 -0.4143 0.6050 -0.6352 -2.9911 0.5101 -1.2296 0.0619 0.6063 0.5438 0.3544 0.7301 0.4243 0.7254 1.0206 0.8757 -0.4379 0.6518 1.8017 0.3941 -0.4458 -0.2909 0.6246 -0.2257 1.4769 0.2378 0.2157 0.0840 -0.1034 0.3161 0.2058 0.2577 0.9021 1.3288 0.1115 0.4687 0.5046 0.0662 -0.0924 -0.5631 -0.2718 0.8960 0.3351 0.5177 0.1394 -1.4134 0.1948 0.4707 0.9190 0.0658 1.1212 0.8515 0.0079 0.6708 1.4707 0.4206 0.1179 -1.0344 0.0933 0.6553 -0.3704 0.3682 -0.1828 0.3383 -0.4870 -0.4063 -2.7097 0.5207 0.6581 -1.7352 -0.1627 0.0339 -0.0991 0.5783 0.2926 -1.4871 0.3630 -0.4391 -0.4857 0.5885 -0.9641 -0.6855 0.5990 -0.2653 0.3306 1.2139 0.4024 -3.2252 1.4837 0.7745 -0.2860 0.3611 1.0070 0.0918 -3.6478 -0.1031 -0.7540 0.7477 0.9927 0.2912 0.3058 0.9818 0.5959 -0.8173 0.1320 -0.0509 0.4416 0.7889 0.1313 0.0221 0.2854 -0.1196 -0.2447 0.1119 -0.1527 -0.5558 -3.0631 1.5800 0.3460 0.6861 0.3206 -0.6013 0.6477 0.4726 -0.0746 0.1824 0.8144 -0.0282 0.3625 -0.7882 0.4250 -0.4021 0.0846 -1.6144 -0.3117 -0.6529 0.2487 -0.0906 0.3573 0.2037 0.5648 -0.8513 -0.2669 0.5254 0.1040 0.9280 0.7114 -0.1476 0.9522 0.4234 0.2400 0.3690 -1.0421 0.8654 1.2531 -0.9005 -0.1236 0.4212 0.9004 0.2956 -3.7894 1.0468 -1.6270 0.1758 1.2358 1.2010 0.8974 0.0414 0.5933 0.1769 0.8461 -2.1588 0.0700 -1.3890 0.0930 -1.2491 0.2855 -0.0236 0.3838 -0.0120 -1.4242 0.8679 -0.2745 0.6080 0.4214 1.1089 0.9924 0.2515 0.3629 0.8565 0.7339 0.8771 -0.1237 -3.9683 -0.0907 0.2387 -3.5793 0.0157 -0.2185 1.0026 -1.3162 1.3626 -0.5800 0.6292 0.6915 0.9442 0.2738 -0.3652 0.0373 2.4633 -1.5192 0.4725 0.0107 -0.7492 0.1921 -0.3263 -0.1279 0.0626 1.0259 0.6415 1.2934 -0.1954 -0.1645 -0.2418 0.2559 0.2856 -0.4890 0.7434 0.3684 0.6723 0.2288 0.3015 -0.3860 -0.8854 0.1164 -0.1232 -0.7335 -0.0161 -0.4314 -0.0681 0.0001 -0.9031 -0.6804 -0.3122 0.6556 -0.4294 -4.1303 0.3307 0.0922 0.3840 0.9567 0.7299 -0.4880 0.1781 -1.0628 0.0039 0.5713 -0.1343 -1.2083 -0.6725 -0.1189 -0.1762 0.5035 -0.3348 0.0485 0.0785 -0.6835 -0.3318 -1.8916 0.7556 0.5293 0.3223 0.5917 -1.8993 0.5123 0.2874 0.1297 -0.3627 -0.5852 -0.1750 0.2819 -0.4125 1.9893 -0.2331 0.9790 -0.3040 1.0203 -1.7156 -0.3605 -0.8582 0.9193 0.8354 1.2512 -1.5532 1.0011 -0.1909 -0.9769 -0.8774 -3.8103 0.6445 -0.1900 -3.3177 -0.4189 -2.9972 0.0658 -0.5521 -0.8269 -0.7389 0.2843 -4.3428 -1.1476 -0.5359 -3.8507 0.3237 1.2996 0.2144 -0.4254 -0.1524 0.0911 -0.2431 0.0933 trans-urocanate 1.4711 -0.6411 -3.8439 0.3750 1.7344 0.7945 0.8377 -0.4370 1.1988 0.6326 -0.1588 0.5033 0.2990 -1.1075 0.7787 -1.1111 -1.5831 0.6024 0.9448 0.9987 1.2262 2.4022 0.8304 2.1401 -0.2002 2.2501 0.6249 0.1627 -0.1828 -0.5187 -3.9561 0.3031 0.6255 -0.9255 -0.5823 -1.8493 -0.5389 -0.4349 1.9060 -1.2373 0.2535 1.8097 1.2311 -0.5270 0.7569 -1.5354 -0.8747 -0.6465 0.7488 0.3360 -1.0815 0.0992 1.0764 1.3603 1.6717 -0.9495 0.5309 0.8034 0.1422 -0.9626 1.3564 1.1306 -0.0178 1.2748 -0.3802 -0.0577 1.6070 0.5821 -0.3185 1.2926 -0.6703 0.9407 0.3110 -0.2791 1.1722 -0.4345 0.1356 -1.4570 1.2253 0.0580 -0.1017 -0.6941 0.5250 0.6144 -1.5308 -0.1091 0.4876 -1.0375 0.1837 2.1263 -0.0126 -1.8107 -0.4661 0.0480 1.4291 2.1382 -0.6311 -0.4484 1.1535 0.8779 0.1229 -1.0387 -0.4612 0.6677 -0.0712 -0.1858 0.7504 -0.2771 -0.1674 0.2784 -1.4887 0.1682 0.9080 -0.9151 0.1144 -0.7642 0.3405 -0.1427 -1.8858 -0.0917 0.5572 0.6084 0.5843 0.1543 0.1251 -1.3325 0.8498 0.0116 -1.7937 -0.1361 -0.1036 -3.6291 -0.2887 -0.6397 0.6254 -0.0320 -0.1208 2.0157 1.4902 0.2282 -0.4899 1.3230 1.9212 -1.0378 -0.2879 0.4244 0.4811 0.4418 -0.6143 -1.1256 0.0830 0.1315 0.2706 0.2005 -0.5176 2.0251 0.4113 0.2874 -0.5700 -2.4124 -1.0367 1.4114 0.3475 -0.7837 0.0522 -0.4444 0.7934 0.8442 -0.3345 -0.1410 0.2101 0.7281 -0.5286 -0.3878 0.5911 0.6502 0.6845 -0.1828 -0.3209 0.2486 -0.0114 1.6596 -2.4434 0.1184 0.3391 1.4293 0.5443 0.5381 0.9280 -0.2166 -0.4120 -0.3053 0.1826 -0.1058 -0.0128 -0.6180 0.3114 -0.7071 -0.4218 -0.4714 0.5659 0.3617 -0.6492 -1.0263 -0.0788 -0.5542 -0.0260 2.3950 -0.5197 0.3095 0.7956 0.2136 0.7397 0.4665 -0.0746 -0.8642 -2.2507 0.1452 0.1346 0.1520 -1.1006 -0.6360 -0.5714 -0.0003 -1.0461 -0.8009 0.0780 -0.8267 -0.4297 1.2670 -0.1760 1.2014 0.0107 0.6276 -0.3600 -1.8720 0.0559 -0.8097 -1.4622 1.1110 2.0326 0.9076 -0.5157 -1.0383 0.9723 -0.7875 -0.7219 -1.0587 -0.6543 -0.0069 0.2742 -0.1214 -0.5433 -0.6757 -1.9048 -0.7582 -0.4297 1.5628 -0.6496 -0.9330 0.7430 -0.2306 0.4460 -0.7376 0.1818 -2.7148 0.7313 -0.0719 -0.5286 -0.2328 0.3275 -0.1729 -0.7139 0.6215 -0.2575 -0.0785 2.6906 0.7114 -0.9271 0.8559 -0.5819 -0.4584 0.2307 3.0133 0.2524 0.0398 -0.0024 2.1679 -1.0392 -0.3179 -0.7864 -0.2596 0.8378 -1.1041 -0.9537 0.1741 1.3437 -0.5975 -0.3918 0.7459 0.2669 -0.9119 -0.2785 0.3033 0.3048 -0.5880 -0.8712 -0.2412 0.2913 -0.9062 -0.1339 -0.5798 -0.2608 -0.5051 -0.7950 -0.2093 0.7068 0.3718 0.1897 0.1107 -0.3917 -1.8513 0.5607 -0.6407 0.4105 0.3375 0.3538 -0.1090 -0.7603 -0.5123 0.0113 0.7307 0.7299 -0.8271 0.7639 -1.9531 -0.3325 0.5911 -2.0783 0.2584 0.2486 1.7733 0.8593 0.4035 -0.9251 -0.2681 0.4155 0.2897 1.2113 -1.3194 -1.1471 -2.8442 0.7135 -0.4380 2.1181 0.3287 0.3159 0.9212 -0.3466 0.5774 -0.3238 -0.0279 -0.4370 0.1912 0.9348 -0.2076 1.7058 0.2862 1.2951 -0.7367 -0.1967 -0.3535 -1.5096 0.6963 0.0989 3.4897 -1.8921 -0.0813 0.1783 -1.3224 0.2025 0.4185 -1.6632 -0.5611 -0.5204 0.1434 0.9450 0.6521 0.6011 0.0326 -0.1342 -0.7276 -3.2339 1.0030 0.4372 -0.8828 -0.4210 0.7985 -0.8433 0.9575 -0.5820 0.1606 -2.3736 -0.4755 -0.1218 -0.3316 0.8130 0.0194 -0.7328 0.2921 tricosanoyl sphingomyelin (d18:1/23:0)* -1.4781 -0.3951 0.6634 0.2365 1.3860 -0.6416 -0.9749 -0.7730 0.0788 -1.1648 -1.8636 0.4066 -0.6052 -2.8727 -0.5176 -0.2069 -0.0531 -0.9116 1.7222 1.2347 0.9432 2.8985 1.3771 -0.6331 0.2601 0.4293 0.4078 1.7649 0.9936 0.9689 2.1395 0.1666 -0.0847 0.6737 0.1392 0.4817 0.5761 -0.3212 1.5827 0.3914 0.7001 1.3608 1.6311 -0.2254 1.2353 -0.2507 1.5238 0.2023 -0.5403 -3.0119 0.3595 1.0674 -0.2448 -2.2980 1.4282 1.0137 1.2419 1.1784 0.5740 0.6944 0.5479 0.6613 0.3259 -0.7508 1.1122 0.0016 0.7944 0.5886 1.5389 0.4037 -0.2139 1.6353 1.0188 0.9664 -0.2507 0.2632 1.3480 -0.7105 -0.4271 0.7254 1.7815 -1.6283 -0.2417 2.1725 -0.4672 -0.5679 -0.4036 -0.1897 -1.7418 0.6130 0.7171 -0.8151 -0.7412 0.3193 -0.2915 -0.9902 1.1706 0.5701 1.7000 0.6919 0.5625 -0.7947 0.5570 0.1707 1.5311 0.4834 -0.5446 -0.5117 -0.9316 0.8382 -0.1055 -0.1342 0.5055 -0.0956 -0.6644 -0.0603 -0.7638 -0.9696 -1.5057 0.4744 -0.1868 0.6457 0.9776 -2.1597 0.7683 1.0251 0.2900 -0.3974 0.1290 -0.6320 -0.1621 -0.6026 0.2415 0.3688 0.3739 -0.8862 -0.4391 -0.7592 -0.3151 1.2564 -1.3569 -0.2817 -0.0396 -0.4438 -0.7887 0.4290 0.7262 -0.9022 0.0248 1.2601 0.5357 0.5457 1.3436 2.3512 0.2921 1.3429 0.3331 1.4960 -1.4777 -0.6872 1.1250 -0.1943 0.2900 1.6948 -2.5094 0.1802 1.0825 -0.0656 -1.1147 -0.2034 -1.0883 0.3936 -1.6506 0.0293 0.1266 -0.8880 -0.5110 1.0674 -0.0390 1.3948 -1.8544 0.1248 0.3434 -0.3383 1.5352 -0.7755 -0.0461 1.0514 -0.3331 0.8395 -2.1023 -2.3816 0.0690 -0.1229 -1.4303 -0.5214 0.3017 0.9262 0.2967 0.0100 0.5101 1.2162 0.2059 0.5728 -0.1261 1.3783 0.9854 0.6518 -1.7021 0.1564 2.2650 0.2346 -0.4524 1.8297 0.5089 0.2391 -0.7457 0.3216 -1.1882 -1.3273 -0.3877 -0.6527 0.4204 -0.4975 0.9223 -1.7862 -0.2071 2.1661 0.5770 0.0231 0.9211 0.7682 -2.4332 -0.0747 -0.5998 0.1816 -0.2532 -1.6880 1.6028 -0.4915 -0.2083 1.0593 0.1585 -0.7656 0.3346 -0.9562 -0.9624 -0.4644 0.0658 -0.0764 -1.4826 0.6929 0.2005 0.0180 0.8343 0.5095 -0.5172 -1.7083 0.9856 0.3428 -0.1779 0.1799 -0.1258 -0.5870 -0.2055 -0.1969 1.1865 0.4314 0.6171 0.2472 -1.0448 -0.7040 0.1375 0.3837 -0.8393 0.7748 1.1979 0.0651 -0.6369 -1.2966 0.7061 -0.9423 -0.1473 -0.8266 0.6484 2.8318 -0.7332 0.1940 -1.0057 -0.9525 -0.1887 0.3729 -0.8643 -1.3200 0.0319 -0.1944 -0.5739 -1.6557 -1.9758 1.0813 1.6293 0.5714 1.1580 0.9442 0.4898 -0.7225 -0.4449 -1.1528 -0.8810 0.4415 -0.0203 1.1938 -1.1076 -0.4301 1.3868 -0.6271 1.0001 0.2669 0.0470 -0.4483 0.9404 -0.3862 2.5300 0.1397 -0.2072 0.1700 -1.0793 -1.0414 0.1314 0.2042 1.6026 -1.0103 -0.6562 -0.2263 0.3526 0.7281 -0.0085 -1.8207 -0.4447 -1.2868 -1.8331 -0.2651 -0.3273 -0.3787 -1.8370 -1.8142 -1.9547 1.8083 0.3684 -0.2603 -0.4440 1.2095 -0.6145 0.0060 -1.2246 0.1218 0.1518 -0.4204 -0.9324 -0.9713 -2.9548 1.2459 1.0134 -1.2161 -0.0390 -0.1534 -0.1342 0.7986 0.9156 -0.0883 0.3852 -1.3035 0.0087 -0.3465 0.0927 -1.4110 -1.0329 1.5748 0.8975 -0.0791 -2.2517 0.5096 -0.3341 -0.6211 -0.1346 -0.4646 -1.6203 0.8637 -0.1909 0.4574 0.4954 -0.7976 -0.3476 -0.4301 -0.2954 -0.1377 -1.7123 0.5574 1.4470 1.4387 0.2799 0.1069 0.3147 -0.2822 -0.0296 -1.2021 -1.7734 -1.7352 -2.2804 -0.6073 tridecenedioate (C13:1-DC)* 1.2911 0.7564 1.7789 1.4359 0.8933 0.6065 1.2278 0.2124 -0.0058 0.2128 0.3233 0.0125 1.2866 0.1656 0.3978 -0.0506 1.1411 0.4363 0.1539 -0.3902 0.4675 -0.0937 -1.8593 -0.2073 1.4707 0.6158 0.5240 1.1600 -2.0614 -0.1144 0.1026 -0.0980 -1.7981 0.0272 0.1490 -0.0484 -0.3184 0.7992 0.1910 0.8976 -0.1726 -1.7270 1.0158 0.3755 0.8874 1.2279 0.3760 -0.6047 -1.1251 -2.2410 0.5391 -0.0419 0.2052 1.3517 -1.9095 0.2859 0.2168 1.4813 -0.2196 1.1733 -2.0758 0.6257 0.8077 -0.9387 0.2660 -0.0116 -0.9384 -0.0253 0.6655 1.1411 1.0395 -0.1572 0.0144 -0.4375 -0.4277 -0.9515 -0.0578 0.3361 -0.5756 -0.4476 0.1049 0.2351 0.0214 0.2845 -0.9093 0.0437 -0.2698 1.4554 -0.6413 -0.0583 0.4065 0.5992 -0.4933 -0.5132 -0.2496 -0.2976 0.1067 0.2334 1.0484 0.9639 0.3206 -2.1827 -2.0847 0.4887 1.0919 -2.1745 0.5827 0.8052 1.9112 -0.1559 -0.0355 0.2958 0.0474 2.1753 0.3660 -0.7997 -0.4762 -2.1950 0.3744 -0.0663 0.3670 0.1627 1.7846 -1.0348 0.5741 0.6618 0.1844 -0.4996 1.1484 -0.3676 0.8170 0.5679 -0.2293 -0.5253 -2.3412 -0.4053 0.8879 0.4861 -0.8246 -1.7341 1.4124 0.2801 1.1138 0.5693 0.8709 0.2806 0.3351 0.5609 -0.3402 0.6238 0.5937 0.5957 0.0893 0.9143 0.1602 -1.2289 1.9791 0.3725 -1.1273 0.1541 0.8611 1.5237 -0.4575 1.6843 -2.2119 1.1644 -2.4448 -1.5940 -2.4824 0.6293 -0.8486 0.3095 0.4428 0.2134 0.8201 1.5225 0.6987 -2.0623 1.1617 1.6183 -2.1906 1.1440 0.9086 -2.3205 -2.0567 0.9623 0.3221 -0.6766 0.1749 -2.1458 1.0782 -2.0890 -0.1280 -0.2366 0.6226 0.3803 -0.1427 0.4568 -1.0226 0.9527 -0.8628 -1.1358 -2.1077 -0.0791 0.4795 0.2140 -2.3441 -1.4638 -0.5491 -0.3894 -0.1489 -0.4470 -0.6302 -0.2492 0.3707 0.2817 -0.6665 -0.3371 0.5947 -2.4846 0.8282 -0.6614 0.0786 0.2468 0.1301 0.8477 -2.5153 0.2438 -0.3889 -1.5290 -1.6842 -2.1263 -2.2259 -0.2582 -0.3408 -0.3582 -0.5782 1.0289 0.6877 -0.1546 -0.5398 0.3219 -0.1989 1.5296 0.6400 0.2342 0.0362 1.2268 -0.9853 -0.7198 0.0152 0.8108 0.6905 0.6630 0.7293 -1.1604 -0.5471 0.5644 0.9026 0.3234 0.0998 -0.5446 -0.0959 0.0943 -0.0514 0.3110 -2.4583 -0.1467 -0.4944 -2.4467 0.1503 0.0084 -0.2406 0.4015 -0.9761 0.1084 0.9663 -0.4111 0.4318 -0.0422 1.0353 -2.5313 -0.8885 0.7711 0.4912 -0.9092 -0.7417 -0.1394 -0.6346 0.2893 -0.1853 -0.2292 0.2931 0.2130 -0.3264 0.1124 0.1660 1.6696 -0.7717 -0.9642 1.3593 -0.1362 0.1964 1.4953 1.1050 -1.3407 -2.4568 0.4508 1.2131 -0.4346 1.0893 -0.6350 -2.4097 0.1978 1.1672 -0.2028 -2.2915 -0.2680 -0.3811 0.6147 1.2408 1.1301 -0.2417 1.0629 0.2422 0.9140 -0.0971 -0.1261 -0.6281 1.0305 -2.1970 2.1322 0.0458 0.6111 0.4927 0.8833 -1.4848 0.3960 -2.5613 -2.1373 0.5870 0.6071 0.8937 -1.1735 -0.9958 -0.4860 0.4097 1.1426 0.2792 0.7036 1.9826 -0.5404 0.1397 1.5526 0.8405 -2.6629 1.1480 -0.6374 -0.3591 0.3322 0.1721 -0.3849 -0.4673 -0.7209 0.8023 1.0883 -0.4975 0.0601 1.0614 0.1404 0.2441 1.2444 0.4923 0.3046 0.5724 0.2788 0.1905 -0.4921 -0.1473 -0.2329 0.2647 -0.6276 -0.3719 1.1171 -1.1624 -0.1400 0.0723 -0.6456 1.1013 1.7732 -0.7602 0.7300 0.1149 0.1894 -0.6861 0.4474 -0.4780 -0.2147 0.6801 1.0095 1.4270 0.1891 -2.2705 -0.1283 1.0288 1.1644 0.6981 0.2155 0.3655 -0.2782 trigonelline (N^-methylnicotinate) -1.7900 -0.3160 -0.4510 -1.9100 -0.4430 -0.6320 1.1700 0.3360 -1.8700 -1.6900 -1.3800 0.3500 -1.0800 -1.2700 1.7300 1.0000 0.5140 -1.7300 -0.4430 -0.0440 -0.6980 0.4880 0.7490 -0.3110 -1.3700 -0.5630 0.9230 0.2850 -0.7590 -0.6620 1.4900 0.3270 0.1960 -0.0537 0.5200 0.5310 0.1170 -1.0100 0.0744 1.0300 -1.2600 -0.5230 1.4800 0.8690 0.5200 -1.1800 -1.1200 -0.5590 1.3800 1.3800 -0.4070 0.7930 0.8140 0.1300 -0.2390 0.6830 -0.5030 1.5500 0.5800 -0.6690 0.6280 -0.2710 1.1100 -0.6960 0.9310 -0.2420 0.9660 0.0000 0.1070 0.4300 0.6570 0.9900 0.9980 -0.1200 -0.3170 -0.0251 0.1870 1.2500 0.1510 0.5320 -0.5870 -1.3900 -1.1500 0.8100 -0.6900 1.9500 0.1220 -1.1300 -0.1820 0.8680 -1.1100 -0.0790 -1.8600 -0.0584 0.5390 0.0311 0.0271 -1.4600 -0.1550 0.1170 -0.2150 0.0841 0.5210 1.9400 0.2410 1.7300 -0.7590 1.5000 -1.4500 0.2950 0.2960 0.1410 0.0738 -1.7000 0.3280 -0.2850 -0.3420 0.8110 1.5100 -0.3480 -1.2200 0.1210 0.3600 -0.0420 -0.2550 -0.0680 1.0600 1.4300 -0.1470 1.0100 1.3500 1.1100 -0.0127 0.0458 0.4900 -0.4150 1.0300 -0.6640 0.9390 0.7540 0.2830 0.0120 1.4500 0.1040 0.1360 0.3920 -1.5000 -0.0083 0.3870 0.0987 0.1960 -1.8900 -0.7890 -0.5820 -1.8800 0.4170 -0.3520 -1.2900 0.6820 -0.9890 -0.8270 1.3200 -0.1870 -0.4350 0.3360 -1.3900 1.8800 0.3080 0.4950 -0.3840 -0.2090 -0.5690 1.6900 0.1030 0.9120 -1.1200 -2.3100 -0.7030 0.1320 -0.8020 -0.4070 0.4250 -0.3350 -0.9060 -0.2280 -1.4100 0.5870 -1.4300 -1.7900 -0.3200 -0.2050 -0.4800 0.2190 -0.8780 -2.1700 -1.2900 2.1400 1.1300 1.0600 -1.7400 1.1900 -0.8420 0.1710 -0.2140 -1.1000 0.4030 -0.7160 -1.3000 -1.4300 -0.8830 0.5370 0.5330 0.3320 2.2500 0.5690 -0.3160 1.5200 0.9520 -0.8110 1.3100 0.3240 1.2500 0.8350 0.3050 -0.0017 0.7300 0.9130 1.4200 -0.2140 -0.4100 1.7100 -0.4480 1.7100 -1.2000 -0.3920 0.2360 0.4750 -1.0000 -0.2560 -0.8230 -0.7610 -1.3100 -0.2850 -0.7490 0.5820 -0.2580 0.7130 2.1300 1.0100 1.4600 1.1300 1.0800 0.4050 -1.2300 -0.3590 -0.3940 0.1300 -1.2200 -1.3500 1.4900 -0.3910 0.3130 0.1270 -1.4000 -0.3520 -0.4970 -0.3550 -1.0400 1.6100 -0.3640 0.2840 0.6470 0.8270 0.2650 1.2100 -0.4400 0.6100 0.9040 -0.1330 -1.4800 0.4570 0.6980 0.9900 2.6300 -0.7340 -1.2700 -1.5100 -1.7200 0.8740 0.3690 0.8520 1.8300 -0.3890 -0.1600 0.5900 2.5200 -0.1530 -0.5220 0.8320 0.2600 -1.4100 0.6590 -1.5300 1.0600 0.7910 1.3200 1.4600 -0.7970 0.0163 0.1110 -0.4010 -0.2760 0.2710 -0.2630 2.3500 0.3150 -0.0324 0.5040 -0.4520 -0.0049 -1.5200 -1.9000 0.2020 -0.0460 0.0479 -0.5700 -0.1490 -0.1120 -0.4780 1.2900 -0.2640 0.0854 2.1400 -0.9020 -0.0107 0.6880 1.7700 -0.9830 0.7210 0.0728 1.8600 1.1000 -0.6690 0.1760 1.4800 -0.9590 -0.5650 -0.5800 -1.3900 -0.3460 -1.6400 -1.5200 -0.6350 -1.6500 -2.1900 -0.5450 -0.0572 0.9830 1.1100 1.5200 0.8420 -0.1960 -1.1100 0.5300 0.8120 0.8160 1.3900 0.5070 -0.4240 0.5800 -0.2550 -1.5000 -2.1000 -1.8200 1.4600 0.3370 1.5400 -1.1400 1.9400 0.0036 -0.3790 0.9790 0.5140 -0.4990 -1.3500 0.2800 1.2200 -1.4500 0.8190 -1.5800 -1.7600 -0.0706 -1.6800 -2.1200 0.0190 1.8200 0.1970 -0.0616 -2.2400 -2.2000 -1.4900 -0.8260 0.1280 0.2670 1.4100 0.0928 -1.0000 -1.1700 0.9550 0.0977 trimethylamine N-oxide -0.5977 -0.7102 0.4321 0.3695 -0.4948 1.1383 0.5722 3.6376 0.2824 -1.9526 0.7289 -0.8461 -0.3451 0.5061 1.5503 -0.6349 -0.7325 -0.1497 0.1125 -0.0740 0.9429 0.8914 0.3606 0.4006 1.0821 -0.0350 -0.1939 -0.0988 1.3445 0.3791 0.6346 -0.7196 -0.4095 0.3895 0.2057 0.2017 0.2257 -0.1709 0.1300 -0.3863 0.0697 -2.1886 0.5157 0.2221 -0.7451 -1.0493 0.8255 0.4423 -0.1541 0.4479 -0.0888 -0.9062 0.5681 -0.4399 -0.2302 -0.7377 0.9341 -0.2323 -0.8312 -0.8880 -0.4880 -0.2849 -0.1009 -0.0203 -0.0865 1.0263 -1.1239 -0.5852 0.1014 0.3361 0.5541 0.7412 0.0497 0.7106 0.8040 -0.6283 -0.0160 1.4835 -1.3361 0.5792 -0.3802 0.4804 0.5492 0.3364 1.4828 0.3052 -0.3920 0.0999 -0.1459 0.8215 -0.5669 -1.0844 -0.9553 0.1453 -0.5348 0.8824 0.3279 -1.7119 -0.2472 1.1800 -0.0148 0.7281 0.2349 -0.6854 0.0477 1.3958 0.1873 -0.6640 -0.2166 -1.6162 -0.0544 -0.0303 -0.0371 -0.5417 2.6562 -0.5086 0.1293 -0.3355 -1.8585 1.2199 0.3306 -1.0645 0.2474 -1.0811 -0.1754 1.4507 -0.7262 -0.1604 0.2741 0.8668 -2.3650 -2.6132 0.2955 -0.0998 -0.9930 -0.8337 -0.7725 -0.1030 -0.0171 0.1424 -0.2829 0.1649 1.0935 1.3921 -0.3667 0.1915 -0.7845 2.9717 2.6547 -1.3340 -1.6370 -0.0450 0.9111 1.2315 0.0316 -2.2796 -1.5802 0.3478 -1.4732 0.6697 -0.7820 0.6628 0.3810 2.7050 -0.7731 -1.0375 -0.3194 1.8440 -0.9539 0.2985 0.9543 -0.2298 -0.3805 1.3368 0.3250 -0.1112 0.1603 0.3069 -0.1901 -0.2055 -1.1695 -0.4890 0.6445 -0.7528 -0.6650 0.8234 -1.2635 0.5691 -0.7835 -0.2309 3.0648 -0.4373 -1.6390 -3.2918 -0.3359 0.6253 -2.7724 0.2895 -1.2177 1.5181 0.9091 -0.5426 0.1116 0.2546 -0.4986 -0.3963 0.1270 0.1970 -0.0746 -0.0293 -0.4480 -0.6131 0.0749 -0.8330 -1.0413 -0.0394 1.8159 -0.2874 0.1027 0.2997 0.2562 2.2391 0.1840 -1.1252 1.0130 2.4434 -0.6649 -0.9295 -0.0581 1.8954 -0.5476 0.1597 -0.3026 1.1789 1.4448 -0.7677 -0.0895 0.4771 -0.0150 -1.0006 -0.4392 -0.4839 1.9329 0.1521 -0.3255 1.5390 -0.5754 0.1266 -0.4856 -0.2681 1.2920 -1.3583 -0.7113 -0.0008 -0.7634 -0.8916 0.1885 -1.3216 2.4899 -1.3905 -0.5372 -1.1373 1.9705 -0.8753 0.1839 -0.5386 0.2854 -0.3753 0.6752 -0.9607 0.6881 -1.1895 -0.3157 -0.7159 -0.0918 -0.6465 -0.1666 1.2290 -0.1877 -1.5793 -0.1617 -0.6768 1.3160 -0.2082 0.6184 -0.4116 0.5422 0.6653 1.9853 0.0018 -0.0343 0.0794 0.0986 -1.9158 -0.5233 -0.1220 -1.1639 1.1045 -0.3175 -0.5653 -0.7351 -1.2450 -0.0635 -1.3803 -0.2717 -0.2152 -1.0289 -1.2266 -0.0722 0.9384 -0.1735 -0.8072 1.0544 -0.0009 -0.1413 1.1733 -1.5374 1.1504 -0.1621 -0.9118 1.5797 -1.4752 -0.8280 -0.1034 0.6878 1.0417 -0.3426 -0.9175 -0.6350 0.8246 1.3090 -0.3954 0.3862 1.5318 0.3367 0.2875 -1.0589 -0.8630 0.0671 -0.3684 -0.8823 0.3610 1.0041 -0.4126 -0.2133 -0.8820 0.0201 -1.0507 0.3874 0.6063 -0.2633 0.1013 -2.0347 1.2310 0.3496 -0.8915 -0.3036 1.2780 0.6716 -0.5177 -0.1404 -0.6199 2.3432 2.0059 1.1575 -0.1742 1.2803 -0.0577 -1.9914 2.3385 0.1944 0.2388 -0.7002 0.2943 0.0376 -2.7113 -0.1779 -0.5053 -0.5653 0.1189 -0.6544 2.0881 -0.1645 3.0372 -0.2576 -0.8244 1.3201 -1.1114 1.2574 0.3770 -1.6898 1.0209 -0.4865 2.3432 0.1146 -1.3356 1.3053 -0.9048 0.0898 0.0968 -1.5302 -0.1313 -0.5910 1.6985 -0.4144 2.3954 -0.0282 -1.1775 0.2577 1.1531 tryptophan 1.7848 -0.0111 -0.3859 0.7324 0.7116 0.4995 1.9791 0.6635 0.7377 -0.4923 -2.2233 -1.9572 -1.5012 1.2057 0.6735 0.3796 -0.2972 0.8144 -0.3054 0.5097 -0.0946 0.6025 -1.0067 0.7914 0.1148 1.1356 0.8208 0.5446 0.2100 -0.6693 0.2386 0.8099 0.8434 0.1007 -0.5778 -0.0469 0.3991 1.2762 -0.6661 0.1739 0.8350 0.3525 1.0941 1.0895 -0.5506 1.2215 0.7257 1.6205 -0.8980 -1.3059 0.3666 -0.5689 -0.3782 -0.2784 -1.3226 0.9809 0.3955 0.0344 0.6772 -1.1208 0.2301 -0.8832 -0.8858 0.5613 1.4944 1.4729 1.2643 1.7698 0.0448 -0.0315 -0.1330 0.4815 -0.6113 -1.1985 0.6657 0.4044 -0.5944 -0.9292 1.0660 0.8499 2.0221 1.3881 0.1568 0.4596 0.0942 -0.7032 0.0189 -1.0281 0.9059 -0.8087 0.2095 -0.3490 -1.2959 0.4968 -1.3071 0.4498 -1.1980 -0.4077 0.7339 0.3171 0.5321 0.7048 1.2409 0.4111 -0.2836 -0.1748 -1.3951 0.4024 -1.2085 0.1956 0.6812 1.0085 0.3085 -0.5672 -0.6309 0.0195 0.6051 0.2868 -0.9680 0.0313 0.2503 0.1721 1.8149 -1.9334 0.5163 -0.1738 0.1990 -0.6435 0.9529 0.6883 1.2540 -1.4131 -0.4618 0.1772 -0.1928 1.7100 -0.6772 -1.1672 -0.3810 -0.3141 -1.8435 -0.0890 -0.2835 -0.1650 -1.3050 -0.9995 0.4802 0.0107 -0.6133 0.5479 0.3755 0.1273 0.0361 -0.2908 0.4945 1.2232 1.2410 0.3934 0.3126 0.1867 1.5055 -0.1297 1.1983 -0.9963 -1.4316 -0.0304 1.1232 0.0388 -0.6859 0.6096 1.2566 0.8477 -0.9837 -0.9341 -1.7743 -0.6963 0.6117 -1.1631 -1.1315 0.1417 0.6140 0.8025 -0.0425 1.0991 0.2025 0.0466 0.1769 -0.5520 -1.9511 0.2347 0.5810 -1.0772 -0.2724 0.8786 1.1707 -0.6674 -0.4379 0.2935 0.0162 -1.5414 0.6300 0.0031 0.6241 1.8390 0.8540 0.2156 0.2151 -0.1004 -0.5978 0.9894 0.2430 0.8301 -0.5421 0.2041 0.1461 2.0586 -1.5813 1.9670 -1.8932 -0.5573 -1.4741 -1.2692 -1.2216 1.0872 0.4431 2.0235 -1.3256 1.4287 -0.4338 0.8396 0.3206 -0.9325 0.4676 2.1414 1.3208 0.6839 1.1082 -1.2125 1.9664 0.6178 -0.9050 -0.6950 0.0608 2.9855 1.2275 -0.3072 0.4550 0.0467 0.7131 0.5472 -1.1482 -1.0081 -1.0966 1.1019 1.6275 0.1134 1.0645 1.0926 -3.6845 -0.4414 1.1117 1.0574 0.3332 0.9854 0.8332 0.4874 1.2682 1.6508 -1.2051 0.4813 -0.4746 0.4637 -0.0430 0.4042 0.4924 0.4442 0.2003 -0.2127 -0.8454 1.2828 0.2695 0.2072 0.8266 1.4952 0.3752 0.6344 0.0383 -0.2555 -1.2754 0.1881 -0.4074 0.6684 1.0133 -1.4244 -0.3160 0.8399 -1.1342 -0.2167 -0.6040 -0.7480 -0.6294 1.7433 2.5132 -0.4699 0.8006 1.9234 -1.5711 0.6012 -3.4558 1.4769 -0.1702 -0.1690 -0.2599 0.2784 -1.8845 -0.7413 -0.9022 0.0107 0.5769 -1.3899 1.5031 -0.8524 0.6218 -1.4149 0.9651 0.3219 0.3198 -0.7891 0.1555 -0.2224 0.7401 0.0600 -0.7474 -1.9149 -0.0308 -0.5125 -0.8110 -0.8309 0.9832 -2.2669 0.6941 0.2886 -0.7586 0.0356 -1.7095 -1.1970 -0.4790 1.0805 0.4398 -0.5378 0.3594 -0.5765 -0.8404 -0.1746 -0.6234 0.1099 -2.5956 0.0918 -1.4608 -0.8771 -2.0861 -0.9751 -0.1437 -0.1617 -0.3592 -0.3994 -0.7429 1.4512 -0.9942 -1.8662 1.1829 0.1812 -0.7566 0.6124 -0.5223 -1.8185 -0.7344 -0.1738 -1.2109 -1.8118 -1.5907 -1.1814 -0.2639 0.1976 1.5708 -0.6331 0.2677 0.1158 -0.9460 -1.6855 0.4476 0.9444 1.0522 1.2111 -0.7790 -1.1016 -0.3429 1.0412 0.5517 0.8946 -1.2583 0.4068 -0.0067 -2.0204 -1.8491 -0.5239 -1.3381 -0.1659 -1.3669 -2.9612 tryptophan betaine -2.2047 -1.3549 0.0468 -2.1009 -0.4138 -0.4271 1.5407 0.9585 0.4375 0.1781 -1.0627 0.9737 0.3375 -1.4269 0.5260 1.4770 0.7244 -0.8362 1.1082 0.2774 0.8512 1.1534 1.3250 0.6380 0.4770 0.6671 1.8435 0.7572 -0.5081 0.2883 1.1065 0.7849 -0.3481 -2.0722 1.5146 -0.5887 1.1820 0.8936 0.2474 -0.6222 0.5640 1.5962 1.2412 -1.4853 0.5861 -0.2009 -1.4498 0.3330 0.9296 1.9982 0.3807 1.4328 1.1806 -1.2149 -0.3149 0.5674 1.3275 -0.7492 -1.0301 0.0835 0.9387 0.9945 -0.2307 -0.3302 -1.5626 -1.6280 0.5669 -0.3516 -0.2425 1.9410 0.7476 0.9547 0.5409 -1.4223 0.2314 -0.7743 0.6353 1.1094 -1.7437 -0.3711 -0.5407 -1.7058 -0.1618 0.6277 -0.5517 1.9069 0.0359 -0.1681 0.0374 1.0746 0.3847 1.6342 -1.6254 -0.1399 1.0334 -1.4106 1.1040 0.1620 -0.1139 1.5989 1.3433 1.4798 1.1854 0.5894 0.8636 -0.0763 0.0957 -0.7025 -0.4585 -1.1052 -0.5583 -0.5362 -0.5429 -0.9430 -1.8403 0.4831 0.9273 -1.4738 0.0557 0.6736 1.0142 0.7554 1.1619 0.2256 1.1314 -1.9229 0.4464 0.4986 -0.5393 -0.8889 0.8537 0.0673 0.8599 0.2534 0.5408 -0.6623 1.3491 0.4013 0.4741 1.3687 0.9547 1.1767 -1.3054 0.3152 0.2678 0.5245 0.1364 1.5114 1.1822 1.0594 0.4246 0.2795 -0.8692 -0.2259 0.0529 0.3112 -0.1209 0.3280 0.1697 -0.6972 -1.5834 -0.8079 0.2613 0.3530 -0.0129 0.8622 0.7771 0.4887 1.0014 -0.0363 1.5549 0.4371 1.2373 0.9372 0.7352 -0.1235 -0.7360 0.2290 1.4267 0.0465 0.4503 0.3486 -0.3469 -1.3751 1.1927 -0.1029 0.7376 -0.3171 -0.8954 -0.8421 -0.2182 -0.4459 2.1390 -2.5372 -0.3134 -1.9934 -0.2920 1.3633 -1.5049 0.5678 1.4098 -1.6053 0.8811 0.4561 0.5920 -0.1895 0.4203 1.0478 -0.5385 -0.1241 0.5679 0.1393 1.6364 -0.4058 -0.9420 0.3295 1.4059 -0.2453 0.3054 -1.1302 -2.5658 -0.5986 -1.0920 -0.0047 1.3160 -2.2407 1.4433 1.2226 0.7787 -0.3671 -0.7272 -1.8575 1.3847 -0.4063 1.3864 0.3303 -0.9773 -0.7356 -1.6419 0.0867 -0.7453 -1.5448 0.8533 0.1864 -0.5402 -1.5167 -0.7801 0.4568 -1.7079 -0.7154 -0.4155 -0.1436 1.3904 1.0117 -1.3271 0.1266 -0.1346 0.6847 -0.9643 0.3208 -1.6705 -0.1685 -0.3388 0.9223 -0.8210 -0.5211 0.0983 -0.1094 -0.6818 0.5581 1.2236 -0.2529 -0.0360 0.1138 -1.7551 1.2696 0.8097 0.9011 0.7231 -1.0501 0.8933 1.2240 -2.4158 0.6460 0.2258 -1.0790 0.1047 -0.8847 -2.8089 1.2930 -0.1577 0.4936 0.0306 -0.3032 0.7151 -0.2701 0.9286 -0.8128 -0.1905 1.4238 -2.3413 0.1640 -0.6230 0.0138 0.2551 0.1148 0.9961 0.3389 -1.2701 0.5338 -1.4438 -1.5673 -0.5110 -0.1629 -0.1122 0.2654 0.0376 0.3227 0.0793 0.3652 -0.2666 -0.9819 0.3947 -0.1998 0.0970 -0.1083 -1.2145 -3.0806 -0.7018 0.6221 0.3996 -0.1471 0.8527 -0.9749 0.9122 0.8550 0.4967 -1.8232 0.3260 -2.1946 -0.0718 0.5343 -1.5534 0.3884 -0.4991 -1.3058 -1.2411 -0.8332 -1.1516 0.2356 -1.0052 -0.2062 -0.2568 -0.9708 -0.5283 -0.3195 0.3247 -0.9397 -2.8757 1.1299 -0.0459 1.3831 -2.4034 1.3973 -0.5671 -1.6382 -1.1711 0.2934 -0.3823 0.8852 -1.8730 0.0396 -0.2590 -2.4414 1.4741 0.0500 -0.8596 0.6359 -0.1073 1.1171 0.4282 1.3042 0.8401 -0.2558 0.0431 1.2946 1.0045 0.1354 -0.8823 0.9521 -0.4656 -0.2457 -1.0629 1.7690 1.1274 -1.3517 -0.7216 -1.3920 -0.4182 -0.6276 -0.6973 -0.5964 0.8175 1.3077 0.7379 -0.1548 -0.7361 0.2241 0.3818 0.3342 tyramine O-sulfate 2.0066 0.5033 -0.6815 2.2710 0.7661 -0.1853 1.4753 0.1107 -1.1160 0.2583 0.8409 -0.3489 0.6930 -0.0479 -0.4548 -1.1467 1.4708 0.4483 -1.0224 -0.8590 -0.9091 -1.4371 -0.7338 -1.0444 -0.2559 -1.0365 -1.2311 -0.9607 -0.9056 1.4706 -1.2457 -0.9154 -0.1730 0.9337 -0.2818 -1.0755 -1.0121 -0.8327 -0.0317 -1.2472 -0.8219 -0.6326 0.1195 1.1993 -0.9164 -1.2618 -1.0674 0.3764 -1.0390 0.1031 -1.0381 0.1107 -0.9893 1.0576 -0.7705 -1.2084 -1.0725 0.7021 -1.1088 0.7690 -0.9194 1.1749 2.3015 -0.9649 1.1179 0.3229 0.5579 0.5995 -0.1789 -0.8973 -0.0466 -1.1851 0.8667 1.0325 0.8415 -0.4799 1.6196 0.6919 0.7420 -1.1081 1.6287 1.6528 -1.0560 -1.2287 1.1855 -1.1728 -0.9168 1.0263 -1.2513 -0.7903 -1.3865 0.7122 -1.0043 1.4322 -1.0134 0.5048 0.3972 -1.0119 0.7363 -1.1752 -1.2017 0.7069 -0.9354 0.8949 -0.9594 2.6688 1.0892 0.6014 1.1158 1.0692 -0.6317 0.9509 0.2504 0.2301 0.7775 -0.3768 0.2684 0.0007 0.2578 -1.2875 1.1511 -1.0105 -0.2124 -0.7881 0.3382 0.1432 -1.1987 0.9450 0.2125 0.7319 0.5338 0.1448 -0.7933 0.4507 0.2943 0.2604 0.0006 0.8671 -1.0906 -0.6376 -0.4876 -0.0944 -1.0125 0.5336 -0.9397 -1.1260 -1.0551 0.8512 -0.9685 -0.9314 2.1886 1.9849 0.9464 -0.1802 0.0958 -0.9035 0.8320 -0.8903 -0.1777 0.6638 0.2571 0.2886 0.7325 -0.0568 0.1546 0.3189 0.4541 2.0026 2.5952 -1.0640 -1.2461 -1.0834 0.6202 -0.8684 -1.2232 0.9779 1.8702 -0.8800 -1.0087 -0.8592 0.0259 -1.3315 0.8189 1.4383 0.8662 1.1592 0.3079 -0.9944 0.5539 0.5256 0.1487 -0.1257 -0.9777 -0.9218 1.0401 0.1762 -0.9999 0.3939 -1.0913 -0.8069 -0.0972 0.4070 -0.6351 -1.0422 1.6524 -0.7914 -0.7231 -0.4343 0.7736 0.3700 0.2643 0.0140 -1.3016 0.8118 0.7436 1.5692 2.4038 1.4207 2.1345 0.1603 0.4183 1.0729 0.3877 0.4214 -1.3903 2.0944 -0.6471 2.4367 0.7647 -1.0493 0.6770 0.6124 0.3160 -1.1794 -0.2154 1.0027 1.0782 0.0213 -0.0373 0.1712 -1.1295 0.2380 -1.1097 0.6089 0.3332 -1.0816 -0.5267 0.5954 1.1304 -1.1652 -0.2849 0.3697 0.1752 -0.4792 -1.1689 -0.0392 1.1754 0.1545 -1.0549 -1.2469 2.5323 0.5628 -0.4282 1.6012 -0.1994 1.4111 -0.2604 1.2847 -1.0368 0.7743 1.6899 1.1459 -1.2378 0.2575 0.6687 -0.5070 -1.1525 0.2617 -0.7908 -0.8769 0.0778 -1.2470 -0.6793 -1.2602 -1.3472 0.2743 -1.2019 0.5116 0.6348 -0.1311 1.0868 -1.2907 1.6873 -1.2727 -0.1293 0.2396 -1.1814 0.3915 0.5926 -1.2165 0.8702 -0.4775 1.6093 -1.2272 -1.1038 0.8438 0.6427 -0.5198 -1.2252 -0.3897 -1.0468 1.4576 0.6843 -1.2422 -1.3469 0.1387 -1.0624 -1.1144 -1.0294 0.3463 0.1841 -0.2619 2.1018 -0.3501 1.2840 -1.3939 1.2202 -1.1059 -1.1651 0.3175 -1.0083 1.2221 -1.0892 0.0194 -1.1416 -0.1881 0.1783 -0.0957 0.0468 -0.9291 0.1820 0.1252 0.6077 0.1859 1.0020 1.8940 1.8058 2.6159 -0.4725 1.2635 0.6694 1.6596 -1.1844 -1.3788 0.4415 0.6743 -1.3113 0.2578 0.6218 -0.5697 -0.0578 -1.1789 1.1845 -1.4332 -0.8798 0.9179 2.2085 0.3201 -0.7963 -0.4752 -0.9998 -0.6977 0.8512 0.1027 -0.1826 0.2101 -1.4824 -1.2856 -1.2492 -0.7001 -1.1144 0.5837 -1.4411 -1.4250 0.4027 -1.4624 -1.4621 0.4503 -0.2775 1.1717 1.2134 1.1919 1.3597 -1.2051 -1.2828 -0.6103 -0.2991 0.1153 0.4029 1.1041 -0.3418 0.9156 -1.0480 1.3559 -1.3498 -1.4620 -0.0718 1.8105 0.3014 0.6908 tyrosine 1.7977 0.3605 0.2829 0.9323 -0.5938 0.5018 1.2692 1.2929 1.2983 0.6099 -0.2676 -1.0546 -2.3049 0.8330 0.8919 -1.0153 -0.2969 -0.1826 -1.2527 -0.7493 -1.9943 -1.1058 -1.2369 -0.8564 -1.3253 -0.1114 0.2428 -0.5359 -0.7088 -0.0817 -1.5403 -0.4892 -0.3101 -0.3846 -0.3331 0.6101 0.7082 0.0449 -1.3478 -0.1247 -1.1059 -2.4825 0.5920 0.2194 -0.8809 1.5617 -0.5940 0.4426 -3.1284 1.2436 -0.3632 -0.9948 -1.3259 1.1225 -2.3424 0.0744 -1.2672 -0.9271 0.0938 -0.9193 -0.9883 -0.4012 -2.1878 1.4470 0.6879 0.9353 1.3484 0.1805 -1.0569 -1.1386 -0.4237 0.2486 -0.5685 -0.2997 1.1173 0.9934 -1.1970 -0.2636 1.1223 1.2110 0.8391 0.9739 0.7920 0.0717 1.3379 -1.7315 -1.4855 -0.3015 0.4463 -2.2801 -0.3997 -0.7505 -1.1261 -0.2092 -0.6916 -0.7610 -0.4969 -1.0591 0.3288 -1.2866 -0.7022 0.9013 -0.2413 0.6409 -1.0372 0.0879 0.0471 0.5734 -0.6228 -0.1311 0.4022 0.7597 -0.4338 -0.1306 0.5131 0.8899 -0.4245 0.4757 0.5959 -0.6179 1.1735 0.5162 -0.5632 -1.6413 0.6337 0.4037 -0.0043 1.0694 0.4334 1.4742 1.0645 -0.3543 -0.2395 0.1973 0.7946 1.9230 -0.8015 -1.7766 -1.9947 -1.1468 -0.6027 -2.6279 -0.4503 0.5846 -1.4936 -0.3647 -0.4550 1.3229 -2.2009 -1.0729 -0.4788 -1.2144 -0.3278 -0.7714 -0.0761 -0.2474 0.7355 -0.1060 0.4156 -0.1701 2.1322 0.4388 1.8769 -1.9770 -1.5261 -0.1897 1.0158 0.7995 -0.1482 -0.2691 1.6164 -0.8052 0.2322 -1.6017 -1.0560 -0.2453 1.3091 -2.0326 -2.0218 -1.0929 0.8728 0.6678 -0.3515 -0.4012 0.4139 -1.2313 -0.0903 -1.7756 -1.5906 0.1624 0.2885 0.4816 -1.6944 -0.7506 1.2719 -1.0997 -0.1657 0.0481 -0.5465 -0.7712 -0.6075 -0.0621 1.3436 0.7539 1.8929 -0.4263 -0.4555 -1.0070 0.0344 -0.0321 -0.2408 1.0456 -1.5134 0.0845 1.3644 1.9250 0.3644 2.4258 -1.5673 0.4477 -0.8638 -0.1342 0.0090 1.4068 0.5344 2.5870 -0.3824 0.3501 -0.3388 1.2605 0.6145 -1.3863 -0.5569 0.6289 0.6304 0.3288 0.8476 -1.0835 1.4191 0.9349 0.6192 2.0040 0.0764 2.6365 1.0238 0.4639 1.6608 0.4000 0.3262 0.1543 -0.5749 -0.4832 -0.6657 1.9790 1.5088 0.0230 -0.0390 1.0454 -1.3219 -1.7566 0.3353 0.1172 0.6982 1.8372 0.4386 0.3543 0.8019 1.8131 -0.2539 -0.4296 0.3057 0.6627 1.2465 1.3781 0.2086 0.5657 0.2350 -0.4682 -0.1857 0.5132 0.4460 -0.7359 1.1170 0.4714 -0.1783 0.3768 -0.0474 0.3925 -0.2010 0.5213 -1.0504 -0.2666 1.3549 -0.1735 -0.0184 1.7786 -0.2355 -0.4529 0.9324 -0.8551 -0.0247 1.8612 1.3184 -0.7218 0.4334 2.3522 0.3053 0.1333 -0.9695 0.4180 0.4213 2.0099 2.2925 0.7785 -1.7391 -0.1531 -0.7958 -0.0081 0.9437 0.9487 -0.8608 -0.0014 0.4877 -0.0147 0.3985 -0.8361 0.0105 0.0894 0.2907 -0.3650 0.0279 0.1868 -0.0436 0.0512 -0.9699 0.4133 1.9258 -0.4097 1.9572 -0.2821 0.9837 0.5558 0.5385 0.0983 0.0745 0.7978 0.7209 0.0336 -0.9202 -0.2122 -1.0341 -0.3753 0.3666 0.8798 1.0379 0.6462 -1.5273 -0.7369 0.0751 0.1494 -1.5947 -0.5879 -0.4778 0.2993 0.0307 -0.4773 -0.3498 1.9259 -0.3200 -1.7619 -0.0557 0.7698 -0.7274 1.8469 -0.8573 0.6577 -0.7168 0.9683 0.0309 -0.4527 -0.9026 -0.6976 -0.1289 0.2581 1.6550 -1.0960 0.1402 -0.9944 -0.3668 -0.5312 -1.6786 0.7348 2.2490 0.5943 -0.9179 -0.0484 -0.4816 1.5011 -0.2987 -0.8069 -0.4966 1.1864 -0.0543 0.2735 -0.7606 0.9204 -0.8282 -0.1324 -1.1366 -1.0894 undecanedioate (C11-DC) 1.0619 0.5620 0.9664 0.9236 -5.0108 1.5140 -0.7988 1.2435 1.2078 1.4941 1.6999 0.9279 -0.9311 0.7766 -0.3082 0.3138 1.0925 -0.1506 0.2303 0.3641 -0.2288 -1.3197 -0.0632 -0.4486 -0.5883 -0.2224 0.2245 -5.3887 0.6442 1.2631 0.3062 -0.2153 -1.1955 -0.7857 -0.0218 1.6994 0.1988 0.7007 0.3775 -0.7993 0.3999 -0.1287 -0.2590 -0.6454 -0.8033 -0.6329 -0.1902 0.4102 -0.0517 1.1411 0.4284 0.6555 0.4555 1.3450 0.5120 -0.0805 -0.1055 -1.1526 0.7441 0.0403 -0.3996 0.3348 0.6347 1.6960 -0.4040 -0.9956 0.2838 -0.8399 -0.6220 1.0999 0.1974 0.2772 0.7621 0.3686 -0.3216 0.0725 -1.1914 -1.8870 0.4528 -0.1791 -0.8356 1.5968 1.1949 -0.1105 0.1898 -0.0324 0.4880 -0.3251 -0.4080 0.2869 -0.3484 0.7674 -0.2862 -0.2682 1.1806 0.0566 -0.5622 1.0249 -0.6625 0.3025 0.8310 0.3052 0.4565 -0.5061 -0.5730 0.3582 1.6160 -0.4165 0.9134 0.8547 1.1970 0.5200 -0.6695 1.2851 0.6344 0.9833 -0.6109 -0.2434 1.1773 -0.7656 0.8997 0.0703 -0.3848 0.1806 0.3491 0.5157 -1.0725 -0.4016 -0.4142 -0.1826 0.4200 0.3551 -0.2003 0.1188 0.2765 -0.6245 -0.1446 0.3070 -0.4504 0.4784 1.3110 0.0830 -1.0808 0.3936 0.7147 0.4030 -0.7676 0.6691 -0.6144 -1.8803 -0.6440 -1.6550 -1.3173 -1.1382 0.2729 0.1284 0.5726 -0.4146 0.1439 -0.4905 1.1682 0.2112 0.1738 0.5374 1.3986 -0.4121 0.4773 0.2982 0.6172 0.7260 -0.2697 1.6043 -0.0105 1.7496 1.0815 -1.1832 -0.3939 1.0389 -0.1104 -0.3262 0.0555 0.1347 0.1862 0.0825 -0.2447 0.6786 0.8391 -0.1733 1.2598 0.1299 0.5317 1.7236 0.0210 0.0260 -0.6951 0.6499 1.1576 -0.8812 -0.3178 -0.6010 -0.2200 0.4723 0.6254 -1.5422 -0.2532 -5.1876 -0.8888 -0.0730 0.7851 0.0301 -0.2848 -1.1502 0.2951 -1.3381 -1.0136 -0.3046 0.9856 0.6526 0.0881 0.9188 0.3777 0.2955 -0.2694 1.7750 -0.1591 -0.6200 1.2117 0.3718 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1.2511 -0.1584 -0.9865 0.1030 -5.6572 0.0948 -0.7727 -0.4031 0.8839 1.1503 1.1412 0.0757 -0.3356 0.9853 -0.1615 1.8101 0.7483 0.5539 1.8424 -0.2835 1.4379 -0.3448 -0.7816 0.7212 -0.8915 -0.7552 -0.6741 -0.4458 0.5276 -0.9590 -1.1067 -0.1877 -4.7884 -0.4836 0.5130 -0.0304 0.4049 -0.2002 -0.5575 -1.2152 0.4369 1.0022 1.5152 0.2467 0.3399 0.2998 -0.0298 -1.4674 1.0931 0.6387 undecanoate (11:0) 3.0194 0.8656 0.9117 1.0289 -1.5557 2.4002 -0.8189 1.7889 1.3488 1.9909 1.7317 0.2370 0.8270 2.7993 -0.4120 0.8813 1.0548 0.1414 0.8788 0.6704 -0.7065 -1.3212 0.0168 -0.5149 -0.1972 0.1335 0.7730 -2.3340 0.2096 0.6527 0.2965 -0.3605 -0.0151 -0.1258 -0.0737 1.4978 -0.2082 0.5127 1.1690 -1.7393 0.3169 1.0007 0.0092 -1.2894 -1.1340 -0.6783 -0.2026 -0.0900 -0.8296 1.1518 0.3503 0.2781 0.5514 0.2103 0.4422 -0.4605 -0.0215 -1.1523 0.7771 -0.8415 0.3095 -0.4669 1.6129 3.3305 0.1159 -0.1033 0.5899 -1.0824 -0.3894 0.7789 -0.0291 -0.1327 1.0642 -0.4435 -0.2222 0.1794 -0.1362 -2.2659 0.4348 -1.1186 -0.6254 1.5180 1.5802 0.0206 0.0050 -0.8412 0.8919 -0.0018 -1.0664 0.8872 -0.5136 -0.0037 -0.5495 -0.4309 0.4036 -0.5086 -1.1077 1.6343 -0.7088 0.3064 0.7698 -0.2120 0.5584 0.2899 -0.4552 1.4645 1.6108 0.1474 1.9441 0.8657 0.6689 0.3728 -0.2902 0.9249 -0.1660 0.9169 -0.6457 -0.3127 1.0498 -1.1383 0.6319 0.0594 -0.6282 0.2349 0.5747 -0.4456 -1.8122 -0.3053 -1.5112 -0.3402 0.5363 -0.6217 -0.8230 0.2218 0.1360 -0.4952 -0.9441 0.6395 -0.8054 1.3258 1.0970 0.1815 -1.4541 0.4555 0.4963 0.5697 -0.4059 0.5723 -0.7689 -1.2604 -0.3865 -1.1652 -0.6525 -0.9949 1.1071 1.3613 -0.0549 -0.2824 0.5054 1.1650 2.5287 0.0720 0.0757 0.7444 1.6471 -0.4100 0.3328 0.0154 0.2003 0.3181 -1.0588 2.0415 -0.7477 1.9207 0.5382 -1.7206 -0.6040 1.3728 0.0300 0.1703 0.0383 0.1590 0.8323 -0.0309 0.3783 1.2560 1.4618 -0.0485 3.0263 1.0749 -0.3070 1.4622 -0.2584 0.5067 -0.6354 0.3854 2.2559 -0.6041 -0.9173 -0.2562 -0.1613 0.9462 -0.2310 -1.1974 -0.3259 -1.4051 -1.1594 0.6685 1.5656 0.7216 -0.3566 -1.1868 0.2161 -0.1640 -1.4168 -0.8461 0.0268 0.3286 -0.6673 0.7238 -0.3059 -0.1845 0.7003 2.5295 -0.6823 -1.0550 -0.3296 -0.6924 -0.8303 -0.6479 0.1771 -0.4216 -1.4816 -0.8358 -1.4835 -0.4300 1.2365 0.2636 0.3837 -0.9547 1.1449 -1.1534 -0.0711 -0.2589 -1.0912 1.5840 0.4241 1.5973 0.1536 -0.4486 0.3431 -0.3615 0.4358 -0.4484 -0.5489 -0.1544 0.0638 -0.7357 -0.9212 0.4956 -0.8010 0.3933 0.5002 -0.0910 -0.6739 -0.5415 1.0658 0.9320 0.1544 -1.2481 0.7328 -0.6244 0.0010 -0.5407 -0.8315 1.1963 -0.7799 -0.5886 0.9254 -1.1307 -0.8465 0.5521 -1.7153 0.1670 -0.4701 -0.5863 -0.2002 -0.9587 -0.2166 -1.1562 -0.6363 -0.6271 0.8809 1.4287 1.7116 0.0766 -0.2151 -1.5742 -1.2192 -0.9937 1.2617 0.0629 -1.6145 0.0456 -0.9967 -1.6732 -0.2416 -0.9966 -0.4544 -0.4516 -0.2222 -1.1156 0.1001 -1.1075 -1.9945 0.9183 -0.5097 0.6618 -0.1144 0.1014 0.3188 1.1860 -0.7951 -0.6930 0.2957 -0.7442 -1.4347 0.2242 -0.6440 -1.2917 0.3151 -1.4970 -1.7127 1.8339 -0.6494 0.0817 1.3589 -0.9180 -0.8765 2.0678 -0.4380 -1.9116 0.3183 0.0064 -0.2577 0.7419 0.6580 -0.8833 0.0722 0.1725 0.8178 -1.0880 3.3687 -1.0963 0.1956 -0.7077 -0.1457 -1.2345 -1.0024 0.6496 1.2101 -0.8567 -1.3698 -0.8781 -2.7782 -0.1103 -1.1401 -0.7872 1.0208 1.1474 1.8234 0.6404 0.4523 1.7856 -1.5324 2.0625 -0.2357 0.3600 1.7643 -0.7439 1.8001 -1.2493 -0.7287 0.1790 -1.7423 -1.7979 -0.4812 -0.0990 -0.0648 -1.7272 -0.9000 -0.5585 -1.3398 -0.3232 0.3719 -0.4828 -1.0860 -0.0693 -1.0461 -0.0827 0.2594 0.4503 2.4014 -0.8831 -0.3454 -0.4926 -1.1172 -1.1792 1.1204 0.4417 uracil 1.0868 -0.3826 1.9731 0.9845 0.0455 3.6497 -0.4910 3.9202 0.8171 3.3362 3.1662 0.1920 -0.5661 0.1502 -0.5914 -0.3928 1.1981 0.3005 0.0048 -0.2351 0.1945 -0.8079 0.0819 -0.3958 0.0289 0.8235 -0.0079 0.4159 0.3439 0.1582 -0.7059 0.1858 -0.1592 -0.8204 0.6479 3.0774 0.0477 -0.3116 -0.4577 -0.2837 -0.1029 -0.1827 0.9124 -0.1710 -0.0251 -0.0033 0.7100 -0.2384 -0.1217 -0.0272 -2.0769 0.5912 -0.5717 2.0851 -1.7717 0.1647 -0.3834 -0.2556 0.1978 -0.2056 -0.4646 -0.4244 -0.7755 3.4049 -0.3403 -0.2995 2.1123 -0.2201 0.0514 -0.4437 -0.1953 -0.2805 0.2125 -0.3312 -0.5455 -0.4702 -0.7367 -1.1262 0.4150 -0.1882 -0.3255 1.4395 0.1324 -0.1792 1.6381 -0.5022 -0.1705 0.1113 -0.1409 0.4571 0.1476 1.0178 -0.9216 0.2277 1.3630 -0.1180 0.4224 0.5551 -0.2943 0.0034 -0.1669 0.4696 -0.1537 -1.0669 -0.5013 0.4752 3.4121 -0.8199 0.8045 0.4459 1.4337 1.0930 -0.5747 1.0535 1.3888 0.0996 -0.1983 0.0342 0.8786 0.0404 0.8005 0.3924 0.1053 0.0488 -1.1241 0.8098 -0.5103 1.1273 -0.3188 -0.8454 0.1934 0.8542 0.5048 0.1596 0.2360 0.0719 -0.3596 0.3703 -0.5009 -0.0654 1.2404 -0.7814 0.5898 0.4128 0.1780 0.2081 -0.7150 0.2876 -0.4472 -1.4749 0.2234 -0.7141 -1.9752 -0.7077 -0.9529 -0.3795 0.2267 0.1596 0.5738 -1.5865 2.7473 0.1278 1.2521 -0.6346 1.2769 -0.2820 -0.1882 0.2627 -0.1580 -0.4671 0.4247 0.2052 -0.7525 1.5612 0.2377 -0.4706 0.0103 0.0523 -0.1081 -0.3219 -0.0794 -0.6182 -0.8110 -0.0046 -0.2778 1.7201 2.0624 -0.4515 0.2893 -0.6748 0.4426 3.0932 0.3909 2.0054 -1.0073 0.3057 0.0971 -0.7907 -0.1180 -1.1753 -0.0530 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0.1794 0.2115 -0.1618 1.6194 -1.2479 0.5815 0.1413 -0.9601 -1.4042 0.5266 -0.4896 0.6321 1.3475 -1.1713 0.0621 -1.2005 -1.3811 -1.4377 0.0763 -1.3916 0.5203 0.5538 0.9193 0.3497 0.3941 -1.5694 -1.4858 -1.3415 0.9036 -1.3200 -1.2151 -0.2929 -0.1061 -1.4364 0.2638 -0.9682 -1.3775 -1.4271 0.6929 -1.3432 -0.0265 -0.1581 -1.4863 0.6217 0.1732 0.0177 -1.1356 -1.3415 0.9765 0.3870 0.3227 0.7271 0.3765 -0.0191 -0.0885 0.3707 0.4650 -1.3607 1.4845 -1.1198 -1.2238 0.6499 -1.2512 -0.1637 0.5081 -0.3813 -1.3970 0.8516 -1.2000 -1.5467 -1.4009 0.9724 1.2416 0.8343 0.6763 -1.3571 0.6288 1.0620 2.0269 0.8045 2.7813 -1.5238 0.0850 0.1873 -1.4628 0.2475 0.1961 0.8547 0.6172 -1.3215 -1.2259 -0.2626 -1.2997 0.5259 -1.4350 -0.0106 1.2798 0.7430 1.6264 1.4232 0.8638 2.0947 -1.5650 1.6178 0.2155 0.2874 -0.0693 -1.3369 -1.2500 -1.5573 -1.5535 0.1474 -1.6077 0.0174 0.0815 -0.2112 0.9240 -1.5243 -1.0216 -1.1735 -0.8421 0.4314 0.2542 -1.4286 -0.5474 0.1072 -0.0397 0.6617 0.1786 -0.7227 1.1141 0.3183 0.1086 -0.1202 -1.2627 0.3189 0.2389 0.2372 valine 0.6783 0.2800 -7.7923 0.3952 0.0096 0.4399 1.0621 0.9080 -0.1064 -0.1198 -0.4331 -0.4635 -0.3060 0.5766 -0.6819 0.4468 0.4758 0.5433 0.1538 -0.1975 -1.0292 -0.1372 -0.6314 -0.2125 -1.5086 0.1211 0.6544 0.4651 -1.0096 -0.1578 -0.2616 0.2299 0.0306 -0.0315 0.2092 -0.6834 0.1929 0.3224 -0.7049 0.4767 0.0983 -0.7358 0.6129 -0.5440 -0.2125 0.9754 0.3347 0.3972 -0.8687 0.0594 -7.3234 -0.0197 -0.5535 0.1389 -0.9654 -0.3398 -0.4915 -1.4234 -0.3045 -0.7381 -0.2261 0.4430 -0.2357 0.5028 0.6707 0.8278 0.7068 0.2539 -0.0194 -0.2606 0.2562 0.7622 -0.4208 0.2833 0.5407 0.8653 -0.5366 0.3012 0.7759 0.9990 0.9428 0.9790 1.2470 -0.0075 0.8319 -1.0358 -0.7123 0.4092 0.9678 -0.9356 -0.6193 0.2911 -1.0177 0.5833 -0.1529 -0.1607 0.0241 -0.1430 0.1391 -0.0338 0.1021 0.8802 0.3904 0.3405 -0.8586 0.0751 0.1592 0.4111 -0.4223 0.1457 -7.5972 0.8984 -0.4383 -6.8505 -7.7476 0.3548 0.2566 0.3964 0.3151 -0.2279 0.4107 0.0997 -0.1078 -1.0481 0.8586 0.5664 0.0498 0.3603 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0.9771 1.0062 0.0971 -0.1581 0.0710 1.1219 0.0387 -0.7903 0.0210 0.1716 0.0775 0.1709 0.7118 0.6030 0.2840 -0.5856 0.2000 0.0635 0.8585 -0.0369 0.5349 0.3950 0.1515 0.2611 -0.1857 0.2919 0.2283 0.2740 -1.3235 -0.1412 0.7817 -0.0019 0.4986 0.7537 0.0858 -0.0205 0.2723 -0.6921 0.3266 0.6782 1.0467 -0.5584 0.1030 0.9517 -0.0141 -0.3040 -0.7127 0.8898 0.5692 0.7118 0.8977 0.2703 -0.3707 0.2409 -0.2660 -0.1431 0.6331 -0.0269 0.1961 -0.3373 0.0399 -0.2489 0.5171 0.4045 0.1865 0.1297 0.3331 0.2876 0.2816 0.1342 -0.2042 0.0460 -0.4936 -0.7586 0.6649 -0.4171 -0.1520 -0.5227 0.5843 -0.1779 0.1940 0.3898 -0.5378 0.0234 -0.5914 -0.2414 -0.0990 -0.3512 -0.7688 0.2212 0.0971 0.6687 0.6295 0.4737 -1.3996 0.2328 -0.1109 0.0610 -0.6482 -0.3681 -0.3088 0.1361 -0.1879 0.1634 -0.5040 0.9952 -0.0930 -1.0066 0.5399 0.2031 -0.8223 0.6492 0.2330 -0.2120 -0.9803 0.1836 0.3148 0.7233 -0.3727 -0.3555 0.3389 0.8616 0.2022 -0.2171 0.4056 -0.3306 -0.0822 0.4009 -0.4356 0.7698 0.8169 0.6737 -0.1730 -0.1376 0.2465 0.8357 -0.3106 0.0076 -0.4440 0.6246 -0.0294 0.3517 -0.7846 0.4499 0.0371 0.0884 -0.4107 -0.7048 valylglycine -0.5824 0.7942 0.5255 0.9972 0.1699 -0.9507 1.5450 -1.0065 -0.9227 -0.5310 -0.7211 0.4879 -0.8107 -0.9194 0.2960 -0.9506 -1.0653 0.4953 -0.8228 1.1704 0.5029 0.4629 -0.5241 1.6090 1.0637 0.8648 -1.0403 1.5794 -0.7003 0.1464 -1.0553 0.8687 -0.4884 0.1704 -1.1767 -0.8802 -0.8141 1.6107 0.5715 1.1434 -0.6149 0.7929 0.8549 1.1251 -0.7134 1.3617 -0.8674 -0.8436 -0.8421 -0.8305 1.1159 0.6887 -0.7913 -0.9581 0.8616 -1.0177 1.3100 -0.5533 1.0478 -0.9719 1.5365 0.4075 -0.0986 -0.7660 1.0354 1.3555 1.0633 0.3490 -1.0374 1.2738 1.1768 0.5818 -0.9236 1.5391 -0.8685 -1.0273 0.9927 0.7246 1.3356 1.3121 0.5458 -0.7990 1.3865 1.3864 -0.7665 0.5545 -0.7150 -0.7966 1.6342 1.3286 0.2692 -0.7990 -0.8067 1.8763 -0.8214 -0.7875 -0.8425 -0.8164 1.6651 0.9666 -1.0133 -1.1509 -0.7286 -1.0939 1.4395 -0.7763 -0.9230 -0.9109 1.4432 1.3597 -0.1390 -1.0321 1.4418 -0.8710 -0.8723 1.1879 1.4882 -0.8035 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-2.2579 0.3242 -1.8480 -0.7660 0.4647 -1.1753 0.5788 -3.3982 -0.0451 0.5819 0.2023 -0.9472 X - 24475 0.8142 -1.0889 0.1831 -0.5413 -0.3076 -0.2116 0.6477 -0.1084 -2.3556 -0.0903 -0.0261 -0.0828 -0.2641 0.3475 -0.7983 -1.1255 0.0248 -2.2793 0.4329 1.1397 -0.9693 -0.5418 0.5333 0.9226 -2.2821 0.5300 0.3508 -0.2867 0.4651 -2.3269 -0.3162 -0.1298 -0.1840 -0.2579 -0.0600 0.8850 0.2855 -0.7720 -0.0316 0.2073 -0.8704 0.9307 0.9701 -1.4416 -0.5357 -0.3585 0.6178 0.3868 -0.0353 0.1432 -0.1534 -0.9190 -0.1822 -0.1754 -0.2615 0.0430 -1.4315 -0.2516 0.2350 1.0436 1.3767 0.1509 0.4933 1.0776 -0.4164 -2.4535 0.1061 -0.7833 -1.1885 0.7008 -0.4391 -0.1802 -0.2398 0.8441 0.5036 -1.8959 0.2175 1.0770 -0.9313 -0.8191 -0.0456 -2.2459 -1.0037 -0.6125 0.5382 1.2832 0.1992 -0.3857 0.4668 1.0825 -0.0511 0.5346 -0.1859 -0.0104 -0.8040 -0.5931 -0.3832 -0.0620 -1.2572 -1.0949 2.3793 0.5858 0.9888 -0.1848 -0.2159 -1.8010 1.2660 -0.1595 -2.1137 -2.2167 0.6372 -0.8349 0.7206 -0.0712 0.4761 1.9699 1.1337 -0.5067 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-0.2521 1.4157 -0.9781 -0.4493 2.3948 -0.0960 -2.4100 0.7125 -0.2557 0.1930 -0.3025 -0.2999 0.3024 -0.4097 0.4203 0.7584 0.5326 -0.6044 0.0796 -1.5373 1.8515 -2.3791 0.9546 X - 24512 - retired - adduct of 5-oxoproline 0.5817 -1.4431 0.4233 1.1252 -0.1815 1.7211 -0.6841 1.8760 1.9644 2.5503 2.2439 0.1892 -0.4404 -0.0982 0.0051 0.0823 1.8890 0.3098 0.6913 0.2177 0.7267 0.0537 0.9111 0.3388 0.1069 -0.0918 1.6063 1.7653 2.0398 1.7240 0.1266 -0.1224 -0.9281 -0.4864 0.4368 3.1284 0.6926 1.6484 0.5013 -0.1773 1.4549 -0.1467 -0.9291 -0.1035 -0.6605 -0.1098 -0.7668 0.5567 -0.4023 -0.3510 0.7205 -0.5984 -0.9069 1.1475 0.2638 1.0757 1.0595 -0.3331 -2.1459 0.2672 0.1708 1.1377 -1.3865 0.9442 -0.7540 -0.2407 1.2689 -1.0890 0.6129 1.4677 0.7666 0.3333 -0.2692 -0.0959 -0.1920 0.0880 -0.2037 0.1897 0.5456 -0.2933 -0.3089 1.2204 0.4827 -1.3431 1.6098 0.1506 0.5757 0.7053 0.0879 0.4746 -0.1643 0.9932 -1.3239 0.2123 2.4985 0.8064 -0.5780 -0.2582 -0.5202 0.0274 0.1043 0.6779 0.3131 -0.0522 -0.1828 1.3143 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-1.7155 -1.4868 0.9032 0.9130 2.3633 0.3193 1.0761 1.6222 1.2595 -1.0539 -1.0627 -0.4440 0.0246 -2.4102 -0.1532 -0.1366 -0.3857 -1.1831 0.5031 -0.9284 0.9045 0.4391 -0.9047 -1.0394 0.3003 1.0576 -0.6597 -2.7588 -2.0201 0.7632 2.1561 1.9120 0.3363 -0.6818 0.3995 1.0046 -0.3135 -0.3495 0.5090 X - 24518 0.9032 0.0834 -1.8251 -1.7121 -0.3749 -0.1885 0.5663 -1.9157 0.5802 -1.4707 0.7133 0.5764 0.7824 0.8214 0.4843 -0.3679 -0.0076 0.7262 -1.7536 -1.5915 0.8073 0.3826 0.5061 0.8838 0.3832 -1.7650 0.5407 -1.6946 0.3663 0.1103 -1.9703 0.2536 0.5258 0.6391 0.4426 0.5132 0.4508 -0.0571 0.2283 0.4432 0.8245 -1.3742 0.7498 0.3524 -1.6496 -1.9811 0.5892 -1.7805 0.6272 0.5453 0.5097 0.3411 0.2475 0.9913 0.6666 0.4767 0.5079 0.4771 0.6421 -0.0739 1.0301 0.8533 0.0585 -1.6942 -1.7651 0.6342 0.4630 0.4498 0.5135 0.1628 -0.2364 0.7590 -1.8418 0.3854 0.7795 0.4500 0.7938 0.6355 -1.6418 0.8660 0.8017 0.8549 0.6123 -1.9503 0.4175 0.6096 -1.6485 0.9114 0.2903 -1.5260 0.5030 0.5798 0.4752 -1.4974 0.7030 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0.6997 0.8357 -1.2454 0.4483 1.0269 2.0750 2.6644 -1.2506 -0.8423 -1.3460 -1.0222 -1.0683 -0.4707 -1.5778 -1.5425 0.8478 -0.8908 -0.2989 -1.7646 -0.4768 0.0547 -0.1650 0.6757 0.5681 0.3531 1.1305 -1.5335 0.3112 0.6001 -0.1997 -1.0914 0.5268 -1.0921 -0.3915 -0.5070 -0.3282 -0.8612 -0.9593 0.0610 -0.9920 -0.9968 0.0659 0.6964 -0.8449 -1.0322 -0.6915 -1.0389 -1.1482 -1.3823 0.2416 0.8829 1.2952 -0.2576 2.2249 0.5435 1.7816 0.5156 1.7371 -1.0243 -1.0248 -0.1549 0.4526 -0.0770 -1.1234 2.1483 1.4180 -0.1574 -1.1132 0.5930 -0.4156 -0.9505 -0.0423 -0.4729 -0.0755 0.4103 0.5953 0.8552 1.1076 -0.4039 0.7411 0.8675 2.0161 -0.6720 1.1625 1.2480 -0.0322 -0.1922 -1.3051 1.6385 -0.3780 -1.5183 0.0750 -0.5766 -0.5530 -0.3445 0.0737 1.7031 1.3189 -0.7149 0.3097 -0.6060 -0.9060 0.0382 -0.3004 0.4668 0.5813 0.6882 -1.4163 -1.5207 0.2922 0.4450 -0.6891 -0.6998 -1.1925 -0.7404 -1.9109 -1.1710 -0.9149 0.2535 0.1499 0.6196 -1.5755 -0.2552 -0.1260 -0.5049 0.2785 -0.0001 -0.8698 0.1282 -0.7359 0.4027 1.4721 0.8282 0.4481 -0.3854 1.7171 0.3072 -0.4614 -0.9061 0.2422 -0.9420 -0.7825 0.3793 0.3610 -0.0827 -1.2056 -1.0128 -0.8816 -0.8395 -0.0730 -0.0126 -0.7983 0.1313 -0.4855 -0.5736 0.5844 0.1672 -0.0370 -0.0068 0.3000 -0.6361 -0.5341 0.3546 -0.6827 -0.4253 -0.7686 0.5749 -0.2995 -1.4959 -0.0456 0.1528 -0.0933 -1.2425 -1.2383 0.2167 0.5965 -0.4704 0.0204 -0.3640 -1.6773 -0.1291 1.5022 0.9184 -1.1822 0.1864 -1.3022 0.3097 -0.5608 -0.7226 -0.5278 1.0486 0.2640 -1.1101 -1.4480 -0.6529 -0.0865 1.6066 2.4459 1.3626 1.0755 -1.4119 -0.8165 -0.6307 -0.7189 -0.2270 0.0232 0.1833 -0.5798 -0.8946 -0.5689 -0.5486 -0.8399 -0.0057 -0.0838 -0.0165 -0.4103 1.7260 -1.2578 -0.9671 1.6047 1.8054 0.4135 0.7670 1.6617 0.1958 0.0178 0.1015 -0.6431 -0.3669 -1.1190 0.4918 0.7092 0.6195 0.3070 0.0604 1.7803 -0.7632 -0.5133 -0.5341 -1.0632 -0.3813 -0.9400 -0.8209 -1.1354 0.5748 -1.3117 3.3220 1.3354 2.2435 2.0650 -0.0381 0.6327 0.8425 -1.8788 -0.9898 -1.1434 -0.3347 -1.2774 0.9617 0.0983 1.5555 -0.7107 -0.4471 0.8672 -0.8212 2.5926 -0.9859 0.0516 1.9337 0.2396 0.7940 1.4188 1.2102 2.0483 0.3222 -0.4840 -1.8729 -0.1227 0.8518 -1.0062 -0.8683 -0.4124 -0.2061 -1.2634 0.3072 0.2055 1.9192 2.7390 1.1135 -1.6903 0.7717 -0.5003 -0.3791 -0.0620 -1.0113 1.6245 3.0535 0.6348 1.3014 -0.5032 -0.9830 -0.4756 -0.0012 -1.3479 -2.1104 X - 24804 - retired - probable PFPA ion 1.6975 -0.8616 2.5351 2.1140 -0.7569 2.4550 -0.6543 2.6580 1.8168 1.5229 1.3243 -0.7854 -1.0387 0.5800 -0.8155 -0.5264 1.8383 1.5589 -0.9816 0.1042 -0.3036 -1.7100 0.4887 0.1479 -0.2521 -0.2617 0.7228 0.0480 0.6817 0.2090 -0.8784 -0.0129 -0.7755 -0.0625 1.1012 1.1313 0.0864 0.4524 -0.9732 -0.1350 0.6644 -1.1367 0.0046 0.3933 -0.9998 1.5360 -1.1513 1.0718 -1.7262 -0.3859 0.6856 -0.3251 -0.9230 0.5879 -0.9304 -0.4714 0.0363 -1.5845 -0.4887 -0.5533 -0.2399 -0.6704 -1.0208 2.0870 -0.3362 0.3198 2.8301 -0.8992 -0.5893 0.7549 0.5446 -0.2811 -0.4006 1.5956 -1.1527 -0.4866 -0.0287 -1.3550 0.3627 0.1029 -1.0625 0.6632 0.1258 -0.4453 -0.6151 1.0930 -0.5915 -0.0633 -0.0928 0.3625 -0.5147 1.2752 -0.4038 0.5608 0.7810 0.1997 0.0435 0.2449 0.5099 -0.5748 -0.3704 0.3845 -0.6545 -1.1080 0.2086 0.8892 1.0334 -1.2724 0.6973 0.9080 2.1201 2.3075 -1.3147 -0.6267 -1.0779 -1.1289 -1.2824 -0.5336 -1.2711 -1.3773 0.9529 -0.6663 -0.6342 -1.0519 -0.5525 0.2769 -0.4153 0.6880 0.0032 0.1956 1.2349 -1.1571 0.4545 0.3899 -0.1331 -1.1033 0.4525 -0.9051 -0.4982 -0.4421 0.1266 -0.8897 -1.0770 0.0423 -0.6326 -0.7909 -0.1979 0.5079 -0.7561 -1.2418 -0.7499 -0.8909 -1.3316 -1.5478 0.0089 0.7993 1.1297 -0.5344 2.1415 0.3601 1.6414 0.1038 1.5646 -0.8472 -0.7010 -0.3786 0.3792 -0.1759 -0.7339 1.9717 1.1821 -0.2014 -1.1095 0.9029 -0.0457 -1.0997 -0.2653 -0.1775 -0.1770 0.1221 0.3146 0.6750 1.1303 -0.5752 0.4762 0.8872 2.2820 -0.4218 1.2235 1.1960 -0.5117 0.1561 -1.3462 1.9366 -0.5391 -1.2134 0.1107 -0.5592 -0.6930 -0.4249 -0.2490 1.3189 1.2085 -1.2320 -0.2106 -0.8176 -0.9471 -0.0526 -0.2923 -0.0194 0.6284 0.3864 -1.6333 -1.5733 0.0918 0.0338 -0.3154 -0.8684 -1.1747 -0.6790 -1.6521 -1.1420 -0.7788 0.0806 -0.0088 0.2864 -1.2558 -0.3251 -0.2571 -0.4069 0.2964 0.0920 -0.9978 -0.1333 -0.8852 0.2915 1.4839 1.1423 0.0977 -0.3643 1.8078 0.3589 -0.5466 -0.9931 0.0314 -0.7287 -0.7422 0.3410 0.4836 0.0038 -1.1779 -0.9246 -1.0110 -0.8222 -0.2512 -0.1850 -0.8518 0.0288 -0.2850 -0.5405 0.3196 -0.1228 -0.1427 -0.1780 0.2638 -0.7485 -0.6990 0.1065 -0.4343 -0.3591 -0.6248 0.4333 -0.1503 -1.4987 -0.2057 -0.0058 -0.3123 -1.3550 -0.9592 -0.1613 0.6810 -0.2849 -0.1910 -0.8646 -1.3996 -0.1575 1.2962 0.5280 -0.7663 -0.0015 -1.2126 0.0634 -0.6520 -0.3752 -0.4681 1.0249 0.5670 -1.3620 -0.8887 -0.5975 0.2357 1.4227 1.9718 1.5106 0.8436 -1.4772 -0.6227 -0.9246 -0.3457 -0.3048 -0.0602 -0.1367 -0.3767 -0.9031 -0.3636 -0.3144 -0.6514 -0.0698 -0.1559 0.1311 -0.7946 2.0396 -1.3688 -1.0707 1.2830 1.8140 0.0828 0.9236 1.5610 -0.1152 -0.1024 -0.0328 -0.4082 -0.0369 -1.1798 0.4654 1.0250 0.9818 -0.0233 0.5834 1.6673 -0.7819 -0.3869 -0.3700 -0.3775 -0.2477 -1.0215 -1.1529 -1.1626 0.4636 -1.2895 2.9977 1.4699 2.6573 2.4531 0.2413 0.9497 0.4364 -1.3759 -0.6596 -0.7950 -0.0327 -1.3036 0.7516 0.2147 1.2495 -0.4754 -0.6374 1.1902 -0.4362 2.7695 -0.9962 0.1607 2.4921 0.1532 2.7464 1.9151 1.5201 2.4409 0.2795 -0.2266 -1.5384 -0.3025 0.6741 -1.3138 -0.4896 -0.3538 -0.0676 -0.9335 0.3330 0.1213 1.3909 2.8944 0.7241 -1.4358 1.0059 -0.3611 -0.5889 -0.0936 -1.4476 2.0082 3.3450 0.8600 1.5730 -0.2526 -1.0461 -0.6241 -0.0552 -0.9817 -1.4164 X - 24812 -1.0965 -1.4436 0.0090 -1.3061 0.9733 0.2272 0.3391 0.6054 0.6531 -1.0415 1.2075 -0.3676 0.2116 -1.4805 -0.3544 0.4815 0.9794 1.3823 0.8240 0.6419 -1.2251 -1.8809 0.8515 -0.2027 0.9642 0.8134 0.6117 0.7183 0.5741 0.9479 0.6330 -0.0818 -0.9743 0.7007 -1.7818 -0.5191 -1.3600 1.7586 -1.2951 -0.3262 0.2597 1.2001 0.3689 0.7775 0.4320 -1.6669 1.1390 1.0277 0.6750 1.0144 -1.3857 0.1345 0.5427 1.0151 1.0014 0.5676 0.7553 1.3055 0.9339 -1.5510 -1.2367 0.1884 -1.5843 -1.3070 -1.3713 0.6692 0.4117 0.6013 0.4447 1.2459 0.3202 0.4998 0.8577 0.7462 -0.0790 -1.6055 0.1198 0.6224 -1.2242 0.8910 -1.4577 -1.3371 -1.4151 -1.6234 -1.3136 0.5887 0.5355 0.8533 -1.6382 1.1116 0.1824 0.8367 0.6950 0.2775 -1.3825 -0.2436 -1.3967 1.2167 1.3238 -1.5462 -1.5935 -1.7413 -1.2485 0.9048 0.6041 0.2902 0.7271 -1.4706 0.4722 0.8499 0.4340 0.9097 0.4907 0.8874 -1.4331 0.9206 -1.2079 -1.3458 1.2351 0.7200 0.6510 -1.3669 -1.4562 -0.7433 0.7399 0.9105 0.2818 -1.4829 -1.5167 -1.6821 0.3698 0.8901 0.8356 0.0300 0.3111 0.0312 0.0599 -1.0557 0.7704 -0.9075 1.1825 -1.4924 0.6843 0.5922 -1.2856 -0.7992 -1.4030 -1.4854 -0.0237 1.2793 0.3262 0.6367 0.6187 1.3042 1.0426 -1.2239 -1.3948 -1.2035 0.1270 -0.9356 1.7176 -1.6890 -1.2400 1.0317 -0.0069 0.1242 0.6113 0.6350 -1.6092 0.3429 0.4984 0.6005 0.9360 0.8951 1.0257 1.6023 -1.1826 0.9502 1.0738 0.6544 0.1183 0.2803 -1.4878 -1.4663 -1.2184 0.4565 -1.4618 -1.3469 1.1510 0.8941 0.8761 0.8956 0.0205 0.3737 -1.2231 0.8280 -1.3492 0.5405 -0.2240 1.1694 0.7033 0.8779 0.8554 0.7666 -1.4759 -1.0792 1.0644 1.5030 -1.4038 -1.3944 0.8293 -1.4306 -0.2048 -0.0671 -1.6303 -1.4909 0.5380 0.8071 -1.7582 -0.5148 0.5511 0.7668 -1.2238 -1.7300 -0.1553 -0.3451 -1.6417 0.5494 0.6275 0.7071 0.0612 -1.2768 -1.3768 0.4490 1.1877 -0.1283 0.7691 1.4260 -0.1472 0.8682 -1.5050 -1.7070 0.5807 1.0128 -1.5753 0.1595 0.4820 0.8250 0.6077 -1.5516 -1.5357 0.4895 0.4972 0.8825 -1.5413 -1.3791 0.6548 -0.0328 -1.4177 1.0497 0.6376 1.5231 0.7174 0.6175 0.5285 0.6157 -1.5976 0.9536 0.5252 0.8205 1.0027 -1.3539 -1.6428 0.6003 0.6444 0.7998 0.5211 0.6098 1.1295 1.4875 0.6039 0.3395 -0.1309 1.5352 0.5270 -1.4153 1.1259 0.5343 -0.1463 1.1001 1.2340 -0.3064 -1.5563 0.1438 -1.4253 -1.8486 0.3039 0.2622 0.5362 -1.6117 1.0258 1.0255 -1.4943 1.1256 -0.1056 0.2647 -1.5883 0.8324 -0.5602 -1.7187 0.1791 0.0435 -1.5434 -1.6337 1.0520 0.5525 -0.7490 0.8121 -1.0017 -0.2244 0.2900 0.9650 0.8699 0.5840 0.7658 0.5274 0.2722 0.9270 0.1459 0.4983 -1.3492 -0.4787 0.4501 1.4959 -0.0011 0.7215 -1.5776 -1.5502 -0.3319 0.8207 -1.4562 -0.0316 0.2686 -1.6443 -0.1486 0.9904 -1.2944 -1.6420 -1.5817 0.5035 1.2603 0.9222 1.0271 0.6442 0.8949 0.2181 0.2669 0.0338 -1.8759 0.2943 -0.0130 -1.5760 0.4182 -0.5400 0.6900 0.0672 -1.7161 0.3522 -1.7318 0.8490 0.1522 1.1888 0.5044 -1.4516 0.4190 0.9718 0.3132 -1.7104 0.4380 0.7984 -1.4950 0.8551 0.1405 1.0173 -1.9357 0.2026 0.2876 -0.8565 0.8279 0.2842 -1.2423 -0.1969 1.3216 1.0278 0.9112 -1.7080 0.3392 0.6590 0.0876 0.4925 0.2831 0.1650 0.8930 0.4726 0.3681 0.8917 0.4439 0.2273 0.5201 0.1142 X - 24813 0.7064 -0.4503 -1.6170 -0.3606 1.1570 -1.8319 0.5846 -2.0063 -0.9807 -1.3251 -1.3480 -0.2981 1.1493 0.0731 0.3899 0.0577 -2.1972 -1.1885 0.9995 0.0494 -1.3588 -0.8068 0.5716 0.0472 0.3579 0.8229 -0.5575 0.1739 -0.6044 -0.1967 0.7774 0.3655 1.8163 -1.7918 -1.7658 -2.6056 0.1628 0.9274 0.1274 -0.0907 -1.4396 1.4431 0.8170 0.2109 1.3522 0.2576 0.3819 0.3827 -0.4031 1.3691 0.1662 -0.6419 0.4338 0.7490 -0.0111 0.5011 -1.2767 1.4766 0.3333 -1.3620 0.5140 -1.0542 -0.9698 -0.2661 0.5871 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-0.5412 -1.1060 0.6516 0.5911 -1.4407 0.2819 0.5168 -1.0762 0.9701 -0.5602 -0.7828 0.6763 0.3531 1.3141 0.6849 0.7130 -0.0129 0.1254 -0.5511 -0.2668 0.9374 1.2563 -0.0378 1.8327 -0.1625 -0.7084 0.4503 -0.1171 -0.2037 -0.3317 -0.0771 0.4534 1.5599 1.2723 -1.2952 -0.3568 0.8223 -0.0842 -1.5052 0.5138 -0.3510 -0.5879 -0.6506 -0.4700 0.7525 -0.2144 -0.8000 -1.8125 -3.0063 2.2787 0.0650 -0.7219 2.3821 0.1191 -0.9690 0.2843 0.2934 -0.3098 -0.3301 -0.3082 0.3403 0.4774 0.4702 -1.7154 0.1702 -0.5468 -1.5352 2.3811 -0.8060 -0.2108 0.8044 -0.1896 0.5887 3.3674 -0.3568 -0.9829 -0.8724 -0.1681 -0.6640 0.7100 0.9974 0.7637 0.6483 1.2313 0.4339 -1.1731 -0.3447 0.7243 -0.2331 0.5379 -1.0792 1.0638 1.4098 -1.4800 -0.3435 0.8493 2.0005 1.2068 -0.6864 0.7679 0.3162 -0.6437 -0.6846 -0.2425 -1.0796 -0.3696 1.7476 -0.2431 -0.5412 -1.0185 -1.5585 0.8897 -0.9056 -0.0901 -0.7270 -0.9878 -0.0370 -0.4348 0.4244 -0.2834 -0.2801 0.6582 0.7805 -1.3304 0.3025 -0.7591 0.5231 -0.4147 0.9971 -0.1217 -0.2242 -1.3048 -0.3476 -0.3929 -0.4186 -1.3702 -0.8170 0.0799 -1.7124 -0.5434 0.3509 0.1375 1.5448 0.6057 2.1163 0.1980 1.5174 2.2387 0.7781 -1.6931 0.5715 -1.2131 0.0178 0.6043 -0.9226 0.8396 1.2962 -0.8203 -0.7338 1.2018 -0.1449 0.0312 0.7863 -0.3924 -0.3998 -0.1043 0.8315 -0.0969 0.9277 0.0090 0.7746 0.9247 1.7647 -0.9825 1.1400 -0.3092 0.5510 2.5354 0.6234 1.3484 -1.0837 -0.3048 -0.2094 -0.8653 -0.3889 -0.9283 0.0995 -0.1277 1.5716 -1.1591 0.2911 0.6263 -0.0384 1.0626 -0.0554 -0.1716 0.1658 -0.5001 -1.3628 -1.5627 -0.0983 0.6093 0.4841 -0.7961 -0.2460 1.4265 -0.1236 0.2193 -0.9347 0.7727 -0.9331 -1.3778 -0.3037 0.3801 0.3648 -0.2044 0.7339 -0.3437 -0.4735 0.0313 -0.2734 0.4418 0.3042 1.4275 -0.8883 0.4772 0.5539 -0.2617 0.9060 -0.8954 0.0110 -0.5703 -0.4039 -0.1493 -0.6240 1.4317 0.2552 -0.3597 -1.2504 -0.2941 0.1362 -1.2196 -0.4153 0.7932 -0.0847 -1.8222 0.5568 0.4446 -0.7775 0.3094 0.4549 -0.0604 -0.1344 1.6294 -0.7453 0.3364 -0.9699 -0.6015 -0.0353 -1.1235 0.5277 -0.1339 -0.8244 -2.1887 -1.9691 0.0242 -1.1264 0.3441 -0.3791 -0.3960 -0.6544 -0.5379 0.8545 -0.2251 -0.2031 -1.3195 -0.4654 0.6996 -1.1302 0.0854 -0.7200 -1.1874 0.4907 -2.7243 -1.0826 -0.5932 0.6309 0.5001 0.8841 0.2756 0.2072 -1.3814 0.8192 0.2847 -0.1433 -0.9571 0.2791 -0.1107 -0.8125 -0.4220 -0.9455 -0.3811 -0.9842 -0.6923 0.0904 0.4318 -0.2965 1.5190 -1.0510 -0.8271 1.0599 0.6384 -0.2111 -0.2831 -0.0477 -0.6895 0.5056 -0.0283 -0.0538 0.1010 -1.2189 -0.1132 2.5673 1.0298 -1.2704 -0.1478 0.4723 0.3604 0.2090 -0.0529 -0.3412 0.3288 -1.1018 -1.3279 -0.6119 0.9138 -0.9005 -3.1556 2.0046 1.7354 1.9144 -0.4514 -0.3597 0.7900 -0.2516 -1.3025 -2.5828 -0.9624 0.1431 -0.3352 0.0440 -0.1090 -1.6263 -0.4403 0.8377 -0.5165 1.4444 -0.9364 -0.4358 2.0238 -1.0042 3.1211 0.0056 0.8913 2.0250 1.0611 -1.1474 -1.2347 -0.7752 -0.2980 0.2304 -0.1278 -1.1783 -0.0967 -1.7525 -0.3450 0.3445 1.4041 -0.5488 -0.0032 0.1184 -0.5172 0.0339 -0.2205 -0.7318 0.3158 1.7209 3.5827 2.0462 0.8355 0.5403 0.3173 0.2528 -0.6036 -0.3807 -0.4303 xanthosine 1.5132 -0.2861 1.1937 0.9722 -0.6163 2.5770 -1.2962 1.9777 1.8553 1.7704 2.0615 0.1703 -1.0154 1.1349 -1.3118 -1.1759 1.0298 0.3155 -1.0363 -0.3032 -0.9118 -1.4914 1.1821 -1.0629 -1.0467 -0.0103 1.1882 1.1548 1.0995 1.6631 -1.2841 0.0758 -0.6852 -0.4651 -0.3554 0.7920 -1.0228 1.9887 -0.9585 0.6988 0.7510 -0.6027 0.3691 0.6383 -0.9177 0.9082 0.3046 0.2764 -1.0526 -1.0355 1.1055 0.5612 -0.9966 0.5836 -0.7541 0.0331 -0.0965 -0.7523 -1.1302 0.9979 -0.9234 -1.2481 -1.2215 2.5623 -1.0490 -1.3083 -0.1955 -1.3802 0.4704 0.8944 1.5860 0.3346 0.3721 0.8552 0.3115 0.8861 1.1630 -1.0623 0.1627 0.1731 -1.1394 2.1752 0.5327 0.5823 0.0405 0.7922 0.8377 0.9425 -0.1096 -0.7767 0.3414 0.4697 -1.0134 0.2221 1.0338 1.2233 0.6575 0.8174 -1.0105 0.3986 0.1701 0.9642 -0.9433 0.5034 -0.9621 1.3234 2.0967 -1.1269 -1.4468 1.2679 1.8203 0.2686 -0.9099 0.9754 -1.0794 -1.0708 -0.8992 -1.0132 -1.1791 -0.5077 1.3660 0.7535 -1.1284 0.0944 -1.3188 1.1085 -1.2318 -0.4875 0.1219 -0.6231 0.9409 -0.9331 0.8257 -1.2289 1.2455 0.6570 -1.0437 -0.7377 0.7208 -0.6081 -0.8512 -1.1498 -1.0255 0.9472 0.7297 -1.1472 0.5924 0.0908 -0.9734 -0.9375 -0.8589 -0.8761 -0.9814 -1.5386 0.2155 -0.9039 1.1510 -0.8907 0.5857 -0.6625 2.0685 -1.3414 -0.9210 -1.0744 0.7288 0.1936 0.0062 1.0346 0.1278 0.9052 0.7674 -1.1014 -0.4045 1.3642 0.4552 -0.8011 -0.8685 -0.8729 -1.0214 0.7538 1.2296 0.2001 2.4796 0.2731 -0.9062 1.6943 0.4247 -1.0008 0.5531 -0.6583 0.7796 0.7049 -0.9861 -0.0218 -0.4960 0.3008 0.0738 -1.3503 0.2396 -0.7982 -1.2364 0.0888 1.3216 -1.0649 -1.1499 -0.7826 -1.1470 -0.3851 0.3764 0.7353 -0.0524 -0.2741 -1.3459 -1.1589 -1.2819 0.7967 -1.3378 -1.3313 0.5241 1.5359 0.7876 0.4352 1.1793 0.9138 0.2816 -1.3653 -0.1829 0.0358 0.0824 0.8294 1.1988 0.7654 -1.0464 -1.2114 -0.2402 0.2382 1.5603 1.5995 -1.2817 0.7173 0.9731 0.3263 0.2894 -1.4203 0.0626 0.2500 -1.1484 0.1526 0.3306 1.0965 -0.2056 0.7200 -0.6213 0.2461 0.5743 -0.0548 -1.1817 0.4889 0.6755 -1.2804 1.3928 0.8128 -1.2975 0.4089 0.2731 -0.7877 -1.2496 0.2032 0.4264 0.6575 -0.3667 -1.0242 0.3050 -1.2220 0.3746 -1.1798 -0.3079 -1.1822 -1.2743 0.3112 -0.4310 0.0897 0.5934 -1.3045 -0.5790 -1.0734 -0.5667 -1.1357 0.6183 -1.3829 -1.3254 0.5029 -1.2062 -1.3069 -1.0827 0.3007 1.2314 -1.5381 0.5735 0.5439 0.0608 -1.2569 0.4855 -0.2173 -0.2801 -1.3713 -1.2207 -0.8871 0.6208 0.0531 0.6992 -1.2887 -0.0898 0.2484 -1.3903 -0.3040 -1.0756 -1.1365 -0.0206 0.8868 -1.1223 2.7633 -1.5671 -1.3365 0.0815 0.5040 0.3718 1.0778 -0.0173 0.2701 0.8551 -1.0270 0.6369 0.6601 -1.1670 0.7556 1.7143 -1.1786 0.2637 0.7672 -0.0696 0.3889 0.7107 0.4072 1.1618 0.5616 -0.9699 -1.2873 -1.2243 0.2972 -0.9096 -0.5499 1.4585 -0.6198 1.3123 0.9658 0.7800 -1.2592 -1.4734 0.6550 -0.7063 -0.4255 -1.1496 0.4936 0.0294 1.2079 0.1958 0.6030 1.8859 0.4304 1.6691 -1.2374 -0.5889 1.3090 0.3829 1.3717 -0.0987 2.4711 2.7519 0.9155 -0.3926 -1.4591 0.2437 0.4896 -0.7604 0.1971 -0.4756 0.3420 -1.4520 -0.3416 -0.9194 1.0441 0.8055 -1.2409 -1.3199 -1.3292 0.3780 0.1890 -0.2642 -1.2706 1.4388 2.8027 1.8125 0.9649 1.0367 -1.5203 0.6853 -1.2057 -0.1103 0.1029 ximenoylcarnitine (C26:1)* -1.0344 -1.2734 -1.6231 0.3786 -0.3044 -0.9945 -0.4800 -0.2772 -0.0742 -0.4903 0.4330 0.5135 1.2426 1.0072 0.6328 0.3776 -1.0920 -1.0165 0.0691 1.2294 0.4793 -1.2045 1.9177 -1.4339 -0.3059 0.0063 -0.0530 0.4762 -0.8221 0.9530 0.2577 0.6593 1.1736 0.2638 0.2284 0.6556 0.2525 -0.3628 -1.5630 -0.0993 -0.6299 0.9324 1.0301 -0.8309 1.4548 0.5055 -0.8144 0.2789 0.0924 1.4828 -0.4973 -0.2402 -0.3414 0.8933 1.7756 0.8242 1.9410 0.0707 0.2261 0.1179 -0.1960 -0.3325 0.8124 -1.9506 0.7259 -1.5135 -0.9245 -0.4710 0.9070 0.5066 -0.6286 1.1736 1.8021 1.0277 -1.2228 0.1429 0.8017 -0.4862 0.6753 0.5385 -0.6364 -1.4478 -0.7038 -0.2536 -1.1778 1.4580 0.9955 -0.3612 -0.3205 0.0686 0.4738 0.2670 -1.2324 -1.6466 0.2103 0.7342 0.1349 1.1578 0.7040 -0.6649 1.7614 -1.8705 0.2662 0.0603 0.5434 -0.7139 1.7820 1.0959 0.3037 -0.9087 -0.9949 -1.7836 0.1336 -0.0814 0.6668 -1.5407 -0.5910 0.0668 1.6624 1.3537 0.9210 0.9367 -0.0970 0.6394 -0.2016 0.4487 -0.0786 0.7188 -0.2022 -0.6329 0.9827 0.4659 0.0173 0.6557 -1.0064 -0.4393 1.2436 -0.2275 -0.6987 0.9786 1.0347 0.6261 1.3959 0.0137 0.7307 -0.3733 -0.5939 -0.0168 0.7101 0.7190 1.0872 1.0975 -0.6258 -0.5535 -1.7567 1.4401 -1.0202 1.5378 -0.1209 0.6058 -0.8269 0.7288 -2.6498 0.9099 -0.5137 -1.4512 1.3807 -1.0344 -1.0006 0.2221 -0.6962 0.2406 -0.3118 0.2267 0.3622 1.5924 -1.2408 0.1212 0.8356 -0.4505 -1.0820 -0.0953 -0.1280 -2.0067 2.1157 1.5927 0.3717 0.9463 -0.9661 -1.9739 -1.0765 0.3310 1.6134 2.7618 -0.1160 -0.7433 0.1660 0.7187 -1.1586 -1.6056 -0.7030 0.0830 0.1274 1.0524 1.1573 0.7367 1.5734 1.9271 0.6807 -1.3180 -0.1076 -0.3583 0.2906 0.0651 -0.2278 0.7526 -0.3983 -0.3527 0.6695 -1.8396 0.3957 0.0262 0.5965 -0.4543 0.6531 -0.3743 0.3601 0.0329 -0.9262 -0.9090 0.0178 1.7535 0.9795 1.4495 0.4445 -1.1897 -0.3079 0.5552 0.5826 0.5690 0.9801 0.7792 0.7532 2.0704 -2.1276 -0.6474 -0.0515 -1.6702 0.0189 0.3431 -0.9613 -0.3359 0.6335 1.0651 -0.3742 1.3750 -0.4077 -1.4980 0.9915 0.8754 -0.4094 -0.1856 -0.7593 0.1190 0.9791 1.5270 -1.5010 -1.5626 1.3208 -1.6584 0.2489 1.4598 2.0149 1.5164 -0.8007 -1.0820 -0.9499 0.1201 -0.8259 1.1363 0.0480 0.9402 0.2687 0.3892 -0.0437 -0.6655 -1.1998 -0.3676 -0.6310 -1.5730 -0.2836 -0.0951 -0.2136 -1.5941 -2.4282 0.7777 -0.3326 -1.7847 -1.3366 0.9437 -2.1209 0.4797 -0.4588 1.4707 0.9232 1.2432 -0.2826 0.9749 0.3910 1.5650 0.1451 0.3361 0.8112 -0.9136 0.9545 -0.5409 0.7057 -0.4088 1.6055 -0.9345 -0.2006 0.3377 0.4743 1.4337 -0.8763 -0.1453 0.0247 -0.2471 -0.3627 -0.7847 0.0650 0.5831 -1.9538 -0.2572 -1.1775 0.0188 -1.0120 -1.4807 -1.2351 -0.5963 0.6129 -2.7133 -1.3561 -0.4104 1.1426 -0.0396 -1.9330 1.1234 -2.0569 -0.6896 0.8193 0.1957 -1.3068 0.3785 1.4542 1.0443 0.3609 -2.8119 -0.6769 -1.0541 -0.5750 -0.6366 2.2435 -2.7644 1.1644 -0.4392 0.5134 -1.0568 0.2195 -0.2256 0.8282 -1.4881 -0.1656 0.3314 -1.0156 1.5722 0.4967 0.2963 -0.3843 -0.4202 1.2406 1.1097 -2.0669 -0.4920 2.1848 -0.6266 0.0176 0.5736 -0.2536 -0.2756 -1.5802 0.5821 1.3586 0.0666 -1.2742 0.3348 0.1485 -0.3130 0.5238 -1.2113 0.6721 -1.0267 -0.4289 -1.2467 0.0244 -0.2994 -0.8180 0.6190 -1.2345 -0.6466 xylose -0.1131 0.5546 -0.1443 -0.2249 -1.3023 0.5926 1.9682 0.6090 0.0347 0.1883 0.2577 0.4893 -0.1173 0.4113 -0.0698 0.0287 0.0523 0.0066 -0.0878 0.5017 0.0600 -1.4828 0.1446 -1.2562 0.2143 0.4420 0.0744 -1.2607 -0.5014 1.2300 -0.2660 -1.6451 0.5586 0.7629 -2.1583 -0.3522 0.3427 0.1562 -0.1528 -0.2270 -0.1349 0.5458 1.0389 0.0549 -0.2071 0.3762 -0.1078 0.5166 -0.6904 0.5142 -0.3395 -0.1391 -1.7438 0.5678 -1.4983 -0.6141 0.2560 -1.4589 0.0618 -0.6394 -0.2207 -0.0606 0.6665 0.1875 -0.2115 -0.2582 -0.2523 -0.8676 0.2164 0.2814 -0.7332 0.1805 0.4538 2.3888 -0.4621 0.2214 0.1891 -0.0915 0.1944 -1.8629 -0.6997 0.3112 -1.8154 -0.2580 -0.1228 -1.9611 -1.6572 -1.7420 -2.0046 -1.5152 0.0873 0.1190 0.5744 0.9958 0.6997 -0.0952 0.1053 0.3766 -0.4942 0.6464 0.2064 0.7266 -0.0294 -2.0426 -0.2268 0.5505 0.0784 -0.6271 0.1057 -1.6906 -2.0218 -1.9686 0.8205 -0.1860 0.1234 0.9123 0.4564 -0.2774 0.1669 -0.2263 0.6124 0.1346 0.0543 0.5889 1.2010 -0.1009 0.1088 -0.0552 0.8137 -2.0546 0.5744 2.0161 1.0851 1.1862 0.9402 0.5837 0.6962 -0.6625 0.4619 0.1445 -0.0921 0.0523 0.0780 0.3590 0.5092 -1.0824 -0.6714 0.4338 -0.3846 -1.1536 -1.5904 -0.2655 -0.1463 0.5999 -1.8519 -0.2076 1.7066 -0.0044 0.5042 -1.3317 0.1540 -0.7810 -0.3683 0.0631 0.2879 -0.2744 -0.1686 0.7782 0.4103 0.0968 -0.7282 -0.0906 1.7452 -1.6254 -0.3118 -0.3199 0.4859 -0.0208 -0.0177 0.4470 1.4926 -0.1779 0.3199 0.2558 0.3560 -2.0778 -1.8632 0.2195 -1.6174 0.8105 0.0301 0.1399 -0.3018 -0.2110 -0.0755 -1.5616 -0.2722 0.7153 -0.0288 -0.2806 0.4511 0.0218 -0.1814 2.0734 -1.8443 0.0422 -0.1534 0.5006 -0.0074 -0.0466 -1.7774 1.1248 0.0529 2.7632 -0.0656 0.0902 -0.4289 0.1390 2.0952 0.3117 -0.3915 -0.4528 0.4946 0.4627 -0.1668 -0.2771 0.9496 -2.1190 0.0108 0.5131 -0.7159 1.6048 0.4364 0.1517 1.0445 2.5893 0.1320 1.1704 -0.5279 0.0111 -1.1340 1.2682 -0.1151 1.1196 0.7995 -0.5867 -0.2735 -1.6214 0.7164 -1.9490 -1.9241 -0.6590 0.1698 -0.6301 -0.0110 0.5526 -1.9163 2.8753 0.2066 -0.1257 0.3020 2.8286 2.5012 0.3355 -1.9462 0.0191 -0.9688 -1.3844 0.2496 0.4349 -1.9827 0.6689 0.4757 0.2842 -0.5345 -0.0779 -1.8943 0.6494 1.5376 -0.1308 -0.4389 -0.4004 -0.1338 -0.3816 -0.6703 1.0436 -0.1595 -1.8411 0.7246 1.7972 0.0281 1.3529 0.2655 0.1646 0.4263 -0.3379 0.5020 -0.2693 0.4594 2.2449 -0.3783 0.7571 -1.8547 0.0369 -0.4701 0.9897 1.7778 0.4797 -1.0136 -0.6682 -0.3463 -0.1259 0.0638 -2.0100 0.5888 3.1124 -0.1322 0.1162 0.4628 2.3164 -0.1041 -0.4225 0.5315 0.0407 0.4749 -2.1909 0.8040 0.5345 -0.5118 0.2021 -0.7425 0.2378 0.0708 1.3226 0.0214 0.0580 -1.1665 -1.1481 -0.0843 0.0824 -1.8429 0.8044 -2.0687 0.6338 0.1633 0.1780 2.8396 0.0215 0.0703 -2.0698 -0.0660 2.6593 0.3016 -0.5286 0.8056 0.6745 -0.5160 -0.0302 -1.0529 2.3456 1.9350 1.1924 -0.1794 -2.2194 -1.9567 0.7091 -0.5411 0.1769 1.3098 -0.1395 -0.3141 0.4286 -1.8541 -0.3852 2.8468 -0.0184 -2.3361 0.6794 -1.1157 0.0110 0.0648 2.6434 -0.4108 0.3310 -0.2629 0.1163 0.0301 0.3587 0.2233 -2.2044 -0.6951 0.7861 0.2787 -0.6339 0.5802 0.1184 -0.4322 0.3265 -0.0660 -1.9542 -0.0140 0.3170 0.1021 0.6007 0.4076 -0.2407 -0.4139 2.6356 0.1318 0.9637 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name pubchem_id inchi_key kegg_id other_id other_id_type ri ri_type moverz_quant 10-heptadecenoate (17:1n7) 10-nonadecenoate (19:1n9) 10-undecenoate (11:1n1) C13910 11beta-hydroxyandrosterone glucuronide 1-(1-enyl-oleoyl)-GPE (P-18:1)* 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPC (P-16:0/20:4)* 1-(1-enyl-palmitoyl)-2-arachidonoyl-GPE (P-16:0/20:4)* 1-(1-enyl-palmitoyl)-2-linoleoyl-GPC (P-16:0/18:2)* 1-(1-enyl-palmitoyl)-2-linoleoyl-GPE (P-16:0/18:2)* 1-(1-enyl-palmitoyl)-2-oleoyl-GPC (P-16:0/18:1)* 1-(1-enyl-palmitoyl)-2-oleoyl-GPE (P-16:0/18:1)* 1-(1-enyl-palmitoyl)-2-palmitoleoyl-GPC (P-16:0/16:1)* 1-(1-enyl-palmitoyl)-2-palmitoyl-GPC (P-16:0/16:0)* 1-(1-enyl-palmitoyl)-GPC (P-16:0)* 1-(1-enyl-palmitoyl)-GPE (P-16:0)* 1-(1-enyl-stearoyl)-2-arachidonoyl-GPE (P-18:0/20:4)* 1-(1-enyl-stearoyl)-2-linoleoyl-GPE (P-18:0/18:2)* 1-(1-enyl-stearoyl)-2-oleoyl-GPE (P-18:0/18:1) 1-(1-enyl-stearoyl)-GPE (P-18:0)* 12,13-DiHOME C14829 1,2-dilinoleoyl-GPC (18:2/18:2) 1,2-dilinoleoyl-GPE (18:2/18:2)* 1,2-dipalmitoyl-GPC (16:0/16:0) 1,2-dipalmitoyl-GPE (16:0/16:0)* 1,2-dipalmitoyl-GPI (16:0/16:0)* 12-HEPE 12-HETE 12-HHTrE C20388 (12 or 13)-methylmyristate (a15:0 or i15:0) 1,3,7-trimethylurate C16361 1,3-dimethylurate 14-HDoHE/17-HDoHE (14 or 15)-methylpalmitate (a17:0 or i17:0) 1,5-anhydroglucitol (1,5-AG) C07326 15-HETE C04742 16a-hydroxy DHEA 3-sulfate 16-hydroxypalmitate C18218 (16 or 17)-methylstearate (a19:0 or i19:0) 17alpha-hydroxypregnanolone glucuronide 1,7-dimethylurate C16356 1-arachidonoyl-GPA (20:4) 1-arachidonoyl-GPC* (20:4)* C05208 1-arachidonoyl-GPE (20:4n6)* 1-arachidonoyl-GPI* (20:4)* 1-arachidonylglycerol (20:4) C13857 1-carboxyethylisoleucine 1-carboxyethylleucine 1-carboxyethylphenylalanine 1-carboxyethylvaline 1-dihomo-linolenylglycerol (20:3) 1-dihomo-linoleoylglycerol (20:2) 1-docosahexaenoylglycerol (22:6) 1-lignoceroyl-GPC (24:0) 1-linolenoylglycerol (18:3) 1-linolenoyl-GPC (18:3)* 1-linoleoyl-2-arachidonoyl-GPC (18:2/20:4n6)* 1-linoleoyl-2-linolenoyl-GPC (18:2/18:3)* 1-linoleoylglycerol (18:2) 1-linoleoyl-GPA (18:2)* 1-linoleoyl-GPC (18:2) C04100 1-linoleoyl-GPE (18:2)* 1-linoleoyl-GPG (18:2)* 1-linoleoyl-GPI* (18:2)* 1-methyl-4-imidazoleacetate C05828 1-methyl-5-imidazoleacetate 1-methyladenosine C02494 1-methylhistidine C01152 1-methylnicotinamide C02918 1-methylurate C16359 1-methylxanthine C16358 1-myristoyl-2-arachidonoyl-GPC (14:0/20:4)* 1-myristoyl-2-palmitoyl-GPC (14:0/16:0) 1-myristoylglycerol (14:0) C01885 1-oleoyl-2-arachidonoyl-GPE (18:1/20:4)* 1-oleoyl-2-docosahexaenoyl-GPC (18:1/22:6)* 1-oleoyl-2-docosahexaenoyl-GPE (18:1/22:6)* 1-oleoyl-2-linoleoyl-GPE (18:1/18:2)* 1-oleoyl-2-linoleoyl-GPI (18:1/18:2)* 1-oleoylglycerol (18:1) 1-oleoylglycerophosphate (18:1) 1-oleoyl-GPC (18:1) 1-oleoyl-GPE (18:1) 1-oleoyl-GPG (18:1)* 1-oleoyl-GPI (18:1) 1-palmitoleoyl-2-linolenoyl-GPC (16:1/18:3)* 1-palmitoleoylglycerol (16:1)* 1-palmitoleoyl-GPC* (16:1)* 1-palmitoyl-2-arachidonoyl-GPC (16:0/20:4n6) 1-palmitoyl-2-arachidonoyl-GPE (16:0/20:4)* 1-palmitoyl-2-arachidonoyl-GPI (16:0/20:4)* 1-palmitoyl-2-dihomo-linolenoyl-GPC (16:0/20:3n3 or 6)* 1-palmitoyl-2-docosahexaenoyl-GPC (16:0/22:6) 1-palmitoyl-2-docosahexaenoyl-GPE (16:0/22:6)* 1-palmitoyl-2-linoleoyl-GPC (16:0/18:2) 1-palmitoyl-2-linoleoyl-GPE (16:0/18:2) 1-palmitoyl-2-linoleoyl-GPI (16:0/18:2) 1-palmitoyl-2-oleoyl-GPC (16:0/18:1) 1-palmitoyl-2-oleoyl-GPE (16:0/18:1) 1-palmitoyl-2-oleoyl-GPI (16:0/18:1)* 1-palmitoyl-2-palmitoleoyl-GPC (16:0/16:1)* 1-palmitoyl-2-stearoyl-GPC (16:0/18:0) 1-palmitoyl-2-stearoyl-GPE (16:0/18:0)* 1-palmitoylglycerol (16:0) 1-palmitoyl-GPA (16:0) C04036 1-palmitoyl-GPC (16:0) 1-palmitoyl-GPE (16:0) 1-palmitoyl-GPG (16:0)* 1-palmitoyl-GPI* (16:0) 1-pentadecanoylglycerol (15:0) 1-ribosyl-imidazoleacetate* C05131 1-stearoyl-2-arachidonoyl-GPC (18:0/20:4) 1-stearoyl-2-arachidonoyl-GPE (18:0/20:4) 1-stearoyl-2-arachidonoyl-GPI (18:0/20:4) 1-stearoyl-2-docosahexaenoyl-GPC (18:0/22:6) 1-stearoyl-2-docosahexaenoyl-GPE (18:0/22:6)* 1-stearoyl-2-linoleoyl-GPC (18:0/18:2)* 1-stearoyl-2-linoleoyl-GPE (18:0/18:2)* 1-stearoyl-2-linoleoyl-GPI (18:0/18:2) 1-stearoyl-2-oleoyl-GPC (18:0/18:1) 1-stearoyl-2-oleoyl-GPE (18:0/18:1) 1-stearoyl-2-oleoyl-GPG (18:0/18:1) 1-stearoyl-2-oleoyl-GPI (18:0/18:1)* 1-stearoyl-2-oleoyl-GPS (18:0/18:1) 1-stearoyl-GPC (18:0) 1-stearoyl-GPE (18:0) 1-stearoyl-GPG (18:0) 1-stearoyl-GPI (18:0) 21-hydroxypregnanolone monosulfate (1) 21-hydroxypregnenolone disulfate 2,2'-Methylenebis(6-tert-butyl-p-cresol) 2,3-dihydroxy-5-methylthio-4-pentenoate (DMTPA)* 2,3-dihydroxyisovalerate C04039 2,3-dihydroxypyridine (2,4 or 2,5)-dimethylphenol sulfate 2,6-dihydroxybenzoic acid 2-aminoadipate C00956 2-aminobutyrate C02261 2-aminoheptanoate 2-aminooctanoate 2-aminophenol sulfate 2-arachidonoylglycerol (20:4) C13856 2'-deoxyinosine C05512 2'-deoxyuridine C00526 2-hydroxy-3-methylvalerate 2-hydroxyadipate C02360 2-hydroxyarachidate* 2-hydroxybehenate 2-hydroxybutyrate/2-hydroxyisobutyrate 2-hydroxydecanoate 2-hydroxyglutarate C02630 2-hydroxyheptanoate* 2-hydroxyhippurate (salicylurate) C07588 2-hydroxylaurate 2-hydroxymyristate C13790 2-hydroxynervonate* 2-hydroxyoctanoate 2-hydroxypalmitate 2-hydroxyphenylacetate C05852 2-hydroxyphytanate* 2-hydroxystearate C03045 2-isopropylmalate C02504 2-keto-3-deoxy-gluconate C00204 2-ketocaprylate 2-linoleoylglycerol (18:2) 2-methylbutyrylcarnitine (C5) 2-methylbutyrylglycine (C5) 2-methylcitrate/homocitrate 2-methylserine C02115 2-myristoylglycerol (14:0) 2-naphthol sulfate 2-oleoylglycerol (18:1) 2'-O-methylcytidine 2'-O-methyluridine 2-oxoarginine* C03771 2-palmitoleoylglycerol (16:1)* 2-palmitoyl-GPC* (16:0)* 2-piperidinone 2-pyrrolidinone 2R,3R-dihydroxybutyrate 2S,3R-dihydroxybutyrate 2-stearoyl-GPE (18:0)* 3-(2-hydroxyphenyl)propionate C01198 3-(3-hydroxyphenyl)propionate C11457 3,4-dihydroxybutyrate 3-(4-hydroxyphenyl)lactate (HPLA) C03672 3,4-methyleneheptanoate 3,7-dimethylurate C16360 3-amino-2-piperidone 3-aminoisobutyrate C05145 3beta,7alpha-dihydroxy-5-cholestenoate C17335 3beta,7beta-dihydroxy-5-cholestenoate 3beta-hydroxy-5-cholestenoate C17333 3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-CMPFP) 3-carboxy-4-methyl-5-propyl-2-furanpropanoate (CMPF) 3-decenoylcarnitine 3-formylindole C08493 3-hydroxy-2-ethylpropionate 3-hydroxy-3-methylglutarate C03761 3-hydroxyadipate* 3-hydroxybutyrate (BHBA) C01089 3-hydroxydecanoate 3-hydroxydecanoylcarnitine 3-hydroxyhexanoate 3-hydroxyhippurate 3-hydroxyisobutyrate C06001 3-hydroxylaurate 3-hydroxyoctanoate 3-hydroxypyridine sulfate 3-hydroxystachydrine* 3-hydroxystearate 3-indoxyl sulfate 3-ketosphinganine C02934 3-methoxycatechol sulfate (1) 3-methoxytyrosine 3-methyl-2-oxobutyrate C00141 3-methyl-2-oxovalerate C00671 3-methyl catechol sulfate (1) 3-methylcrotonylglycine 3-methylcytidine 3-methylglutaconate 3-methylglutarate/2-methylglutarate 3-methylglutarylcarnitine (2) 3-methylhistidine C01152 3-methylxanthine C16357 3-phenylpropionate (hydrocinnamate) C05629 3-sulfo-L-alanine C00506 3-ureidopropionate C02642 4-acetamidobutanoate C02946 4-allylphenol sulfate 4-cholesten-3-one C00599 4-ethylcatechol sulfate 4-ethylphenyl sulfate C13637 4-guanidinobutanoate C01035 4-hydroxy-2-oxoglutaric acid C01127 4-hydroxychlorothalonil 4-hydroxyglutamate C03079 4-hydroxyhippurate 4-hydroxyphenylpyruvate C01179 4-imidazoleacetate C02835 4-methoxyphenol sulfate 4-methyl-2-oxopentanoate C00233 4-methylcatechol sulfate 4-vinylguaiacol sulfate 4-vinylphenol sulfate C05627 5,6-dihydrothymine C00906 5,6-dihydrouridine 5-acetylamino-6-amino-3-methyluracil C16366 5alpha-androstan-3alpha,17alpha-diol disulfate 5alpha-androstan-3alpha,17alpha-diol monosulfate 5alpha-androstan-3alpha,17beta-diol disulfate 5alpha-androstan-3beta,17alpha-diol disulfate 5alpha-androstan-3beta,17beta-diol disulfate C12525 5alpha-pregnan-3beta,20alpha-diol disulfate 5alpha-pregnan-3beta,20alpha-diol monosulfate (2) 5alpha-pregnan-3beta,20beta-diol monosulfate (1) 5alpha-pregnan-3beta-ol,20-one sulfate 5alpha-pregnan-diol disulfate 5-dodecenoate (12:1n7) 5-dodecenoylcarnitine (C12:1) 5-(galactosylhydroxy)-L-lysine 5-hydroxylysine C16741 5-methylthioadenosine (MTA) C00170 5-methylthioribose 5-methyluridine (ribothymidine) 5-oxoproline C01879 6-bromotryptophan 6-hydroxyindole sulfate 6-oxopiperidine-2-carboxylate 7-HOCA C17337 7-methylguanine C02242 7-methylurate C16355 7-methylxanthine C16353 8-hydroxyoctanoate 8-methoxykynurenate C05830 9,10-DiHOME C14828 9-hydroxystearate acetoacetate C00164 acetylcarnitine (C2) C02571 aconitate [cis or trans] adenine C00147 adipate C06104 adipoylcarnitine (C6-DC) adrenate (22:4n6) C16527 alanine C00041 allantoin C02350 alliin C08265 alpha-hydroxyisocaproate C03264 alpha-hydroxyisovalerate alpha-ketoglutaramate* alpha-ketoglutarate C00026 alpha-tocopherol C02477 AMP C00020 androstenediol (3alpha, 17alpha) monosulfate (2) androstenediol (3alpha, 17alpha) monosulfate (3) androstenediol (3beta,17beta) disulfate (1) C04295 androstenediol (3beta,17beta) disulfate (2) C04295 androstenediol (3beta,17beta) monosulfate (1) andro steroid monosulfate C19H28O6S (1)* C04555 androsterone glucuronide C11135 androsterone sulfate anthranilate C00108 arabinose C00216 arabitol/xylitol C01904 arabonate/xylonate arachidate (20:0) C06425 arachidonate (20:4n6) C00219 arachidonoylcarnitine (C20:4) arachidonoylcholine argininate* arginine C00062 asparagine C00152 aspartate C00049 azelaoyltaurine azelate (nonanedioate; C9) C08261 behenoylcarnitine (C22)* behenoyl dihydrosphingomyelin (d18:0/22:0)* behenoyl sphingomyelin (d18:1/22:0)* benzoate C00180 beta-alanine C00099 beta-citrylglutamate C20775 beta-cryptoxanthin beta-hydroxyisovalerate betaine C00719 beta-sitosterol C01753 bilirubin C00486 bilirubin (E,E)* bilirubin (E,Z or Z,E)* biliverdin C00500 branched chain 14:0 dicarboxylic acid bromine butyrylcarnitine (C4) C02862 caffeic acid sulfate caffeine C07481 campesterol C01789 caprate (10:0) C01571 caproate (6:0) C01585 caprylate (8:0) C06423 carboxyethyl-GABA carnitine C00318 carotene diol (1) carotene diol (2) carotene diol (3) catechol sulfate ceramide (d16:1/24:1, d18:1/22:1)* ceramide (d18:1/14:0, d16:1/16:0)* ceramide (d18:1/20:0, d16:1/22:0, d20:1/18:0)* ceramide (d18:2/24:1, d18:1/24:2)* cerotoylcarnitine (C26)* C-glycosyltryptophan cholate C00695 cholesterol C00187 choline C00114 cinnamoylglycine cis-4-decenoate (10:1n6)* cis-4-decenoylcarnitine (C10:1) citraconate/glutaconate citrate C00158 citrulline C00327 corticosterone C02140 cortisol C00735 cortisone C00762 cortolone glucuronide (1) creatine C00300 creatinine C00791 cys-gly, oxidized cystathionine C02291 cysteine C00097 cysteine-glutathione disulfide cysteine s-sulfate C05824 cysteine sulfinic acid C00606 cysteinylglycine C01419 cysteinylglycine disulfide* cystine C00491 cytidine C00475 cytosine C00380 decanoylcarnitine (C10) dehydroepiandrosterone sulfate (DHEA-S) C04555 deoxycarnitine C01181 deoxycholate C04483 diacylglycerol (14:0/18:1, 16:0/16:1) [2]* diacylglycerol (16:1/18:2 [2], 16:0/18:3 [1])* diglycerol dihomolinoleate (20:2n6) C16525 dihomolinolenate (20:3n3 or 3n6) C03242 dihomo-linolenoylcarnitine (C20:3n3 or 6)* dihomo-linolenoyl-choline dihomo-linoleoylcarnitine (C20:2)* dihydroorotate C00337 dimethylarginine (ADMA + SDMA) C03626 dimethylglycine C01026 dimethyl sulfone C11142 docosadienoate (22:2n6) C16533 docosadioate (C22-DC) C19625 docosahexaenoate (DHA; 22:6n3) C06429 docosahexaenoylcarnitine (C22:6)* docosahexaenoylcholine docosapentaenoate (DPA; 22:5n3) C16513 docosapentaenoate (n6 DPA; 22:5n6) C16513 docosatrienoate (22:3n3) C16534 dodecadienoate (12:2)* dodecanedioate (C12) C02678 dopamine 3-O-sulfate C13690 DSGEGDFXAEGGGVR* ectoine C06231 eicosanedioate (C20-DC) eicosapentaenoate (EPA; 20:5n3) C06428 eicosapentaenoylcholine eicosenedioate (C20:1-DC)* eicosenoate (20:1n9 or 1n11) C16526 eicosenoylcarnitine (C20:1)* epiandrosterone sulfate ergothioneine C05570 erucate (22:1n9) C08316 erythritol C00503 erythronate* estriol 16-glucuronide estriol-3-glucuronide estriol 3-sulfate C05141 estrone 3-sulfate C02538 ethylmalonate etiocholanolone glucuronide eugenol sulfate Fibrinopeptide A (2-15) Fibrinopeptide A (3-15) Fibrinopeptide B (1-11) Fibrinopeptide B (1-12) Fibrinopeptide B (1-13) Fibrinopeptide B (1-9) formiminoglutamate C00439 fructose C00095 fructosyllysine fumarate C00122 galactonate C00880 gamma-carboxyglutamate gamma-CEHC gamma-glutamyl-2-aminobutyrate gamma-glutamylalanine gamma-glutamyl-alpha-lysine gamma-glutamylcitrulline* gamma-glutamyl-epsilon-lysine gamma-glutamylglutamate C05282 gamma-glutamylglutamine C05283 gamma-glutamylglycine gamma-glutamylhistidine gamma-glutamylisoleucine* gamma-glutamylleucine gamma-glutamylmethionine gamma-glutamylphenylalanine gamma-glutamylthreonine gamma-glutamyltyrosine gamma-glutamylvaline gamma-tocopherol/beta-tocopherol gentisate C00628 gluconate C00257 glucose C00031 glucuronate C00191 glucuronide of C10H18O2 (1)* glucuronide of C10H18O2 (7)* glu-gly-asn-val glutamate C00025 glutamine C00064 glutarate (C5-DC) C00489 glutaroylcarnitine (C5) glycerate C00258 glycerol C00116 glycerol 3-phosphate C00093 glycerophosphoethanolamine C01233 glycerophosphoglycerol C03274 glycerophosphoinositol* glycerophosphorylcholine (GPC) C00670 glycerophosphoserine* glycine C00037 glycine conjugate of C10H14O2 (1)* glyco-beta-muricholate glycochenodeoxycholate C05466 glycochenodeoxycholate 3-sulfate glycochenodeoxycholate glucuronide (1) glycocholate C01921 glycocholenate sulfate* glycodeoxycholate C05464 glycodeoxycholate 3-sulfate glycohyocholate glycolithocholate sulfate* C11301 glycosyl ceramide (d18:1/20:0, d16:1/22:0)* glycosyl ceramide (d18:2/24:1, d18:1/24:2)* glycosyl-N-(2-hydroxynervonoyl)-sphingosine (d18:1/24:1(2OH))* glycosyl-N-behenoyl-sphingadienine (d18:2/22:0)* glycosyl-N-palmitoyl-sphingosine (d18:1/16:0) glycosyl-N-stearoyl-sphingosine (d18:1/18:0) glycoursodeoxycholate glycylvaline guaiacol sulfate guanidinoacetate C00581 guanidinosuccinate C03139 guanine C00242 guanosine C00387 gulonate* C00257 heptanoate (7:0) C17714 heptenedioate (C7:1-DC)* hexadecadienoate (16:2n6) hexadecanedioate (C16) C19615 hexadecasphingosine (d16:1)* hexadecenedioate (C16:1-DC)* hexanoylcarnitine (C6) hexanoylglutamine hippurate C01586 histidine C00135 histidine betaine (hercynine)* histidylalanine homoarginine C01924 homocitrulline C02427 homostachydrine* C08283 HWESASXX* hydroxyasparagine C03124 hydroxy-CMPF* hydroxy-N6,N6,N6-trimethyllysine* hydroxypalmitoyl sphingomyelin (d18:1/16:0(OH)) hydroxyproline C01157 hyocholate C17649 hypotaurine C00519 hypoxanthine C00262 imidazole lactate C05568 imidazole propionate indoleacetate C00954 indoleacetylglutamine indolelactate C02043 indolepropionate indolin-2-one C12312 inosine C00294 isobutyrylcarnitine (C4) isobutyrylglycine (C4) isocitrate C00311 isoleucine C00407 isoleucylglycine isovalerate (C5) C08262 isovalerylcarnitine (C5) isovalerylglycine kynurenate C01717 kynurenine C00328 lactate C00186 lactobacillic acid lactose C00243 lactosyl-N-behenoyl-sphingosine (d18:1/22:0)* lactosyl-N-nervonoyl-sphingosine (d18:1/24:1)* lactosyl-N-palmitoyl-sphingosine (d18:1/16:0) lanthionine laurate (12:0) C02679 laurylcarnitine (C12) leucine C00123 leucylalanine leucylglutamine* leucylglycine lignoceroylcarnitine (C24)* lignoceroyl sphingomyelin (d18:1/24:0) linoleate (18:2n6) C01595 linolenate (18:3n3 or 3n6) C06426 linolenoylcarnitine (C18:3)* linoleoyl-arachidonoyl-glycerol (18:2/20:4) [1]* linoleoyl-arachidonoyl-glycerol (18:2/20:4) [2]* linoleoylcarnitine (C18:2)* linoleoylcholine* linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [1]* linoleoyl-docosahexaenoyl-glycerol (18:2/22:6) [2]* linoleoyl ethanolamide linoleoyl-linolenoyl-glycerol (18:2/18:3) [1]* linoleoyl-linolenoyl-glycerol (18:2/18:3) [2]* linoleoyl-linoleoyl-glycerol (18:2/18:2) [1]* linoleoyl-linoleoyl-glycerol (18:2/18:2) [2]* lithocholate sulfate (1) lysine C00047 malate C00149 maleate C01384 malonate C00383 malonylcarnitine maltose C00208 mannitol/sorbitol C00794 mannonate* mannose C00159 margarate (17:0) margaroylcarnitine (C17)* mead acid (20:3n9) methionine C00073 methionine sulfone methionine sulfoxide C02989 methyl-4-hydroxybenzoate sulfate methyl glucopyranoside (alpha + beta) methylmalonate (MMA) C02170 methylphosphate methylsuccinate myo-inositol C00137 myristate (14:0) C06424 myristoleate (14:1n5) C08322 myristoleoylcarnitine (C14:1)* myristoylcarnitine (C14) myristoyl dihydrosphingomyelin (d18:0/14:0)* myristoyl-linoleoyl-glycerol (14:0/18:2) [1]* myristoyl-linoleoyl-glycerol (14:0/18:2) [2]* N1-Methyl-2-pyridone-5-carboxamide C05842 N1-methylinosine N1,N12-diacetylspermine C03413 N2-acetyl,N6-methyllysine N2-acetyl,N6,N6-dimethyllysine N-(2-furoyl)glycine N2,N2-dimethylguanosine N4-acetylcytidine N6-acetyllysine C02727 N6-carbamoylthreonyladenosine N6-carboxymethyllysine N6-methyladenosine N6-methyllysine C02728 N6,N6-dimethyllysine C05545 N6,N6,N6-trimethyllysine C03793 N(8)-acetylspermidine C01029 N-acetyl-1-methylhistidine* N-acetyl-2-aminooctanoate* N-acetyl-3-methylhistidine* N-acetylalanine C02847 N-acetylalliin N-acetylarginine C02562 N-acetylasparagine N-acetylaspartate (NAA) C01042 N-acetyl-aspartyl-glutamate (NAAG) C12270 N-acetyl-beta-alanine C01073 N-acetylcarnosine N-acetylcitrulline C15532 N-acetylglucosamine/N-acetylgalactosamine N-acetylglutamate C00624 N-acetylglutamine C02716 N-acetylglycine N-acetylhistidine C02997 N-acetylisoleucine N-acetyl-isoputreanine* N-acetylleucine C02710 N-acetylmethionine C02712 N-acetylmethionine sulfoxide N-acetylneuraminate C00270 N-acetylphenylalanine C03519 N-acetylproline N-acetylputrescine C02714 N-acetylserine N-acetyltaurine N-acetyltheanine N-acetylthreonine N-acetyltryptophan C03137 N-acetylvaline N-alpha-acetylornithine C00437 N-behenoyl-sphingadienine (d18:2/22:0)* N-carbamoylaspartate C00438 N-delta-acetylornithine nervonoylcarnitine (C24:1)* N-formylanthranilic acid C05653 N-formylmethionine C03145 N-formylphenylalanine nicotinamide C00153 nicotinamide N-oxide nicotinamide riboside C03150 nisinate (24:6n3) N-linoleoylserine* N-methylhydroxyproline N-methylpipecolate N-methylproline N,N-dimethyl-5-aminovalerate N,N-dimethylalanine N,N,N-trimethyl-5-aminovalerate N,N,N-trimethyl-alanylproline betaine (TMAP) N-oleoylserine N-oleoyltaurine nonadecanoate (19:0) C16535 nonanoylcarnitine (C9) N-oxalyl glycine (NOG) N-palmitoylglycine N-palmitoyl-heptadecasphingosine (d17:1/16:0)* N-palmitoylserine N-palmitoyl-sphingadienine (d18:2/16:0)* N-palmitoyl-sphinganine (d18:0/16:0) N-palmitoyl-sphingosine (d18:1/16:0) N-stearoylserine* N-stearoyl-sphingadienine (d18:2/18:0)* N-stearoyl-sphinganine (d18:0/18:0)* N-stearoyl-sphingosine (d18:1/18:0)* O-acetylhomoserine C01077 o-cresol sulfate octadecadienedioate (C18:2-DC)* octadecanedioate (C18) octadecanedioylcarnitine (C18-DC)* octadecenedioate (C18:1-DC)* octadecenedioylcarnitine (C18:1-DC)* octanoylcarnitine (C8) C02838 oleate/vaccenate (18:1) oleoyl-arachidonoyl-glycerol (18:1/20:4) [1]* oleoyl-arachidonoyl-glycerol (18:1/20:4) [2]* oleoylcarnitine (C18) oleoylcholine oleoyl ethanolamide oleoyl-linolenoyl-glycerol (18:1/18:3) [2]* oleoyl-linoleoyl-glycerol (18:1/18:2) [1] oleoyl-linoleoyl-glycerol (18:1/18:2) [2] oleoyl-oleoyl-glycerol (18:1/18:1) [1]* oleoyl-oleoyl-glycerol (18:1/18:1) [2]* ornithine C00077 orotate C00295 orotidine O-sulfo-L-tyrosine oxalate (ethanedioate) C00209 palmitate (16:0) C00249 palmitoleate (16:1n7) C08362 palmitoleoyl-arachidonoyl-glycerol (16:1/20:4) [2]* palmitoleoylcarnitine (C16:1)* palmitoleoyl-linoleoyl-glycerol (16:1/18:2) [1]* palmitoloelycholine palmitoyl-arachidonoyl-glycerol (16:0/20:4) [1]* palmitoyl-arachidonoyl-glycerol (16:0/20:4) [2]* palmitoylcarnitine (C16) C02990 palmitoylcholine palmitoyl dihydrosphingomyelin (d18:0/16:0)* palmitoyl-docosahexaenoyl-glycerol (16:0/22:6) [1]* palmitoyl ethanolamide C16512 palmitoyl-linolenoyl-glycerol (16:0/18:3) [2]* palmitoyl-linoleoyl-glycerol (16:0/18:2) [1]* palmitoyl-linoleoyl-glycerol (16:0/18:2) [2]* palmitoyl-oleoyl-glycerol (16:0/18:1) [1]* C13861 palmitoyl-oleoyl-glycerol (16:0/18:1) [2]* C13861 palmitoyl sphingomyelin (d18:1/16:0) palmitoyl-sphingosine-phosphoethanolamine (d18:1/16:0) pantoate C00522 pantothenate (Vitamin B5) C00864 paraxanthine C13747 p-cresol glucuronide* p-cresol sulfate pelargonate (9:0) C01601 pentadecanoate (15:0) C16537 pentose acid* perfluorooctanesulfonate (PFOS) C18142 perfluorooctanoate (PFOA) phenol sulfate C02180 phenylacetylcarnitine phenylacetylglutamine C04148 phenylalanine C00079 phenylalanylglycine phenyllactate (PLA) C05607 phenylpyruvate C00166 phosphate C00009 phosphocholine C00588 phosphoethanolamine (PE) C00346 phytanate C01607 picolinate C10164 picolinoylglycine pimelate (C7-DC) C02656 pimeloylcarnitine/3-methyladipoylcarnitine (C7-DC) pipecolate C00408 piperine C03882 pregnanediol-3-glucuronide pregnanolone/allopregnanolone sulfate pregnen-diol disulfate* pregnenediol sulfate (C21H34O5S)* pregnenetriol disulfate* pregnenetriol sulfate* pregnenolone sulfate progesterone C00410 proline C00148 prolylglycine prolylhydroxyproline propionylcarnitine (C3) C03017 propyl 4-hydroxybenzoate sulfate pseudouridine C02067 pyridoxal C00250 pyridoxate C00847 pyroglutamine* pyrraline pyruvate C00022 quinate C00296 quinolinate C03722 retinal C00376 retinol (Vitamin A) C00473 ribitol C00474 riboflavin (Vitamin B2) C00255 ribonate (ribonolactone) C01685 ribose C00121 ribulonate/xylulonate/lyxonate* S-1-pyrroline-5-carboxylate C04322 (S)-3-hydroxybutyrylcarnitine saccharopine C00449 salicylate C00805 S-allylcysteine sarcosine C00213 S-carboxymethyl-L-cysteine C03727 sebacate (C10-DC) C08277 sedoheptulose serine C00065 serotonin C00780 S-methylcysteine S-methylcysteine sulfoxide spermidine C00315 sphingadienine sphinganine C00836 sphinganine-1-phosphate sphingomyelin (d17:1/14:0, d16:1/15:0)* sphingomyelin (d17:1/16:0, d18:1/15:0, d16:1/17:0)* sphingomyelin (d17:2/16:0, d18:2/15:0)* sphingomyelin (d18:0/18:0, d19:0/17:0)* sphingomyelin (d18:0/20:0, d16:0/22:0)* sphingomyelin (d18:1/14:0, d16:1/16:0)* sphingomyelin (d18:1/17:0, d17:1/18:0, d19:1/16:0) sphingomyelin (d18:1/18:1, d18:2/18:0) sphingomyelin (d18:1/19:0, d19:1/18:0)* sphingomyelin (d18:1/20:0, d16:1/22:0)* sphingomyelin (d18:1/20:1, d18:2/20:0)* sphingomyelin (d18:1/20:2, d18:2/20:1, d16:1/22:2)* sphingomyelin (d18:1/21:0, d17:1/22:0, d16:1/23:0)* sphingomyelin (d18:1/22:1, d18:2/22:0, d16:1/24:1)* sphingomyelin (d18:1/22:2, d18:2/22:1, d16:1/24:2)* sphingomyelin (d18:1/24:1, d18:2/24:0)* sphingomyelin (d18:1/25:0, d19:0/24:1, d20:1/23:0, d19:1/24:0)* sphingomyelin (d18:2/14:0, d18:1/14:1)* sphingomyelin (d18:2/16:0, d18:1/16:1)* sphingomyelin (d18:2/18:1)* sphingomyelin (d18:2/21:0, d16:2/23:0)* sphingomyelin (d18:2/23:0, d18:1/23:1, d17:1/24:1)* sphingomyelin (d18:2/23:1)* sphingomyelin (d18:2/24:1, d18:1/24:2)* sphingomyelin (d18:2/24:2)* sphingosine C00319 sphingosine 1-phosphate C06124 stachydrine C10172 stearate (18:0) C01530 stearidonate (18:4n3) C16300 stearoyl-arachidonoyl-glycerol (18:0/20:4) [1]* stearoyl-arachidonoyl-glycerol (18:0/20:4) [2]* stearoylcarnitine (C18) stearoylcholine* stearoyl sphingomyelin (d18:1/18:0) C00550 suberate (C8-DC) C08278 succinate C00042 succinimide C07273 succinylcarnitine (C4) sucrose C00089 sulfate* C00059 sulfate of piperine metabolite C16H19NO3 (2)* sulfate of piperine metabolite C16H19NO3 (3)* tartarate C00898 tartronate (hydroxymalonate) C02287 taurine C00245 tauro-beta-muricholate taurochenodeoxycholate C05465 taurochenodeoxycholic acid 3-sulfate taurocholate C05122 taurocholenate sulfate* taurodeoxycholate C05463 taurodeoxycholic acid 3-sulfate taurolithocholate 3-sulfate C03642 tetradecadienoate (14:2)* tetradecanedioate (C14) theobromine C07480 theophylline C07130 thioproline threonate C01620 threonine C00188 threonylphenylalanine thymol sulfate C09908 thyroxine C01829 tigloylglycine tiglyl carnitine (C5) trans-urocanate C00785 tricosanoyl sphingomyelin (d18:1/23:0)* tridecenedioate (C13:1-DC)* trigonelline (N'-methylnicotinate) C01004 trimethylamine N-oxide C01104 tryptophan C00078 tryptophan betaine C09213 tyramine O-sulfate tyrosine C00082 undecanedioate (C11-DC) undecanoate (11:0) C17715 uracil C00106 urate C00366 urea C00086 uridine C00299 ursodeoxycholate C07880 valerate (5:0) C00803 valine C00183 valylglycine vanillylmandelate (VMA) C05584 X - 07765 X - 11261 X - 11299 X - 11308 X - 11315 X - 11372 X - 11378 X - 11381 X - 11407 X - 11441 X - 11442 X - 11478 X - 11491- retired for deoxycholic acid glucuronide X - 11522 X - 11530 X - 11578 X - 11787 X - 11795 X - 11843 X - 11847 X - 11850 X - 11852 X - 11880 X - 12007 X - 12026 X - 12096 X - 12100 X - 12101 X - 12117 X - 12127 X - 12206 - retired for ascorbic acid 3-sulfate* X - 12212 - retired for 4-allylcatechol sulfate X - 12216 X - 12283 X - 12411 X - 12462 X - 12472 - retired for glutamine conjugate of C6H10O2 (2)* X - 12524 X - 12543 X - 12544 X - 12680 X - 12729 X - 12739 - retired for glutamine conjugate of C6H10O2 (1)* X - 12798 X - 12844 X - 12847 X - 12849 X - 13007 X - 13431 X - 13507 X - 13728 X - 13835 X - 13866 X - 14056 X - 14904 X - 14939 X - 15161 X - 15220 X - 15245 X - 15469 X - 15486 X - 15503 X - 15523 X - 15666 X - 15674 X - 15728 X - 16245 X - 16570 X - 16576 X - 16580 X - 16654 - retired for deoxycholic acid (12 or 24)-sulfate* X - 16935 X - 16938 X - 16944 X - 16946 X - 16964 X - 17010 X - 17146 X - 17185 X - 17335 X - 17337- retired for undecenoylcarnitine (C11:1) X - 17351 X - 17438 X - 17653 X - 17654 X - 17676 X - 17690 X - 18249 - retired for 3,5-dichloro-2,6-dihydroxybenzoic acid X - 18779 X - 18886 X - 18901 X - 18913 X - 18914 - retired for 3-bromo-5-chloro-2,6-dihydroxybenzoic acid* X - 18921 X - 18922 X - 19141 X - 21258 X - 21285 X - 21286 X - 21310 X - 21319 X - 21339 X - 21353 X - 21364 X - 21383 X - 21410 X - 21441 X - 21448 X - 21467 X - 21470 X - 21471 X - 21607 X - 21628 X - 21729 X - 21733 X - 21736 X - 21785 X - 21796 X - 21821 X - 21829 X - 22162 X - 22519 X - 22764 - retired for branched-chain, straight-chain, or cyclopropyl 12:1 fatty acid* X - 22771 X - 22775 X - 22776 X - 23047 X - 23314 X - 23587 X - 23590 X - 23593 X - 23639 X - 23641 X - 23644 X - 23659 X - 23665 X - 23680 X - 23739 X - 23780 X - 23782 X - 23786 X - 23984 X - 23997 X - 24241 X - 24243 X - 24295 X - 24328 X - 24337 X - 24348 - retired for GlcNAc sulfate conjugate of C21H34O2 steroid** X - 24408 X - 24410 X - 24411 X - 24422 X - 24425 X - 24431 X - 24432 X - 24455 X - 24456 X - 24473 X - 24474 X - 24475 X - 24512 - retired - adduct of 5-oxoproline X - 24518 X - 24527 - retired for glutamine conjugate of C6H10O2 (1)* X - 24542 X - 24544 X - 24545 X - 24546 X - 24549 X - 24556 X - 24588 X - 24686 X - 24699 X - 24728 X - 24803 - retired - probable PFPA ion X - 24804 - retired - probable PFPA ion X - 24812 X - 24813 X - 24831 - retired - probable isoleucine adduct X - 24849 X - 24928 X - 24947 X - 24949 X - 24951 X - 24952 X - 24953 X - 24975 X - 25009 X - 25109 X - 25271 X - 25343 X - 25371 X - 25376 - retired for hydroxy-undecanedioate (OH-C11:0-DC)* X - 25381 X - 25382 X - 25384 X - 25389 X - 25395 X - 25396 X - 25397 X - 25398 X - 25399 X - 25400 X - 25402 X - 25404 X - 25405 X - 25406 X - 25411 X - 25417 X - 25419 X - 25420 X - 25422 X - 25427 X - 25429 X - 25431 X - 25433 X - 25451 X - 25452 X - 25453 X - 25519 X - 25520 X - 25563 X - 25617 X - 25645 xanthine C00385 xanthosine C01762 ximenoylcarnitine (C26:1)* xylose C00181 METABOLITES_END #END