#METABOLOMICS WORKBENCH wpathmasiri_20140314_9642851_mwtab.txt DATATRACK_ID:63 TEXT OUTPUT STUDY_ID:ST000031 ANALYSIS_ID:AN000051 PROJECT_ID:PR000025 VERSION 1 CREATED_ON 10-02-2015 #PROJECT PR:PROJECT_TITLE Metabolomics Involved in Early Life Antibiotic Exposures PR:PROJECT_TYPE Obesity modeling of antibiotic exposure PR:PROJECT_SUMMARY The project Metabolomics Involved in Early Life Antibiotic Exposures profiled a PR:PROJECT_SUMMARY total of 90 samples from five sub-studies (DuraSTAT, TranSTAT, NOD, EstroSTAT PR:PROJECT_SUMMARY and VG STAT) which included a total of four sample matrices (urine, serum, liver PR:PROJECT_SUMMARY tissue and cecal contents). Within each sub-study, there were three sample PR:PROJECT_SUMMARY matrices except for VG STAT, for which there was only two. For each matrix type PR:PROJECT_SUMMARY within each sub-study 6 samples were analyzed for a total of 18 samples per PR:PROJECT_SUMMARY sub-study (9 of each in VG STAT), the samples were equally divided into PR:PROJECT_SUMMARY STAT/PAT-treated (sub-therapeutic antibiotic treatment (STAT) and therapeutic PR:PROJECT_SUMMARY dose-pulsed antibiotic treatment (PAT)) collected at various time-points versus PR:PROJECT_SUMMARY untreated Controls for each matrix. PR:INSTITUTE New York University PR:DEPARTMENT School of Medicine PR:LABORATORY Blaser Laboratory PR:LAST_NAME Blaser PR:FIRST_NAME Martin J. PR:ADDRESS 550 First Avenue, BCD 690, New York, NY 10016 PR:EMAIL Martin.Blaser@nyumc.org PR:PUBLICATIONS Cho I, Blaser MJ. The human microbiome: at the interface of health and disease. PR:PUBLICATIONS Nature Reviews. Genetics 2012; 13; 260-270 PR:PHONE - #STUDY ST:STUDY_TITLE Metabolomics Involved in Early Life Antibiotic Exposures(TranSTAT-Serum) ST:STUDY_TYPE Metabolomics ST:STUDY_SUMMARY In the TranSTAT sub-study, a total of 18 samples from 8 week old, female Swiss ST:STUDY_SUMMARY webster mice; comprised of 6 serum samples, 6 cecal content samples and 6 liver ST:STUDY_SUMMARY tissue samples were analyzed. Three mice/matrix were inoculated with cecal ST:STUDY_SUMMARY contents from STAT mice and 3 mice/matrix were inoculated with cecal contents ST:STUDY_SUMMARY from Control mice. The mice were housed with conventional bedding and fed a high ST:STUDY_SUMMARY fat diet. ST:INSTITUTE RTI International ST:DEPARTMENT Systems and Translational Sciences (STS) ST:LABORATORY NIH Eastern Regional Comprehensive Metabolomics Resource Core (RTI RCMRC) ST:LAST_NAME Sumner ST:FIRST_NAME Susan ST:EMAIL ssumner@rti.org ST:NUM_GROUPS 2 ST:TOTAL_SUBJECTS 6 ST:STUDY_COMMENTS TranSTAT_Serum Study ST:PHONE - ST:ADDRESS - #SUBJECT SU:SUBJECT_TYPE Animal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENOTYPE_STRAIN Swiss Webster Mice SU:GENDER Female SU:ANIMAL_ANIMAL_SUPPLIER Taconic SU:ANIMAL_HOUSING Conventional SU:ANIMAL_FEED High Fat Diet SU:SPECIES_GROUP Mammal #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS - STC001 Treatment Group:Control SUBJECT_SAMPLE_FACTORS - STC003 Treatment Group:Control SUBJECT_SAMPLE_FACTORS - STC005 Treatment Group:Control SUBJECT_SAMPLE_FACTORS - SPL201 Treatment Group:Pooled QC SUBJECT_SAMPLE_FACTORS - SPL202 Treatment Group:Pooled QC SUBJECT_SAMPLE_FACTORS - SPL203 Treatment Group:Pooled QC SUBJECT_SAMPLE_FACTORS - STS002 Treatment Group:STAT SUBJECT_SAMPLE_FACTORS - STS005 Treatment Group:STAT SUBJECT_SAMPLE_FACTORS - STS008 Treatment Group:STAT #COLLECTION CO:SAMPLE_TYPE blood CO:COLLECTION_TIME 8 weeks CO:BLOOD_SERUM_OR_PLASMA serum CO:COLLECTION_SUMMARY - #TREATMENT TR:TREATMENT_SUMMARY Three mice were inoculated with cecal contents from STAT mice and 3 mice were TR:TREATMENT_SUMMARY inoculated with cecal contents from control mice. STAT = sub-therapeutic TR:TREATMENT_SUMMARY antibiotic treatment. TR:TREATMENT_ROUTE cecal transfer #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Frozen serum study samples were thawed on ice and vortexed for 30 seconds. SP:SAMPLEPREP_SUMMARY Aliquots of 50/100 µL (sub-study dependent) were transferred into BSI-labeled SP:SAMPLEPREP_SUMMARY eppendorf tubes. Purchased mouse sera (Sigma #S7273) was also transferred into SP:SAMPLEPREP_SUMMARY three BSI-labeled eppendorf tubes (50/100 µL) for QC samples during analysis. SP:SAMPLEPREP_SUMMARY Freshly prepared 0.9% Saline (wt/v) solution in 10% D2O, was added to each tube SP:SAMPLEPREP_SUMMARY (150/100 µL) and they were vortexed for 30 seconds. Freshly prepared 10 mM SP:SAMPLEPREP_SUMMARY Formate solution containing 2% (wt/v) NaN3 was added to each tube (50 µL) to SP:SAMPLEPREP_SUMMARY serve as internal standard and they were vortexed for 30 seconds again, then SP:SAMPLEPREP_SUMMARY centrifuged at 12000 rcf for 5 minutes at 4 °C. A 200 µL aliquot of the SP:SAMPLEPREP_SUMMARY supernatant was transferred into 3 mm NMR tubes (Bruker-Biospin, Germany), which SP:SAMPLEPREP_SUMMARY were kept on ice until data acquisition. SP:SAMPLEPREP_PROTOCOL_FILENAME TranSTAT_Serum_Metabolomics_Procedure.docx #CHROMATOGRAPHY CH:CHROMATOGRAPHY_TYPE - CH:INSTRUMENT_NAME - CH:COLUMN_NAME - #ANALYSIS AN:LABORATORY_NAME RTI/ DHHMRI AN:ANALYSIS_TYPE NMR AN:ACQUISITION_DATE 41527 AN:SOFTWARE_VERSION Top Spin 3.2 AN:OPERATOR_NAME Wimal Pathmasiri/ Kevin Knagge/ Jason Winnikie AN:DETECTOR_TYPE NMR AN:DATA_FORMAT NMR #NMR NM:INSTRUMENT_TYPE Bruker Avance III NM:NMR_EXPERIMENT_TYPE 1D 1H NM:FIELD_FREQUENCY_LOCK Deuterium NM:STANDARD_CONCENTRATION 1.0 mM NM:SPECTROMETER_FREQUENCY 700 MHz NM:NMR_PROBE cyrogenically cooled ATMA inverse probe NM:NMR_SOLVENT D2O NM:NMR_TUBE_SIZE 5mm x 4inch NM:SHIMMING_METHOD topshim NM:PULSE_SEQUENCE cpmgpr1d NM:WATER_SUPPRESSION presat NM:PULSE_WIDTH 14.84 us NM:POWER_LEVEL 25.704w NM:RECEIVER_GAIN 4.5 NM:OFFSET_FREQUENCY 3300.70 Hz NM:CHEMICAL_SHIFT_REF_CPD Formate NM:TEMPERATURE 298.1 K NM:NUMBER_OF_SCANS 512 NM:DUMMY_SCANS 4 NM:ACQUISITION_TIME 2.3243434 NM:RELAXATION_DELAY 2 s NM:SPECTRAL_WIDTH 20.1358 NM:NUM_DATA_POINTS_ACQUIRED 65536 NM:REAL_DATA_POINTS 65536 NM:LINE_BROADENING 0.5 NM:ZERO_FILLING yes NM:APODIZATION lorentzian NM:BASELINE_CORRECTION_METHOD polynomial NM:CHEMICAL_SHIFT_REF_STD Formate NM:INSTRUMENT_NAME Bruker Avance III #NMR_BINNED_DATA NMR_BINNED_DATA:UNITS Peak area NMR_BINNED_DATA_START Bin range(ppm) STC001 STC003 STC005 SPL201 SPL202 SPL203 STS002 STS005 STS008 0.50...0.52 0 0 0 0 0 0.00261 0 0.00212 0 0.52...0.57 0 0 0 0.045 0.0468 0.000378 0.0847 0.0165 0 0.57...0.60 0.00769 0.0000351 0.00813 0.0373 0 0 0 0 0 0.60...0.64 0.00144 0 0.0122 0 0.0558 0 0 0 0 0.64...0.67 0 0 0.00539 0 0 0.00901 0 0 0.0204 0.67...0.70 0.0233 0 0 0.0625 0.019 0 0.067 0.00472 0 0.70...0.76 0 0.00276 0.0509 0 0 0 0.0362 0 0.0615 0.76...0.79 0 0 0 0 0 0 0 0 0 0.79...0.81 0.115 0.143 0.142 0.0433 0.0437 0 0 0.143 0.131 0.81...0.83 2.68 0.716 3.11 1.59 0.74 0 1.32 3.86 3.68 0.83...0.89 49.1 4.49 30 19.5 16.9 0.649 46.4 46.4 46.9 0.89...0.91 6.88 0.348 3.96 4.81 4.6 0.108 7.25 3.87 6.31 0.91...0.94 6.59 0.399 5.96 8.03 6.78 0.455 6.04 6.36 5.77 0.94...0.99 13 0.811 13.7 28.5 27.8 1.63 11.6 12.3 11.5 0.99...1.05 4.57 0.196 4.76 7.89 8.14 0.242 4.45 4.28 3.75 1.05...1.08 0.19 0 0.208 0.824 0.374 0 0.00282 0.0793 0.155 1.08...1.10 0 0 0 0.338 0 0.0299 0.0215 0 0 1.10...1.12 0 0 0.0478 0.92 0 0.234 0 0.00194 0.0647 1.12...1.15 0 0.037 0.0753 14 10.5 1.38 0 0.278 0.359 1.15...1.21 20.9 3.31 36 51.2 53.1 4.54 25.3 31.5 26.1 1.21...1.23 5 1.05 4.53 4.24 3.35 0.603 3.65 6.28 6.57 1.23...1.25 10.5 1.73 8.16 8.02 5.13 0.958 11.1 13.1 13.2 1.25...1.29 42.6 5.76 25.7 29.9 19.1 4.5 47 39 46.9 1.29...1.35 128 12.3 120 284 269 22.5 123 120 138 1.35...1.38 2.45 0 0.188 0 9.92 0 0 0.523 1.73 1.38...1.42 0.849 0 0.0261 1.04 9.42 0.0829 0 0.213 1.41 1.42...1.48 4.14 0.437 4.46 23.9 28.5 1.89 3.35 4.89 6.02 1.48...1.52 0 0 0 0 5.07 0 0 0.1 0.08 1.52...1.56 0 0 0 0.45 6.5 0.00552 0 0 0 1.56...1.62 0.276 0.0146 0.111 1.15 7 0.00496 0.58 0.125 0.171 1.62...1.65 0 0 0 0 2.08 0 0.0272 0 0 1.65...1.69 0.348 0 0 1.33 2.6 0 0 0 0 1.69...1.74 3.55 0.0404 2.49 9.61 9.88 0.35 0.0511 2.65 0.896 1.74...1.78 0.0918 0 0 6.12 6.28 0.256 0.0823 0 0 1.78...1.83 0.0139 0.000319 0 0.221 0.146 0 0 0 0 1.83...1.85 0 0 0 0.627 0 0 0.000189 0 0 1.85...1.87 0 0 0.224 1.34 0 0.0977 0 0 0 1.87...1.93 4.31 0.0164 3.88 58.9 52.8 4.39 0.931 2.51 3.53 1.93...1.95 0.376 0 0 0.718 2.93 0 0 0 0 1.95...1.97 0.851 0.0815 0.254 1.24 2.34 0 0.0524 0.386 0.233 1.97...2.03 12.8 1.22 6.9 10.5 10.4 0.126 9.19 11.3 11.2 2.03...2.09 10.3 0.709 6.5 14.5 14.5 0.286 4.61 7.21 7.57 2.09...2.14 7.77 0.718 6.67 7.82 8.15 0.143 2.93 8.21 8.44 2.14...2.19 1.68 0.0171 0.514 4.43 4.56 0.0318 0 1.51 0.292 2.19...2.21 0.256 0 0 0.677 0.696 0 0 0.122 0 2.21...2.27 6.12 0.104 4.77 10.4 8.65 0.803 3.97 5.26 5.99 2.27...2.32 7.3 0.202 6.52 6.04 5.88 0.245 3.33 5.88 6.39 2.32...2.37 3.26 0.00178 2.59 8.11 7.05 0.499 0 2.43 2.58 2.37...2.42 12.3 1.14 13.3 12.1 11.1 0.739 13.1 12.2 12.9 2.42...2.48 5.81 0.368 6.06 0.215 0.164 0.0129 1.63 5.64 7.31 2.48...2.50 0.178 0 0.0369 0 0 0.00734 0 0 0.0216 2.50...2.56 3.04 0.181 2.51 0 0.0351 0 1.12 2.96 2.92 2.56...2.62 0.0143 0 0 0 0 0 0 0 0 2.62...2.65 0.532 0 0.0349 0.496 0.598 0.00958 0 0.315 0.126 2.65...2.68 1.79 0.0243 1.08 0 0 0 0.503 1.69 1.06 2.68...2.72 3.62 0.0146 1.54 0 0.143 0.0153 0.173 3.37 1.5 2.72...2.76 5.75 0.216 1.64 0 0 0 4.88 6.6 2.91 2.76...2.81 4.14 0.0398 0.376 0 0.0719 0.00563 4.48 4.91 0.533 2.81...2.84 0.171 0.0254 0 0 0 0 0.125 0.0441 0 2.84...2.87 0 0 0 0.106 0 0.000495 0 0 0 2.87...2.93 2.97 0.00985 0.308 3.12 3.07 0.0213 0.104 0.119 0.222 2.93...2.95 0.883 0 0 0.423 0.248 0 0 0 0 2.95...2.98 1.84 0 0.0245 1.51 1.18 0 0.00511 0 0 2.98...3.00 1.84 0 0 2.32 1.7 0 0.0258 0 0.325 3.00...3.06 8.38 0.419 4.49 17.7 16 0.7 2.69 4.5 6.45 3.06...3.08 0 0 0 1.14 1.77 0 2.55 0 0 3.08...3.12 0.351 0 0.504 1.42 1.19 0 0.175 0.075 0.629 3.12...3.16 1.02 0.0134 1.3 5.38 4.95 0.0613 0 0.597 1.84 3.16...3.18 0.257 0.16 0.689 0.62 0 0.0342 0 0.492 0.969 3.18...3.21 18.3 1.9 17.2 14.8 12.3 1.05 5.34 20.7 19 3.21...3.26 68.2 7.2 70.5 16.8 12.7 2.35 69.6 75.1 74.3 3.26...3.31 8.08 0.459 5.22 68.5 70.1 4.44 6.62 5.31 6.83 3.31...3.33 0 0 0 0 1.33 0 3.3 0 0 3.33...3.36 0.623 0.19 2.29 1.73 1.33 0.024 1.49 1.96 1.51 3.36...3.38 0 0.278 0.471 0 0.33 0.00352 0 0.398 0.316 3.38...3.44 59.5 7.05 76.6 5.45 6.52 0.305 81.5 65 63.3 3.44...3.49 63.4 7.49 82.8 0 0 0 92.1 69.8 66.9 3.49...3.51 8.54 1.08 9.98 0.635 0.625 0.0874 10.8 9.09 8.15 3.51...3.57 34.7 3.55 39.4 28.7 26.5 1.95 35.6 37.4 36.8 3.57...3.61 4.22 0.313 4.15 5.84 6.21 0.409 0.666 3.84 3.83 3.61...3.63 1.78 0.2 1.57 3.96 3.12 0.457 0 1.87 2 3.63...3.69 15.7 1.95 22.6 42.2 45.1 2.69 8.79 23.5 19.5 3.69...3.74 55.6 6.43 72.5 7.52 7.94 0.292 75.7 61.3 58.3 3.74...3.80 35.8 3.59 40.4 18 18.8 0.685 37.2 35.7 35.3 3.80...3.85 47.5 5.21 59.3 8.75 9.68 0.0186 60.4 49.9 48.1 3.85...3.87 2.78 0.415 2.39 3.98 3.85 0.171 0 2.03 1.79 3.87...3.92 48.6 5.23 58.9 23 21.3 1.36 60.3 50.8 48.5 3.92...3.98 10.9 0.984 9.5 6.33 8.72 0.221 5.23 10 10.2 3.98...4.02 2.33 0.0167 0.984 0.941 2.78 0 0 0.935 0.993 4.02...4.04 0.176 0 0 0 0.058 0 0 0 0 4.04...4.08 2.65 0.177 1.52 2.15 2.64 0.28 0.091 2.36 2 4.08...4.14 24.4 2.22 24.8 52.8 49.7 4.23 19.7 23 24.5 4.14...4.18 3.65 0.263 2.86 0 2.74 0.119 2.21 2.26 2.52 4.18...4.22 0.568 0 0 0 0.381 0 0.048 0 0.0114 4.22...4.26 1.33 0.00359 0.248 0.0698 1.04 0.0000608 0 0.101 0 4.26...4.30 2.01 0 0.0127 0.0289 0.582 0.00669 0.0613 0.0033 0.0712 4.30...4.35 3.6 0.0599 1.41 0 0 0 0.082 2.49 1.68 4.35...4.40 0.572 0 0 0.0019 0 0.00277 0 0 0 4.40...4.43 0.0147 0.00405 0 0 0 0 0.0349 0.0104 0 4.43...4.47 0 0 0.0315 0 0 0.00227 0.0106 0 0.0233 4.47...4.49 0.00352 0 0 0 0.0377 0 0 0.00997 0 4.49...4.54 0 0 0 0 0 0 0.0232 0 0 4.54...4.59 0.0434 0.00418 0.0229 0.045 0 0 0 0.0292 0 4.59...4.61 0 0 0 0 0.00955 0 0.00204 0 0.038 4.61...4.66 19.9 2.1 26.5 0 0 0 30.3 22 21.6 4.66...4.68 0.126 0.00786 0.0943 0.00368 0 0.121 0.237 0.149 0.0953 4.68...4.70 0 0 0 0 0 1.02 0.0658 0 0 5.20...5.26 20.5 160 22.6 0 6.43 183 25.3 20.8 19.9 5.26...5.32 16.9 135 4.17 0.31 0.136 155 11.4 15.8 13.1 5.32...5.38 2.94 114 0 0 0 132 0 1.07 0.259 5.38...5.44 0.0305 96 0.0355 0.108 0 113 0 0.00462 0.0187 5.44...5.50 0.0187 80.6 0.00714 0 0 100 0.00699 0.0311 0.0186 5.50...5.56 0 68 0.00176 0 0 96 0 0 0.0151 5.56...5.62 0.0492 54.1 0 0.0575 0.0325 70.7 0.133 0 0.0408 5.62...5.65 0 26.3 0.00791 0.0315 0 24.6 0 0.00719 0 5.65...5.71 0 48.9 0.0435 0 0.019 36.1 0 0 0.027 5.71...5.77 0.0308 49.2 0 0 0 17.5 0.0196 0 0 5.77...5.83 0 37.6 0 0.0517 0 0.953 0 0.0126 0 5.83...5.89 0.00483 22.9 0.0216 0 0.0307 0 0.0492 0 0.049 5.89...5.95 0.0153 10.7 0.0103 0.0843 0 0.00646 0 0 0 5.95...5.99 0 1.4 0 0 0.00142 0 0 0.0193 0.0366 5.99...6.03 0.0326 0 0 0 0 0 0.0632 0 0.00348 6.03...6.06 0 0 0.0585 0.0148 0 0 0 0 0.0501 6.06...6.11 0.0189 0 0 0.0243 0.0462 0 0 0 0 6.11...6.16 0.00603 0 0.0183 0 0 0 0 0.0279 0 6.16...6.22 0 0 0 0 0.0275 0 0 0 0.0168 6.22...6.26 0 0 0.00269 0 0 0 0.131 0 0 6.26...6.31 0.0016 0 0 0.000138 0.0424 0 0 0.0434 0.00927 6.31...6.34 0.0396 0 0.024 0 0 0 0.0324 0 0 6.34...6.38 0 0 0 0 0.0578 0 0.0742 0.0412 0 6.38...6.41 0 0.0006 0.00535 0 0 0 0 0 0.0285 6.41...6.46 0.0412 0 0 0.0326 0.0179 0.003 0.0748 0 0 6.46...6.50 0 0 0.0448 0 0 0 0 0 0 6.50...6.53 0.00727 0 0 0.00867 0.0176 0.00104 0.0211 0.0296 0.0123 6.53...6.57 0 0 0 0.0198 0.0177 0 0.0419 0 0.036 6.57...6.61 0 0 0.0156 0.0114 0 0 0 0.0394 0 6.61...6.65 0.00598 0 0 0 0.0327 0 0.0172 0.00233 0.0255 6.65...6.70 0 0 0 0 0 0 0.00918 0.000229 0.00101 6.70...6.75 0.0242 0.000976 0 0.0564 0.0522 0.0058 0 0 0.00271 6.75...6.81 0 0 0.00508 0 0.00897 0 0.00227 0 0 6.81...6.86 0.0299 0 0.0381 0.114 0.054 0 0.0324 0.00716 0.0232 6.86...6.91 0.229 0.0126 0.166 0.967 0.814 0.00369 0 0.196 0.644 6.91...6.96 0 0 0 0 0 0 0 0 0 6.96...7.01 0.0158 0 0.365 0.147 0.0364 0.000682 0 0.0384 0.0311 7.01...7.06 0.0116 0.00539 0 0.0162 0 0 0.0034 0 0.0485 7.06...7.11 0 0 0.0076 0.00478 0 0 0.0724 0.00497 0 7.11...7.17 0 0.00106 0 0 0 0 0 0 0 7.17...7.22 0.248 0 0.181 1.39 0.597 0.034 0.142 0.215 0.708 7.22...7.27 0 0 0.0274 0 0 0 0.0391 0.0351 0 7.27...7.30 0.0142 0 0 0.268 0.0231 0 0.0094 0 0.0324 7.30...7.35 0.59 0.0133 0.324 2.16 1.04 0.0543 0 0.112 0.323 7.35...7.39 0.0087 0 0.021 0.722 0.0986 0.00143 0.127 0.0118 0.0453 7.39...7.44 0.155 0.0127 0.113 1.15 0.27 0.00459 0.203 0.119 0.312 7.44...7.48 0 0 0 0 0 0 3.67 0 0 7.48...7.51 0 0.00115 0 0 0 0 0 0 0 7.51...7.56 0.0274 0 0.00812 0.112 0.0126 0.000405 0.0297 0 0.0151 7.56...7.60 0.00308 0 0.00672 0.0196 0 0 0 0.0509 0 7.60...7.65 0 0.00188 0 0.0122 0 0.00381 1.13 0 0.00289 7.65...7.68 0.0601 0.00267 0 0.0156 0 0 0.0165 0.00358 0 7.68...7.71 0 0 0 0 0.0193 0 0 0 0 7.71...7.76 0 0.00811 0.0776 0.394 0.0926 0.0119 0.0692 0.0487 0.0925 7.76...7.80 0 0 0 0 0 0 1.51 0 0 7.80...7.85 0.0024 0 0 0 0.038 0 0 0 0 7.85...7.88 0.00539 0.00506 0.151 0 0 0.0059 0.0136 0 0.0248 7.88...7.92 0.00498 0 0 0.0414 0 0 0.0189 0.0242 0.00447 7.92...7.94 0 0 0 0 0 0 0 0 0 7.94...7.98 0.0232 0.00492 0 0 0 0.00842 0.0868 0 0.0402 7.98...8.02 0 0 0.0355 0 0.0465 0.00229 0 0 0 8.02...8.06 0 0 0 0 0 0 0.0371 0.013 0.0216 8.06...8.10 0.0186 0.00431 0.0115 0 0 0.00622 0 0 0 8.10...8.15 0 0 0 0 0 0 0.0269 0.00892 0.0351 8.15...8.17 0 0 0 0 0.0154 0 0 0.00448 0 8.17...8.23 0.0295 0.00126 0 0.00303 0 0.00709 0 0 0.0116 8.23...8.25 0 0.00153 0 0.0329 0.0133 0 0.0238 0 0.0289 8.25...8.30 0 0 0 0 0 0 0 0 0 8.30...8.32 0.0344 0.0025 0.000576 0.051 0.105 0.0191 0.0959 0.0376 0.0506 8.32...8.37 0 0.0000393 0 0 0 0.00264 0 0.00588 0 8.37...8.40 0.0113 0.000205 0 0.048 0.048 0 0.00406 0 0 8.40...8.40 0 0.0037 0 0 0.00435 0 0 0 0.00803 8.50...8.54 0 0 0 0 0 0 0.0172 0.000942 0 8.54...8.58 0 0 0 0.025 0 0 0 0 0 8.58...8.63 0 0.00794 0.0331 0.000516 0 0 0.0383 0.0545 0.0367 8.63...8.65 0.0108 0 0.059 0 0.0107 0.00661 0.0628 0 0.0393 8.65...8.70 0.0135 0.00679 0 0 0 0 0 0 0 8.70...8.75 0 0 0.0186 0.0241 0.064 0 0.0058 0.00583 0.00439 8.75...8.77 0.0296 0.00285 0 0.0064 0 0.00231 0.0122 0.02 0.0016 8.77...8.81 0.0165 0 0 0.0193 0 0 0 0 0 8.81...8.87 0 0.00509 0.0474 0.013 0.0419 0 0.0346 0.0173 0 8.87...8.90 0.00888 0 0 0 0.0236 0 0 0.0312 0.0183 8.90...8.95 0 0.00214 0.000533 0 0 0 0 0 0 8.95...8.99 0.0109 0 0.0252 0 0.0129 0.000443 0.00473 0.00382 0 8.99...9.00 0.00286 0.000863 0 0.0424 0 0 0 0 0.0223 NMR_BINNED_DATA_END #END