#METABOLOMICS WORKBENCH ZQL666_20230321_060238 DATATRACK_ID:3798 STUDY_ID:ST002522 ANALYSIS_ID:AN004155 VERSION 1 CREATED_ON 04-12-2023 #PROJECT PR:PROJECT_TITLE LBP resists hepatic oxidative stress by regulating LD homeostasis PR:PROJECT_SUMMARY Stress elevates the formation of ROS and lipid peroxidation, which induce lipid PR:PROJECT_SUMMARY droplets (LDs) accumulation and adverse metabolic disturbance. Here, we explored PR:PROJECT_SUMMARY the novel role of Lipopolysaccharide-binding protein (LBP) as an anti-oxidant, PR:PROJECT_SUMMARY which can capture unsaturated triglyceride (TG) into LDs to avoid lipid PR:PROJECT_SUMMARY peroxidation. Oxidative stress upregulates LBP level and promotes LDs growth via PR:PROJECT_SUMMARY the LBP/TG phase transition. Upon N-Acetyl-L-cysteine (NAC) elimination of ROS, PR:PROJECT_SUMMARY LBP is exported from LD along with PRDX4, resulting in an increase in PR:PROJECT_SUMMARY phospholipid synthesis. Chronic stress causes LBP upregulation and leads to PR:PROJECT_SUMMARY obesity, which can be rescued by NAC treatment in vivo. These results support PR:PROJECT_SUMMARY that LBP maintains homeostasis by coupling lipid metabolism and redox signal, PR:PROJECT_SUMMARY which provides insights into redox medicine that mitigate stress-induced PR:PROJECT_SUMMARY metabolic dysfunction. PR:INSTITUTE University of Science and Technology of China PR:DEPARTMENT Department of Endocrinology and Laboratory for Diabetes PR:LABORATORY The First Affiliated Hospital of USTC, Division of Life Sciences and Medicine PR:LAST_NAME Zhang PR:FIRST_NAME Qilun PR:ADDRESS Lujiang road no.17 PR:EMAIL zql66666@mail.ustc.edu.cn PR:PHONE +8618356507293 PR:DOI http://dx.doi.org/10.21228/M8S99J #STUDY ST:STUDY_TITLE Lipidomics study on the effect of LBP protein on hepatic lipid composition in ST:STUDY_TITLE mice ST:STUDY_SUMMARY Stress elevates the formation of ROS and lipid peroxidation, which induce lipid ST:STUDY_SUMMARY droplets (LDs) accumulation and adverse metabolic disturbance. Here, we explored ST:STUDY_SUMMARY the novel role of Lipopolysaccharide-binding protein (LBP) as an anti-oxidant, ST:STUDY_SUMMARY which can capture unsaturated triglyceride (TG) into LDs to avoid lipid ST:STUDY_SUMMARY peroxidation. Oxidative stress upregulates LBP level and promotes LDs growth via ST:STUDY_SUMMARY the LBP/TG phase transition. Upon N-Acetyl-L-cysteine (NAC) elimination of ROS, ST:STUDY_SUMMARY LBP is exported from LD along with PRDX4, resulting in an increase in ST:STUDY_SUMMARY phospholipid synthesis. Chronic stress causes LBP upregulation and leads to ST:STUDY_SUMMARY obesity, which can be rescued by NAC treatment in vivo. These results support ST:STUDY_SUMMARY that LBP maintains homeostasis by coupling lipid metabolism and redox signal, ST:STUDY_SUMMARY which provides insights into redox medicine that mitigate stress-induced ST:STUDY_SUMMARY metabolic dysfunction. Hepatic lipidomics in overexpressed LBP and WT mice ST:STUDY_SUMMARY treated with NAC after 24h fasting ST:INSTITUTE University of Science and Technology of China ST:DEPARTMENT Department of Endocrinology and Laboratory for Diabetes ST:LABORATORY The First Affiliated Hospital of USTC, Division of Life Sciences and Medicine ST:LAST_NAME Zhang ST:FIRST_NAME Qilun ST:ADDRESS Lujiang road no.17 ST:EMAIL zql66666@mail.ustc.edu.cn ST:PHONE +8618356507293 ST:SUBMIT_DATE 2023-03-21 #SUBJECT SU:SUBJECT_TYPE Mammal SU:SUBJECT_SPECIES Mus musculus SU:TAXONOMY_ID 10090 SU:GENDER Male #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS - KIHFD1 Genotype:LBPKI/KI | Treatment:HFD16W RAW_FILE_NAME=KIHFDLIM37.RAW SUBJECT_SAMPLE_FACTORS - KIHFD2 Genotype:LBPKI/KI | Treatment:HFD16W RAW_FILE_NAME=KIHFDLIM38.RAW SUBJECT_SAMPLE_FACTORS - KIHFD3 Genotype:LBPKI/KI | Treatment:HFD16W RAW_FILE_NAME=KIHFDLIM39.RAW SUBJECT_SAMPLE_FACTORS - KIND1 Genotype:LBPKI/KI | Treatment:ND RAW_FILE_NAME=KINDLIM79.RAW SUBJECT_SAMPLE_FACTORS - KIND2 Genotype:LBPKI/KI | Treatment:ND RAW_FILE_NAME=KINDLIM80.RAW SUBJECT_SAMPLE_FACTORS - KIND3 Genotype:LBPKI/KI | Treatment:ND RAW_FILE_NAME=KINDLIM84.RAW SUBJECT_SAMPLE_FACTORS - WTFAST1 Genotype:Wild-type | Treatment:FAST24H RAW_FILE_NAME=WT18FAST.raw SUBJECT_SAMPLE_FACTORS - WTFAST2 Genotype:Wild-type | Treatment:FAST24H RAW_FILE_NAME=WT19FAST.raw SUBJECT_SAMPLE_FACTORS - WTFAST3 Genotype:Wild-type | Treatment:FAST24H RAW_FILE_NAME=WT20FAST.raw SUBJECT_SAMPLE_FACTORS - WTFASTNAC1 Genotype:Wild-type | Treatment:FAST24HNAC3H RAW_FILE_NAME=WT21FASTNAC.raw SUBJECT_SAMPLE_FACTORS - WTFASTNAC2 Genotype:Wild-type | Treatment:FAST24HNAC3H RAW_FILE_NAME=WT22FASTNAC.raw SUBJECT_SAMPLE_FACTORS - WTFASTNAC3 Genotype:Wild-type | Treatment:FAST24HNAC3H RAW_FILE_NAME=WT23FASTNAC.raw SUBJECT_SAMPLE_FACTORS - WTHFD1 Genotype:Wild-type | Treatment:HFD16W RAW_FILE_NAME=WTHFDLIM25.RAW SUBJECT_SAMPLE_FACTORS - WTHFD2 Genotype:Wild-type | Treatment:HFD16W RAW_FILE_NAME=WTHFDLIM26.RAW SUBJECT_SAMPLE_FACTORS - WTHFD3 Genotype:Wild-type | Treatment:HFD16W RAW_FILE_NAME=WTHFDLIM27.RAW SUBJECT_SAMPLE_FACTORS - WTND1 Genotype:Wild-type | Treatment:ND RAW_FILE_NAME=WTNDLIM61.RAW SUBJECT_SAMPLE_FACTORS - WTND2 Genotype:Wild-type | Treatment:ND RAW_FILE_NAME=WTNDLIM62.RAW SUBJECT_SAMPLE_FACTORS - WTND3 Genotype:Wild-type | Treatment:ND RAW_FILE_NAME=WTNDLIM63.RAW #COLLECTION CO:COLLECTION_SUMMARY Quick-frozen fresh tissue with liquid nitrogen CO:SAMPLE_TYPE Liver #TREATMENT TR:TREATMENT_SUMMARY WT and LBPKI/KI mice were fed with normal diet(ND) and high-fat diet(HFD) for 16 TR:TREATMENT_SUMMARY weeks respectively. WT mice were fasted for 24 hours or treated with NAC for 3h TR:TREATMENT_SUMMARY after a 24-hour fast. #SAMPLEPREP SP:SAMPLEPREP_SUMMARY Lipids were extracted according to MTBE method. Briefly, a 200-µL volume of SP:SAMPLEPREP_SUMMARY water was added to 30 mg sample and vortexed for 5 s. Subsequently, 240 µL of SP:SAMPLEPREP_SUMMARY precooling methanol was added and the mixture vortexed for 30 s. After that, 800 SP:SAMPLEPREP_SUMMARY µL of MTBE was added and the mixture was ultrasound 20 min at 4℃ followed by SP:SAMPLEPREP_SUMMARY sitting still for 30 min at room temperature. The solution was centrifuged at SP:SAMPLEPREP_SUMMARY 14000g for 15min at 10℃ and the upper organic solvent layer was obtained and SP:SAMPLEPREP_SUMMARY dried under nitrogen. #CHROMATOGRAPHY CH:INSTRUMENT_NAME SHIMADZU UHPLC Nexera LC-30A CH:COLUMN_NAME Waters ACQUITY UPLC CSH C18 (100 x 2.1mm,1.7um) CH:COLUMN_TEMPERATURE 45 CH:FLOW_GRADIENT 0-2 minutes, B was maintained at 30%; 2–25 min, B changed linearly from 30% to CH:FLOW_GRADIENT 100%; 25–35 min, B maintained at 30%. CH:FLOW_RATE 300 μL/min CH:SOLVENT_A 60% acetonitrile/40% water; 0.1% formic acid; 0.1Mm ammonium formate CH:SOLVENT_B 10% acetonitrile/90% isopropanol; 0.1% formic acid; 0.1Mm ammonium formate CH:CHROMATOGRAPHY_TYPE Reversed phase #ANALYSIS AN:ANALYSIS_TYPE MS #MS MS:INSTRUMENT_NAME Thermo Q Exactive Plus Orbitrap MS:INSTRUMENT_TYPE Orbitrap MS:MS_TYPE ESI MS:MS_COMMENTS mass spectrometric analysis was performed using a Q Exactive mass spectrometer MS:MS_COMMENTS (Thermo Scientific). ESI source conditions were as follows: Heater Temp 300 °C, MS:MS_COMMENTS Sheath Gas Flow rate 45 arb, Aux Gas Flow Rate15 arb, Sweep Gas Flow Rate 1arb, MS:MS_COMMENTS Spray voltage 3.0KV, Capillary Temp 350 °C, S-Lens RF Level 50%, MS1scan MS:MS_COMMENTS ranges: 200-1800. The mass-charge ratio of lipid molecules and lipid fragments MS:MS_COMMENTS were obtained by collecting 10 fragment maps (MS 2scan, HCD) after each MS:MS_COMMENTS fullscan. The resolution of MS1 at M/Z 200 was 70,000 and that of MS2 at M/Z 200 MS:MS_COMMENTS was 17,500. LipidSearch was used for peak identification, peak extraction and MS:MS_COMMENTS lipid molecules identification (secondary identification). The main parameters MS:MS_COMMENTS were precursor tolerance: 5 ppm, Product Tolerance: 5 ppm, and Product Ion MS:MS_COMMENTS Threshold: 5%. The obtained data were subjected to quality control for MS:MS_COMMENTS subsequent data lipid difference analysis. MS:ION_MODE POSITIVE #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Relative intensity MS_METABOLITE_DATA_START Samples KIHFD1 KIHFD2 KIHFD3 KIND1 KIND2 KIND3 WTFAST1 WTFAST2 WTFAST3 WTFASTNAC1 WTFASTNAC2 WTFASTNAC3 WTHFD1 WTHFD2 WTHFD3 WTND1 WTND2 WTND3 Factors Genotype:LBPKI/KI | Treatment:HFD16W Genotype:LBPKI/KI | Treatment:HFD16W Genotype:LBPKI/KI | Treatment:HFD16W Genotype:LBPKI/KI | Treatment:ND Genotype:LBPKI/KI | Treatment:ND Genotype:LBPKI/KI | Treatment:ND Genotype:Wild-type | Treatment:FAST24H Genotype:Wild-type | Treatment:FAST24H Genotype:Wild-type | Treatment:FAST24H Genotype:Wild-type | Treatment:FAST24HNAC3H Genotype:Wild-type | Treatment:FAST24HNAC3H Genotype:Wild-type | Treatment:FAST24HNAC3H Genotype:Wild-type | Treatment:HFD16W Genotype:Wild-type | Treatment:HFD16W Genotype:Wild-type | Treatment:HFD16W Genotype:Wild-type | Treatment:ND Genotype:Wild-type | Treatment:ND Genotype:Wild-type | Treatment:ND AcCa(12:0)_POS1 23003.2759 36383.5070 33117.3846 69580.9318 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5419325.8640 2322509.6830 3234517.2340 3441716.2890 40063471.3300 4791338.9280 AcCa(18:1)+H_3POS 4264987.1510 6292837.6460 13719287.2900 1848554.1460 1119493.8830 6897500.4270 5237257.8740 6606877.9930 3054852.1690 6515821.6260 2999086.5670 2728054.1380 AcCa(18:1)_POS12 7078233.2660 3609590.5540 4154769.7810 3569734.4410 99661314.8000 1250217.4430 AcCa(18:1)_POS13 50903.0524 97425.4760 31689.5225 82845.7267 512616.7489 25695.1564 AcCa(18:2)+H_4POS 1661278.3190 1859157.1080 3584659.9050 1802027.7370 1187748.6850 5926075.4560 2747149.0550 3118239.4360 1703219.3800 5497770.3540 3260572.3510 2034729.3850 AcCa(18:2)_POS14 7626961.3570 3206013.8980 4648759.6240 3207453.8460 43183161.3600 1970646.7960 AcCa(18:3)_POS15 350491.5807 168896.9224 139078.6703 67390.3565 4040879.9310 23650.9885 AcCa(19:0)_POS16 137006.4331 89163.1607 142368.8015 138259.6296 1574304.3950 172832.5013 AcCa(19:1)_POS17 62544.3190 61001.2457 23888.0560 38572.7015 607465.8769 133023.9795 AcCa(20:0)_POS18 229117.6366 199516.8259 368393.9518 304787.0740 2384615.2360 398080.8195 AcCa(20:1)_POS19 390487.2200 121584.7631 357377.2030 321388.1995 15867831.5800 365848.4892 AcCa(20:1)_POS20 46787.7568 61391.0002 67450.0789 93113.3344 15237324.5300 110923.7416 AcCa(20:2)_POS21 11495.9479 1279863.7890 20002.1141 29055.2866 12268238.9000 14768.5614 AcCa(20:3)_POS22 2869.6189 1228.0707 2437.2121 892.3675 26612.4109 696.1329 AcCa(20:4)+H_5POS 3735121.6610 3153604.4690 3482204.2250 2333917.0360 1850798.3210 5398329.3740 5482036.4400 6567128.7550 3188281.6760 6798102.8930 4061202.0200 2428075.9480 AcCa(20:4)_POS23 3954713.4040 2872307.2120 2111807.7080 3235839.0020 6103154.0660 4788029.8250 AcCa(21:0)_POS24 1852.1299 55769.0301 24580.5830 7106.8657 134810.8186 74403.4859 AcCa(21:1)_POS25 15344.7124 93220.7210 36261.9382 22852.9143 3533.4602 146340.4158 AcCa(22:0)_POS26 34817.1234 31246.8420 48263.2688 55932.2344 183605.3275 63913.1753 AcCa(22:1)_POS27 55721.9307 85504.3722 122046.3089 117320.3451 1039226.7190 123626.7724 AcCa(22:2)_POS28 13116.2576 5247.1265 19591.0499 21158.9417 2561188.8800 54180.2750 AcCa(22:6)_POS30 221723.1600 252953.8062 113036.5678 331737.5886 687991.6412 271548.7619 AcCa(24:0)_POS31 102530.9429 70495.5683 112318.8034 203761.9639 147933.9728 124078.9284 AcCa(24:1)_POS32 31373.2947 45814.9581 51300.5370 89612.3354 216628.3462 52000.9592 Cer(d12:0_18:0+O)_POS121 718595.6715 482970.4618 257362.3866 531350.0355 507493.5587 267487.3358 Cer(d14:0_18:0+O)_POS124 713372.5250 608699.5159 449007.0719 379367.9323 333323.5487 337911.1930 Cer(d16:0_18:0+O)_POS133 800279.7357 500157.5238 478866.3627 796510.1950 699025.7384 343329.1600 Cer(d16:0_18:0)_POS131 4505384.0530 2575017.1400 821239.0464 5324177.5200 7461862.7550 1434075.9320 Cer(d16:0_20:0+O)_POS156 558677.2761 399529.1521 177416.7517 391956.7992 541655.9706 158568.6565 Cer(d18:0_16:0)+H_45POS 1423679.4000 1622711.8320 1730546.6240 1353228.7280 1407166.3090 3003595.6310 3068252.7890 2490841.0390 847164.0499 1623160.8190 969250.4552 904490.4038 Cer(d18:0_18:0)_POS154 14099197.8800 7957481.5990 4171450.9020 14551340.9100 11514097.0000 3507868.5590 Cer(d18:0_22:0)+H_68POS 2501656.4690 2173947.8470 2076475.2100 2140353.9030 1344647.3050 2394359.6610 5589545.3330 1974241.5890 1125249.5340 1603284.5290 1444968.2990 1163578.3570 Cer(d18:0_22:1)_POS182 1329930.4030 762342.1470 950993.2329 1032921.2470 549645.6239 559751.7541 Cer(d18:0_23:1)_POS193 845132.5976 731338.7475 904002.6208 858305.3127 458666.4155 866917.2373 Cer(d18:0_24:5)_POS227 4685908.9600 2239645.8400 2267336.9660 1658861.5500 1589906.5520 1191187.0160 Cer(d18:0_26:0)_POS236 0.1358 0.1081 34187.0429 58922.5137 157522.1752 131107.6795 Cer(d18:1_16:0)_POS137 1576080.7370 1467893.4540 670841.1100 1481732.3170 367509.3423 649487.5189 Cer(d18:1_16:0)_POS139 723323.8603 789694.8980 474217.0821 1254140.7100 261266.5038 2144526.2080 Cer(d18:1_16:0)_POS141 255806.4972 159971.0583 104094.8536 159932.7732 86635.2047 162885.4957 Cer(d18:1_16:1)_POS149 423424.0197 325621.8878 318108.5888 389589.8934 167110.3855 121641.3372 Cer(d18:1_18:0)_POS159 1048457.8110 798975.8484 813134.1526 1806225.3070 246406.5160 2832822.1030 Cer(d18:1_20:0)+H_61POS 4678066.7260 8035452.9010 7414596.9620 2175773.3680 1924977.9240 4203135.9860 14177380.5800 7797309.1500 1791191.9740 2105046.1490 1160439.2280 1150410.2750 Cer(d18:1_22:0)+H_69POS 35171128.8700 37382646.4500 34263774.9100 40137546.5100 25863974.0200 44009267.3600 106579958.6000 37407210.2100 16740798.2500 27714852.7400 15463638.1500 14769665.0500 Cer(d18:1_22:0)_POS184 1636263.0510 901204.3264 1606834.4740 665420.9137 334192.4893 815805.7355 Cer(d18:1_22:2)_POS190 194292.6604 198926.5233 217907.5869 164160.5141 333546.3874 300272.5230 Cer(d18:1_23:0)+H_72POS 6127279.3250 7370503.6960 9270565.8250 11242543.7600 7833280.9040 24226449.7600 18788166.3900 10007013.8000 3513268.5760 6483054.1980 4508888.1790 4763930.0560 Cer(d18:1_23:3)_POS198 3505863.0510 1597771.2030 1661150.0730 1599567.6680 910962.6069 1601193.6130 Cer(d18:1_24:0)+H_78POS 13310691.2300 14837268.9100 15768230.8000 35988053.0400 23059465.4300 53938526.3400 36726585.5300 18097487.4700 8065751.1190 22954475.4900 13453517.1000 15621378.1100 Cer(d18:1_24:0+O)_POS204 2162784.4710 1277977.8610 2126444.1320 2371501.7540 709751.2431 2632112.6150 Cer(d18:1_24:1)+H_80POS 16327868.7000 24309157.7700 26304142.4300 34956776.3000 24014469.9400 92967217.8400 42089400.4300 27737384.7900 7577595.1850 35695623.8800 16040720.9600 18613858.1000 Cer(d18:1_24:1)_POS210 6866763.2780 23112997.8200 192478.6000 147012.3453 5083599.0280 166727.8529 Cer(d18:1_24:1)_POS211 400224213.1000 337451911.5000 279169355.2000 342962278.7000 100633949.2000 285221404.7000 Cer(d18:1_24:1)_POS213 219139.4679 141382.3323 97296.2522 276810.3235 38984.7213 113503.3975 Cer(d18:1_24:2)_POS223 471580.0775 365667.6374 739269.6716 278060.2412 345852.7765 1451376.6650 Cer(d18:1_24:3)_POS225 17377393.7500 8525190.0000 1703851.5460 7261070.5510 5309693.5830 4856102.3690 Cer(d18:1_25:2)_POS233 194715.8483 157245.0940 155716.8068 176528.5875 117014.3501 652988.9365 Cer(d18:1_25:3)_POS234 14898931.7900 6541499.0560 6540303.1680 9857133.6010 5113846.8030 11812786.0600 Cer(d18:1_26:0+O)_POS239 921281.9314 423641.6808 502431.9707 672261.3949 506784.9869 471252.5835 Cer(d18:1_26:5)_POS245 15168815.8700 11285967.0900 6855697.3590 10730956.3900 7903669.8510 7147956.7050 Cer(d18:2_16:1+2O)_POS150 418566.4761 482438.2272 325391.0796 741396.5046 256098.8533 328908.5492 Cer(d18:2_22:0)+H_70POS 3412485.2150 3774833.2360 2863563.8250 4450158.1730 2472755.2240 3414258.6580 9473431.7150 4190307.0110 1422609.5140 2706958.0650 1208922.5460 1344344.4090 Cer(d18:2_22:2)_POS191 6262067.6060 3910550.7780 2713029.0640 3201829.5180 2577875.1980 2476863.8860 Cer(d18:2_24:1)+H_82POS 2343681.4710 3480702.1910 3446782.9550 4879962.4890 3559599.5640 12150396.2900 5880436.9300 4795362.2050 963155.7741 5676659.7990 2332711.8370 2585108.7720 Cer(d18:2_25:4)_POS235 669726.4575 428679.8839 363723.7014 444650.9526 174421.1518 250297.2679 Cer(d19:2_26:5)_POS248 373371.3083 99894.2784 167485.5449 1397649.8450 68992.3484 2324919.1350 Cer(d20:0_18:0)+H_59POS 1091312.3450 1139882.0550 1397163.8650 1054226.9500 772137.3115 1061625.9440 1635590.5000 1261604.7400 1777408.2250 903731.2832 701323.2977 754685.2724 Cer(d20:0_18:0)_POS169 36699603.4500 29433761.1900 19397475.8900 28558054.0200 27685960.7900 13697209.2000 Cer(d20:0_22:5)+H_83POS 5757581.4050 5461824.8350 4970801.5160 6707329.1160 3685115.0490 9793764.1530 14307426.6200 7303624.5490 2338126.7020 4311717.8810 1993890.4180 2013886.5320 Cer(d20:0_26:6)_POS250 353793.5677 323133.7493 407016.7502 816644.6629 75776.1530 1181544.4500 Cer(d21:1_23:1)_POS240 2088212.5140 3001386.4300 1214607.7640 2468968.4680 1605996.6180 1794713.4810 Cer(d21:1_24:5)_POS247 194775.7426 164596.0959 94210.5062 245051.5263 59769.1241 107744.9502 Cer(d22:0_18:0)_POS179 17662897.4600 10773978.6000 7459848.1970 12841174.6300 10472150.7100 8300162.0710 Cer(d22:0_20:0)_POS199 313762.4483 197104.9073 123582.0938 188828.6646 177908.9292 118008.2163 Cer(d22:1_18:0)_POS181 6057533.1350 2671561.4250 2508889.7940 3853300.3580 2665631.2230 1586119.6420 Cer(d26:0)_POS118 307456.0171 190478.6172 131691.3656 229814.1594 194477.9563 122249.5314 Cer(d28:0)_POS119 7926741.0470 5406625.6670 3922808.6600 6072071.9260 5712073.9170 2998285.2160 Cer(d30:0)_POS120 9346589.4480 6386493.8430 5298929.5220 7764760.5230 6763437.4490 4305711.1310 Cer(d31:0)_POS122 179241.3904 112526.1946 101496.7596 158600.6761 123992.4894 74631.7816 Cer(d32:0)+H_39POS 21253200.3900 21725784.5000 21949172.9500 24858380.3500 18513682.4800 23743013.7300 39253723.6000 25430836.5000 11101611.3800 15050016.4500 9550560.9410 12917021.7800 Cer(d32:0)_POS123 67918020.8000 40471438.9300 33784176.6900 49118687.1800 45341195.3000 27978143.6200 Cer(d33:0)_POS127 159827.7569 109723.7909 22127.7099 92554.5684 73797.8369 20969.8963 Cer(d33:4+O)+H_43POS 611437.0982 646414.8886 721003.9048 569786.6290 540940.0541 585057.8145 1001862.2940 952748.6354 378366.2143 620839.8927 308452.6427 313974.5786 Cer(d33:4+O)_POS130 464084.7427 309522.5116 278922.3216 371768.9405 344759.5765 177513.7610 Cer(d34:0)+H_44POS 15309435.6800 23545755.7400 19536244.1900 20717968.1900 19001364.7000 18352657.3800 25564270.6100 16967080.1200 9811049.2540 8133423.5940 8190473.5290 14835575.1800 Cer(d34:1)+H-H2O_49POS 5018378.6850 7823795.1140 9585004.8660 5560788.6030 9041943.0340 14584222.1000 12299075.6900 13559467.0600 1932902.0420 8083655.0490 3241701.3310 2381326.4570 Cer(d34:1)+H-H2O_POS134 696259.5241 67380.7602 252028.0169 150125.8708 240666.7218 235256.6000 Cer(d34:1)+H-H2O_POS142 195466.3760 64783.1817 40114.4785 69943.3687 42295.9157 56999.8402 Cer(d34:2)_POS146 212874.3115 100572.8643 99059.7232 139604.9411 130829.8779 12334.8589 Cer(d36:0)+H_52POS 1953437.1910 1428174.2700 2412758.1730 2064869.7730 1617519.0160 1435569.4040 2673822.5550 2112116.4620 1132616.2160 795078.5103 1109334.9060 1249811.5380 Cer(d36:1)+H-H2O_POS160 122104.4818 80857.1558 76511.6656 67763.7768 54894.2311 133466.7671 Cer(d36:3+O)_POS164 166592.7500 100485.4149 35633.2814 149190.4851 156449.1197 47038.1100 Cer(d38:1)_POS171 951653.0568 594035.9167 1189404.7720 1489833.2990 2002635.5470 463579.9450 Cer(d38:3)_POS174 289998.3277 282295.8388 182758.2693 264422.0045 309780.5142 812760.6095 Cer(d39:2+2O)_POS178 76468256.0700 84062665.8000 47402707.8900 53254461.2200 14620979.7100 6554477.3210 Cer(d44:1+O)_POS238 18044.5826 14857.7896 34018.4546 41303.1130 11400.0619 56234.1964 Cer(d44:3)_POS242 854965.6904 1531601.1770 807849.1578 1204010.0850 751390.4266 949127.4879 Cer(d44:5)+H_86POS 25281447.4200 33875906.4700 40118925.6500 51229747.3200 35440850.9500 123990490.1000 56024050.7100 41788232.3800 11182592.8300 53936535.1200 25789997.3800 26949577.9100 Cer(d46:5)_POS249 335398.5055 177404.3121 177494.4313 195998.1984 111382.3655 33564.9170 Cer(d48:8)_POS251 290476.3411 96952.1533 118444.4158 200990.0852 121923.3765 18270.7168 CerG2GNAc1(d30:3)_POS354 79493.0581 103774.7982 52034.4991 56826.2883 90248.4956 39676.6652 CerG2GNAc1(d40:1)_POS355 516665.3683 180033.0118 314267.9152 285755.5893 28059.9868 53757.6732 CerG2GNAc1(d41:1)_POS356 100565.3320 107104.7725 46136.7849 229822.1495 115418.1096 22118.2066 CerG2GNAc1(d42:1)_POS357 241116.2686 60887.9960 140328.1479 316482.8344 5733.3230 38600.2985 CerG2GNAc1(d42:2)_POS358 317560.7735 142203.5603 175770.1986 390363.3173 29012.8946 63914.7740 CerG2GNAc1(d43:2)_POS359 468660.3809 361083.9733 82577.3138 402933.2183 304258.0123 154609.4467 CerG3GNAc1(t40:1+O)_POS360 130703.5724 172719.3954 200757.5647 284674.9585 208398.5139 118113.5367 CerG3GNAc2(d48:4)_POS362 69326.5684 49662.6490 165549.1745 115596.7732 107245.2830 50546.2395 CerG3GNAc2(m37:1)_POS363 3240286.8490 1877527.4710 1198561.0560 2351531.5940 516595.5892 488118.4351 CerG3GNAc2(m38:1)_POS364 1959136.9620 762376.9106 833706.2854 2768200.3530 122748.9104 548876.0280 CerG3GNAc2(m39:1)_POS365 5217594.4890 2383205.7950 1987075.9030 4124544.8010 545183.9733 1274004.0760 CerG3GNAc2(m39:2)_POS366 987350.2642 806342.7385 234799.5618 1440609.9330 281397.5303 251279.0177 Cer(m18:0_18:0)_POS256 283719.1722 236379.3845 163805.8975 479869.7893 234387.1309 398753.1068 Cer(m18:0_20:0)_POS263 164145.6819 145243.6711 154150.0777 298658.1180 105984.1834 197504.1062 Cer(m18:0_22:0)_POS270 315437.4011 297290.7380 395731.5501 536560.8921 148781.8005 337464.1498 Cer(m18:0_22:5)_POS280 85514.6653 118603.5629 140696.2320 72362.8697 27060.6541 59643.3723 Cer(m18:0_23:4)_POS291 516608.4942 392927.7090 486242.6273 438696.5317 129147.1472 216967.7115 Cer(m18:1_18:0)_POS257 40834.7323 28770.1632 39970.9670 10632.8898 6784.6976 94965.4740 Cer(m18:1_18:2)_POS259 483390.8026 498957.0785 321775.2232 409440.9498 21450.1266 879303.0519 Cer(m18:1_23:3)_POS290 237078.9119 148938.4228 77788.0608 243152.3930 173654.8895 87909.9267 Cer(m18:1_24:0+O)_POS294 685888.3228 968356.1577 846648.1136 687189.1802 725562.7585 399229.8081 Cer(m18:1_25:0+O)_POS315 641509.4613 578005.9344 354310.4593 1119463.6690 346733.1615 814051.4721 Cer(m18:1_26:0+O)_POS319 1530234.1150 1288051.8480 941288.9523 1041956.0270 784579.7062 667992.9400 Cer(m18:1_26:0+O)_POS320 120890.3024 42523.4518 69536.9017 50487.4682 17380.1710 63143.0392 Cer(m19:0_18:2)_POS261 1414639.9840 1038891.7160 1140933.6950 1207157.5190 1120169.2400 1252065.2040 Cer(m19:0_20:2)_POS267 4421744.7520 1822532.4030 3701255.4650 2328972.4720 661582.1330 1563497.6570 Cer(m19:0_21:2)+H_96POS 14424431.3600 14205466.7800 14708872.8000 16195325.3600 10080246.6100 18797367.1400 40533098.4500 15440231.2200 6421859.5810 11214615.8600 6293193.0560 5484001.3120 Cer(m19:0_21:2)_POS271 2043542.3240 2472924.9690 1716946.0450 1040292.6670 477180.4714 565898.6075 Cer(m19:0_21:2)_POS272 67428128.9100 37411652.3800 49418869.3000 24011361.0600 11985729.2200 19176460.6400 Cer(m19:0_21:2)_POS274 764762.3713 430771.2109 688752.3229 498557.4676 89813.6711 24885301.7500 Cer(m19:0_21:2)_POS275 144822.3938 127938.8824 111571.8144 127836.1165 10435.9524 66717.6300 Cer(m19:0_21:4)_POS279 1559750.2490 1473013.3500 803229.0975 832985.7520 321490.8999 599979.9290 Cer(m19:0_22:2)+H_100POS 2631654.2410 2720140.8060 3896147.8410 4697908.7310 2948179.8340 10588660.9600 7274073.4540 4364158.1360 1460027.3180 2832343.1150 2124651.9410 1769770.7690 Cer(m19:0_22:2)_POS284 1186819.5850 405235.1744 752264.1054 785349.2630 154986.3025 579440.8319 Cer(m19:0_22:2)_POS286 2269246.4700 691235.3340 2142407.4510 817550.4698 286439.8048 514563.7640 Cer(m19:0_22:2)_POS288 54634734.6000 19554054.6000 38923239.9500 39913114.7900 6340515.2150 29876344.6600 Cer(m19:0_23:2)+H_104POS 5682854.5690 5566887.7260 8175367.2550 15288649.5400 8785021.5760 23171108.7900 13832779.6200 7899005.9910 3116812.5660 9922519.0650 5437830.5490 6042938.7470 Cer(m19:0_23:2)_POS296 53864743.8500 33462689.0200 56478052.5300 38521664.5100 11350047.2700 32562497.6500 Cer(m19:0_23:2)_POS298 35677351.3400 59578899.0700 62548634.3600 22294941.6700 12224195.8200 33719213.4100 Cer(m19:0_23:2)_POS299 206724.2398 21478.1611 80151.1952 19701.2312 9077.0849 45703.5544 Cer(m19:0_23:3)+H_105POS 6808868.7810 9126765.6730 11018948.0800 14259440.4700 8945154.7630 39135887.9200 15707036.4300 11031816.5600 2915713.7940 15074676.5900 6508459.7240 6892468.7490 Cer(m19:0_23:3)_POS300 1993669.6390 2068271.9080 1525131.3460 1634015.4220 685798.3585 1909046.7570 Cer(m19:0_23:3)_POS301 97919825.0800 79225803.3500 71908094.8700 68768972.0900 25467728.7100 65604929.7800 Cer(m19:0_23:3)_POS303 27383425.7900 27389338.8000 740913.4409 67096027.0400 26357800.8700 61751202.2700 Cer(m19:0_23:3)_POS305 291011.6198 354037.7895 180984.4266 57235.8156 240571.4607 118126.9351 Cer(m19:0_23:3)_POS306 3876.6824 306616.8061 44403.4348 68105.7588 80075.4239 31310.9833 Cer(m19:0_23:4)_POS311 22791184.1900 18573701.4700 16053939.6000 14982508.4100 7620878.2550 13867917.4400 Cer(m19:0_24:2)_POS316 887815.3506 436787.5312 1057734.5660 611805.6747 147067.4258 615483.1509 Cer(m19:0_24:3)_POS317 993281.7242 641562.3581 964726.8840 1010029.9430 194529.5645 1103865.8830 Cer(m19:0_25:2)_POS321 339070.6390 127992.6980 303053.9190 345708.1850 225083.3882 564093.8933 Cer(m19:0_25:3)_POS322 162089.2043 159172.7874 210914.0638 183761.8316 62877.8733 363594.0147 Cer(m19:0_25:4)_POS323 234923.7039 111171.6111 68154.7275 175221.7569 36658.2623 215916.5298 Cer(m19:1_15:1)_POS253 636104.8640 1144400.6810 382430.8723 1361214.2020 780598.5652 2465456.8490 Cer(m19:1_15:1)_POS254 303114.3671 144288.9611 102472.5043 168253.9111 56021.0971 147710.0257 Cer(m19:1_20:2)_POS269 225567.6437 120633.8412 190970.5156 78920.7657 114535.8646 106298.7252 Cer(m19:1_21:2)_POS277 7108640.9440 5486374.9630 5578414.9900 3049316.2670 1413503.5380 2113720.5070 Cer(m19:1_22:2)_POS289 4545422.1140 2580428.2230 3730162.7260 3232323.8310 805274.2583 1894225.3040 Cer(m19:1_23:3)+H_108POS 832461.5084 1418951.4780 1256099.4290 1675935.3570 1150250.2290 4231535.4940 1887639.5470 1709725.4780 980817.9575 2106819.7260 800564.5649 790661.8954 Cer(m19:1_23:4)_POS313 878086.6760 807325.7744 665315.4095 483196.0211 575339.8830 284250.6248 Cer(m19:1_24:3)_POS318 145274.6899 111269.0488 98462.2456 123652.8289 69693.8702 93366.6756 Cer(m20:1_18:1)_POS264 13025899.1200 10466721.2800 8526675.9610 6605319.6980 4964317.9090 6724316.0470 Cer(m22:1_22:6)+NH4_111POS 624537.2139 11264082.7100 1049055.3520 149471.3751 1401612.4210 417940.0513 13401479.7100 823607.5711 2371260.2140 75712.2670 57172.0096 1916477.8660 Cer(m32:0)_POS252 1246975.6940 838192.2538 224830.4385 965346.6997 598144.3031 341463.8441 Cer(m35:2)+H-H2O_POS255 14671.1557 8906.1079 30214.5381 21955.5594 59466.0947 7471.2866 Cer(m37:0+2O)+H-H2O_POS260 8674.1687 5468.3586 59301.1889 368420.8974 13211.0421 74492.6627 Cer(m39:1)+H-H2O_POS266 172682.5298 56922.1030 122184.4599 50327.9135 5779.6227 26881.6835 Cer(m41:1)+H-H2O_POS282 97373.2795 73796.5589 136610.2508 101836.2071 21911.8502 82245.8414 Cer(m41:1+O)_POS283 14898931.7900 6541499.0560 6540303.1680 9857133.6010 5113846.8030 11812786.0600 Cer(m41:2)+H-H2O_POS285 215748.2131 254695.5423 160516.3334 206338.1896 68343.8217 172168.2826 Cer(m45:4)+H-H2O_POS324 329443.9903 195553.8083 198393.1190 538405.2853 412075.5440 565984.8179 Cer(m45:6)_POS325 227665.0495 14541.8876 153840.9027 768448.2252 67451.2632 114711.7289 CerP(d15:0_24:0)+H-H2O_POS368 1460890.5280 58535.2919 161909.0369 151116.8108 1031066.7800 244931.3509 CerP(d15:2_16:1+2O)_POS367 103514.8660 132239.0718 181705.9840 236807.3011 190207.6947 296096.8689 CerP(d16:2_23:0)+H-H2O_POS369 426595.4063 382250.9194 143118.4898 240754.6621 290620.0424 174897.1660 CerP(d19:1_24:0+O)_POS374 101110.7423 137709.5188 58109.2841 187833.2208 167890.0082 147563.6325 CerP(d23:0_17:1)+H-H2O_POS371 1538000.5620 1248867.9110 512732.6238 1269651.6470 747660.8433 670860.9960 CerP(d23:1_16:1+2O)_POS370 43001.9395 5723.6830 62146.1767 1917.7790 46682.2011 0.1937 CerP(d41:0+O)_POS372 141498.2175 131072.7183 197843.3671 336041.2212 182076.7337 370854.7904 CerP(d41:1+O)_POS373 820833.7951 633949.5518 551683.8841 1467530.2860 932689.0385 1146054.4210 CerP(m18:0_21:0+O)+H-H2O_POS377 1074025.1810 673426.1811 397100.6067 433407.0243 1182086.9970 146294.3662 CerP(m19:0_18:0)_POS375 376687.3080 196775.9218 183479.1478 154843.1452 100583.2761 153683.3149 CerP(m19:0_20:0)_POS376 1238896.5990 548345.7026 466320.0947 799772.6893 473603.9083 955061.3923 CerP(m19:0_20:1)_POS378 265485.7710 59169.5205 161242.3255 151305.7914 73864.3152 103083.5833 CerP(m41:0+O)_POS379 180755.1340 69653.0090 20476.9673 60489.0928 83408.0707 32623.7948 CerP(t34:3+2O)_POS380 94298.6648 26688.2698 105518.1970 39471.6216 117853.6379 28263.9330 Cer(t16:0_16:0)_POS326 713372.5250 608699.5159 449007.0719 379367.9323 333323.5487 337911.1930 Cer(t16:0_19:0)_POS330 260598.1467 204562.8744 15442.9178 233602.1317 198893.6425 86039.6125 Cer(t17:1_24:2)_POS342 152665.1005 83527.0164 345763.8466 167397.9264 88241.1888 743555.3616 Cer(t18:0_16:0)+H-H2O_POS328 36162152.2700 26936125.4900 15869536.8300 35733846.3800 15474727.2200 12388674.0200 Cer(t18:0_16:0)+H-H2O_POS329 189907.1238 654070.8769 453961.7846 1051082.2700 194618.3032 1977714.5080 Cer(t18:0_18:0)+H-H2O_POS333 1048457.8110 798975.8484 813134.1526 1806225.3070 398921.4703 2832822.1030 Cer(t18:0_24:0+O)_POS344 130271.1579 46371.3153 83605.2617 540736.5651 38358.7191 75638.7845 Cer(t18:0_24:3)+H-H2O_POS348 17377393.7500 8525190.0000 1703851.5460 7261070.5510 5309693.5830 4856102.3690 Cer(t18:0_25:3)+H-H2O_POS351 3077359.2450 799567.6780 2498667.5280 1366314.7970 427366.9822 1291698.7520 Cer(t18:1_18:0+2O)_POS336 136187.6241 61802.0492 179339.3143 94184.4075 55630.2318 505107.0539 Cer(t20:1_16:0+O)_POS337 160099.9052 608591.9861 335901.0367 502100.1516 367936.3770 99608.7318 Cer(t34:0)_POS327 4053356.0240 2551648.3870 2046726.7710 3364261.6160 3253829.9780 1604871.6960 Cer(t36:0+O)_POS334 168928.1969 107442.9810 86099.9931 143998.1323 133088.6331 74282.6528 Cer(t36:0)_POS331 1761387.4890 1182763.8580 610155.6908 1486940.2640 1440434.0050 683867.0558 Cer(t44:4)_POS353 784068.2138 411972.1017 297319.9462 671678.9356 271156.8387 763276.8098 ChE(15:0)_POS396 22433317.7800 18226375.8000 15821767.2900 14712420.1400 7481720.6540 13624850.9500 ChE(16:0)_POS397 221407.5736 117904.2061 163688.4839 552693.0551 30205.5452 223945.0611 ChE(18:0)_POS398 313167.2309 22094.8881 19491.6475 228735.3832 227454.1454 138546.6530 ChE(18:1)_POS399 5470049.9840 2801532.6790 2864762.7220 14213945.0500 1431800.5980 3383843.6590 ChE(18:2)_POS401 4880317.6850 717264.0920 2750639.7840 10692861.6600 1427111.0500 2689754.8000 ChE(28:0)_POS404 481930.7608 38508.9023 228976.7131 705389.6344 65897.8241 421901.7782 CL(70:3)_POS34 19554718.4300 8427614.1860 12295810.7000 16602735.5100 805480.1396 8592492.3580 CL(70:4)_POS35 10857301.7800 5385287.6090 2206538.3280 4065198.7420 15154588.6300 11878826.8900 CL(70:6)+Na_8POS 1325714.2360 1766712.8170 2210903.4030 2676355.8680 1365571.8800 6864198.1890 3735570.6290 1170521.1610 542468.4289 1603936.2400 748495.6870 1527385.7210 CL(70:7)+H_9POS 803891.6177 1061059.5740 1100271.0260 2976576.2070 1325429.5190 7893843.0610 3846079.1400 1039611.6890 562160.3651 1247266.4380 610071.2271 1326774.4300 CL(70:7)+Na_10POS 1398725.5530 1642214.8740 1861514.0030 5198479.2550 2173534.1770 13086725.7300 5366490.1180 1748658.5460 956253.5329 2260784.6340 1417911.7430 2302342.8390 CL(70:7)_POS41 2477804.1560 9.2392 5.0292 4065368.5590 1295740.2160 1325140.1860 CL(72:4)_POS42 6518311.1510 2474931.3550 5879370.3810 6245790.7750 421431.3641 2631716.2300 CL(72:5)_POS43 2401252.4150 1360659.8210 1345939.4080 1496647.8860 32676.3692 1176622.4260 CL(72:5)_POS44 2445262.9700 161674.1163 412865.5631 827467.5218 2190257.0940 2577845.6000 CL(72:6)+Na_12POS 5879325.1430 7563780.5240 7630291.0330 4466902.1450 2514216.2980 9415636.9060 13484660.1500 4294196.0200 2556178.7000 3161322.5130 1336827.9340 2772939.2980 CL(72:6)_POS45 2353142.6990 2558985.2000 2304853.0930 2138829.2350 3896651.0310 1712603.2970 CL(72:7)+H_13POS 8191980.4440 12592991.9500 9788229.4280 7729401.9500 4658934.9860 17823037.5400 31914170.0900 6734336.5150 4138134.0310 4235052.8660 1846957.6750 3568320.5760 CL(72:7)+Na_14POS 14268933.3900 15391408.9800 16645864.9500 13875167.1400 7972767.1880 28418642.3800 40386310.1300 12044193.5100 6699187.3660 8253304.6540 4111910.6230 6516681.7760 CL(72:8)+H_15POS 10496587.9600 11677340.0200 10632492.1500 18711579.5300 10988091.7900 39835287.4500 48136150.7200 11880419.6200 8225244.0230 6395673.7900 4066418.4690 5648956.1520 CL(72:8)+Na_16POS 17478244.1900 15008556.2100 16739174.6000 27706902.8700 16902381.3500 65044392.0200 71368604.3700 18883534.5200 10898938.1000 11765554.5700 7935502.2480 8940930.8270 CL(72:8)_POS51 1662305.2680 173378.4747 607775.3418 840329.9957 1535997.5730 1639149.6620 CL(74:1)_POS55 190680.9959 75269.7088 120668.4318 939104.1438 128080.2555 399068.1743 CL(74:3)_POS57 620039.2959 137168.2268 623628.4069 601076.5814 52917.0483 259677.3949 CL(74:3)_POS58 15516815.9200 7017966.4520 12347017.3400 14049058.9300 3296197.5190 7711844.6950 CL(74:4)_POS59 1690255.2260 1216253.6450 1781309.8580 3997926.5260 895059.7305 1131293.6790 CL(74:5)_POS60 6103990.2990 2725984.5260 6625428.0900 7841203.2680 756731.5325 2237745.1810 CL(74:7)_POS62 20604592.5400 17155259.1700 11183728.4700 16172691.9600 2238023.8840 11564998.0400 CL(74:9)+Na_24POS 4050496.6380 4143389.1090 4907882.1440 2680540.3410 1304613.8320 5715481.1170 7944570.5660 2410766.0830 1116915.3230 1300172.6870 429864.9372 1058545.5550 CL(74:9)_POS66 101263.8610 41715.7178 91472.0385 111423.8148 184384.0621 73807.9751 CL(75:7)_POS68 515757.8412 444363.7416 532578.6270 227387.3826 35927.9003 122500.1595 CL(76:10)_POS70 200736.1643 111184.2054 306854.7809 194693.5975 26618.5104 156529.2246 CL(76:11)_POS71 169246.3418 188838.8822 210250.5269 186043.0874 215652.6848 37622.1143 CL(76:4)_POS74 3741761.0880 132458.3194 345226.0607 2925391.8510 167818.4863 350267.2281 CL(76:7)_POS76 3395952.6400 2294012.1280 2933326.4460 1239808.0230 655991.2981 1530626.3090 CL(76:8)_POS77 12496595.2400 10650862.7700 8000051.1520 9362228.2670 1722517.9420 7122332.5340 CL(77:5)_POS79 142228.2408 185691.7782 280567.6504 65210.0368 45489.2935 79104.5196 CL(77:8)_POS80 1055820.5960 546975.4799 1025198.8150 1454787.3930 360817.7438 686935.0881 CL(78:11)_POS83 245217.5751 144648.8591 326986.8338 249424.0702 264491.4446 189977.5754 CL(78:11)_POS84 26263936.4700 18354335.7000 18900967.9700 16943372.3400 7471540.9360 17831606.7000 CL(78:12)_POS85 295580.1158 200487.1971 296427.6358 178094.2357 15509.7113 105791.3405 CL(78:13)_POS86 143302.5303 222264.7959 298145.5456 86504.2003 281542.2267 103050.5893 CL(78:4)_POS87 733898.3247 837870.2327 674802.9669 318238.8096 297209.2499 268007.6829 CL(78:4)_POS88 144038.8971 65575.9098 127299.5409 139830.4989 29339.4526 6602.7168 CL(78:5)_POS89 11229938.4900 9103557.8620 5510976.8420 8808256.4490 5235882.2840 5200117.0000 CL(78:6)_POS90 523468.9937 532302.7090 681483.8118 519016.7865 313984.9128 556773.6306 CL(78:7)_POS91 71535121.7800 54750854.6100 43055667.3100 40310200.5000 27165845.8000 50259985.9100 CL(78:9)_POS92 10869005.6000 8980767.5880 7751988.0900 11292364.0400 3336582.9130 6738983.5350 CL(79:4)_POS93 4462826.6870 3847804.7260 2334144.9210 3999945.0730 2674654.0320 4211926.3050 CL(79:6)_POS94 274627.6338 225213.2711 510907.4508 131005.6301 35623.3593 84388.0966 CL(79:7)_POS95 717156.2144 432213.1469 612671.9609 525923.4967 695334.7063 285765.8039 CL(80:11)_POS97 3723277.8450 2844535.1770 1172539.8080 3087646.9110 2562048.7020 1502531.8370 CL(80:12)_POS98 6988127.0150 5655080.1580 2370158.2150 6499685.4130 4869915.3020 3146674.4070 CL(80:7)_POS100 586499.9782 741439.6493 561911.1713 695974.3645 884211.2729 499693.8772 CL(81:8)_POS103 147344.4874 33458.9872 167554.9457 121869.1760 94156.5788 70266.5533 CL(81:9)_POS104 229430.5764 131639.3088 222147.7515 20968.9376 173919.3356 80957.1102 CL(81:9)_POS105 42507.4584 13376.5714 109494.3485 78813.7342 220384.3545 46854.7167 CL(82:10)_POS106 1777737.2410 1783886.2170 2862714.7040 3154416.2230 1116113.1350 2817342.8190 CL(82:10)_POS107 9626021.4130 9632005.0910 6915274.8920 5375738.3320 16380760.0000 6312238.4300 CL(82:15)_POS110 383145.2136 389294.8339 620194.1315 260874.6705 5499383.6620 111770.6298 CL(82:6)_POS111 566475.0224 157507.6948 141107.7889 219181.2597 581635.1153 139903.9382 CL(82:7)_POS112 222577.1920 119636.3009 159779.6802 186775.3710 81241.7262 283250.1763 CL(82:9)_POS113 261059.5137 359208.0951 253516.6678 528031.1606 5962263.8850 310242.5186 CL(86:16)_POS116 25897.1157 12758.5623 27367.0371 6134.0732 128925.7986 22714.6594 CL(88:15)_POS117 325378.5726 368822.3770 32045.6728 168558.0711 98882.3075 67501.1051 Co(Q10)_POS407 5886001.2290 5315975.9690 4356423.3560 7030700.2180 65331354.8000 14891000.4400 Co(Q6)_POS408 1035436.4280 732386.5494 1113918.6490 980016.7794 1707973.3490 846455.7448 Co(Q7)_POS409 4649767.8410 6277221.6150 5096005.5550 5160408.0720 3873892.8500 1628038.5710 Co(Q7)_POS410 936577.9559 681398.3658 907179.1857 786763.8496 1505968.9670 734946.7396 Co(Q8)+NH4_144POS 2099111.0880 3889673.7440 2554997.0880 6908712.1840 5079738.7260 14315557.2500 13532836.4700 3177940.5110 3051786.6710 721781.2582 745878.9764 2108738.3500 Co(Q8)_POS412 62101260.0400 47977843.7500 48102140.0700 54124979.7800 26749602.3400 32301768.7700 Co(Q8)_POS413 342810.7615 263353.3003 367234.3369 278240.1747 516548.8254 235367.7522 Co(Q9)_POS415 352153746.4000 280615323.0000 327550803.7000 338161131.7000 650055408.8000 298891037.4000 DG(10:0_18:2)_POS482 21083.1117 85749.8829 78731.3657 96984.7201 5747.9994 3341.4450 DG(10:0_20:4)_POS507 30245.2819 21349.0415 39695.0155 25212.9879 65803.7373 39272.6202 DG(10:0_22:6)_POS607 254634.3226 461511.5337 267926.1255 391357.1139 27512.5348 84537.0549 DG(10:1e_10:4)_POS438 1330011.7560 1010675.8020 1495938.3020 1268424.8850 2262892.0790 1219482.4850 DG(12:0_10:2)_POS444 119156.8488 10682.9941 177676.6581 741016.4137 112433.0232 244490.4328 DG(12:0_10:2)_POS446 182847.8079 17343.0000 265976.7993 977427.4757 2395.3490 372234.4030 DG(12:0_18:2)_POS500 258252.3125 220088.5278 14135.4756 238809.6179 219254.8564 111451.0897 DG(12:0_22:5)_POS769 590914.7624 501446.9107 342930.8725 867309.6207 1288808.0480 685792.2853 DG(12:0_22:6)_POS776 2025455.6670 1418470.0070 901357.9939 2102212.2080 230146.4337 86603.5296 DG(12:0e_22:3)_POS740 11811976.8900 8927380.5640 6518037.9440 11836116.1900 3093503.1890 708783.3771 DG(12:0e_22:3)_POS744 10312217.7800 6910726.0280 4644520.4150 7804726.3460 14662065.4100 17968169.1200 DG(12:0e_22:3)_POS746 17136573.4900 15969643.4000 11038591.1500 17872167.3300 9284813.0010 5052553.1410 DG(12:0e_24:1)_POS810 1605080.0490 1877075.2480 1541340.6590 1616230.2100 1064161.8240 193720.8828 DG(12:1e_12:4)_POS464 1031644.0570 870978.9217 1140144.5900 954404.2808 1813533.8160 770449.8143 DG(12:1e_22:3)_POS762 356900.4104 725484.1215 510006.1195 646326.4035 15354.6682 252643.1365 DG(12:1e_22:3)_POS765 3588032.2190 4924793.1630 2898102.5470 5388951.1480 756842.4129 469899.0293 DG(12:1e_22:3)_POS766 1816516.9840 3358863.9260 720744.7481 3138649.8620 627168.7194 291588.3741 DG(12:1e_24:2)_POS879 44433212.3000 23739700.1200 6506540.5310 50201795.5400 37877761.8300 12620956.4600 DG(14:0_18:2)_POS576 3285307.2380 3410888.7150 1218945.0870 6271596.6670 1088096.3200 78988.2668 DG(14:0_22:6)_POS981 3407252.9210 6733656.4740 1874915.9110 7314264.0560 1058071.6800 644714.3240 DG(14:0_24:2)_POS1033 4215047.5450 4182075.7880 5280066.0840 4218018.6310 2471612.5680 1413698.2080 DG(14:1e_22:2)_POS882 529311.3672 591968.4041 888502.7830 728140.9294 1245095.1450 889783.1426 DG(14:1e_22:2)_POS886 2016542.8920 392811.0687 896254.8768 1040857.9790 2325641.8460 3927484.0460 DG(14:1e_22:2)_POS887 1211598.4060 1330424.3030 1008326.7780 833606.0595 836335.8050 343197.1361 DG(15:0_18:1)_POS614 191030.7104 504967.4907 382913.2798 510417.4919 247434.7974 48463.9112 DG(15:0_18:2)+Na_226POS 434185.5907 1592867.3650 541999.8354 494551.8070 688397.6633 1240167.1650 1938487.0020 550864.1508 416094.2925 237272.8183 148129.6402 703586.1530 DG(15:0_18:2)_POS618 2560717.4640 2180177.8830 1305652.3940 3692984.9460 623069.0181 299011.3536 DG(15:0_22:6)_POS1028 688233.4782 472292.7859 146012.9871 993022.7868 592387.9869 336252.6424 DG(15:0)_POS419 58051.4534 63193.1266 105168.0247 93359.6339 62247.9024 88856.1419 DG(15:3)_POS420 122719.6019 199793.3764 53644.9013 278826.2382 145603.8622 73982.9768 DG(16:0_14:0)_POS492 167897.6838 186961.5669 22479.9571 257684.5050 134423.2318 173482.1644 DG(16:0_16:0)+Na_205POS 7323540.4760 21078921.0400 10216045.9200 5622012.8360 10881585.7300 6965428.7180 27220395.3400 5129953.3630 9594620.7650 2434105.7540 2236964.2380 8960389.0900 DG(16:0_16:0)_POS527 2182640.1550 2560708.3980 1456314.1030 3230082.8040 7376826.4450 613227.8060 DG(16:0_17:0)_POS611 167468.4957 108426.1956 87220.0291 144996.1539 122084.1361 74275.2371 DG(16:0_18:1)+NH4_230POS 17546117.0300 309114891.6000 33625936.9800 6607892.9990 18329154.5200 13406546.5300 194719934.1000 15882336.6700 27861755.6500 4058124.8690 2432209.5020 18667590.5100 DG(16:0_18:1)_POS638 162417.9306 88644.3801 29243.8758 362392.3023 90738.4293 53100.2654 DG(16:0_18:1)_POS639 2623192.2900 3442369.0620 2183481.1440 3538512.2140 751690.6358 793898.9514 DG(16:0_18:1)_POS640 32054300.7100 62083408.5200 31747509.3200 52237673.2600 41570957.5900 11739277.9700 DG(16:0_18:1)_POS643 20116061.0700 107986484.0000 46728548.6600 79592521.9000 544231.9584 194085.1447 DG(16:0_18:2)+NH4_240POS 30380745.5200 204692380.7000 43088194.7900 18252427.3900 26569405.5300 59730751.4300 181833296.7000 25685584.2000 27054944.6500 9195974.0670 4635008.3280 29506238.7400 DG(16:0_18:2)_POS682 387532309.2000 430574685.3000 225539784.9000 380364473.2000 149147268.3000 87381607.9500 DG(16:0_18:2)_POS686 7778513.8300 8841987.7980 1527682.9030 10343153.7000 8744313.2790 2346951.0120 DG(16:0_18:2)_POS690 647616.3003 561322.0635 400597.5263 762766.0527 105556.7940 78671.2836 DG(16:0_18:3)+NH4_251POS 2810416.4410 6495191.8670 2924252.1610 3211295.3920 3775487.5530 11182971.5300 19479408.8900 2176445.4940 2021138.8880 1707759.0880 789013.1840 5770439.1110 DG(16:0_18:3)_POS732 30259286.5000 24930611.0600 12707576.2500 9181340.4180 6199070.6910 1270044.6920 DG(16:0_20:4)+H_316POS 669323.7754 1924097.7620 996502.8886 762539.5618 759506.7846 1243776.2230 2908144.7740 392672.8053 367457.5078 479678.8781 181593.1451 139562.6546 DG(16:0_20:4)+H_318POS 116719846.4000 423167594.5000 203680268.5000 38734216.6800 44357820.6400 71783183.6200 264339140.5000 84503535.5000 67194070.2900 14400292.2300 10007285.8400 45146373.9600 DG(16:0_20:4)+NH4_315POS 9973040.6060 37936516.2500 14930654.3900 9601317.1170 8111904.8390 15065834.1100 48868750.7400 6577169.1350 5362927.8710 6077245.8300 2410534.2220 4588504.8920 DG(16:0_20:4)_POS908 10794610.2300 10828054.2900 4084301.6950 14209366.6900 2745191.7650 1579850.6090 DG(16:0_20:5)_POS951 812389.6809 90529.6844 549251.4396 1710786.9680 164980.4859 402667.5127 DG(16:0_22:5)_POS1073 8573825.4290 8896236.2470 5834599.1190 11248048.1100 4765791.5720 2516689.2720 DG(16:0_22:6)+H_387POS 131901221.8000 200071551.2000 151028562.3000 55581915.4100 66202458.8100 240012843.7000 357416508.1000 155457709.2000 86470668.6500 42567506.4100 27759489.9000 112477889.6000 DG(16:0_22:6)+Na_386POS 51256725.0200 155029002.9000 112100055.8000 29093933.0000 15379651.3000 59894234.2700 68683132.4500 17568730.5100 7112555.2610 9488240.6890 4071997.7950 6387889.2740 DG(16:0_22:6)+NH4_385POS 26451199.1000 109605786.1000 63861476.0200 14974337.0600 8689059.5120 31198689.2500 38898251.9900 8691983.7660 4197985.6400 5010461.5430 2036456.9990 3616990.5510 DG(16:0_22:6)_POS1094 178398871.3000 265653318.7000 114349985.3000 207872384.5000 30762085.5100 32381706.1800 DG(16:0_24:1)_POS1159 57950.5016 87161.6562 29251.2762 22748.6269 115889.6420 82006.4687 DG(16:0e_22:6)_POS1124 446893.4285 530490.0009 821170.5700 1099301.7950 1313855.6920 1080806.6800 DG(16:1_18:2)_POS735 625352.4433 1265216.9950 869419.7261 1569961.3570 262200.2116 178889.2006 DG(16:1_18:3)_POS756 15448898.0900 16883699.0600 10742817.8100 18473399.4600 2476503.8810 1000323.7420 DG(16:1_18:3)_POS758 1924402.7210 2765706.0690 815899.1968 2670158.4140 124961.9369 29292.7679 DG(16:1_22:6)_POS1130 10647133.9800 16304567.3800 6755322.3910 16171619.7100 3434510.6720 508161.5868 DG(16:1_22:6)_POS1133 13571408.8800 21982519.6600 161949.2264 19055820.7200 1594795.1160 577611.3091 DG(16:1)_POS423 12322.2038 4494.4543 5811.8063 0.0051 1369195.0720 13676.2896 DG(16:2)_POS424 45401.4816 63431.9676 8754.1186 63898.2568 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3907488.1150 4597224.9710 2061998.4160 3936501.8630 2272474.2370 316548.5022 DG(34:5e)_POS775 32436.9387 79756.1141 36185.9151 90719.6954 81403.2544 42253.3465 DG(34:6e)_POS779 1021703.1460 1380532.2520 1060002.8700 1176948.0990 197667.4901 21528.3190 DG(34:6e)_POS780 611683.2873 872220.7070 226801.3031 550458.8255 118782.7322 45881.6059 DG(34:7e)_POS784 182643.2658 103422.0825 492670.2600 628564.9508 9747.8829 114078.9810 DG(34:7)_POS781 8569.4396 35112.1911 35312.7972 87270.1428 37542.0622 50730.5471 DG(35:0e)_POS785 169200.4447 85697.9196 125888.3429 225959.8201 140125.8008 12548.7915 DG(35:1e)_POS788 54277.1957 21006.4950 92622.7700 91714.6871 21631.8135 4230.3780 DG(35:1e)_POS789 485026.4758 339176.3074 358627.5803 814605.3005 239769.1083 64849.0899 DG(35:2e)_POS792 223971.3119 127251.9227 286659.0748 206361.7023 58472.9638 26086.0322 DG(35:2e)_POS793 512429.6820 326905.0879 345213.5486 455372.7860 106227.5352 24308.6919 DG(35:3e)_POS798 3553420.7700 1944374.7470 962825.2866 3804068.6430 930593.5144 1067178.7200 DG(35:3e)_POS799 281787.8924 116108.2141 218953.9953 165661.5290 252850.0776 168182.6882 DG(35:4e)_POS801 211837.6887 234572.6394 305392.7846 288752.0006 50331.7980 58911.3664 DG(36:0_16:0)_POS1282 1863746.8200 2084987.2040 2403893.6830 3609926.0750 620929.2861 3224024.6120 DG(36:0e)_POS805 386660.6408 381472.2493 353662.1651 286296.5616 443760.0202 120986.7219 DG(36:1e)_POS809 382868.3161 346165.0446 560118.5698 437415.4232 412607.1152 82808.8786 DG(36:2e)+H_294POS 97205.1818 1709896.8620 82697.4175 147882.7901 1136208.6280 137991.0408 1546748.5940 76927.5347 811258.4240 84668.3825 43179.7029 1087106.1850 DG(36:2e)+H_296POS 5478828.2930 9642710.3420 16222892.0500 33379048.5500 34831059.9200 31347847.8100 43537950.8500 39034641.6200 7250285.3250 26062390.0000 25275858.4300 32982378.2500 DG(36:2e)_POS837 2255115.4930 1838018.6530 363227.6978 1952516.0990 6729129.2340 338838.6151 DG(36:2e)_POS838 612596.7119 615800.5000 672133.1628 673016.9265 340666.8532 350138.7870 DG(36:2e)_POS839 1975591.7910 1411936.2300 2211421.7930 1631514.0600 721966.0338 363655.9082 DG(36:2e)_POS840 116708.0669 43043.6143 33885.8546 20718.0663 15248.9033 63021.3703 DG(36:2e)_POS841 1603100.6380 1753638.4160 601902.0218 1877995.1890 1988991.9660 1477239.9280 DG(36:2e)_POS842 1413353.6520 1176387.8370 1289890.5340 1295428.2110 671981.4479 121297.4435 DG(36:2e)_POS843 1013456.1140 679158.9964 475889.7047 676405.6780 996444.6469 446932.7230 DG(36:3e)+H_306POS 331032.7451 2334415.7010 414201.9920 202424.5854 751476.3171 334049.0994 2972262.7200 347098.3557 830126.4703 153476.5082 124987.2919 617912.8492 DG(36:3e)+H_308POS 72939884.5600 93199267.0600 110625867.4000 69670253.7400 76899669.8800 50689537.0200 58441870.5700 63122915.6400 28032747.5700 61979966.9600 18177983.0500 40232302.0500 DG(36:3e)_POS878 339019.4642 341018.0328 109274.5618 270962.6430 355204.0248 306070.3259 DG(36:3e)_POS880 1551957.0690 1069817.0450 424961.0268 749359.5698 692978.3336 462421.6356 DG(36:3e)_POS881 1157392.7190 655623.3696 1069427.5500 1654963.8730 1634238.2140 363910.3684 DG(36:3e)_POS883 792390.7188 734127.7108 524491.9266 1326971.8810 750224.0227 994629.8755 DG(36:3e)_POS884 615339.9475 645627.7940 662090.6687 747049.0610 622396.2201 415444.2490 DG(36:3e)_POS885 97705.5376 76035.7262 10430.8642 68768.2864 226255.3053 24332.2644 DG(36:3e)_POS888 959642.3762 689629.0216 624174.5088 1529220.5450 1863223.5520 735854.4410 DG(36:3e)_POS889 138213.1723 152652.0814 31688.6470 90862.4560 138368.6425 26568.9724 DG(36:4e)+H_322POS 11981828.2900 8556578.2150 7594193.4510 27264412.1200 20529175.7000 43668634.9900 17761758.8400 12665296.1600 14122142.4700 14769716.0000 16502991.4500 19755438.1300 DG(36:4e)+H_323POS 2363252.6460 1742996.3030 1827101.9090 2012976.4510 1365656.7630 3734563.5760 4324853.1380 2686435.1570 1137810.3220 2405943.5780 1542012.9690 1127011.6820 DG(36:4e)+H_324POS 3081324.8870 15696499.4300 4478098.9200 980947.1667 3716143.6080 3095182.1220 16615394.2200 4141819.9650 4506364.9430 1196134.8490 927760.5647 4111354.3180 DG(36:4e)+H_325POS 246181241.3000 284696853.5000 393395758.5000 32754737.5400 11487934.8200 43665143.8800 124577810.0000 63071324.3000 23690310.1000 9605791.7260 10605312.7700 13690476.5400 DG(36:4e)_POS934 10933542.1800 8138353.9590 5368597.7970 11925622.6200 10692314.7900 5848170.2050 DG(36:4e)_POS936 1113527.0520 841407.0527 660905.3591 916540.0877 352238.9998 485690.5692 DG(36:4e)_POS937 928718.7919 977809.2691 31432.4790 143712.3796 110518.5033 194342.2388 DG(36:4e)_POS938 7835708.8660 11406279.9700 8176977.8670 8654463.5390 3725703.5570 2158616.8430 DG(36:4e)_POS939 101049.2432 49485.0258 365974.0368 154137.9334 244721.5981 367131.6972 DG(36:4e)_POS940 3443931.0930 2494875.2350 1490214.3480 2332162.2480 4147100.3310 1242490.3260 DG(36:4e)_POS941 542169.8639 450025.4798 636368.9863 714307.6968 559339.2184 163689.0832 DG(36:4e)_POS943 9069896.0650 9733809.5150 5822614.8840 9634272.0680 4573428.6130 2333236.3610 DG(36:4e)_POS944 132565.7306 259433.8285 271456.4477 172446.7527 438510.9747 263063.4025 DG(36:5e)+H_332POS 3381757.3720 2192464.9350 2607633.2580 7535767.8460 5842274.6240 15218309.3000 4565266.0270 5389552.3790 2836543.4180 9343633.9360 7282520.0930 6996058.5120 DG(36:5e)+H_336POS 2948476.5500 5187678.5250 3250303.8690 1503257.4840 2032435.4730 5205180.2980 9342951.3290 3400404.1060 2472104.2030 1613893.6800 1184806.7990 2895489.1040 DG(36:5e)+H_339POS 150118054.8000 129544960.9000 169797016.3000 20339095.2400 8317664.3310 42439373.5500 82156999.7100 30449144.9600 13638040.4000 6780295.5750 6203531.9240 7275344.3340 DG(36:5e)_POS955 43664.7250 56450.1298 2851.5957 11855.1332 7387.7160 3954.3761 DG(36:5e)_POS956 55143.0758 59057.0137 100256.0558 84293.4475 43756.5990 64947.4833 DG(36:5e)_POS957 2390845.0880 1943496.4020 2500048.9050 1724932.3350 583057.0931 1080374.6770 DG(36:5e)_POS958 4522596.9650 5437138.6200 3422996.5190 2211849.9770 2980875.8910 2483939.5760 DG(36:5e)_POS960 8101605.4710 6432987.5010 4818925.2300 6838701.7920 4127248.8190 5165566.8630 DG(36:5e)_POS961 3420653.0920 2190103.0350 2769881.8790 4126550.3730 1050202.8820 1600268.3310 DG(36:5e)_POS962 560344.7805 498775.1567 267405.0162 397112.9568 69061.6561 219453.2198 DG(36:5e)_POS963 702249.6189 948742.3690 525130.9158 813546.0830 82189.8468 17152.9715 DG(36:5e)_POS964 37518003.1500 30949968.1800 31646677.1400 26128418.2300 10993784.0400 6736778.3880 DG(36:5e)_POS965 1124119.0950 959760.0583 957709.5020 1302848.1310 1288286.4120 1038034.9490 DG(36:5e)_POS966 1764425.0460 1671001.6410 1696249.4710 1618916.4440 620238.5112 180653.6063 DG(36:5e)_POS967 13939733.4500 11884049.9500 9608828.7990 14615197.0400 7951279.9590 3437318.4470 DG(36:5e)_POS969 25015836.8300 26992839.6900 15228456.7800 27063564.3700 12174019.6500 5998437.3230 DG(36:5e)_POS970 1070374.0600 383090.0765 108341.0754 139865.3392 213349.6350 108068.2487 DG(36:6e)+H_342POS 24701270.0800 17154130.4700 16881063.8500 78679372.7800 50012836.2000 64076067.9300 46469082.1400 33505279.0300 29812170.7600 68346786.3500 27976705.3300 27287213.2300 DG(36:6e)+H_343POS 2324066.0210 2488800.3020 2456786.1430 4280331.6650 2661669.5090 7248779.5320 7343047.0230 4822957.4570 1620478.4190 5266619.0470 2428981.4060 2239063.0840 DG(36:6e)+H_346POS 18997249.3500 22238290.4500 20426921.4400 17408900.8900 8888860.4290 42382855.3100 55900781.9600 14424667.6500 7835270.6480 9513063.0070 4241275.1890 6586732.4160 DG(36:6e)_POS985 47987.8369 23435.3702 49784.1188 29567.8776 14515.8325 15321.3265 DG(36:6e)_POS988 251935.7878 282796.2873 249799.7633 235595.6665 25286.5510 232764.3668 DG(36:6e)_POS994 75571185.4600 38999047.2600 46020504.6300 54471405.0500 63973734.6900 56024871.1500 DG(36:6)_POS984 316763.4897 346520.6714 46601.8629 135498.9064 24303.9538 84155.1411 DG(36:7e)_POS1007 106494.7388 67640.3901 68364.3357 153820.6762 19345.8991 59181.9819 DG(36:7e)_POS1008 328757.6529 523703.5865 185785.9664 193402.7676 22100.5013 53510.8368 DG(36:7e)_POS1009 3588032.2190 4924793.1630 2898102.5470 5388951.1480 756842.4129 469899.0293 DG(36:7e)_POS1010 1816393.0140 3357678.5580 1576979.3440 3141687.0380 626985.2184 291107.9297 DG(37:0_24:1)_POS1287 103796.1305 70782.3018 60366.8061 105020.1695 29056.5477 116008.1994 DG(37:1e)_POS1015 5030710.2330 3457099.6050 2246757.1730 4053094.0040 3590458.9070 2811823.6960 DG(37:3e)_POS1020 1297057.7020 452865.3583 153569.0419 728407.0532 343534.2303 16730.8956 DG(37:4e)_POS1025 484263.1242 338996.2489 358865.7623 823485.7899 239978.9824 64918.9735 DG(37:4)+H_352POS 448883.5918 1701836.5510 634937.9388 189503.5048 365554.4823 543105.9616 2195560.7850 381972.1486 415818.9936 100136.3031 56239.6123 321940.6087 DG(38:1_18:1)_POS1284 3985344.9030 4638655.4940 4368435.4220 8550477.2080 1525255.6280 5996690.2260 DG(38:1_18:2)_POS1285 4720402.7660 5280222.2590 4527633.5220 8432614.1060 1426520.1290 4448623.8380 DG(38:1_20:3)_POS1286 4530156.4330 2565730.5490 3956742.6260 6711042.8930 924545.2746 3993087.7070 DG(38:1e)_POS1032 138944.5452 154213.9655 112908.2205 52384.5428 44649.4000 20176.2876 DG(38:2e)_POS1035 932936.5393 525379.2878 41457.6475 879303.3004 262974.7468 639891.8957 DG(38:3e)_POS1041 553358.2506 365763.6435 15624.8470 397310.4482 322880.3910 52365.0773 DG(38:3e)_POS1042 379775.8596 286027.8656 300493.6543 179244.2545 207177.6781 380724.0127 DG(38:3e)_POS1043 386660.6408 381472.2493 353662.1651 286296.5616 443760.0202 120986.7219 DG(38:4e)_POS1066 411911.4485 357517.8169 307248.8192 549068.8454 1785482.9980 294097.7553 DG(38:4e)_POS1067 1163876.0260 694416.5055 1132149.5850 816093.8303 639157.0936 1064388.8840 DG(38:4e)_POS1068 1432340.2130 1877443.9560 1325900.8180 1615405.4510 1062933.8630 193588.2896 DG(38:5e)+H_379POS 40494261.2200 32379084.3000 28928166.2200 34390932.6200 25323479.8600 37071167.9600 34418583.0000 27240873.0300 15688045.9400 24572422.7800 19443980.7200 20812000.7500 DG(38:5e)_POS1078 2255115.4930 1838018.6530 363227.6978 1952516.0990 6729129.2340 338838.6151 DG(38:5e)_POS1079 283118.3805 422425.0178 224020.3991 232087.8624 15802.6588 14776.7511 DG(38:5e)_POS1081 665586.2173 1038764.4750 430676.5727 818989.1625 252526.8224 61804.0317 DG(38:5e)_POS1082 1413353.6520 1176387.8370 1289890.5340 1295428.2110 671981.4479 121297.4435 DG(38:5)_POS1069 790145.7113 1234237.7130 227713.5862 1112863.9310 156035.8624 325295.6372 DG(38:6e)+H_390POS 393330923.1000 318874103.7000 309739637.5000 288719692.2000 288535579.7000 390452721.3000 617101922.2000 427081406.8000 362396677.4000 289458711.3000 203096944.0000 265922859.4000 DG(38:6e)+H_391POS 9593181.0320 9687765.2070 9932441.2180 9361665.6760 5305079.8290 12379423.4800 21236611.0000 14626089.0300 4175981.1090 10182238.6400 6497956.5720 4428346.7040 DG(38:6e)_POS1120 770911.8615 581320.9160 97585.2168 8957682.8580 8136111.9930 378038.0808 DG(38:6e)_POS1121 45467073.0700 23975950.8600 6476100.8290 50415123.4400 38091386.6000 12560555.7100 DG(38:6e)_POS1122 826660.2888 1932041.8440 578997.3400 1825132.4370 641337.8618 924890.1481 DG(38:6e)_POS1123 1026622.3100 1014265.6870 545159.5006 836819.5638 165891.4277 574604.9114 DG(38:6e)_POS1125 1718628.3460 1074305.6000 611869.4531 1187559.0200 569569.7214 336411.9326 DG(38:6e)_POS1126 743742.9551 455308.7328 46310.7926 123582.8951 172921.9034 99804.4939 DG(38:6e)_POS1127 77238.9309 58535.5757 517363.1710 83398.8744 1275634.9970 200943.6679 DG(38:6e)_POS1128 471452.2812 399471.9146 748100.3108 467075.5114 571568.9762 731900.5610 DG(38:6e)_POS1129 1211598.4060 1330424.3030 1008326.7780 833606.0595 836335.8050 343197.1361 DG(38:6)_POS1098 168436984.5000 110048121.1000 52516651.4800 113805856.1000 56767931.4800 32270918.5000 DG(38:6)_POS1099 3940593.7450 4047616.2480 63418076.0000 21502016.5300 9259259.4410 911154.5041 DG(38:6)_POS1103 2480595.5910 614115.0123 675734.1285 1781991.1850 186428.4917 183450.1114 DG(38:7e)+H_398POS 13966466.9300 12964803.0100 14771835.1800 20620371.1700 15993408.8400 31386123.6700 19493864.4200 18271548.7100 10354234.2200 27560913.2900 13260223.3700 14335453.5400 DG(38:7e)_POS1135 630128.8738 497105.1944 703571.3972 537067.8010 2848783.9020 232176.3480 DG(38:7e)_POS1136 731943.4407 492632.5819 500341.6348 613550.9008 556587.8340 42934.0573 DG(38:7e)_POS1137 657296.0758 868502.4279 595854.3144 665779.7908 111796.0619 16082.4872 DG(38:7e)_POS1138 541831.5717 676657.1015 1262087.4090 1024234.8890 7845482.4300 1334108.4360 DG(38:7e)_POS1139 1158429.6760 822865.5394 878818.3877 1063426.1170 2458027.6910 241632.4955 DG(38:7e)_POS1140 634672.6313 520630.9173 381799.3013 656887.0450 323524.3916 131016.1886 DG(38:7e)_POS1141 1217895.9720 1879470.5470 747334.9077 1842072.6090 410477.8013 271607.8591 DG(38:7)+H_397POS 23324900.5800 61264308.2000 33826762.9100 23355170.6200 16068961.3900 35738095.7100 75092241.7600 14211572.9900 10162370.7700 11502273.4800 6054590.7610 8914457.0590 DG(38:7)_POS1134 1441495.2600 1418451.9870 66720.0829 1325179.6330 239065.6606 61645.4526 DG(38:8e)_POS1144 702249.6189 948742.3690 525130.9158 813546.0830 82189.8468 17152.9715 DG(38:8e)_POS1145 410260.0483 276364.7028 286437.5664 584901.4158 133992.7931 129983.8609 DG(38:8e)_POS1146 1810866.8110 1527339.8890 2094084.7560 1788207.7990 3154344.0500 1520926.0350 DG(38:8e)_POS1147 1306594.4870 1884063.4260 1022953.6220 2290005.3720 405209.8219 396447.6571 DG(39:2)_POS1148 234052.2347 104280.7661 198203.7764 116636.6700 99940.9058 16042.0102 DG(39:5)_POS1154 1041044.0850 595653.1791 663845.7608 642505.2036 447928.7358 192522.9094 DG(39:6)_POS1157 2974032.9350 1263434.2060 1957148.8150 2186899.9190 754863.0153 493303.6086 DG(4:0_10:1)_POS418 4190.7899 17639.1579 0.0073 4839.2313 893885.1085 2480.1722 DG(4:0_14:1)_POS427 536.2338 7183.2382 15721.1433 505469.3738 3438204.7460 4316.1442 DG(40:3e)_POS1166 71813.5679 303868.6808 190600.2528 400925.2029 799338.0798 175506.5275 DG(40:4e)_POS1171 112236.7456 61743.1584 99085.2325 60786.0762 26698.8935 304688.9236 DG(40:6e)_POS1202 379449.5853 281678.6375 299639.0681 178673.8687 216374.4927 379925.1948 DG(40:6)_POS1180 911132.8123 419950.2502 151694.7270 626888.1182 1058746.3050 327108.1404 DG(40:6)_POS1193 345727.8383 332571.0051 196345.2288 159087.7883 290658.2001 236598.9881 DG(40:7e)_POS1219 220490.0182 105915.2012 113810.4668 87591.2000 118081.9154 322241.9103 DG(40:8e)_POS1224 782215.3925 429035.1107 56127.4568 222596.2125 1003619.9750 124822.3037 DG(40:8e)_POS1225 278458.2783 174594.8683 154891.9878 143979.5629 135664.6933 37896.1742 DG(40:8e)_POS1226 665586.2173 1038764.4750 430676.5727 818989.1625 252526.8224 61804.0317 DG(40:9e)_POS1229 456142.9242 352068.2813 577376.8203 520439.2832 184504.7413 169801.4019 DG(40:9e)_POS1230 810334.4132 1019457.2200 587389.7749 861682.6441 182275.4827 606533.3528 DG(40:9e)_POS1231 927413.4233 702135.0184 947200.2249 838062.5155 1847949.4630 771995.1068 DG(42:5)_POS1245 2979618.9570 3894745.5300 2731524.4880 2392533.3270 2198019.1430 580231.6802 DG(42:6)_POS1249 3437585.0320 1955355.3900 879819.5443 1691489.4520 430462.9125 88323.5523 DG(42:7)_POS1256 13487889.2900 11257966.9000 2887782.1830 11842503.3500 4115094.1760 957694.7240 DG(42:8)+H_446POS 4047391.5860 7061726.5200 5995113.4800 1569341.4590 1263958.4990 5421746.5730 11436856.5600 6278452.7400 2167262.7030 1085647.5820 606139.8931 1603972.8720 DG(42:9e)_POS1263 404664.2554 494623.4450 287856.7749 397306.6609 774659.0397 434606.8665 DG(44:12)_POS1266 2360815.0560 1705725.7940 370109.3078 1960202.8390 1981968.8760 1449524.7700 DG(44:5)_POS1269 23828.5900 49922.6089 44980.1252 16798.6561 124957.0968 9484.3723 DG(48:1)_POS1280 169886.7296 18775.8101 70161.1554 897508.5807 448271.7181 160317.7558 DG(6:0_20:4)_POS472 168504.5428 207215.5010 275707.2860 84143.0415 112480.6541 6005.8423 DG(8:0_11:2)+NH4_194POS 2678546.1960 2974347.3290 2959505.8570 2967951.8990 2297424.0730 3188597.2400 3951102.0570 3902996.5610 2391452.6730 2593517.7220 1826355.6020 2228095.6510 DG(8:0_18:2)_POS469 36974.6069 31714.7948 29362.6244 36397.2222 10409.9764 1803.0749 DG(8:0_22:6)_POS509 49075.1765 71773.8871 85547.8145 112015.6089 11177.0518 15831.9093 DG(8:0e_10:4)_POS430 697352.6603 493978.2853 691715.2388 635298.0727 1255029.1180 556033.5303 DG(8:1e_12:3)_POS437 92500.0397 75502.9135 111727.7609 100107.1895 9797578.3950 5579.4595 DGDG(32:2)+NH4_453POS 8820912.1690 10264143.2200 11905944.6400 12044866.2200 6448950.3490 17836276.7600 13295670.7500 11199978.8100 5277461.1470 11407038.3100 4605936.5770 7977697.2630 DGDG(40:3e)+H_459POS 2931892.3200 2837449.5350 3066379.7830 3046227.5620 3069102.4220 2831063.8320 2639537.6530 3244140.4200 2909528.1980 3450461.4310 3543754.8080 3465534.5810 DGDG(43:10e)+H_461POS 32249895.1700 26902850.6500 54127584.1500 26042179.8700 7330003.1490 48227200.9600 45789350.4500 77961371.7500 19403240.8000 50240629.9600 26452797.1000 20985467.0500 GM1(t46:2)_POS1288 1096690.1780 500045.4260 202670.0330 476988.1497 46432.6555 219279.6997 GM2(d34:1+O)_POS1289 185113.8226 199912.8740 118950.2445 371190.5553 35575.9473 177215.3503 GM2(d36:1+O)_POS1290 48814.9996 136286.7056 107727.5627 188654.3615 210943.7866 259650.0684 GM2(d40:1+O)+H_469POS 32185193.3400 14447486.0600 18031193.6200 35130616.5100 27750931.9400 35180272.6500 33998850.2700 23202458.1400 29490306.0200 19989342.4700 18714125.3800 21272215.8800 GM2(d40:1+O)_POS1291 3240286.8490 1877527.4710 1198561.0560 2351531.5940 516595.5892 488118.4351 GM2(d41:1+O)+H_470POS 3299849.0620 2062074.5630 3624861.3630 6243481.3550 4995026.8490 15143234.8600 5429524.8350 5084305.2300 3815046.7650 2843658.9210 3609640.3680 4120819.9350 GM2(d41:1+O)_POS1292 1959136.9620 762376.9106 833706.2854 2768200.3530 122748.9104 548876.0280 GM2(d42:1+O)_POS1293 5217594.4890 2383205.7950 1987075.9030 4124544.8010 545183.9733 1274004.0760 GM2(t42:0+O)+H-H2O_472POS 3848195.0820 1935115.1680 3183807.9640 13092583.4100 7784817.0470 19229813.0000 4812567.1140 5332475.2870 4665428.3500 8787346.4610 6770466.3230 9487105.5190 GM3(d40:3)+H-H2O_POS1296 224977.0331 280442.9630 22673.6803 175980.1368 125268.8036 85777.0665 GM3(m38:1)_POS1298 224977.0331 280442.9630 22673.6803 176034.0616 125268.8036 85777.0665 Hex1Cer(d18:0_15:0+O)_POS1299 36555.3207 11900.1059 29590.2192 122675.5705 128084.5964 7213.5143 Hex1Cer(d18:0_24:0+O)_POS1317 5109290.1870 2370709.8100 3271466.0870 5820895.9110 3238410.9140 4525114.9780 Hex1Cer(d18:1_20:0)+H_479POS 1358332.9950 2022819.2590 1697605.4910 876980.5002 433643.3642 1206949.2550 3143650.2880 3331616.1700 534581.3490 862268.0147 536561.2499 355315.8333 Hex1Cer(d18:1_20:0+O)_POS1309 1272216.2560 1091559.3450 2198473.8140 2958511.8180 1074181.5870 2650783.4070 Hex1Cer(d18:1_22:0)+H_484POS 6568699.0410 7730415.9090 5619170.8580 5398490.5100 2782055.0970 7058525.7470 15313240.2800 12198151.6700 2644178.5410 5948298.4050 2144636.8480 2387969.3600 Hex1Cer(d18:1_24:0)+H_488POS 1942825.3080 2189277.4250 2347913.0740 2970948.0430 1730323.6520 6166072.7870 5291113.0860 4931056.3470 1078863.9680 3794251.2340 1490693.5070 1758479.6980 Hex1Cer(d18:1_24:0+O)+H_490POS 201305.2245 37393.0075 137260.9004 132918.0034 89149.2436 300897.3202 203977.7138 264944.8123 121142.7665 213338.4264 159670.0150 122000.6219 Hex1Cer(d18:1_24:0)_POS1318 41662.8850 55660.3262 842623.5924 842633.6123 121756.8865 52929.3062 Hex1Cer(d18:1_24:1)+H_491POS 1362927.0400 2254730.6910 1698961.3840 2075875.8520 1230375.2000 6716469.9770 3144342.5670 4107446.5530 588540.5743 4152431.4570 1508894.1550 1483977.6210 Hex1Cer(d18:2_24:0+O)_POS1323 235042.3670 159505.5435 241396.4970 714579.1814 2681661.4500 258016.3112 Hex1Cer(d21:0_23:3)_POS1330 2539092.8030 3811228.9720 418514.6347 2967182.5670 886339.2166 202503.3406 Hex1Cer(d24:1_22:0)_POS1331 1651487.8200 678416.1007 1353154.0870 1774782.7110 1932581.5350 907609.0543 Hex1Cer(d35:1+O)+Na_477POS 17426472.4000 21386976.7900 24722654.3900 18077782.0000 13382344.9200 27541319.4900 51639286.5700 40385888.1200 12909679.6600 16316316.8300 10228619.5300 8168507.4320 Hex1Cer(d35:2+O)_POS1303 2760595.5190 2075954.8620 1822782.3150 6004802.3990 5476477.6360 3586714.2930 Hex1Cer(d37:2+O)+Na_478POS 2278639.3450 3076562.2390 1903781.0500 3363685.1480 2674354.7280 7454365.7560 13158422.0400 4919343.9580 1530959.6040 3399944.9210 2067010.5530 1801451.7530 Hex1Cer(d37:2+O)_POS1306 1496427.2570 3774124.4260 5343837.6300 2066120.5650 1115242.4030 2625578.7980 Hex1Cer(d42:1)+H-H2O_487POS 2527831.0250 3956706.8010 4032768.9540 2540408.1260 2712780.8630 3469787.3330 1911042.4680 2648915.0910 1168672.3680 1882266.0890 2038461.7850 1442439.3670 Hex1Cer(m19:0_21:2)+H_494POS 1842548.1950 2552781.9060 1598831.3760 1448846.8840 845061.3422 2075289.9070 3066868.2380 2838100.7880 883144.1277 2053939.2230 877808.1026 852536.4259 Hex1Cer(m19:0_21:2)_POS1332 3157841.2890 1857575.1750 1924702.4670 2308490.5490 802922.2708 1879030.2000 Hex1Cer(m19:0_22:2)_POS1333 1648416.8710 704079.4010 880790.6097 1830063.9390 367155.7245 1623097.3360 Hex1Cer(m19:0_23:2)+H_496POS 1930351.5060 1458300.4650 1572039.5640 1609390.4480 2080618.1040 2469952.7760 2035515.5060 1258830.2210 1331808.8330 1632913.4390 859224.0811 1349651.4670 Hex1Cer(m19:0_23:2)_POS1334 2285702.0320 1365373.6260 1479939.4070 2034763.3720 1593957.0810 2578912.6010 Hex1Cer(m19:0_23:3)_POS1335 2109570.4340 1651774.2860 1394531.9310 2278826.1850 1587914.5600 2234776.5630 Hex1Cer(m19:0_24:3)_POS1336 122390.1022 333477.1885 173803.1915 81834.1735 29608.6800 88450.0357 Hex1Cer(m19:0_26:5)_POS1337 718096.7922 408823.8453 400539.2044 618579.4541 3998952.7610 347843.1952 Hex1Cer(m21:0_26:6)_POS1338 67335.5782 283378.7655 90546.0760 633172.6287 172051.5441 190722.6556 Hex1Cer(t18:0_22:1)+H-H2O_498POS 856155.4325 953601.5513 710132.5104 547036.9555 541158.1422 1229044.7430 796528.6139 733250.2981 549143.0045 579145.0096 543665.4287 491918.0475 Hex1Cer(t18:0_26:1)+H-H2O_POS1348 618445.5577 1454188.1880 1081776.7230 2017554.1870 111651.8196 12879.5827 Hex2Cer(d13:0_17:1)+H-H2O_POS1350 49059.8670 18502.8893 20377.0574 19973.8530 2089.2753 21806.4960 Hex2Cer(d33:0)_POS1351 602141.9110 406484.7020 198722.8106 545721.6903 142756.6989 277595.1230 Hex2Cer(d33:1)_POS1352 476337.0509 410927.4170 292179.5360 496321.4393 134114.5492 400149.3557 Hex2Cer(d35:1)_POS1354 923038.5751 693223.8566 381817.9641 590627.1699 931749.5104 373722.6661 Hex2Cer(d40:0)_POS1358 713176.7612 554189.3163 338623.6232 598054.8594 298199.0450 314749.3085 Hex2Cer(d43:1+O)_POS1371 93841407.5800 9.0000 197574.0127 504874.5312 85565.5216 958.5629 Hex2Cer(d44:5)_POS1374 459364.6533 252050.8219 108232.4015 359966.0158 353373.3490 154208.6758 Hex2Cer(d45:2+O)_POS1375 238003.3487 147761.9782 191902.0045 110874.3516 65095.1194 84149.6614 Hex2Cer(m19:0_22:2)_POS1380 129554.4920 36589.7948 63813.2503 137225.4811 43081.8529 70558.0876 Hex2Cer(m19:0_23:0+O)_POS1381 116003.0285 85783.4846 419222.6492 367120.8100 280425.3982 17364.5081 Hex2Cer(m19:0_23:2)_POS1382 485882.6552 209488.0606 226159.1641 497466.3729 156190.4321 263366.4881 Hex2Cer(m19:0_23:3)_POS1383 268916.5791 120998.9001 140252.7497 242237.9003 128789.6351 117550.1074 Hex2Cer(m19:0_25:2)_POS1385 85440.2612 246849.8820 120625.3377 271007.4022 1303.1726 8891.6566 Hex2Cer(m22:0_19:0)+H-H2O_POS1378 873228.6603 696540.7917 215322.1755 937258.9380 1541581.9020 832273.9642 Hex2Cer(m22:1_19:0)+H-H2O_POS1379 4935891.7400 2489626.2950 2122480.2220 3791123.9660 1655063.9500 543976.7516 Hex2Cer(m37:5)+H-H2O_POS1376 198983.6185 129547.5996 94292.9604 82862.4826 252388.4056 99402.5503 Hex2Cer(m40:3)_POS1377 1493479.3960 1053588.3160 292185.6249 862930.3914 906588.7555 458889.5941 Hex2Cer(m42:4)_POS1384 1308419.2050 651673.8220 501872.3208 671954.7734 638798.2234 114722.5376 Hex2Cer(t20:1_19:0)_POS1386 930983.9543 547327.3994 683518.9888 324177.4815 33255.8093 1572.5665 Hex2Cer(t43:0)_POS1388 177248.5660 104484.4936 131148.2000 133891.8157 113124.3358 130353.1634 Hex2Cer(t45:0)_POS1389 62179.0621 69495.4343 60771.3142 28768.4581 130458.7902 98943.9170 Hex2Cer(t45:3)_POS1390 261046.7371 229898.4986 191066.4827 228997.0703 440568.3780 86719.3038 LPC(14:0)+H_520POS 5096510.6590 5970752.8500 6967313.1600 8664749.6150 5085417.5060 16352184.7300 7992315.1660 13638435.2100 7175723.3670 9594610.3610 7197715.3920 9207527.8510 LPC(14:0)_POS1395 5104745.9790 5103557.8650 5875043.9030 8318996.0620 2004403.4750 969047.9754 LPC(14:1e)_POS1396 374187.0453 226463.5645 456785.6348 191620.1176 604843.6158 177029.9762 LPC(15:0)+H_521POS 3327981.5740 3460829.4770 4427250.9690 8012655.5290 5336324.5210 10196344.6800 6234280.5980 8357875.4440 5087259.1560 10981910.8600 8947581.5240 9186454.5050 LPC(15:0)_POS1399 8884002.8220 7897724.2220 5092983.7360 6139972.8390 3990408.6010 2024563.9120 LPC(15:0)_POS1400 653821.8458 1395372.9340 2305537.1810 511020.5590 936217.9376 167811.1239 LPC(16:0e)+H_534POS 3191147.6910 3716527.2640 2774359.7400 3655370.1960 3172824.7680 5386551.6500 4573925.3950 4671378.4680 3088246.8160 9294703.3580 5442030.6040 5753895.4040 LPC(16:0)+H_523POS 1860469555.0000 2170020055.0000 2599024667.0000 1653405724.0000 1064452677.0000 2508220102.0000 2699156122.0000 3356003190.0000 1710902854.0000 2741782364.0000 1677455986.0000 1776306269.0000 LPC(16:0)+Na_524POS 357091960.6000 313996757.9000 443404231.7000 280828909.7000 150473064.8000 405396490.2000 403403931.5000 535489262.7000 281757188.6000 467083623.5000 333216796.3000 323904222.1000 LPC(16:0)_POS1402 14765551.1500 17645955.7000 12984290.5700 11127238.2500 7695727.0970 3775158.5540 LPC(16:0)_POS1414 154175.2223 87196.5832 351530.6023 24693.4279 118368.1456 36330.5069 LPC(16:0)_POS1416 1712993.5670 970102.8453 1895867.3030 1025159.3880 1153180.0400 274873.5637 LPC(16:1)+H_535POS 41679064.4400 55299014.9500 62242975.3000 79068165.4600 45915742.9000 107768225.6000 52771987.9800 99112691.5100 45289147.4000 125437363.3000 72976095.7000 102449244.9000 LPC(16:1)_POS1434 315948.1520 985440.2057 424375.0453 268374.0844 38470284.8800 108432.1659 LPC(16:1)_POS1435 47544.8633 24065.8543 127585.1052 119895.4904 795794.6960 41186.2746 LPC(16:2e)+H_537POS 2779695.8840 2822467.2480 3248856.6740 2718541.8470 1534558.9060 4281734.7710 4052399.4720 3550980.7590 2782470.0880 3748863.4480 2206229.2300 2209393.4080 LPC(16:2e)_POS1438 2140170.3130 2701120.5580 1460385.3310 1321812.3040 1090304.4840 450555.2421 LPC(17:0)+H_538POS 12370553.3400 14017927.6100 17289590.8200 12726537.6000 10175095.9500 22670139.1800 19645069.7400 20987348.9900 11359864.2900 18114092.5800 17347495.5800 12642458.1900 LPC(17:0)_POS1443 3458668.9700 3398684.3260 4208097.0480 1235793.6770 1416465.2090 181323.8092 LPC(17:1)_POS1445 2036389.5480 3103501.9420 3591582.8370 2836599.5830 1811718.6370 292376.2122 LPC(18:0e)+H_546POS 1146878.6150 1214141.6280 965720.3471 1155871.9160 943235.0491 2045014.5490 1771265.8050 1800317.7780 1068678.1370 2705382.1040 1518911.0680 1570463.1760 LPC(18:0)+H_541POS 722939580.1000 975476396.7000 1083648100.0000 326549255.5000 243797049.7000 514604824.6000 928775352.3000 895130907.8000 499688772.4000 710932301.7000 403057364.9000 392594937.3000 LPC(18:0)_POS1453 9543244.3660 3624490.1090 2981154.8710 9302179.8870 1778161.6000 1175156.9620 LPC(18:0)_POS1455 57538.0340 82813.0295 90588.7889 112088.2679 72887.6337 35032.4538 LPC(18:0)_POS1456 1648417.3370 9983865.6030 7096137.8580 1592999.7670 1340015.7340 677043.1401 LPC(18:0)_POS1458 411727.3914 588031.2254 771671.6816 583094.6530 549256.5020 564100.5369 LPC(18:1e)+H_550POS 2380164.0480 2979996.1400 2374969.6020 1623023.8670 1467407.6080 2664720.9780 3280905.8520 3218935.9700 2077200.9150 6376039.8980 3462923.9120 3848959.4850 LPC(18:1e)_POS1472 3168785.7140 3976123.3270 2904552.7220 5296434.1890 2527926.2040 1039999.3280 LPC(18:1)+H_547POS 309122972.5000 309158824.7000 418265462.9000 249112784.2000 160853314.8000 378005308.8000 414617522.9000 842428569.3000 338228923.1000 577767934.1000 284218732.0000 394130579.0000 LPC(18:1)+Na_548POS 59804380.7900 56334575.8300 85120914.8200 40927461.6600 37938564.4000 74567088.3400 76497552.6200 134479634.0000 51504312.0300 94957810.9100 81422879.5700 66576070.7100 LPC(18:1)_POS1470 9089380.5320 15968944.2000 9823806.7030 7167393.0750 5709907.6180 3640451.8750 LPC(18:2e)_POS1493 637578.1179 859486.8942 652208.3013 1348383.9480 734574.9946 528329.0481 LPC(18:2)+H_551POS 318613959.4000 313166284.8000 339994421.2000 348356393.2000 241676525.7000 539910486.4000 541416178.2000 939936408.3000 480236300.7000 794584085.8000 486106775.9000 668460339.3000 LPC(18:2)_POS1480 9482248.4170 8487473.9120 6803646.2030 4172098.8340 4406142.3380 5552967.5210 LPC(18:2)_POS1481 3293270.1650 13729657.1300 3207141.0280 8081922.3780 1958733.5250 3847073.5030 LPC(18:2)_POS1484 1308312.5080 740244.7433 1914131.6270 745949.6294 6831323.6900 363210.4871 LPC(18:2)_POS1486 676845.4634 253789.0608 493546.4365 180360.0377 2723401.1400 359761.7656 LPC(18:3e)_POS1497 246365.2024 370716.1224 82502.3704 264044.3676 531241.5185 62897.2184 LPC(18:3e)_POS1498 497760.1107 470092.6830 395730.6415 992938.3560 852346.1590 171479.8954 LPC(18:3)+H_553POS 8280964.8520 7713221.8450 9420890.9320 14430675.5800 9297548.6780 20846850.5300 17645038.5400 27777319.9500 13715143.6800 20289924.4000 14760720.3500 19969772.3500 LPC(18:3)_POS1496 12982270.7000 5338552.7290 5405485.1970 15623465.5300 14625275.0600 9735248.4340 LPC(19:0)+H_560POS 3808809.8860 4143462.0500 5199887.2540 5144417.4600 3446030.9980 11244636.6900 5959686.0040 5098792.0680 2873120.9110 9986853.5010 6038328.1570 4072045.2990 LPC(19:0)_POS1501 50470.1177 109188.2701 49201.1850 141486.1733 53488.1958 18757.4678 LPC(19:1)_POS1504 409647.6032 531014.8291 502077.9910 491019.5447 226700.6356 47322.1191 LPC(20:0)+Na_563POS 639283.7117 375777.1439 412127.6928 668924.2342 311987.0709 664073.5918 669087.6431 493296.8943 363128.5582 989521.0008 636463.8546 388269.7728 LPC(20:1e)_POS1513 148035.2411 160530.7257 58591.0304 472479.1003 93532.2413 87640.4074 LPC(20:1e)_POS1514 146252.6313 169284.3391 174507.2860 204426.2159 117174.5612 116459.1935 LPC(20:1)+H_564POS 7379140.7360 9678750.1100 10787791.2600 6696189.3240 3760997.5860 12038922.4700 8281144.7960 11524012.2000 5623733.2240 17620059.0700 7640608.6510 7177636.6450 LPC(20:1)_POS1511 763191.3113 786066.1717 870134.9610 919599.4183 1165053.3320 116177.8918 LPC(20:2)+H_566POS 5046195.9210 8075889.5050 9330417.4830 4214406.8550 3352955.7600 9868268.7940 6772243.3650 17705255.7400 6812036.8630 11697485.0900 6630840.7010 5899650.1340 LPC(20:3)+H_568POS 114687106.2000 106969731.4000 178002009.5000 36843042.6200 20961960.9200 78771411.6400 111228258.6000 137182002.9000 53782389.9500 95815034.1000 55178356.7300 47682274.6500 LPC(20:3)_POS1516 1376105.2280 1762282.3170 1539797.5170 1661640.4550 843138.9354 516563.1192 LPC(20:4)+H_572POS 294846627.9000 364607465.6000 439446212.7000 153527349.4000 116643277.9000 252866552.5000 528209824.6000 913005389.3000 342353184.7000 427079176.0000 228717185.7000 281153485.8000 LPC(20:4)+Na_571POS 59656082.4600 53232217.2400 68797907.3300 30650344.7600 19043332.9800 39250596.2900 92641072.9900 155278888.8000 68615486.5000 72958206.0200 40022843.4400 43679409.9900 LPC(20:4)_POS1527 114944.3837 229525.8147 306526.5229 78065.6760 74994.2220 36885.3056 LPC(20:4)_POS1528 142243.4069 95462.2033 44131.5914 45343.1037 11821.3424 24708.6946 LPC(20:4)_POS1530 992035.8072 717299.0504 997284.8182 711799.9000 743093.4787 402495.8903 LPC(20:4)_POS1532 612135.9816 504838.2133 775427.3706 809502.9169 224284.4533 488685.0711 LPC(22:0)+H_576POS 560191.7687 561478.6675 472243.8652 1102130.6270 749761.8623 1191893.1220 851277.1477 846905.7907 669389.9576 1638297.1090 884842.0756 721763.7774 LPC(22:2)_POS1541 193059.8138 231399.2192 238345.9973 286240.0710 111239.1562 23606.1827 LPC(22:3)_POS1542 111423.7198 184037.6956 126817.2493 141895.7777 347105.0461 40953.9894 LPC(22:4)_POS1544 331152.4714 399671.7261 299276.7853 461726.0955 584108.6797 74473.4275 LPC(22:6)+H_581POS 165839223.7000 160164863.4000 216086386.1000 143049946.3000 108681932.2000 200767996.6000 321293202.9000 488914675.5000 198687070.0000 223280536.0000 158535078.5000 176099529.5000 LPC(22:6)+Na_580POS 28610547.1600 21298163.5200 28622573.0400 23869047.0800 17942790.4500 28915879.4000 51830247.0000 78713257.2500 35998498.9900 33954613.6900 23980450.5900 22427788.8200 LPC(22:6)_POS1555 9649051.1150 15246940.6100 2829540.4180 2599789.8720 1249357.9630 1248138.3220 LPC(22:6)_POS1557 66979.1126 77695.4593 144370.4653 13331.8267 14830.1216 8748.7733 LPC(22:6)_POS1559 4474148.1510 5729940.4980 2549475.1690 368952.3540 746022.0824 227221.4083 LPC(22:6)_POS1561 1166230.0610 179841.7049 775158.5208 627431.1277 935921.7747 390936.6751 LPC(24:2)_POS1570 212515.8459 245593.5185 315195.8144 424035.7671 126324.7573 78199.8046 LPC(36:0)_POS1572 306400.1617 101809.0600 121007.3308 390523.7200 146764.3464 285735.2766 LPC(36:1)_POS1573 16337595.1900 11324118.2800 12387470.1600 22200427.3600 10410820.4100 26532154.3500 LPE(14:1e)_POS1574 34396.3148 16008.0493 18807.6244 113721.4118 14557.4489 14061.4404 LPE(16:0)+Na_585POS 11290557.0600 7883974.0510 13903748.7200 14783724.5400 7900184.7600 21157649.1700 13587529.3200 20264653.2800 9112811.8480 17498699.0700 13972213.0900 11472069.6500 LPE(16:0)_POS1578 148482014.9000 162072013.0000 131834377.1000 172810743.8000 1591257.0240 39369486.9200 LPE(16:0)_POS1584 379099.3614 333909.3480 79162.0462 148471.1540 202663.8729 18476.9712 LPE(16:1e)+H_588POS 1056341.5710 1124709.5820 1720500.1020 1133759.1940 862007.9408 2578482.3810 1521614.6250 3509519.5310 857502.0736 1354217.3060 909968.5407 773785.0612 LPE(16:1p)+H_589POS 1237757.2860 1102681.4930 1397619.6450 2113402.0140 790133.5164 2545553.1170 1797160.4880 2425291.8390 1229527.3390 2469630.5110 1505667.8570 1381288.0420 LPE(16:1p)_POS1586 2398165.0100 2712900.5890 1887678.6700 2712610.1980 470095.0921 659293.2739 LPE(18:0)+H_591POS 210641226.6000 172697213.5000 257581661.0000 109879645.4000 59299639.3800 168421648.7000 274809194.3000 287811138.7000 116421229.0000 157981087.2000 111798508.7000 80729818.5700 LPE(18:0)_POS1592 5656308.1080 7667750.6160 4236657.3880 3544202.2800 2058322.5230 741284.4430 LPE(18:0)_POS1593 3096353.3830 5184752.3000 3989150.5570 3017567.7270 1994753.6870 666287.9158 LPE(18:0)_POS1595 481529.8923 705757.9423 986845.2570 319120.8369 31534.1863 56520.1161 LPE(18:0)_POS1596 490388.0807 3120161.1100 2921340.4660 517138.6797 1208748.6470 235606.1997 LPE(18:0)_POS1597 106140.1305 133465.4224 181437.3193 99638.5017 71761.9853 175330.5403 LPE(18:0)_POS1598 80699.9169 428531.7260 193050.3903 123337.5040 23096.8843 112871.9809 LPE(18:1e)+H_596POS 878708.8501 943320.9887 1532498.0130 648914.2069 472368.6435 1598648.4150 1451309.9690 3014215.0670 723444.2890 921920.9638 463725.9569 483329.9882 LPE(18:1e)_POS1604 86090.8546 109670.6797 91513.4507 121891.5212 367943.4383 11741.6951 LPE(18:1)+H_595POS 69102314.0600 62166391.7900 101403471.5000 45630630.4200 26344317.4500 99699099.7900 92891471.5400 167602784.0000 52833931.2500 90681748.6000 60101524.3700 51531994.9400 LPE(18:1)+Na_594POS 8653939.8730 6504310.4220 12207080.0600 5927663.8560 3387849.1430 12118031.8200 11056749.0900 19678665.3300 11025126.5200 11759392.2300 8000778.7520 6763936.1590 LPE(18:1p)+H_597POS 2486125.6520 2160354.8940 3123183.4450 1162580.1950 634679.4327 2097914.1900 3586273.7620 3410845.8470 1307516.0630 1817145.0590 1349336.3280 921103.3823 LPE(18:1p)_POS1605 3734584.6190 1333681.1490 3670982.2620 2000514.6820 8948493.7490 1012513.2900 LPE(18:1p)_POS1606 347640.8854 598794.3952 401503.5248 372842.7051 2179232.6780 55791.1610 LPE(20:2)+H_602POS 284135.7887 529964.4813 657672.2538 294871.9203 262025.7630 1677487.3810 969473.7173 1874867.2340 392295.3024 1439073.9430 1020746.9200 795449.1043 LPE(20:3)_POS1612 1588154.1550 2549178.8110 1857101.5910 1314460.6460 1021449.8030 444102.4885 LPE(22:6)+H_607POS 42328468.9700 33031019.3800 51973905.8700 42807183.7400 28625766.8500 83224678.8000 68182452.2400 119402335.7000 43845502.7000 78502020.9300 49758660.3000 43334807.6900 LPE(22:6)+Na_606POS 3909392.5290 2644923.2190 5040901.0820 4446510.2260 2993928.6570 7659365.9240 6569195.3830 11833733.0500 3689418.6750 7077243.9530 4821075.1150 3515837.1130 LPG(10:1e)_POS1614 180895.9554 23415.7691 193357.9275 591399.0765 66545.6726 414773.4063 LPG(13:0)_POS1615 301747.1220 206461.0201 200075.6778 959499.4894 1028710.4840 772808.2091 LPG(16:0)+H_608POS 2114728.6540 1807951.4320 2244058.6120 2527872.3550 1051455.6370 2376191.7550 2242023.9860 2828880.3170 1802571.1000 1771672.1520 1870916.0670 1501261.1490 LPG(18:2)+H_609POS 2578131.5610 3305790.2530 3392232.3180 1211488.4600 700957.3743 2141884.3530 2637206.3200 3081873.3200 1717438.5740 2263552.7240 1826861.0610 1697453.9990 LPI(16:0)+H_610POS 2799801.2810 2020860.6810 2023232.7510 12779319.6100 8811741.1790 7882867.3630 3687053.4160 3243173.4480 4689637.6300 3190045.0560 5079862.8600 3605112.5430 LPI(18:0)+H_611POS 40256583.2500 23343956.1500 29161585.5400 41374814.8000 42763649.1100 42893768.5000 42236990.9600 39680176.0900 40463465.4800 24416727.8100 34757703.7800 22962555.6200 LPI(18:1)+H_612POS 1711244.3250 1206336.8470 1368671.7490 3451089.6960 3008765.9440 3952824.6880 1666925.3140 2106519.3650 1682704.2900 2885716.3500 2972883.1520 2091757.6780 LPI(18:3e)_POS1622 636699.1599 571638.8021 129323.0624 594432.9976 306275.4718 128593.8536 LPI(20:4)+H_613POS 11824391.2200 11313258.2900 11980101.0800 11967632.6700 11946271.1000 13621398.8800 15434673.8700 15719553.0200 12299200.1200 12110956.2300 11175853.3400 10010885.4500 LPI(20:4)+Na_614POS 2954497.1070 2013315.9850 1960898.7530 3249179.5940 3476719.6170 3098266.4210 3671463.4820 3418327.8250 3096176.2060 2443419.2960 2259777.9520 1367350.4330 LPS(22:6)+H_617POS 8627100.1770 5766657.0570 7831936.8570 14697062.3100 11741985.1900 21300232.0900 12133701.5300 14500287.6400 11029326.6900 8812060.5680 14542780.4200 10999938.1000 MG(13:0)_POS1624 75670.6062 60660.2601 39593.6307 174814.0236 181910.0480 46430.0694 MG(16:0)_POS1628 720218.0095 540550.3470 373693.2307 595696.1333 751263.0965 280215.4254 MG(16:1e)_POS1631 3204685.8420 3662976.6010 4152079.6880 4344895.2360 1642932.7230 2767184.9950 MG(16:2e)_POS1638 19566560.6500 24024948.0200 14720432.4100 21024056.9500 7048736.8390 4196610.8310 MG(17:0)+NH4_654POS 12219560.7400 15803176.1000 10432532.6300 13257474.8500 13393318.8800 11439713.9100 13594808.2400 12205094.1800 9560934.7690 12462836.9200 7910331.9110 11601825.9100 MG(18:0)_POS1650 362320.3437 226767.0155 193224.5581 352437.3115 332725.8769 168556.0936 MG(18:3e)_POS1655 729047.5384 550343.4569 806698.4867 1046289.9270 237048.9083 652382.5237 MG(18:3e)_POS1656 2428752.6660 1055627.5280 2176040.9380 1460759.9140 582230.7538 1574564.8920 MG(18:3e)_POS1657 29759802.1700 30032785.1700 23988784.6700 25083536.3400 8751742.8260 5659027.2790 MG(18:3e)_POS1658 807356.3332 784838.6404 772966.5024 537950.7646 303863.1580 233598.5986 MG(18:3e)_POS1659 17970328.4400 27432101.1100 12226389.1300 69661.9232 7503977.1850 57685.4720 MG(18:3e)_POS1660 1967118.5050 1714122.0800 1524143.0080 517049.6599 535141.3934 409006.6506 MG(18:3e)_POS1661 367658.6906 694195.2356 24019.2878 1188218.4440 204662.3513 549885.3837 MG(20:4e)_POS1665 580395.5416 494191.2320 543596.3208 459369.7541 122715.9641 63592.8281 MG(20:4e)_POS1666 553478.4586 537282.5996 575795.2181 383402.2062 189239.7758 122735.8966 MG(20:5)_POS1667 1330011.7560 1010675.8020 1495938.3020 1268424.8850 2262892.0790 1219482.4850 MG(22:4)_POS1668 10172.1514 5233.1505 13146.9267 264684.5523 11255.0731 61807.8494 MG(32:0)_POS1670 298829.4172 184609.7271 3127692.9410 6743337.9300 10969918.5800 798196.4070 MG(32:1)_POS1672 161358.6514 85494.5803 27196.9783 60253.6358 106055.1387 33132.0371 MG(34:1)_POS1678 653240.3224 416981.4543 120418.9610 224151.7678 205480.2317 221224.2415 MGDG(33:4)+NH4_769POS 8975938.9380 8725053.8020 8952559.4830 17665182.9500 11154827.3900 35459312.4300 23798145.7800 16174726.3600 4695485.8300 17507725.3800 11639204.2200 7266703.4680 MGDG(34:4)+NH4_771POS 1058782173.0000 1242568306.0000 1076882199.0000 1000547099.0000 640572560.4000 1483755485.0000 2848676907.0000 1630796016.0000 530810842.3000 1129105107.0000 701612679.8000 558284540.2000 MGDG(34:7e)+NH4_775POS 10127349.4700 13297724.0200 11020847.4400 21855801.2000 17624970.8500 34718010.3500 25169227.3200 17977996.0700 6127009.5110 18779854.9600 11939709.0200 9478557.2900 MGDG(36:4)+NH4_777POS 7443121.8480 5258496.0670 4606257.9790 14996737.2600 7326941.5790 18841721.3600 15890670.0400 6709636.4170 3822395.7630 11728106.5500 6693524.2450 5019923.8620 MGDG(38:7e)+NH4_781POS 1122832.1780 969677.9195 1272143.0440 1973141.1300 1543692.1850 3242694.6050 3020886.7800 1861495.9140 571719.0194 1043006.0980 887855.5130 671448.5194 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PE(37:1e)_POS2659 53040632.7000 43545344.3200 361818.5638 59854727.9200 2076333.7340 1428137.8930 PE(37:1e)_POS2660 50493842.0700 36191638.8200 31871775.8600 71139764.5400 61887607.9900 60329180.2300 PE(37:1e)_POS2661 530784.3853 548584.7544 108132.2867 366423.4860 171957.5885 377627.6812 PE(37:2e)+H_1318POS 2839672.1140 3801376.0380 2967463.5890 8305587.0420 8531528.3760 16716078.4100 7450252.0320 6495414.4560 2021303.6970 11222758.5700 5276174.1220 4463332.4490 PE(37:3e)+H_1319POS 597309.6868 685378.0579 589290.2237 1556147.9060 1308216.6310 2449198.6890 1386739.7320 1262815.9340 632767.5389 1883566.6260 878498.3750 940522.7269 PE(37:3e)_POS2671 3879872.2470 781358.1851 1051712.7860 5211548.3680 55805626.3000 2964416.0800 PE(37:4e)_POS2674 574974.7155 397107.8711 405710.8913 909318.5291 297403.6590 788133.7578 PE(38:1_22:0)_POS2946 189613.4634 464910.0382 149451.5328 4497966.8350 1538169.3070 4501446.3290 PE(38:1e)+Na_1326POS 1071957.9330 1041659.3220 1183435.9590 902949.6825 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457961.6546 11272.1504 35349.0274 PE(39:2e)_POS2793 48288553.3900 36520597.5600 28502340.2100 58715020.3700 24256889.8800 43398419.2800 PE(39:2e)_POS2795 3083961.4100 2002051.6740 10826090.3700 4143859.7030 2669778.7520 5591736.1750 PE(39:2e)_POS2796 156116.3297 141895.4129 127693.1624 220755.3526 111703.4524 185294.9343 PE(39:2e)_POS2797 5785546.2480 5542219.1280 2896197.7180 5441257.8260 3653779.1330 2459842.3790 PE(39:2)_POS2792 35037572.2300 40760348.4300 40062984.8300 49183824.1100 54958504.7500 24798701.2400 PE(39:3e)_POS2800 6474426.6490 6569597.9450 2943417.1970 8308016.0100 35175144.5400 7908093.7550 PE(39:3e)_POS2801 619718.2063 471280.9394 278035.3863 842785.2647 8299110.5680 484453.2047 PE(39:3e)_POS2802 3110949.4930 2533067.5610 1586332.2090 2917388.8100 5918920.6150 1778511.5600 PE(39:3)_POS2799 646005.6909 3090528.1670 2513163.2670 214500.1275 2538816.4230 1567618.6730 PE(39:4e)+H_1380POS 1472510.2290 1722633.5520 2229223.8300 2767009.3980 1604118.7470 5645351.9810 3664759.1500 4855878.5080 793143.6664 5198363.3340 2007142.5480 1558656.5590 PE(39:4e)_POS2806 53150617.4600 39289507.3500 32112881.9300 59645715.3500 26179286.8300 60523312.1000 PE(40:0e)_POS2811 268698256.7000 214243016.9000 236310600.6000 256158847.8000 500804873.0000 227603298.0000 PE(40:4)_POS2826 682528.6257 344063.3732 536628.7440 403040.8753 915717.9905 285955.8212 PE(40:5e)+Na_1402POS 1093665.2580 1105206.7630 1291715.3620 890660.5098 2409234.1680 1246694.7950 3127295.1240 2415051.5250 737497.3716 907234.6447 520639.4001 403353.3143 PE(40:5e)_POS2835 539046.0320 298503.7115 253812.4427 524252.7733 359668.4538 374690.2207 PE(40:7)_POS2866 1880158.2030 1220039.3810 2129745.2790 1433610.2370 807992.1596 1294648.2830 PE(40:9e)+H_1429POS 7536604.1750 7241576.9650 9844076.5880 12886061.0100 8223372.8480 20697612.9900 15065783.1100 19693334.3100 3564432.1520 16601785.5900 7905916.6060 5826800.5830 PE(41:0e)_POS2884 197620.0888 126290.0464 180217.2182 358148.4300 72053.5305 342288.3879 PE(41:2e)_POS2886 570878.6743 1108744.5250 718331.1874 1552094.9090 653327.9636 441301.1771 PE(41:3e)_POS2888 659277.1387 344928.9143 395199.0869 785466.8775 829775.7159 738522.3089 PE(41:3e)_POS2889 196802.5209 121671.1689 322916.0206 280227.8194 584735.5716 296130.8179 PE(41:4e)_POS2890 17711257.2200 11947298.6900 13947179.3200 27924800.5900 10481096.8700 29534822.6400 PE(41:5e)_POS2893 1131765.4110 612170.9408 731919.1435 663436.0201 11325612.2300 1340319.0460 PE(41:5e)_POS2894 572287.9247 1115212.1910 993680.5137 2714965.7130 3829797.0890 1358220.5680 PE(42:11)_POS2900 4373556.0680 776735.9120 98305.4718 956969.7981 627540.2537 310440.3206 PE(42:2e)_POS2905 4908211.7260 6251893.0470 1681849.9610 3524464.6090 26375.6404 5347489.6760 PE(42:2)_POS2901 103871.2098 86352.6966 96117.0626 175981.2059 839434.2846 89494.9885 PE(42:2)_POS2902 728274.3580 170673.6913 676137.2688 907207.3755 2998249.2560 1365988.2260 PE(42:2)_POS2904 412580.0640 222857.6236 458922.1947 501648.0709 203935.8184 501028.9068 PE(42:3e)_POS2907 272146149.8000 211663328.5000 239336404.0000 256434597.1000 489060901.2000 222985394.2000 PE(42:4e)_POS2909 732593.8434 464828.4151 525111.9468 566228.0354 299216.5506 1315938.0180 PE(42:5e)_POS2912 1136657.0140 710829.6705 891502.5519 983587.3599 776200.2768 1265569.4580 PE(42:7e)_POS2920 34069.3440 15705.8288 9.0000 2676919.1490 68459973.2500 9.0000 PE(42:9)_POS2927 1523248.1710 744224.5576 941706.8668 1251997.6440 3037290.3900 592827.5970 PE(43:0e)_POS2929 55978.0814 15621.7579 68496.0302 63112.3349 109546.8874 62440.1664 PE(43:2e)_POS2930 1072918.6160 595171.3046 760830.0081 1046853.0770 38612550.4300 1418828.6780 PE(43:2e)_POS2932 190093.5040 174644.2402 119721.7308 123801.3390 923688.8773 319140.6537 PE(43:3e)_POS2933 197620.0888 126290.0464 180217.2182 358148.4300 72053.5305 342288.3879 PE(43:4e)_POS2934 62749.0318 3564.8259 5013.3975 6178.4086 441395.5858 24464.7010 PE(44:0e)_POS2935 1802112.2290 1292534.5630 872946.2535 1571381.1410 2012534.1630 767678.2852 PE(44:3e)_POS2939 47579731.4400 31680433.0700 23371661.2800 32205083.4500 54128885.3900 24627955.4300 PE(44:4e)_POS2941 128340.5583 146637.1344 33932.9304 356401.3719 25019.4428 110528.5151 PE(44:5e)_POS2943 325570.0824 278582.4181 313466.3455 436842.6645 169012.0410 776358.4563 PE(47:3)_POS2945 89408.0643 22360.5677 383178.9965 257193.9013 1450815.5990 1176615.9590 PE(60:2)_POS2947 165366.7936 184725.2290 103085.0091 953025.6039 421173.3579 888501.5616 PE(62:1)_POS2948 148887.4243 30267.8855 80342.2825 1458575.3120 9561.1194 1243196.4670 PE(62:2)_POS2949 18658.1584 14842.3601 0.3292 166606.3204 5523.8237 125639.0203 PE(8:0e_10:1)_POS2459 93150503.9100 95528369.7500 69955348.1200 59944458.7900 22760236.1000 31865587.1800 PE(8:0e_8:0)_POS2441 943287.0613 1327112.0690 1248149.1900 915436.3953 225865.5463 192633.7947 PE(8:1e_10:0)_POS2461 255972.4558 498050.0066 299309.4041 81982.7720 197659.5314 61419.9975 PE(8:1e_10:0)_POS2462 1071080.5150 2067597.2070 1150821.1540 585123.0711 178098.5813 669762.3204 PE(8:1e_10:0)_POS2463 1927235.6080 775192.9769 545770.5687 338384.9635 197604.6749 100369.2147 PE(8:1e_10:0)_POS2464 239954.4060 235054.5163 395259.5570 136131.1078 38854.1290 72695.0592 PE(8:1e_10:0)_POS2465 156197.2123 1983451.2500 225773.7807 1232187.3020 75128.0411 268639.3182 PE(8:1e_10:0)_POS2466 191736.1092 166859.3388 193225.1374 243179.9882 220824.7912 279614.5812 PE(8:1e_10:1)+H_1254POS 17144627.6000 11328616.2400 14995774.2100 18165681.5300 10796756.3200 29708394.6100 24212549.1800 39560897.6500 20487621.6000 38512251.2200 28514021.7900 22671700.1100 PE(8:1e_10:2)+Na_1255POS 3541748.9610 2141589.3990 2722956.3560 5371387.5810 2800357.4700 6122193.1260 3850765.0390 5178877.6090 2733267.9560 5924104.9440 5132232.7460 3607531.1000 PE(8:1e_12:0)_POS2472 1505914.7890 1403568.0720 889448.8717 695873.7812 1285493.3430 583111.5547 PE(8:1e_12:1)_POS2474 1187905.3490 1337782.9340 1422770.9680 1502499.7000 687951.7537 166198.4351 PE(8:1e_12:2)_POS2478 1586568.8880 2549178.8110 1857101.5910 1314460.6460 1021449.8030 444102.4885 PE(8:1e_12:2)_POS2479 526066.7863 721517.2773 695355.7740 233504.1362 1500526.0480 102565.4453 PE(8:1e_12:2)_POS2480 223154.9266 1793619.7600 435279.3418 396025.0866 159007.3374 195196.9136 PE(8:1e_12:3)+H_1262POS 77036674.5600 63695037.8700 86461285.3800 64319105.8300 37056219.0800 82848517.9000 128786968.1000 199059492.5000 84786482.4700 136937372.5000 81558116.4500 79975035.8000 PE(8:1e_12:3)+Na_1261POS 9338548.6570 5382659.7290 9578842.8610 6700222.8830 4223646.8960 8674247.7370 12223219.7800 20154425.6400 9274235.6460 13179379.1800 9019440.2820 6869419.7840 PE(8:1e_12:3)+Na_1263POS 2904838.1950 2074944.6080 3943265.6020 1987708.4120 1079891.1060 4039163.7710 3604618.3380 6174094.2060 2049268.4390 3882857.9480 3073921.7600 2114736.6290 PE(8:1e_12:3)_POS2482 87408883.0900 102068290.9000 70419484.5200 62556476.5900 23051455.5500 32558994.9700 PE(8:1e_12:3)_POS2483 2698270.7660 3146042.7900 2204956.0210 2361130.1140 1362822.1170 719984.2520 PE(8:1e_12:4)_POS2484 1004795.9600 979338.1796 1039795.7050 1174710.8250 195073.9323 296683.8151 PE(8:1e_14:2)_POS2486 218997.9798 327304.3619 339470.7780 372913.8594 47327.1103 67383.2881 PE(8:1e_14:3)_POS2487 1505914.7890 1407173.5220 889448.8717 695873.7812 1285493.3430 583111.5547 PG(14:3)+Na_1461POS 8089849.0120 4500551.7980 20703.6152 24851106.3500 36035481.5600 275255.4486 19521505.0200 13649595.2000 16017942.2900 5011078.6860 10926158.3300 2414778.6550 PG(16:0_18:2)_POS2970 96453.8969 23883.0317 86849.5720 13383.0960 27703.3377 5581.9156 PG(18:0)_POS2950 47693018.0600 57629347.7400 35792382.7800 45034384.2600 34647556.9200 15800095.4600 PG(18:1_18:2)+H_1483POS 843059.4059 808436.6086 762865.4624 320449.8051 196379.1237 240683.2099 1267734.2810 1485722.6140 423030.6020 383652.5836 180618.5739 214643.9160 PG(18:1_18:2)_POS2984 690709.5261 358488.8787 677448.5917 841307.3411 67666.1731 283903.8265 PG(18:1_22:4)+NH4_1496POS 813305.8679 917914.2489 755464.4233 233289.0562 366236.2566 402449.4279 1562893.8680 3468653.3000 635463.9071 341610.9951 250173.0594 215585.6124 PG(18:1_22:4)_POS3020 734272.0691 657896.6711 907920.1457 846438.3734 121764.6052 1062451.9850 PG(18:1_22:6)+Na_1500POS 2043782.6910 1985668.2980 2970963.7680 1009946.0710 625255.3105 2056833.3820 2341215.1830 2680848.0610 652198.7463 2020828.3580 831486.2643 813340.3267 PG(18:1_22:6)+NH4_1499POS 4247104.4480 4414119.6300 5342518.9380 2102188.2600 1922793.9780 4198606.7200 6256681.9790 8324808.0850 2198590.8310 4433830.7650 1806556.4600 1929855.2390 PG(18:2_20:4)_POS3013 261715.7995 263098.5850 312046.2002 332155.7127 121600.7702 137821.3757 PG(18:2_22:6)+H_1504POS 404736.8014 432771.9917 399296.7531 239188.2592 215077.8812 887791.8624 628416.5388 473886.4550 113013.0876 764907.1181 297777.1633 272686.2614 PG(18:2_22:6)+NH4_1502POS 2200932.9480 1881179.7130 2245014.0270 1496106.3590 1235919.0550 4030955.0840 2773691.0140 4001902.4910 1050746.2510 3359718.9440 1625439.5650 1483815.0980 PG(20:3_18:2)_POS3005 543651.5581 492169.9977 1190426.2370 744438.1279 73697.3302 393996.1870 PG(20:3e_24:1)_POS3067 348573.0536 68256.5699 248569.0398 131417.4040 591824.4055 18411.3633 PG(20:4e_23:1)_POS3049 33580.3930 9062.6385 50619.1945 19672.0302 119822.0376 66005.2905 PG(20:4e_24:1)_POS3068 2983028.0950 1028015.8200 1433262.4650 1534582.9140 149306.8720 381600.3825 PG(20:5_18:2)_POS3018 740484.6800 245339.9000 571684.0584 642897.5603 113485.2276 158450.7440 PG(20:5_22:6)+H_1509POS 889611.5311 762917.7477 1054408.1170 493712.6937 463420.3748 1965397.6780 1118496.6310 1296998.6120 301390.5096 1492875.8330 813261.1757 569821.2554 PG(22:4_18:2)_POS3023 434950.3767 378047.2606 758105.2938 741610.8256 41221.4185 396629.9863 PG(22:4_20:4)_POS3044 829509.9142 441127.2519 919417.5828 1159373.7340 323193.1831 463863.6827 PG(22:5_18:2)_POS3027 2634901.4940 1641697.8470 8321948.4050 3208816.6050 541871.0844 2384282.2800 PG(22:5_22:6)+NH4_1517POS 587555.5545 752660.4698 878494.6648 365240.5156 262078.6781 1102777.0900 1332777.2590 1434384.0960 331812.3885 877401.8947 247561.4006 252320.7544 PG(22:6_22:6)+NH4_1521POS 1911171.1240 1905020.3660 2322328.0780 2159099.7780 2928327.2400 12465331.0300 2171391.4510 1545213.8690 455474.4881 6590686.8190 3340453.5540 2869331.1460 PG(24:0_24:0)_POS3089 199725.5038 290717.7373 220513.8095 533343.9399 9847.8641 245965.1208 PG(24:1_20:2)_POS3065 15147.7285 3115.7418 23728.6562 0.1588 52601.6954 29521.8795 PG(25:0_19:0)_POS3053 235293.0770 628739.9271 237859.6499 453150.4083 99170.5380 25880.4716 PG(26:0_16:0)_POS3037 41803.7426 234179.8160 97394.4081 192426.4592 2238.8336 76526.7913 PG(26:0_16:0)_POS3038 18432.9565 95411.1343 14910.7895 156031.2904 17789.9962 8508.0077 PG(26:1_18:2)_POS3066 16850.0373 97074.7626 16952.9500 60555.1096 2178.4642 69371.2704 PG(26:1)_POS2952 10138.8207 23294.4449 43891.8192 34085.8932 55868.5793 113353.7689 PG(27:0_19:0)_POS3072 318328.5183 332909.4836 505776.7420 1230303.0010 4533.4404 471935.3786 PG(27:0_19:0)_POS3074 654047.2619 822826.4757 821777.9480 483726.6186 44554.3903 64002.1093 PG(27:0_19:0)_POS3075 1010132.0800 3465580.3020 1697384.6990 4755345.7330 125307.7434 17002.4311 PG(27:0_19:1)_POS3080 1006403.3310 489769.4409 2699348.9190 852694.1246 474440.8341 102928.7767 PG(27:0)_POS2954 742455.6701 506121.8798 513970.8986 622078.3605 504986.2168 332945.0024 PG(27:1_19:0)_POS3082 15546692.5000 28179133.6400 13491552.3700 26628779.2500 1949443.3590 471383.3841 PG(28:0_18:2)_POS3084 324906.0132 211065.8726 299551.8303 385721.2337 19938.9588 151381.6944 PG(28:1_18:2)_POS3086 27401.5156 16756.5934 40409.6987 61521.7005 70439.8436 4314.8440 PG(28:1_22:1)_POS3104 76000.0731 209283.6079 143493.1389 144561.9955 49.2757 125063.9965 PG(29:0_19:0)_POS3090 367420.5010 761456.3126 416498.8706 1187290.3550 64410.6566 9194.2610 PG(29:0_19:0)_POS3091 555561.3965 518984.4220 702828.6329 552937.6921 115234.9949 36087.5359 PG(29:0_19:0)_POS3092 2036513.2540 965952.5681 4531586.7920 4780817.5220 123861.1913 43914.2863 PG(29:0)_POS2955 877194.2024 534525.9444 539447.0945 823838.8210 709075.3539 371136.4161 PG(29:0)_POS2956 609068.1806 396612.1290 325413.4247 456528.3602 132361.4883 247587.2955 PG(29:1_19:0)_POS3093 53298.7494 43064.2223 108490.0894 56701.6970 1659.8476 10294.6885 PG(29:1_19:0)_POS3095 1127166.9900 383880.6332 1181500.1290 6055143.0320 117826.1452 66753.6213 PG(29:1_19:1)_POS3097 162685.2090 141899.0554 326260.8537 289522.2415 11710.5877 16838.3888 PG(29:1_19:1)_POS3098 324472.8359 200582.5197 609906.4850 439667.8275 20016.1381 4353.9273 PG(29:2e)+NH4_1462POS 52416587.0200 57303739.6100 56761974.8400 66701131.4000 53726453.4400 60011020.2500 59312282.6800 61717374.7000 41731005.0800 50152334.9500 45974072.7500 51599254.3300 PG(29:2e)_POS2957 305968.7736 239225.5368 83081.1093 52694.2392 84087.7759 606572.8652 PG(29:2e)_POS2958 611487.2458 74043.9702 79334.7079 430881.1485 130795.2512 113512.5976 PG(29:2e)_POS2959 489674.9091 1197018.2280 301105.5267 2257834.6690 391915.7571 192228.6172 PG(29:3)_POS2960 433411.6897 279344.4472 271941.1160 530295.4351 386071.0777 211667.4898 PG(30:0_14:0)_POS3050 8566.0136 20084.3226 47624.8312 103998.1274 130198.5509 77213.9171 PG(30:0_16:0)_POS3078 680866.9229 359751.0935 80345.2178 738149.2986 740372.7393 165112.2158 PG(30:0_16:1)_POS3079 296413.9675 452251.4418 507712.5782 252078.3490 1638.0320 258878.2452 PG(30:0_18:1)_POS3096 206468.9391 426709.7359 389035.1374 1072779.2720 13320.9812 31844.7448 PG(30:0_18:2)_POS3099 257566.8855 305506.3980 336546.8800 654943.3598 581815.6839 7193.6789 PG(30:0e)_POS2961 226244.3877 167595.7809 424942.5066 298279.2453 397561.5102 212416.8854 PG(30:1_18:1)_POS3100 216952.7669 476482.5269 226595.5931 413379.5310 4313.1340 33903.3277 PG(30:1_18:2)_POS3101 610554.9474 782752.0403 80852.8463 651112.6750 34057.6266 305831.9219 PG(30:1_18:2)_POS3102 209856.0165 295268.1999 335669.8650 451510.7094 7977.3196 27608.1679 PG(31:2e)+NH4_1464POS 66079004.4200 55325262.3100 68312993.4800 76317090.6200 71066711.2700 54043254.0100 48666746.6000 55460578.4500 54184372.3000 46582377.0300 63439301.2900 70630782.3800 PG(32:5)_POS2963 34565.3177 3507.5966 47429.1963 3979.5197 65142.0022 5863.1734 PG(32:7)_POS2964 240129.1143 120969.9388 264649.8680 466412.7203 421322.3835 208289.9392 PG(34:1)_POS2965 51913.6328 2876.9261 8321.8014 71615.2649 2198.1821 3152.5594 PG(34:1)_POS2966 1041784.7600 1071883.3500 903188.3647 678606.1848 161678.4544 349949.4264 PG(34:5)_POS2978 52010.5521 18121.0834 46352.6791 188210.1760 3379.9564 35482.9052 PG(34:6)_POS2979 105079.3557 56654.1622 157692.5261 48915.5430 5316.4261 36170.2303 PG(35:0_9:0)_POS3052 434915.4138 475724.0096 387109.5947 670897.1183 885.8219 11646.9319 PG(35:1_9:0)_POS3056 31057.3761 60530.5272 54525.9742 188108.5776 141388.5520 74034.7964 PG(36:1_8:0)_POS3055 21812.5407 49545.8873 20817.5294 52985.9573 902.8671 46894.0746 PG(37:1_11:0)_POS3094 115832.9985 69831.0257 69707.4571 71757.7551 1075.5768 31117.8733 PG(38:3)+NH4_1485POS 534940.0506 559864.5970 614358.7357 476627.4985 516159.0513 666195.7866 1207411.4640 3079127.3980 842540.6954 575440.5019 371789.9310 521805.2665 PG(38:3)_POS2999 64461.9056 101873.6729 207501.9993 156791.4924 56350.4157 112322.1728 PG(38:4)_POS3000 532389.8784 234778.2809 744380.3932 476998.9573 92995.9126 97106.7247 PG(38:4)_POS3001 757325.6032 539064.5412 696236.4633 625336.5753 113539.2739 748025.6737 PG(40:1)_POS3019 199251.7727 162151.9340 87897.7722 225447.7086 448120.8711 235743.8338 PG(4:0_21:0)_POS2951 117417.3522 83569.5317 69365.9336 117213.0088 88489.4362 61311.2742 PG(40:6)_POS3022 402864.5690 258424.4280 670154.8660 475665.9335 64868.2968 198386.6652 PG(40:9)_POS3036 155885.6101 103442.4766 111345.7085 143804.8897 28384.8639 76343.6445 PG(44:0)_POS3051 295399.0257 316476.4006 377053.6242 440435.6512 29651.3758 4249.3547 PG(44:1)_POS3054 27251.6175 32414.8046 74178.0204 51632.3717 112414.7504 70586.4236 PG(44:1)_POS3057 28583.0988 139040.7259 41737.7511 387759.0540 12314.2229 3034.2818 PG(45:1)_POS3070 486155.8632 665004.1699 820964.4541 1088562.6370 12021.6887 12044.9973 PG(46:2)_POS3085 9425.9224 28430.3878 31045.3333 24699.0678 76774.0927 49008.7056 PG(47:3)_POS3087 88682.7920 184548.2973 250670.1211 272882.8703 2215.7826 13330.1966 PG(47:4)_POS3088 490402.0176 684119.0590 815365.7545 1096512.5360 4426.2749 13118.4516 PG(48:4)_POS3103 160310.2092 25766.1122 113145.6475 220523.6654 6074.8877 79680.2988 PG(50:3)_POS3105 108028.0935 384297.0456 95355.8214 292469.4520 365361.0700 196076.5021 phSM(t36:4)_POS5650 3547193.7840 2036044.6490 1520316.8750 2922924.4830 1180644.5130 764405.7982 PI(11:0_23:1)_POS3108 66153.5005 45401.6681 65683.6158 107753.6622 128336.2363 16544.6592 PI(14:1e_22:1)_POS3123 128265.7703 189242.0019 42173.4170 153389.4510 151315.0307 134473.8526 PI(16:0_18:1)_POS3109 17695712.9200 10141643.3400 5253233.7540 9568306.1330 3654893.0950 4936573.0000 PI(16:0_18:2)+NH4_1538POS 9180035.3370 4772239.4700 5415753.2120 39335379.7400 24826136.6100 44051987.2300 16784827.0400 46282678.8600 12237575.1700 19330301.1800 28785072.7500 14754046.7800 PI(16:0_20:3)_POS3126 806608.7179 532266.0997 326603.1963 479209.9985 518342.1826 596703.3153 PI(16:0_20:4)+Na_1553POS 23250872.9500 14876618.0400 17881733.3400 55050464.0900 38060064.6700 44145540.0400 31234083.7900 29700436.1400 23857852.7200 46678946.6800 27289684.9600 23940364.7300 PI(16:0_20:4)+NH4_1551POS 34315774.1500 25867418.2200 22695422.2100 108929201.0000 68597169.5900 87044043.4100 69107064.1300 45451761.5000 43753247.7900 93902895.0100 37594833.0900 39724332.5400 PI(16:0_22:6)+Na_1576POS 1473614.7840 947507.5425 1000044.1130 7317117.2980 4982093.4530 5178855.8520 2245498.7050 2178829.9330 1398853.6810 2125550.7950 2126081.8610 1626669.5540 PI(16:0_22:6)+NH4_1575POS 2214952.5860 1683170.0530 1591523.0170 12276827.4700 8379699.1170 8489174.0340 3868833.2900 3373168.5890 2663884.0940 3828316.5760 2988436.0390 2751080.5170 PI(17:0_18:1)_POS3114 1886590.9350 982556.3276 488404.5666 2294083.0510 559379.2330 635709.8465 PI(17:0_20:4)+H_1557POS 2462866.7130 1697848.7110 2012964.1900 5313237.0220 3426365.8080 8977918.9730 4267174.2430 5963401.6710 1585406.8370 7525126.3760 4849232.6720 2882514.4900 PI(18:0_18:1)+NH4_1544POS 1877553.5210 1862764.3790 2127200.3710 3477458.0700 1682713.5510 6573769.8440 3620156.0930 3653015.2600 1048747.8200 4521499.4980 2010639.4350 850805.0695 PI(18:0_18:1)_POS3116 200570.1076 211175.3894 40294.3691 57556.2729 443896.2140 271392.5924 PI(18:0_18:2)+NH4_1547POS 14412925.6700 11682526.5000 8833391.9110 31454976.9000 26073534.6000 44905804.3600 20522946.4800 1023638.1240 15825804.4000 16075982.6100 18808038.8400 23591695.1100 PI(18:0_18:3)_POS3129 126392.1181 106084.7906 34092.6381 230538.9144 6351618.4140 53950.4741 PI(18:0_20:3)+H_1561POS 18886236.7500 15376600.2100 12906571.7200 15304522.3900 12069067.5700 15268759.9800 17551815.1800 11860976.2500 7222893.8530 10915650.9400 7835183.4380 9344852.2870 PI(18:0_20:3)+NH4_1560POS 55813194.7700 46331920.6700 36976797.3000 47116359.2500 34475890.2800 48365983.5900 52091424.1400 38037018.9000 22369157.8800 32304303.8200 23226160.6100 29446591.1800 PI(18:0_20:3)_POS3140 292832.8108 21652.9404 211924.7237 1217183.1830 209198.0283 33815.1659 PI(18:0_20:4)+H_1567POS 180637186.7000 158829268.2000 146111650.6000 143811528.3000 145716172.0000 187318434.4000 305887049.2000 211647529.1000 183676896.6000 136109465.9000 92964817.4700 133118900.6000 PI(18:0_20:4)+NH4_1566POS 513515498.6000 491205516.8000 427947372.7000 417218432.2000 418683222.4000 529822211.4000 879866028.4000 645683181.5000 538175030.9000 396013985.6000 268082542.2000 398766060.5000 PI(18:0_20:4)_POS3146 1469411.8330 12712672.2400 837023.5728 25794575.4900 2014276.1250 1086310.5500 PI(18:0_22:6)+NH4_1586POS 6226930.3520 7010686.2080 6361229.1600 20771809.4400 22178583.1700 24244419.4800 16271594.3900 10135637.9200 9413133.9700 7098017.1880 7852025.0160 11438307.5100 PI(18:1_18:1)_POS3120 3008113.3700 2554185.6030 1334196.2030 2682844.4510 3282368.4060 1463751.3870 PI(18:1_18:2)+Na_1550POS 4353354.0380 2372001.7130 2580751.1600 10005952.8600 5761334.1510 6403100.3720 3162836.9120 3841204.6000 2912883.9920 6059201.0050 4740627.6000 4147279.1950 PI(18:1_18:2)+NH4_1549POS 4583077.6780 2722107.6690 3283916.4800 10282846.3700 8363686.0870 18978545.3600 8346028.8040 7150724.1080 4193410.8590 12891190.0900 9197356.3800 9335679.8770 PI(18:1_18:2)_POS3125 97419.9772 107007.0619 59508.4603 174677.5464 183776.5112 30387.5325 PI(18:1_20:2)_POS3137 265768.2186 195795.8008 96815.1932 198232.6306 1466487.4220 102759.0075 PI(18:1_20:3)_POS3142 106893.1615 355879.3509 95807.3648 60862.7685 2037130.5350 119199.9503 PI(18:1_20:4)+H_1570POS 6353313.4570 6111845.9450 6857921.6720 9722791.3900 7281809.3500 13802182.0800 9581381.5580 8687050.0440 5181639.2170 12794908.4300 6054840.7880 6654921.7850 PI(18:1_20:4)+Na_1571POS 14789730.9200 11884348.7600 16152649.1700 18067591.1500 13532685.4500 23292234.4400 13954853.2300 18057876.8300 9393520.8880 22596362.5700 14038066.0900 13428874.5400 PI(18:1_20:4)+NH4_1569POS 22249592.6700 21355915.6900 22870089.6900 33604621.5200 24599173.9100 46700051.1300 32787928.0900 28392780.5100 16956502.7900 41873837.2600 21252353.8800 22867883.4900 PI(18:1_22:4)_POS3161 393525.7462 512440.2344 87432.6459 456009.5569 427641.2447 172960.7293 PI(19:0_20:4)_POS3156 2048907.2480 918210.0544 273197.4687 2130612.3910 888102.4869 176370.4442 PI(28:1_10:3)+NH4_1563POS 2721740.7830 2939930.8530 2130590.2030 8192636.5750 4602405.5470 6848403.4670 3481186.7400 3731344.3740 2393153.4210 6321026.6470 3842969.8120 2925840.0360 PI(28:1_10:3)_POS3141 5317735.1760 2628760.9300 1075110.2530 5474759.6100 1487775.1390 909365.6118 PI(34:2)+Na_1539POS 5832247.6500 2324606.3290 3319253.7960 24458865.8600 14696186.6200 23356356.7500 7727124.8910 7988637.4410 7086990.1150 10522898.6300 12166934.9900 8706251.2250 PI(38:5)_POS3151 73110.4197 37830.2767 40940.5054 206165.1282 66954.5022 43745.7722 PI(40:5)+NH4_1584POS 2550841.2690 1352371.6240 2816753.1810 3208117.3040 2054516.3220 5399835.1070 2205480.1350 3061661.3930 1328225.0590 4518850.2120 2474303.0700 2139650.7470 PI(40:5)_POS3163 1443907.3720 574977.3734 510525.4019 1899829.3470 755905.3496 461671.5161 PI(43:0)_POS3169 520617.8398 496518.4823 270141.6450 572544.6417 31449.5513 21368.6884 PI(8:0e_10:0)_POS3106 1717534.7250 1127859.2140 174304.7675 2698726.2770 1132074.0490 492582.4183 PI(8:1e_12:3)_POS3107 1936496.1420 1627147.1800 468918.1755 1949369.5740 1072894.6020 398170.7773 PIP(17:1_16:0)+H_1597POS 9074430.6820 5469361.2040 6848583.4250 15009575.9000 12679713.7900 12635139.9700 10069534.7000 10442973.6300 8328343.0550 14496216.6200 11093173.0200 8543021.0350 PIP2(24:2)_POS3184 1267048.5220 1772611.3560 117262.4520 342020.1337 186787.4534 131866.5417 PIP2(49:0)_POS3185 1344381.4750 319051.3298 173978.2204 150085.5512 69794.8982 45913.7107 PIP2(51:1)_POS3187 0.8358 45157.0336 16293.3434 13777.2710 1174139.4990 95132.4999 PIP3(21:0)_POS3189 83204.9749 465153.7130 248116.5310 572874.7561 9099.1049 69360.9697 PIP(36:4e)_POS3172 11471.1360 6484.6249 19824.5725 8979.4154 54229.0082 1926.8608 PIP(38:2)_POS3173 63245.0018 84925.5549 78153.4791 103546.8119 83159.5797 49300.7784 PIP(50:1)_POS3174 579168.6122 514785.9480 269218.0911 229700.3005 224954.3706 4178.0645 PIP(50:2)_POS3175 516654.7648 532329.2765 550594.0671 585507.7469 141866.8849 316383.9547 PIP(52:1)_POS3176 1306460.0930 1192518.9190 801572.4902 708536.7954 555872.3415 7900.8554 PIP(52:2)_POS3177 5487695.7980 3852550.5770 2293843.9220 2544701.9570 1372217.3650 514428.1091 PIP(52:2)_POS3178 1118684.7490 390144.9578 541944.5089 338255.6866 962880.1755 55815.2596 PIP(52:3)_POS3179 11094766.2600 7359403.2620 6350199.9060 6581053.0540 9305852.6420 1092005.5410 PIP(52:3)_POS3180 1433829.0380 1056011.2100 2747076.7340 3037764.6370 1003896.0360 760771.2964 PS(10:1e_16:0)_POS3193 73660.0957 7997.4347 17501.4493 28047.7344 8155.1861 16467.8462 PS(10:1e_18:1)_POS3194 208634.3779 90830.5842 228056.7801 108014.7373 16939.2995 50930.7371 PS(12:0e_6:0)+H_1608POS 8666323.0460 6565044.0560 12662530.4100 10397208.2300 9704295.9330 11331742.9900 10779243.1200 12589121.5700 9076038.4170 7376085.0990 7049877.8640 7875069.1320 PS(14:0_21:0)_POS3199 82774.8927 37180.8171 248664.8574 37044.6046 237412.5096 142759.9825 PS(16:0_18:1)_POS3197 2677906.0140 2888803.8150 450989.6239 1184886.2250 107049.6019 812744.6962 PS(16:0_18:2)_POS3198 156598.7640 120414.0104 176033.0119 120883.8683 14607.9482 30554.9723 PS(16:0_20:4)+H_1615POS 21800562.5200 18151597.4000 17134314.8900 32272474.4200 18129816.9200 37924536.7300 35623271.0000 31768300.3700 20818466.6800 40496460.7400 15762493.5300 24491921.0600 PS(16:0_20:4)+Na_1616POS 5983218.0070 4394468.8310 5350922.0750 8050132.0010 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14831859.4100 11326040.1100 12903772.8300 1948631.5900 13385741.2600 5031231.5880 3648498.0560 SM(d42:5)_POS3387 1292403.4360 1883120.0140 412148.0504 1218506.8180 321265.5120 1251866.5240 SM(d43:2)+H_1709POS 394100.1151 590787.3856 765298.4001 1104960.4090 779442.1044 3140452.7290 1541364.1190 1646011.0470 312294.9527 1352793.5490 893492.8056 910530.6503 SM(d43:4)+H_1712POS 8727811.0290 7682471.7010 12097767.5400 13764097.3300 7977133.1800 30859622.0700 25104144.1400 24416485.6200 5002102.4630 10806606.6100 8597460.7010 5371402.5960 SM(d43:4)_POS3395 29879541.0500 13034952.3500 11947788.2300 24964153.5400 9583773.7050 13344212.3800 SM(d43:5)+H_1713POS 1483915.1320 1435657.8730 1917355.4050 2656309.2120 1223210.7920 7839709.6990 4063514.8170 5033795.5800 820638.7267 3207283.0120 2109996.4540 1624064.4570 SM(d43:5)_POS3396 2424054.3410 1169542.6530 1126350.8510 2093360.5010 913171.7554 1976931.9380 SM(d44:0)_POS3397 62431.5864 27131.2783 23456.9510 69374.4786 90724.1446 63895.1963 SM(d44:1)+H_1717POS 239406.1260 205764.7192 271166.8355 351144.3799 339055.5970 732542.7933 789580.1488 551372.5289 106232.1610 336843.9467 173549.3488 167838.7084 SM(d44:2)_POS3400 4415.0396 17968.2975 12474.7419 3070.1256 23386.8082 33310.6258 SM(d44:3)_POS3404 276170.6758 180681.7083 213674.5888 280335.2705 233972.2138 386770.1495 SM(d44:4)_POS3406 39380202.6000 22431965.6200 17824206.1700 26210546.7700 11793519.6000 18742846.5300 SM(d44:5)+H_1722POS 32905342.3500 32530786.5900 48311844.3600 62278133.6900 33633013.2900 223334884.8000 91080968.1400 110739256.8000 13554076.6700 115587242.4000 49829645.7600 29928867.2300 SM(d44:5)_POS3407 25297682.8800 17925901.9600 7094616.5540 27299340.3200 21717264.3600 7967358.6470 SM(d44:5)_POS3408 32586141.0300 2861973.3850 2362636.8410 3195567.4590 2252191.7780 3426881.6320 SM(d44:6)+H_1723POS 3610899.6600 3747337.3470 4561800.0280 5519164.6800 3973607.8500 16835910.2300 9009021.3950 11145578.9600 1724834.0970 10873449.0200 5068118.4420 3100261.2880 SM(d44:6)_POS3409 5260652.7650 3637806.6790 1823025.1300 5053917.0970 3331328.1140 2556506.9800 SM(t18:0_23:1)_POS3420 192673.2806 124347.5993 167897.8642 475154.8803 166860.9660 461770.1917 SM(t34:1)_POS3411 47801.3104 30737.1988 36845.9227 112237.0516 18897.2794 47293.1240 SM(t36:1)_POS3414 19759457.2700 14627179.3900 11541632.9700 14236334.9200 15569824.6800 8142775.9400 SM(t40:0)+H_1726POS 1389093.9610 1042121.9200 1406977.8580 1188154.1770 777325.8267 1732254.2230 4343270.4380 3243885.2120 1111343.1090 886303.0802 686617.9784 439030.1314 SM(t40:1)_POS3416 209203.6409 121814.2076 147357.6172 574634.5104 378052.7729 675480.5080 SM(t40:5)_POS3417 379245.6410 212571.1515 318368.8159 304967.1936 5314869.1140 705985.6632 SM(t40:6)_POS3418 2118375.5190 1503562.5380 1141302.2000 2333187.2220 37338748.0700 3511641.2320 SM(t41:0)+H_1728POS 1624341.9380 1393507.3380 1322822.0270 1022163.2700 771612.6384 2721924.9090 5382089.9150 3118955.5180 821446.2340 910828.2160 699262.0029 591089.8785 SM(t42:0)+H_1729POS 1264097.3720 1068057.2990 100750.0700 1621717.9250 1140895.0190 2622840.6830 4497933.4650 3261359.3770 985307.6942 1167371.2380 705799.3033 511379.5936 SM(t42:1)+H_1732POS 851506.7119 1026783.5090 1139046.9070 1329644.4360 990087.9969 2541711.3450 2750103.4770 2661090.8450 732097.7426 1131300.8390 763708.1163 604189.2583 SM(t42:2)_POS3425 96846.4453 102978.5447 108933.8354 95488.9244 32097.6919 124354.5735 SM(t42:7)+H_1734POS 1777801.2330 1255540.4880 1250117.5210 998376.1779 1211569.3450 3352033.0280 1391317.5460 4299560.1660 1107618.1670 1459132.0740 1223035.0860 995954.4358 SPH(d12:0)+H_1735POS 5137257.8930 4605364.1190 4458609.0280 2821420.8340 3585594.1550 3238333.0280 4362203.8090 5128981.3990 4272773.4630 5194309.1540 2802787.9270 3439719.1490 SPH(d12:0)_POS3426 16230361.9400 8482053.1110 4978561.8800 15052982.2100 15012290.8800 5893826.8480 SPH(d14:0)+H_1736POS 4995788.7260 5096680.8840 4708950.6860 4256651.1750 4630104.8580 4002833.6390 5580568.0080 5995700.6540 4113999.5330 5097917.8060 3925711.7430 3844620.0520 SPH(d14:0)_POS3427 28376805.0300 19450138.2400 11654694.0100 28931181.7600 26701032.6300 12342055.8200 SPH(d14:0)_POS3428 638158.0207 197253.4867 87439.7907 344910.4652 323785.2689 246944.8862 SPH(d14:0)_POS3429 15845.8932 25606.3992 17775.2073 63197.1513 1768.5980 348430.7844 SPH(d14:0)_POS3430 73986.0329 126065.4204 300345.7417 96285.0981 1376857.9300 57990.0172 SPH(d14:0)_POS3431 45515.8804 78160.8964 34505.2506 17314.4141 25143.1108 8733.9033 SPH(d14:0)_POS3432 91584.9398 62341.6873 23260.5447 69715.2856 32573.1985 33228.1858 SPH(d14:0)_POS3433 12973.1697 12401.7044 11690.0462 8825.2433 9246.2261 4584.9877 SPH(d14:0)_POS3434 21269.4708 16654.9450 178749.1533 247637.7299 2500088.9040 86756.9634 SPH(d14:0)_POS3435 47421.0848 27402.0834 66064.8275 334089.7290 358100.3421 261563.3606 SPH(d16:0)+H_1737POS 476509850.9000 522262868.9000 378491972.9000 468250668.9000 422827940.1000 432046367.5000 540396436.6000 496133159.6000 367630723.5000 480084408.1000 298524397.2000 370276117.6000 SPH(d16:0)_POS3441 282510975.3000 200090601.0000 110441800.9000 277159630.8000 233417618.7000 123799467.7000 SPH(d16:1)+H_1754POS 2627435.1260 2721039.9690 2679367.6760 2484418.8070 2182326.2480 2490886.5170 3715485.6770 3535779.5680 1880652.2110 2735393.9910 1795103.6730 1709448.7650 SPH(d16:1)_POS3469 1766291.0920 1070152.0510 529244.3522 1573994.7060 1246380.2940 628330.1325 SPH(d17:0)+H_1755POS 18536406.4600 17294961.8800 20083282.0100 18671105.3000 16458715.2100 15108973.3400 17446763.0300 17394895.0400 11674963.2200 54260142.4800 26392131.6500 29003516.6900 SPH(d18:0)+H_1757POS 9116401.7770 9981150.3940 8122609.7730 9328986.7380 7842584.4830 8294840.0680 11463875.6800 11241641.0900 7346850.9850 9253500.3330 5543254.6690 6406899.8940 SPH(d18:0)_POS3470 161503517.3000 96221271.4100 51040864.8200 174526891.3000 144703300.7000 78454119.2800 SPH(d18:0)_POS3473 1149528.8170 488981.5962 508972.4221 67116839.9500 1791016.8710 193015.7992 SPH(d18:0)_POS3474 740004.2707 302963.6970 260819.8196 469446.6458 177937.8823 1896446.4830 SPH(d18:0)_POS3475 223748.8773 125763.5863 79807.1822 148983.0517 235181.3662 131684.0433 SPH(d18:0)_POS3476 212274.5827 80879.9895 1129412.0290 6229589.4210 188996.9880 301493.7526 SPH(d18:0)_POS3477 69955.7416 20145.3422 22122.2166 23995.8029 20377.5972 11066.7194 SPH(d18:0)_POS3478 92753.2490 365553.7160 241173.6954 608951.4857 517182.0705 145303.5725 SPH(d18:1)+H-H2O_POS3481 637513.5953 4455587.0780 2646008.0410 3987878.1580 930700.7350 6562271.4190 SPH(d18:1)+H-H2O_POS3482 250092.4987 94138.3359 115877.1527 564449.1133 337103.2633 321823.2670 SPH(d18:1)+H-H2O_POS3483 1236898.2560 1118677.4860 253185.5463 497681.8563 84736.3660 372969.5080 SPH(d18:1)+H-H2O_POS3484 1377940.5070 113277.5658 780985.1425 68592.5565 169705.1433 96977.9617 SPH(d18:1)_POS3479 13595609.8600 9022570.1310 10191340.0500 9971744.7540 4060794.3130 10632808.7800 SPH(d18:2)+H_1764POS 10423538.4200 4498734.3200 12857475.8200 14696829.4800 2784854.2430 7623317.0660 9778918.3930 10251376.0100 4094323.2600 7997927.5120 9759347.8880 3737186.9760 SPH(d18:2)_POS3485 436144.9691 212638.7629 224856.5782 214805.6644 76518.6666 349272.4565 SPH(d19:0)+H_1765POS 10484258.9900 10214913.3300 11778613.4200 10805272.6500 3680672.2890 6870130.7470 11656149.2300 7922510.5350 4338870.0900 32118963.0800 11794271.9000 17476906.6200 SPH(d19:0)+H-H2O_1766POS 2506538.3170 2424182.7870 3180077.1710 4045586.1430 3221438.7860 3999098.4260 2953877.9380 4045873.6370 2839336.4700 4759449.1000 4021204.3600 3611551.5500 SPH(d19:0)+H-H2O_POS3486 181740.2772 130562.9867 85946.0334 176724.5603 121481.2455 72295.4550 SPH(d20:0)+H_1768POS 3946969.9030 5050530.6260 4436590.9680 4565517.5460 4092510.8190 4287898.7460 5648542.7970 6167260.4470 2937426.4540 4988518.2970 3023485.4820 3022202.7650 SPH(d20:0)+H-H2O_1769POS 6960390.9860 6833818.7150 8389870.4970 10357445.3400 7778948.3340 8421280.2970 8445750.8900 12716488.2800 8065873.8520 12323173.5900 11598423.4600 12703178.4600 SPH(d20:0)+H-H2O_1770POS 310726.5814 1780345.4540 515462.9591 427583.1554 918667.5316 483349.2940 1882330.4080 617528.6136 584843.8095 798814.4125 442966.9642 653453.5009 SPH(d20:0)_POS3487 89276942.1300 36869263.5900 27154945.7300 78257851.9500 77532596.4700 56596942.4800 SPH(d20:0)_POS3489 4385030.0520 158469.5951 130295.7248 2693568.8940 498700.7730 1459039.4820 SPH(d21:0)+H-H2O_1771POS 1943599.4320 2488419.1470 2055042.8940 2722764.0400 2485766.2200 2364621.1000 2305820.7420 2588759.6240 2298077.0100 2837135.8410 2749278.5170 2813379.8320 SPH(d22:0)_POS3490 47102933.3800 25156365.2300 19021220.3700 33546207.6300 32018537.4200 18816514.5200 SPH(d22:1)_POS3509 17078041.4800 8267800.3660 4377221.5080 13713309.8200 15489998.5300 10366885.1400 SPH(d22:1)_POS3510 1323796.2400 1113559.4500 1016571.7790 1003452.7840 804826.7349 529234.6670 SPH(d22:2)_POS3511 1148514.4850 661389.3749 246743.4117 921724.9846 908653.6069 623222.9551 SPH(d24:0)_POS3512 173471.7762 117501.3751 75680.0565 157214.5360 128563.6759 63375.7434 SPH(m18:0)_POS3513 1353181.0080 271857.0119 66741.0346 426421.9354 965754.5700 888437.3373 SPH(m19:1)+H_1779POS 1381363.3420 1615797.6030 1577617.4420 1992870.2790 1886910.8030 1744513.2720 1750124.8020 1953728.6510 1819221.3270 2264872.6530 2139086.6280 2194117.2880 SPH(m20:0)_POS3514 1168950.5320 709620.6329 339088.8229 652088.8457 613668.7945 587323.6499 SPH(m20:1)_POS3515 451597.0143 193919.7851 90803.4119 308165.2352 317062.3968 200865.5867 SPH(m22:0)_POS3516 69282.1727 49106.3985 59425.2365 115645.9116 11473.7380 65603.1881 SPH(t16:0)+H_1780POS 4190515.6570 4488891.4990 3176750.4290 2835817.4490 3273143.6250 2672158.0640 3237106.6990 1912717.3430 342389.6730 2845367.1750 2423753.5450 2489539.2460 SPH(t16:0)_POS3517 8947750.7460 6203830.8450 3925000.8440 9005919.4720 9049842.5730 4022362.9400 SPH(t16:0)_POS3518 229589.3489 550187.8384 79713.3755 115856.0133 65056.2535 55639.2876 SPH(t16:0)_POS3519 445592.9437 202983.4620 6993.6984 20722.6707 12877.3126 13825.2711 SPH(t16:0)_POS3520 96208.3601 94952.3463 970782.2256 123018.6104 44890.0415 56682.4716 SPH(t16:0)_POS3521 157212.0900 90480.0735 342412.5064 49742.2432 54283.2375 151063.1217 SPH(t16:0)_POS3522 45378.8647 25809.1655 230206.8695 149722.6194 127884.5744 253030.2723 SPH(t18:0)_POS3527 75138249.2400 54454056.1000 32998233.5600 73291619.6800 66057109.5800 33759793.1300 SPH(t18:0)_POS3528 887569.7615 417522.2575 418558.5974 1179442.3000 840501.8151 614898.2440 SPH(t18:0)_POS3530 1383788.2770 571617.6925 1216576.2440 1051095.9830 1138630.9270 1494091.4270 SPH(t18:0)_POS3532 620283.6695 1240203.4170 434757.4261 1600907.1320 357070.8104 397072.5966 SPH(t18:0)_POS3533 63863.9247 54677.3467 799594.6827 67435.3624 35583.6869 68248.9949 SPH(t20:0)+H-H2O_POS3535 490559.8048 258155.2290 593667.1360 736497.5896 602367.2706 1013221.1630 SPH(t20:1)+H-H2O_POS3536 276579.7291 123879.4033 346289.7070 216945.6956 505937.8753 490036.1984 ST(d14:0_18:1+2O)_POS3537 819377.8202 563956.1102 1096502.2120 1028064.6370 87296.6281 456336.2938 ST(d18:1_22:0)_POS3540 981503.6219 582554.0876 255915.3110 614067.2649 321073.8668 290756.4053 ST(d18:1_24:0)_POS3542 122374.4064 76393.4770 16245.0360 125780.7829 880591.6308 12631.2879 ST(d18:1_24:1)_POS3544 89686.3167 0.1265 124515.2185 0.1573 618614.4584 164350.2200 ST(d19:1_26:0)_POS3547 3869750.2260 619227.3533 960128.5281 1047176.1300 297885.0130 158732.6951 ST(d36:2+O)_POS3538 1799876.0060 1286513.3270 502641.0694 1304074.0260 956112.8891 776750.1511 ST(d37:3)_POS3539 817012.8937 718009.1464 195413.5775 716439.6278 392619.5890 444651.6019 ST(d40:2)_POS3541 198983.6185 129547.5996 94292.9604 82862.4826 252388.4056 99402.5503 ST(d42:3)_POS3545 22658.6116 7904.7926 22957.2272 60255.3321 73222.4746 27106.9750 ST(d42:5)_POS3546 112581.6448 42972.3576 177742.0352 149496.2868 9479.4747 55888.7326 StE(32:3)_POS3552 584404.0919 331688.9543 465254.2647 632846.8502 387919.3684 278867.0593 StE(34:4)_POS3553 403341.0378 287182.8586 273239.1744 228011.4054 764367.0200 51672.1713 StE(38:4)_POS3554 153388.7724 78838.0872 44194.1432 85634.8683 39884.2101 44484.1416 ST(m22:1_20:5)_POS3548 12295765.5400 6305882.0130 1795353.0470 11417920.1200 11130164.5100 3283598.1570 ST(t16:0_20:2)_POS3549 1799876.0060 1286513.3270 502641.0694 1304074.0260 956112.8891 776750.1511 ST(t16:1_22:5)+NH4_1792POS 11710960.7400 8602579.3740 7921978.9860 35893579.0500 24055908.7200 29461609.9100 23113668.6700 16160349.8700 14690659.4400 31549602.4700 13342340.5700 13470153.0900 ST(t36:4)+NH4_1788POS 3173932.0220 1770119.4920 1799377.1180 15235083.3200 9538098.8290 15899194.5600 6050456.2190 4403075.7590 4568408.9530 7100086.4790 6196894.2720 5843195.3610 ST(t39:0+O)_POS3550 3306275.5630 2923878.4640 200754.1156 3393659.7580 923866.1571 31099.5756 TG(10:0_10:0_10:4)_POS3590 112091.8294 51040.1997 81404.2739 46702.8939 63518.4898 28715.9281 TG(10:0_10:0_18:2)_POS3713 74431.3350 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TG(17:0_18:1_18:2)_POS4491 1678940.6470 1137800.1150 546473.9280 1391250.7600 2190370.2280 333775.0473 TG(17:0_18:1_18:2)_POS4492 133352089.3000 127340718.2000 100158074.9000 226849622.7000 63111962.2600 23643847.0900 TG(17:0_18:1_18:2)_POS4494 420113.8130 777208.0016 85641.9088 886692.6847 123107.0663 380834.4330 TG(17:0_18:1_22:4)_POS5082 5547308.1220 2697222.0750 3883775.9450 5140677.6320 2522381.5820 700853.2943 TG(17:0_18:1_22:5)_POS5083 5259625.5850 4207383.5440 2246288.9040 4023414.7400 1305913.2120 116052.1969 TG(17:0_18:1_22:6)_POS5089 7266092.9620 5875513.4890 4888733.7220 17780762.9800 2127407.8400 1245414.9120 TG(17:0_18:2_18:2)_POS4506 1876050.6440 2252069.3210 1065400.6080 2375702.9000 689777.0952 97515.4337 TG(17:0_18:2_20:4)_POS4814 143426.3465 80792.4722 34511.1224 13005.0263 132287.2932 931.1793 TG(17:0_18:2_22:5)_POS5087 1219528.2880 2152087.3490 646508.5646 1797776.5040 125390.0078 47018.5956 TG(17:0_18:2_22:6)_POS5090 253640.5659 195767.8852 699021.2839 246360.2110 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TG(18:1_18:2_18:2)_POS4705 853465.1311 327016.5730 230400.3765 815121.1389 529914.3320 242852.7017 TG(18:1_18:2_18:2)_POS4708 325146.4889 512977.8734 180372.9182 161568.4619 16882.8991 182599.4309 TG(18:1_18:2_18:2)_POS4712 1350302299.0000 680740179.7000 743912328.0000 1000593972.0000 633644827.0000 191150975.0000 TG(18:1_18:2_18:3)+Na_2909POS 128475678.4000 172460768.4000 168849656.9000 64359002.5900 38113333.8300 117359102.9000 124064176.9000 37558961.6600 26128524.3500 1079199.6540 25746425.2900 2026031.9350 TG(18:1_18:2_18:3)+NH4_2907POS 2215744222.0000 4845560791.0000 3107575919.0000 242493043.3000 103946264.4000 686820228.7000 2918492334.0000 193957596.6000 127414462.7000 35472805.4900 44109565.0300 65439725.1400 TG(18:1_18:2_18:3)_POS4741 741823.3296 702094.0186 436728.9958 2048435.1270 355385.2576 307364.3464 TG(18:1_18:2_18:3)_POS4744 1811675583.0000 1224265435.0000 979971899.2000 1221468891.0000 582989644.7000 138611221.1000 TG(18:1_18:2_20:4)_POS4998 99283.5703 33470.5229 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293131.0880 WE(2:0_16:4)_POS5577 425405.4172 66550.1395 292971.0263 312409.6658 195732.8902 275250.2191 WE(2:0_18:1)_POS5582 490414.1532 260676.7277 586853.6270 737146.9372 603870.0896 1196380.1930 WE(2:0_20:2)+NH4_3511POS 8317234.2280 12747038.5100 13044095.2000 8765379.1460 11224444.4300 6825352.2270 15184849.4000 9323555.5680 8720064.2370 12926923.8100 10566026.7100 7574317.8030 WE(2:0_20:2)_POS5593 476554.3394 481314.3881 218924.2471 327548.8755 231248.8144 295591.4602 WE(2:0_20:3)+NH4_3525POS 3882074.6190 9986037.3380 10936353.1900 5607518.2530 6215511.8890 3452015.9030 10710305.3600 4972293.9390 4039592.8000 11653893.5500 9696030.5660 4832662.3490 WE(2:0_23:3)_POS5603 5092.4490 314950.9137 31314.0338 4099.0803 3942.2446 1246.9593 WE(2:0_25:3)_POS5604 11615.8519 30238.4338 14172.5446 2503.6928 11846.2113 369.5438 WE(2:0_25:3)_POS5605 7398.6372 203896.7884 8327.1798 948.5355 4141.7237 5813.0817 WE(2:0_26:3)_POS5606 35639.2954 248440.9527 31998.8768 16019.2241 57802.7646 10636.6313 WE(20:4_16:2)+H_3532POS 2370252.4210 4005262.3790 3225212.9820 10125500.2500 10643667.0300 5364152.5860 6674326.9170 2429768.8880 2524684.4730 1900012.8880 2978344.4250 5195078.3450 WE(21:0_15:2)_POS5610 97876.0628 24611.5727 50303.6101 177411.6994 89004.1263 156611.4222 WE(21:1)_POS5584 2141640.6450 1467647.2280 663277.7239 94138.0069 629273.2209 514198.8591 WE(22:0)_POS5587 587218.1323 318986.4931 22696.7348 56248.0102 23651.8936 72717.6914 WE(22:0)_POS5588 72303.1250 25504.0502 29788.7698 48443.7909 117232.1078 83910.2702 WE(22:1)_POS5591 17078041.4800 8267800.3660 4377221.5080 13713309.8200 15489998.5300 10366885.1400 WE(22:2)_POS5592 1149516.2600 662014.0524 246545.0749 922021.8821 908136.7127 623411.3403 WE(22:5_14:2)_POS5613 44036.6282 205981.2903 27751.1299 2118715.9300 405851.8428 589141.1159 WE(22:5_14:2)_POS5614 201086.7018 11260.0643 179199.1989 2259208.5750 483626.2716 487882.8078 WE(22:5_14:2)_POS5615 193805.8323 204099.4594 87194.5283 1099246.4730 283393.9445 217333.0987 WE(22:5_14:2)_POS5617 450535.0808 173119.3118 443698.7996 1626574.7460 25493.5811 1233702.0140 WE(22:5_14:2)_POS5618 254623.5088 626674.6104 543603.8080 3490136.1690 587056.2921 525355.3454 WE(22:5_14:2)_POS5619 57044.8667 24700.8360 11472.4753 89018.0744 73988.6166 702622.8474 WE(22:5_14:2)_POS5620 499465.1186 403611.4972 469978.5979 562746.1287 7823.8089 982782.1263 WE(22:5_14:2)_POS5621 49997.3020 122821.0475 101738.0153 556084.5658 2700.3368 78370.4967 WE(22:5_14:2)_POS5622 183514.3029 7253.0755 144101.9718 174956.7012 57973.6744 464684.1873 WE(22:6_14:1)_POS5616 349936.3313 91733.6558 254693.3056 2600882.2090 696916.8652 576518.5606 WE(22:6_16:2)_POS5627 115096.6649 25221.1979 106035.7027 277920.8809 12112.6838 282013.6738 WE(23:0_17:3)_POS5629 425017.5440 413970.9611 1541161.2770 479057.9447 297823.2157 527563.6933 WE(23:1)_POS5596 1317231.3250 1557642.3080 733113.9385 276542.4767 327345.2622 1904193.9040 WE(23:2)+NH4_3527POS 1209225.4730 1445933.1570 1975533.3130 327522.2456 290205.1104 1105658.4090 1140109.2150 905330.8681 693519.2284 1186180.7580 166870.7681 409924.6421 WE(23:2)_POS5597 6249811.9760 4929000.2020 2855627.3760 1421856.6760 3348745.8460 1598672.7880 WE(23:5_15:2)_POS5626 133078.9975 54970.6496 125683.7497 438444.4755 3942.2374 208978.1847 WE(23:6_15:2)_POS5628 65594.7734 107953.0796 36078.6877 121366.9771 274762.5519 276374.9210 WE(24:0)_POS5599 173473.3296 117500.7313 75677.8644 157214.0991 128585.7274 63370.4896 WE(24:6_12:0)_POS5612 4045526.5980 1743933.0620 2416272.4540 6733897.3590 295814.3236 4622730.4800 WE(25:1_17:3)_POS5630 2579617.6290 1692421.2410 3599322.1600 3736290.4250 1968680.1620 4197454.0680 WE(25:1)_POS5600 5876.3283 45147.6623 18196.1186 2171.1449 4468.0802 93478.1659 WE(25:4_20:0)_POS5633 289264.6493 7705.5261 857952.0324 2150956.0920 3056.4642 1118096.7580 WE(25:6_17:3)_POS5631 45683.2093 27299.5932 9511.9207 144212.1426 38175.4976 176583.6988 WE(26:6_21:4)_POS5634 242548.6809 766203.8524 137690.7037 37529.8845 59107.1231 100926.4993 WE(27:2)+H_3529POS 1369578.4400 1568859.4740 1408220.0070 2269793.3780 1929398.0600 1487296.5770 1614513.7180 1762092.3790 1748106.2390 2310878.7510 1752597.3680 1931172.6190 WE(3:0_14:1)_POS5574 67899.3164 93745.5262 77818.2366 74302.4793 3367.1095 9495.3022 WE(3:0_16:3)_POS5580 254668.5612 278781.7033 294235.2429 230705.7861 41215.1049 58561.4304 WE(3:0_17:3)_POS5583 600068.1256 430173.2137 538936.8187 579489.7181 413074.9717 389896.8085 WE(3:0_19:3)_POS5594 489749.3355 788575.5090 263355.1940 534213.6738 376248.1736 590643.3766 WE(3:0_20:3)_POS5598 2823823.4270 1604189.3900 1164091.2910 249265.0639 1719319.3960 106340.7154 WE(3:0_22:2)_POS5601 399350.2212 551626.8372 319704.0603 139958.0167 127079.6903 660991.5943 WE(3:0_22:3)_POS5602 301302.5224 279312.1988 208887.6304 82798.6705 143128.1620 165654.7989 WE(3:0_26:4)+H_3530POS 1267918.0250 62709129.7300 19536261.4400 2361396.4280 3856870.6570 3180756.8890 10691684.6800 3053693.2330 1000329.8020 10988477.9500 7414188.4910 2453193.9640 WE(30:6_26:6)_POS5635 1056235.3880 278023.7337 776666.0841 1754980.5730 8667.8791 2111453.7290 WE(30:6_26:6)_POS5636 5087478.9250 528170.5484 1721184.1380 9295005.1630 222429.0134 17025083.7100 WE(4:0_15:2)_POS5579 794217.5430 637378.4027 744594.9116 563509.1707 138573.8085 264814.5141 WE(5:0_14:1)_POS5578 947381.8994 975867.3592 1010816.4910 914416.9136 366165.9335 614940.4203 WE(5:0_16:4)+H_3504POS 433718.2440 726301.5504 367903.2629 174744.0267 136732.4238 303886.6940 1359825.9460 721732.9729 272733.6682 472662.4264 196053.7929 192277.6983 WE(5:0_16:4)_POS5585 478359.8950 649789.7423 358642.9102 646991.9793 84658.7038 487961.0123 WE(6:0_16:4)_POS5595 1960.1207 83446.6679 18462.7964 3247.4587 8566.4816 1863.6082 WE(9:0_13:0)_POS5589 2335221.4240 1737196.7750 835020.9778 1780597.3430 1377677.1130 977454.8593 ZyE(10:0)_POS5637 20590.9414 49161.4996 27317.6461 87969.0324 85035.3966 103585.3975 ZyE(11:0)_POS5638 411567.7963 110106.8213 357745.9067 1042737.5810 46058.9391 1468794.2840 ZyE(20:5)_POS5639 2210244.8700 1570575.2080 918409.9916 1413469.7210 1116859.9270 1045426.4880 ZyE(24:7)_POS5641 311282.1245 141746.2889 399450.9325 48774.7814 69777.2557 96610.2881 ZyE(33:6)_POS5642 56826.0684 60223.9283 415225.3888 470549.5176 58416.8041 81815.7683 ZyE(34:3)_POS5644 584404.0919 331688.9543 465254.2647 632846.8502 387919.3684 278867.0593 ZyE(36:4)_POS5647 393859.2392 281278.0022 277117.6043 228704.3033 776277.3732 51975.8018 ZyE(37:2)_POS5648 582046.3650 647592.8730 520543.4450 403470.1243 226927.3927 92306.1715 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 AcCa(12:0)_POS1 1.323 344.2795355 AcCa(14:0)_POS2 1.49972729 372.3108355 AcCa(14:1)_POS3 1.384739603 370.2951855 AcCa(16:0)+H_1POS 121.5452901 400.3421355 AcCa(16:0)_POS6 1.92570227 400.3421355 AcCa(16:0)_POS7 2.813 400.3421355 AcCa(16:1)_POS8 1.616940783 398.3264855 AcCa(17:0)_POS9 2.232 414.3577855 AcCa(17:1)_POS10 1.785 412.3421355 AcCa(18:0)+H_2POS 170.8122606 428.3734355 AcCa(18:0)_POS11 2.644015819 428.3734355 AcCa(18:1)+H_3POS 127.6399079 426.3577855 AcCa(18:1)_POS12 2.083672949 426.3577855 AcCa(18:1)_POS13 2.837 426.3577855 AcCa(18:2)+H_4POS 104.1074454 424.3421355 AcCa(18:2)_POS14 1.715166597 424.3421355 AcCa(18:3)_POS15 1.58961206 422.3264855 AcCa(19:0)_POS16 3.199063565 442.3890855 AcCa(19:1)_POS17 2.387 440.3734355 AcCa(20:0)_POS18 3.805385804 456.4047355 AcCa(20:1)_POS19 2.797569311 454.3890855 AcCa(20:1)_POS20 3.468 454.3890855 AcCa(20:2)_POS21 2.22513795 452.3734355 AcCa(20:3)_POS22 2.225 450.3577855 AcCa(20:4)+H_5POS 100.6893511 448.3421355 AcCa(20:4)_POS23 1.652316492 448.3421355 AcCa(21:0)_POS24 4.197 470.4203855 AcCa(21:1)_POS25 3.852013806 468.4047355 AcCa(22:0)_POS26 5.419278125 484.4360355 AcCa(22:1)_POS27 3.892 482.4203855 AcCa(22:2)_POS28 2.948 480.4047355 AcCa(22:6)_POS30 1.558483199 472.3421355 AcCa(24:0)_POS31 6.784326817 512.4673355 AcCa(24:1)_POS32 5.431838849 510.4516855 Cer(d12:0_18:0+O)_POS121 4.356 500.4673355 Cer(d14:0_18:0+O)_POS124 5.729581362 528.4986355 Cer(d16:0_18:0+O)_POS133 6.728315735 556.5299355 Cer(d16:0_18:0)_POS131 8.761279225 540.5350205 Cer(d16:0_20:0+O)_POS156 7.964315665 584.5612355 Cer(d18:0_16:0)+H_45POS 648.66 540.5350205 Cer(d18:0_18:0)_POS154 10.1479765 568.5663205 Cer(d18:0_22:0)+H_68POS 853.9598107 624.6289205 Cer(d18:0_22:1)_POS182 12.380649 622.6132705 Cer(d18:0_23:1)_POS193 12.92997408 636.6289205 Cer(d18:0_24:5)_POS227 12.39453225 642.5819705 Cer(d18:0_26:0)_POS236 15.39 680.6915205 Cer(d18:1_16:0)_POS137 10.50253051 538.5193705 Cer(d18:1_16:0)_POS139 11.03362958 538.5193705 Cer(d18:1_16:0)_POS141 11.578 538.5193705 Cer(d18:1_16:1)_POS149 9.341447771 536.5037205 Cer(d18:1_18:0)_POS159 12.19915162 566.5506705 Cer(d18:1_20:0)+H_61POS 766.02 594.5819705 Cer(d18:1_22:0)+H_69POS 832.2596677 622.6132705 Cer(d18:1_22:0)_POS184 13.916 622.6132705 Cer(d18:1_22:2)_POS190 12.63092025 618.5819705 Cer(d18:1_23:0)+H_72POS 853.1276709 636.6289205 Cer(d18:1_23:3)_POS198 12.79992052 630.5819705 Cer(d18:1_24:0)+H_78POS 881.7948372 650.6445705 Cer(d18:1_24:0+O)_POS204 12.68396951 666.6394855 Cer(d18:1_24:1)+H_80POS 827.2973376 648.6289205 Cer(d18:1_24:1)_POS210 13.68379938 648.6289205 Cer(d18:1_24:1)_POS211 15.135 648.6289205 Cer(d18:1_24:1)_POS213 17.891 648.6289205 Cer(d18:1_24:2)_POS223 13.67388294 646.6132705 Cer(d18:1_24:3)_POS225 13.52732001 644.5976205 Cer(d18:1_25:2)_POS233 14.19608538 660.6289205 Cer(d18:1_25:3)_POS234 13.826 658.6132705 Cer(d18:1_26:0+O)_POS239 13.817 694.6707855 Cer(d18:1_26:5)_POS245 12.32583291 668.5976205 Cer(d18:2_16:1+2O)_POS150 9.531 583.5044495 Cer(d18:2_22:0)+H_70POS 767.4266146 620.5976205 Cer(d18:2_22:2)_POS191 12.23697375 616.5663205 Cer(d18:2_24:1)+H_82POS 771.1581418 646.6132705 Cer(d18:2_25:4)_POS235 11.78607734 654.5819705 Cer(d19:2_26:5)_POS248 14.943 680.5976205 Cer(d20:0_18:0)+H_59POS 717.18 596.5976205 Cer(d20:0_18:0)_POS169 11.48766159 596.5976205 Cer(d20:0_22:5)+H_83POS 763.9596099 642.5819705 Cer(d20:0_26:6)_POS250 13.3802818 696.6289205 Cer(d21:1_23:1)_POS240 13.23727618 693.6867695 Cer(d21:1_24:5)_POS247 12.855 682.6132705 Cer(d22:0_18:0)_POS179 12.77708481 624.6289205 Cer(d22:0_20:0)_POS199 13.98179552 652.6602205 Cer(d22:1_18:0)_POS181 11.65993548 622.6132705 Cer(d26:0)_POS118 3.15919517 428.4098205 Cer(d28:0)_POS119 4.581335905 456.4411205 Cer(d30:0)_POS120 5.990566955 484.4724205 Cer(d31:0)_POS122 6.652134188 498.4880705 Cer(d32:0)+H_39POS 464.904497 512.5037205 Cer(d32:0)_POS123 7.347006313 512.5037205 Cer(d33:0)_POS127 8.076 526.5193705 Cer(d33:4+O)+H_43POS 154.6576803 534.4516855 Cer(d33:4+O)_POS130 2.485 534.4516855 Cer(d34:0)+H_44POS 551.7385616 540.5350205 Cer(d34:1)+H-H2O_49POS 621.4681605 520.5088055 Cer(d34:1)+H-H2O_POS134 8.880503924 520.5088055 Cer(d34:1)+H-H2O_POS142 12.45270821 520.5088055 Cer(d34:2)_POS146 6.432447331 536.5037205 Cer(d36:0)+H_52POS 636.0844026 568.5663205 Cer(d36:1)+H-H2O_POS160 13.59228536 548.5401055 Cer(d36:3+O)_POS164 7.070394458 578.5142855 Cer(d38:1)_POS171 10.34697477 594.5819705 Cer(d38:3)_POS174 11.49295466 590.5506705 Cer(d39:2+2O)_POS178 10.451 660.5537455 Cer(d44:1+O)_POS238 12.665 711.6973345 Cer(d44:3)_POS242 12.33286156 691.6711195 Cer(d44:5)+H_86POS 827.1442629 670.6132705 Cer(d46:5)_POS249 2.567338551 720.6265155 Cer(d48:8)_POS251 2.552680195 742.6108655 CerG2GNAc1(d30:3)_POS354 5.591 1027.592439 CerG2GNAc1(d40:1)_POS355 11.53404284 1149.798294 CerG2GNAc1(d41:1)_POS356 12.053 1163.813944 CerG2GNAc1(d42:1)_POS357 12.57835708 1177.829594 CerG2GNAc1(d42:2)_POS358 11.46084783 1175.813944 CerG2GNAc1(d43:2)_POS359 7.815 1211.811539 CerG3GNAc1(t40:1+O)_POS360 2.101 1360.867498 CerG3GNAc2(d48:4)_POS362 5.989 1638.035292 CerG3GNAc2(m37:1)_POS363 10.28158597 1456.888628 CerG3GNAc2(m38:1)_POS364 10.78703239 1470.904278 CerG3GNAc2(m39:1)_POS365 11.3088151 1484.919928 CerG3GNAc2(m39:2)_POS366 10.22406956 1482.904278 Cer(m18:0_18:0)_POS256 12.07460436 552.5714055 Cer(m18:0_20:0)_POS263 13.17366785 580.6027055 Cer(m18:0_22:0)_POS270 14.19599425 608.6340055 Cer(m18:0_22:5)_POS280 12.36740693 598.5557555 Cer(m18:0_23:4)_POS291 11.78100928 614.5870555 Cer(m18:1_18:0)_POS257 14.237 550.5557555 Cer(m18:1_18:2)_POS259 2.954972104 563.5510045 Cer(m18:1_23:3)_POS290 3.861118154 631.6136045 Cer(m18:1_24:0+O)_POS294 13.32483949 667.6711195 Cer(m18:1_25:0+O)_POS315 13.83898088 681.6867695 Cer(m18:1_26:0+O)_POS319 13.344 695.7024195 Cer(m18:1_26:0+O)_POS320 14.17027958 695.7024195 Cer(m19:0_18:2)_POS261 11.66301625 562.5557555 Cer(m19:0_20:2)_POS267 12.80171144 590.5870555 Cer(m19:0_21:2)+H_96POS 832.3433359 604.6027055 Cer(m19:0_21:2)_POS271 12.33318543 604.6027055 Cer(m19:0_21:2)_POS272 13.32222063 604.6027055 Cer(m19:0_21:2)_POS274 13.894694 604.6027055 Cer(m19:0_21:2)_POS275 15.429 604.6027055 Cer(m19:0_21:4)_POS279 11.232 600.5714055 Cer(m19:0_22:2)+H_100POS 852.6857459 618.6183555 Cer(m19:0_22:2)_POS284 12.71407288 618.6183555 Cer(m19:0_22:2)_POS286 13.67481289 618.6183555 Cer(m19:0_22:2)_POS288 14.18070133 618.6183555 Cer(m19:0_23:2)+H_104POS 890.7096569 632.6340055 Cer(m19:0_23:2)_POS296 14.31862527 632.6340055 Cer(m19:0_23:2)_POS298 14.73253386 632.6340055 Cer(m19:0_23:2)_POS299 17.426 632.6340055 Cer(m19:0_23:3)+H_105POS 827.3551834 630.6183555 Cer(m19:0_23:3)_POS300 12.26198286 630.6183555 Cer(m19:0_23:3)_POS301 13.24756776 630.6183555 Cer(m19:0_23:3)_POS303 13.7090947 630.6183555 Cer(m19:0_23:3)_POS305 15.27268377 630.6183555 Cer(m19:0_23:3)_POS306 17.881 630.6183555 Cer(m19:0_23:4)_POS311 12.32369162 628.6027055 Cer(m19:0_24:2)_POS316 14.64272702 646.6496555 Cer(m19:0_24:3)_POS317 13.75435526 644.6340055 Cer(m19:0_25:2)_POS321 15.16361964 660.6653055 Cer(m19:0_25:3)_POS322 14.23764191 658.6496555 Cer(m19:0_25:4)_POS323 13.36707667 656.6340055 Cer(m19:1_15:1)_POS253 8.495384211 520.5088055 Cer(m19:1_15:1)_POS254 12.23425264 520.5088055 Cer(m19:1_20:2)_POS269 11.65231754 588.5714055 Cer(m19:1_21:2)_POS277 12.19685996 602.5870555 Cer(m19:1_22:2)_POS289 12.73554634 616.6027055 Cer(m19:1_23:3)+H_108POS 771.2342504 628.6027055 Cer(m19:1_23:4)_POS313 11.35145325 626.5870555 Cer(m19:1_24:3)_POS318 12.85657018 642.6183555 Cer(m20:1_18:1)_POS264 12.23401168 576.5714055 Cer(m22:1_22:6)+NH4_111POS 762.48 667.6136045 Cer(m32:0)_POS252 9.190386959 513.5353545 Cer(m35:2)+H-H2O_POS255 7.693 516.5138905 Cer(m37:0+2O)+H-H2O_POS260 12.89056337 580.5663205 Cer(m39:1)+H-H2O_POS266 13.336 574.5921405 Cer(m41:1)+H-H2O_POS282 14.33291637 602.6234405 Cer(m41:1+O)_POS283 13.828 658.6108655 Cer(m41:2)+H-H2O_POS285 13.25434142 600.6077905 Cer(m45:4)+H-H2O_POS324 12.17569057 652.6390905 Cer(m45:6)_POS325 14.167 688.6003005 CerP(d15:0_24:0)+H-H2O_POS368 12.921 672.5690385 CerP(d15:2_16:1+2O)_POS367 6.506897284 621.4238325 CerP(d16:2_23:0)+H-H2O_POS369 9.991 668.5377385 CerP(d19:1_24:0+O)_POS374 10.325 777.6480175 CerP(d23:0_17:1)+H-H2O_POS371 12.32468645 684.5690385 CerP(d23:1_16:1+2O)_POS370 6.43282763 718.5381335 CerP(d41:0+O)_POS372 11.47711535 751.6323675 CerP(d41:1+O)_POS373 10.4069084 749.6167175 CerP(m18:0_21:0+O)+H-H2O_POS377 13.077 672.5690385 CerP(m19:0_18:0)_POS375 12.80835893 646.5533885 CerP(m19:0_20:0)_POS376 13.81897534 674.5846885 CerP(m19:0_20:1)_POS378 12.938 672.5690385 CerP(m41:0+O)_POS379 14.322 718.6109035 CerP(t34:3+2O)_POS380 3.38 684.4210935 Cer(t16:0_16:0)_POS326 5.774228254 528.4986355 Cer(t16:0_19:0)_POS330 8.202599801 570.5455855 Cer(t17:1_24:2)_POS342 12.612 648.5925355 Cer(t18:0_16:0)+H-H2O_POS328 10.04 538.5193705 Cer(t18:0_16:0)+H-H2O_POS329 11.03101278 538.5193705 Cer(t18:0_18:0)+H-H2O_POS333 12.19929598 566.5506705 Cer(t18:0_24:0+O)_POS344 13.404 684.6500505 Cer(t18:0_24:3)+H-H2O_POS348 13.54180208 644.5976205 Cer(t18:0_25:3)+H-H2O_POS351 13.66258673 658.6132705 Cer(t18:1_18:0+2O)_POS336 12.616 631.5619645 Cer(t20:1_16:0+O)_POS337 11.976 615.5670495 Cer(t34:0)_POS327 7.075552083 556.5299355 Cer(t36:0+O)_POS334 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5.259 463.3781865 DG(26:6e)_POS474 14.529 481.3288315 DG(27:1e)_POS475 4.35 500.4673355 DG(27:6e)_POS476 14.537 495.3444815 DG(28:0e)_POS477 15.43024907 521.4540315 DG(28:0e)_POS478 16.14824511 521.4540315 DG(28:1e)_POS479 14.76310883 519.4383815 DG(28:1e)_POS480 15.24600738 519.4383815 DG(28:1e)_POS481 15.72677232 519.4383815 DG(28:2e)_POS483 14.731 517.4227315 DG(28:2e)_POS484 15.62034738 495.4407865 DG(28:3e)_POS486 5.440739355 510.4516855 DG(28:4e)_POS487 5.282 508.4360355 DG(28:6e)_POS488 13.04248249 509.3601315 DG(28:6e)_POS489 14.53358648 509.3601315 DG(29:6e)_POS491 14.53772915 523.3757815 DG(30:0e)_POS495 10.82976596 549.4853315 DG(30:0e)_POS496 15.96941325 549.4853315 DG(30:0e)_POS497 16.51685716 549.4853315 DG(30:1e)_POS498 15.66356213 547.4696815 DG(30:1e)_POS499 16.17583367 547.4696815 DG(30:2e)_POS501 15.31406021 545.4540315 DG(30:2e)_POS502 15.95149223 545.4540315 DG(30:2e)_POS503 16.51689783 523.4720865 DG(30:3e)_POS506 14.904 543.4383815 DG(30:5e)_POS508 5.923 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DG(36:5e)_POS967 16.23580895 601.5190365 DG(36:5e)_POS969 16.70151516 601.5190365 DG(36:5e)_POS970 17.53541562 601.5190365 DG(36:6e)+H_342POS 473.3889827 599.5033865 DG(36:6e)+H_343POS 563.1486321 599.5033865 DG(36:6e)+H_346POS 947.7212932 599.5033865 DG(36:6e)_POS985 5.928 621.4853315 DG(36:6e)_POS988 7.932633971 621.4853315 DG(36:6e)_POS994 15.06853672 599.5033865 DG(36:6)_POS984 10.068 613.4826515 DG(36:7e)_POS1007 6.714217159 597.4877365 DG(36:7e)_POS1008 8.034305798 597.4877365 DG(36:7e)_POS1009 15.5 597.4877365 DG(36:7e)_POS1010 15.996 597.4877365 DG(37:0_24:1)_POS1287 17.913 990.9787005 DG(37:1e)_POS1015 11.11796212 640.6238355 DG(37:3e)_POS1020 9.16087488 641.5479315 DG(37:4e)_POS1025 17.00918463 617.5503365 DG(37:4)+H_352POS 782.0086191 631.5296015 DG(38:1_18:1)_POS1284 17.71155036 918.8848005 DG(38:1_18:2)_POS1285 17.53315875 916.8691505 DG(38:1_20:3)_POS1286 17.56230703 942.8848005 DG(38:1e)_POS1032 17.36584091 659.5948815 DG(38:2e)_POS1035 12.246 652.6238355 DG(38:3e)_POS1041 9.382 655.5635815 DG(38:3e)_POS1042 10.90826016 655.5635815 DG(38:3e)_POS1043 17.38615924 633.5816365 DG(38:4e)_POS1066 10.54561479 653.5479315 DG(38:4e)_POS1067 12.89721459 631.5659865 DG(38:4e)_POS1068 17.13021763 631.5659865 DG(38:5e)+H_379POS 570.5515681 629.5503365 DG(38:5e)_POS1078 9.127511948 629.5503365 DG(38:5e)_POS1079 10.77074755 651.5322815 DG(38:5e)_POS1081 16.38083659 651.5322815 DG(38:5e)_POS1082 16.886 629.5503365 DG(38:5)_POS1069 9.360663082 660.5561505 DG(38:6e)+H_390POS 542.1227362 627.5346865 DG(38:6e)+H_391POS 635.6282911 627.5346865 DG(38:6e)_POS1120 8.19 627.5346865 DG(38:6e)_POS1121 8.626082947 627.5346865 DG(38:6e)_POS1122 9.212711229 627.5346865 DG(38:6e)_POS1123 10.48082413 649.5166315 DG(38:6e)_POS1125 11.96251407 627.5346865 DG(38:6e)_POS1126 13.486 627.5346865 DG(38:6e)_POS1127 15.80552094 649.5166315 DG(38:6e)_POS1128 16.36875272 627.5346865 DG(38:6e)_POS1129 16.73042386 627.5346865 DG(38:6)_POS1098 11.11780435 641.5139515 DG(38:6)_POS1099 11.646 641.5139515 DG(38:6)_POS1103 13.70188085 641.5139515 DG(38:7e)+H_398POS 480.1584419 625.5190365 DG(38:7e)_POS1135 7.819974726 647.5009815 DG(38:7e)_POS1136 9.513023444 647.5009815 DG(38:7e)_POS1137 10.83090516 625.5190365 DG(38:7e)_POS1138 14.77224913 647.5009815 DG(38:7e)_POS1139 15.50195562 647.5009815 DG(38:7e)_POS1140 15.94729314 625.5190365 DG(38:7e)_POS1141 16.46375004 625.5190365 DG(38:7)+H_397POS 677.76 639.4983015 DG(38:7)_POS1134 11.27986283 639.4983015 DG(38:8e)_POS1144 10.415 623.5033865 DG(38:8e)_POS1145 11.63986633 645.4853315 DG(38:8e)_POS1146 14.531 645.4853315 DG(38:8e)_POS1147 16.143 623.5033865 DG(39:2)_POS1148 13.55925464 685.5741465 DG(39:5)_POS1154 12.58362585 657.5452515 DG(39:6)_POS1157 11.688 655.5296015 DG(4:0_10:1)_POS418 1.095 332.2431505 DG(4:0_14:1)_POS427 1.332 388.3057505 DG(40:3e)_POS1166 13.656 683.5948815 DG(40:4e)_POS1171 13.76147342 676.6238355 DG(40:6e)_POS1202 10.90865014 655.5659865 DG(40:6)_POS1180 3.007 686.5718005 DG(40:6)_POS1193 17.404 686.5718005 DG(40:7e)_POS1219 12.622 653.5503365 DG(40:8e)_POS1224 8.41 651.5346865 DG(40:8e)_POS1225 12.58717746 673.5166315 DG(40:8e)_POS1226 16.454 651.5346865 DG(40:9e)_POS1229 7.545 649.5190365 DG(40:9e)_POS1230 10.45590735 649.5190365 DG(40:9e)_POS1231 14.52655536 671.5009815 DG(42:5)_POS1245 11.68874861 716.6187505 DG(42:6)_POS1249 10.76845467 714.6031005 DG(42:7)_POS1256 10.49890843 712.5874505 DG(42:8)+H_446POS 730.5 693.5452515 DG(42:9e)_POS1263 12.598 677.5503365 DG(44:12)_POS1266 3.095655943 713.5139515 DG(44:5)_POS1269 12.587 744.6500505 DG(48:1)_POS1280 17.211 808.7752505 DG(6:0_20:4)_POS472 3.271 499.3393965 DG(8:0_11:2)+NH4_194POS 97.70390347 400.3057505 DG(8:0_18:2)_POS469 6.248 503.3706965 DG(8:0_22:6)_POS509 5.659551785 546.4153005 DG(8:0e_10:4)_POS430 14.53330026 373.2349315 DG(8:1e_12:3)_POS437 1.436952167 396.3108355 DGDG(32:2)+NH4_453POS 593.5307057 906.6148505 DGDG(40:3e)+H_459POS 920.9741311 985.7185865 DGDG(43:10e)+H_461POS 124.3927955 1013.655986 GM1(t46:2)_POS1288 7.467604251 1718.046252 GM2(d34:1+O)_POS1289 6.933166644 1372.794728 GM2(d36:1+O)_POS1290 8.163 1400.826028 GM2(d40:1+O)+H_469POS 645.5370242 1456.888628 GM2(d40:1+O)_POS1291 10.26670168 1456.888628 GM2(d41:1+O)+H_470POS 677.836017 1470.904278 GM2(d41:1+O)_POS1292 10.78284129 1470.904278 GM2(d42:1+O)_POS1293 11.30115637 1484.919928 GM2(t42:0+O)+H-H2O_472POS 709.44 1484.919928 GM3(d40:3)+H-H2O_POS1296 8.097 1215.772474 GM3(m38:1)_POS1298 8.090243085 1215.770069 Hex1Cer(d18:0_15:0+O)_POS1299 7.916 704.5671105 Hex1Cer(d18:0_24:0+O)_POS1317 13.546 830.7079605 Hex1Cer(d18:1_20:0)+H_479POS 705.7575451 756.6347955 Hex1Cer(d18:1_20:0+O)_POS1309 10.909 772.6297105 Hex1Cer(d18:1_22:0)+H_484POS 773.0707828 784.6660955 Hex1Cer(d18:1_24:0)+H_488POS 825.8081658 812.6973955 Hex1Cer(d18:1_24:0+O)+H_490POS 818.5153653 828.6923105 Hex1Cer(d18:1_24:0)_POS1318 11.458 812.6973955 Hex1Cer(d18:1_24:1)+H_491POS 767.1118844 810.6817455 Hex1Cer(d18:2_24:0+O)_POS1323 11.977 826.6766605 Hex1Cer(d21:0_23:3)_POS1330 16.004 853.7239445 Hex1Cer(d24:1_22:0)_POS1331 16.917 885.7865445 Hex1Cer(d35:1+O)+Na_477POS 666.9 752.5647055 Hex1Cer(d35:2+O)_POS1303 9.510655717 745.5936595 Hex1Cer(d37:2+O)+Na_478POS 658.2 778.5803555 Hex1Cer(d37:2+O)_POS1306 10.51218805 773.6249595 Hex1Cer(d42:1)+H-H2O_487POS 788.022084 794.6868305 Hex1Cer(m19:0_21:2)+H_494POS 772.7572423 766.6555305 Hex1Cer(m19:0_21:2)_POS1332 12.34052256 766.6555305 Hex1Cer(m19:0_22:2)_POS1333 12.87499237 780.6711805 Hex1Cer(m19:0_23:2)+H_496POS 834.96 794.6868305 Hex1Cer(m19:0_23:2)_POS1334 13.37367531 794.6868305 Hex1Cer(m19:0_23:3)_POS1335 12.27127574 792.6711805 Hex1Cer(m19:0_24:3)_POS1336 12.539 806.6868305 Hex1Cer(m19:0_26:5)_POS1337 13.0015128 830.6868305 Hex1Cer(m21:0_26:6)_POS1338 14.01844616 856.7024805 Hex1Cer(t18:0_22:1)+H-H2O_498POS 760.1272265 782.6504455 Hex1Cer(t18:0_26:1)+H-H2O_POS1348 14.072 838.7130455 Hex2Cer(d13:0_17:1)+H-H2O_POS1350 6.153926417 788.5518555 Hex2Cer(d33:0)_POS1351 9.049 867.6515695 Hex2Cer(d33:1)_POS1352 8.689374964 865.6359195 Hex2Cer(d35:1)_POS1354 9.818865288 893.6672195 Hex2Cer(d40:0)_POS1358 10.885 970.7165155 Hex2Cer(d43:1+O)_POS1371 14.957 1021.787334 Hex2Cer(d44:5)_POS1374 11.81930574 994.7189205 Hex2Cer(d45:2+O)_POS1375 13.41676996 1030.776435 Hex2Cer(m19:0_22:2)_POS1380 12.44453606 942.7240055 Hex2Cer(m19:0_23:0+O)_POS1381 12.6140419 976.7658705 Hex2Cer(m19:0_23:2)_POS1382 12.94965844 956.7396555 Hex2Cer(m19:0_23:3)_POS1383 11.84008596 954.7240055 Hex2Cer(m19:0_25:2)_POS1385 13.95929753 984.7709555 Hex2Cer(m22:0_19:0)+H-H2O_POS1378 16.309 928.7447405 Hex2Cer(m22:1_19:0)+H-H2O_POS1379 15.82928632 926.7290905 Hex2Cer(m37:5)+H-H2O_POS1376 7.289 862.6038905 Hex2Cer(m40:3)_POS1377 3.355770974 943.7192545 Hex2Cer(m42:4)_POS1384 3.309 969.7349045 Hex2Cer(t20:1_19:0)_POS1386 13.77247188 965.7247345 Hex2Cer(t43:0)_POS1388 13.969 1006.776435 Hex2Cer(t45:0)_POS1389 14.759 1034.807735 Hex2Cer(t45:3)_POS1390 12.909 1028.760785 LPC(14:0)+H_520POS 94.87338433 468.3084685 LPC(14:0)_POS1395 2.422 468.3084685 LPC(14:1e)_POS1396 2.683590282 452.3135535 LPC(15:0)+H_521POS 107.1066966 482.3241185 LPC(15:0)_POS1399 2.879 504.3060635 LPC(15:0)_POS1400 5.864 482.3241185 LPC(16:0e)+H_534POS 144.6711758 482.3605035 LPC(16:0)+H_523POS 124.8200031 496.3397685 LPC(16:0)+Na_524POS 124.8200031 518.3217135 LPC(16:0)_POS1402 1.489 518.3217135 LPC(16:0)_POS1414 5.109770466 518.3217135 LPC(16:0)_POS1416 5.882293695 518.3217135 LPC(16:1)+H_535POS 99.00665746 494.3241185 LPC(16:1)_POS1434 2.286433388 494.3241185 LPC(16:1)_POS1435 2.941 494.3241185 LPC(16:2e)+H_537POS 125.9193336 478.3292035 LPC(16:2e)_POS1438 1.987323784 478.3292035 LPC(17:0)+H_538POS 145.3331327 510.3554185 LPC(17:0)_POS1443 4.180236623 510.3554185 LPC(17:1)_POS1445 2.994 508.3397685 LPC(18:0e)+H_546POS 208.6530385 510.3918035 LPC(18:0)+H_541POS 174.8524161 524.3710685 LPC(18:0)_POS1453 4.652307631 524.3710685 LPC(18:0)_POS1455 5.071 546.3530135 LPC(18:0)_POS1456 5.89706839 524.3710685 LPC(18:0)_POS1458 7.514367631 524.3710685 LPC(18:1e)+H_550POS 151.4980518 508.3761535 LPC(18:1e)_POS1472 2.418780841 508.3761535 LPC(18:1)+H_547POS 129.0472294 522.3554185 LPC(18:1)+Na_548POS 129.0472294 544.3373635 LPC(18:1)_POS1470 3.250926598 522.3554185 LPC(18:2e)_POS1493 2.666955337 506.3605035 LPC(18:2)+H_551POS 101.1608408 520.3397685 LPC(18:2)_POS1480 3.220201717 520.3397685 LPC(18:2)_POS1481 4.26779062 520.3397685 LPC(18:2)_POS1484 5.914388379 520.3397685 LPC(18:2)_POS1486 7.365920118 520.3397685 LPC(18:3e)_POS1497 1.872535163 504.3448535 LPC(18:3e)_POS1498 2.31 504.3448535 LPC(18:3)+H_553POS 90.71028583 518.3241185 LPC(18:3)_POS1496 2.106025391 518.3241185 LPC(19:0)+H_560POS 205.1707504 538.3867185 LPC(19:0)_POS1501 4.341 538.3867185 LPC(19:1)_POS1504 4.301 536.3710685 LPC(20:0)+Na_563POS 256.7077846 574.3843135 LPC(20:1e)_POS1513 3.352 558.3893985 LPC(20:1e)_POS1514 4.447941751 536.4074535 LPC(20:1)+H_564POS 180.8152893 550.3867185 LPC(20:1)_POS1511 3.296195743 550.3867185 LPC(20:2)+H_566POS 137.2184371 548.3710685 LPC(20:3)+H_568POS 174.2408117 546.3554185 LPC(20:3)_POS1516 3.895999 546.3554185 LPC(20:4)+H_572POS 98.27374705 544.3397685 LPC(20:4)+Na_571POS 98.27374705 566.3217135 LPC(20:4)_POS1527 4.665194316 566.3217135 LPC(20:4)_POS1528 5.074631436 544.3397685 LPC(20:4)_POS1530 5.906497816 544.3397685 LPC(20:4)_POS1532 7.44018972 544.3397685 LPC(22:0)+H_576POS 354.84 580.4336685 LPC(22:2)_POS1541 3.06 576.4023685 LPC(22:3)_POS1542 2.45128364 574.3867185 LPC(22:4)_POS1544 3.314 572.3710685 LPC(22:6)+H_581POS 93.96915725 568.3397685 LPC(22:6)+Na_580POS 93.96915725 590.3217135 LPC(22:6)_POS1555 4.254258049 568.3397685 LPC(22:6)_POS1557 5.078 590.3217135 LPC(22:6)_POS1559 5.888911488 568.3397685 LPC(22:6)_POS1561 7.386178008 568.3397685 LPC(24:2)_POS1570 4.302383253 604.4336685 LPC(36:0)_POS1572 12.566 798.6347135 LPC(36:1)_POS1573 10.487 796.6190635 LPE(14:1e)_POS1574 4.95 410.2666035 LPE(16:0)+Na_585POS 130.9580527 476.2747635 LPE(16:0)_POS1578 2.728232006 454.2928185 LPE(16:0)_POS1584 9.201 454.2928185 LPE(16:1e)+H_588POS 148.6647559 438.2979035 LPE(16:1p)+H_589POS 130.5201468 436.2822535 LPE(16:1p)_POS1586 2.102678813 436.2822535 LPE(18:0)+H_591POS 186.8267882 482.3241185 LPE(18:0)_POS1592 3.305517194 504.3060635 LPE(18:0)_POS1593 4.264620413 482.3241185 LPE(18:0)_POS1595 4.712 482.3241185 LPE(18:0)_POS1596 5.871651667 482.3241185 LPE(18:0)_POS1597 7.276 482.3241185 LPE(18:0)_POS1598 8.136 482.3241185 LPE(18:1e)+H_596POS 215.7 466.3292035 LPE(18:1e)_POS1604 4.186 466.3292035 LPE(18:1)+H_595POS 137.4214827 480.3084685 LPE(18:1)+Na_594POS 137.4214827 502.2904135 LPE(18:1p)+H_597POS 187.3433096 464.3135535 LPE(18:1p)_POS1605 2.668939009 464.3135535 LPE(18:1p)_POS1606 3.262658357 464.3135535 LPE(20:2)+H_602POS 145.5 506.3241185 LPE(20:3)_POS1612 3.307 526.2904135 LPE(22:6)+H_607POS 97.22712166 526.2928185 LPE(22:6)+Na_606POS 97.22712166 548.2747635 LPG(10:1e)_POS1614 1.119 407.1805295 LPG(13:0)_POS1615 1.821 460.2669985 LPG(16:0)+H_608POS 105.24 485.2873995 LPG(18:2)+H_609POS 93.34311089 509.2873995 LPI(16:0)+H_610POS 100.74 573.3034445 LPI(18:0)+H_611POS 137.6445766 601.3347445 LPI(18:1)+H_612POS 106.663027 599.3190945 LPI(18:3e)_POS1622 1.393 603.2904745 LPI(20:4)+H_613POS 83.32303418 621.3034445 LPI(20:4)+Na_614POS 83.32303418 643.2853895 LPS(22:6)+H_617POS 84.60238331 570.2826485 MG(13:0)_POS1624 1.063 311.2192815 MG(16:0)_POS1628 3.053549219 331.2842865 MG(16:1e)_POS1631 12.199 337.2713165 MG(16:2e)_POS1638 11.04747857 313.2737215 MG(17:0)+NH4_654POS 73.36506606 362.3264855 MG(18:0)_POS1650 4.423062636 359.3155865 MG(18:3e)_POS1655 6.839049011 339.2893715 MG(18:3e)_POS1656 7.290189993 339.2893715 MG(18:3e)_POS1657 11.139 339.2893715 MG(18:3e)_POS1658 11.707 339.2893715 MG(18:3e)_POS1659 12.395 339.2893715 MG(18:3e)_POS1660 13.0701515 339.2893715 MG(18:3e)_POS1661 13.611 339.2893715 MG(20:4e)_POS1665 11.2640099 365.3050215 MG(20:4e)_POS1666 12.16270654 365.3050215 MG(20:5)_POS1667 14.524 399.2505815 MG(22:4)_POS1668 5.792 407.3155865 MG(32:0)_POS1670 8.899 577.5166315 MG(32:1)_POS1672 1.033780195 575.5009815 MG(34:1)_POS1678 12.916 603.5322815 MGDG(33:4)+NH4_769POS 599.0600452 754.5463755 MGDG(34:4)+NH4_771POS 634.2038054 768.5620255 MGDG(34:7e)+NH4_775POS 575.46 748.5358105 MGDG(36:4)+NH4_777POS 704.4 796.5933255 MGDG(38:7e)+NH4_781POS 715.5 804.5984105 MGDG(44:2)+H_785POS 1241.16 895.7232765 MGDG(46:7)+H_786POS 945.8554904 913.6763265 PC(10:0_20:3)_POS1749 5.662201869 700.4911835 PC(10:0e_10:0)+H_799POS 256.8903453 552.4023685 PC(10:0e_10:0)_POS1713 3.864543448 552.4023685 PC(10:0e_10:1)_POS1715 2.799020817 550.3867185 PC(10:0e_6:0)_POS1679 2.008 496.3397685 PC(10:0e_6:0)_POS1680 2.68 496.3397685 PC(10:0e_6:0)_POS1681 4.3461625 496.3397685 PC(10:0e_6:0)_POS1682 5.188 496.3397685 PC(10:1e_10:0)_POS1716 3.343918826 550.3867185 PC(10:1e_6:0)+Na_789POS 99.42053546 516.3060635 PC(10:1e_6:0)_POS1686 1.706 516.3060635 PC(11:0_21:0)_POS1759 2.384986513 734.5694335 PC(12:0_18:2)_POS1748 6.871075789 702.5068335 PC(12:0e_6:0)_POS1688 4.28429646 524.3710685 PC(12:1e_10:0)_POS1724 4.052631219 578.4180185 PC(12:1e_22:6)_POS1900 8.549537862 734.5119185 PC(14:0_18:3)_POS1789 6.857401358 750.5044285 PC(14:0_20:4)+Na_908POS 471.0756665 776.5200785 PC(14:0_20:4)_POS1890 7.444560666 776.5200785 PC(14:1e_10:0)_POS1732 5.551893257 606.4493185 PC(14:1e_10:1)_POS1733 4.289088737 604.4336685 PC(14:1e_20:4)_POS1898 10.04533144 738.5432185 PC(14:1e_22:4)+H_1016POS 572.9839005 766.5745185 PC(14:1e_22:4)_POS2054 10.89728119 766.5745185 PC(14:1e_22:5)_POS2060 10.03 764.5588685 PC(14:1e_22:6)_POS2062 9.573296802 762.5432185 PC(15:0_22:6)+Na_1041POS 486.7958097 814.5357285 PC(15:0_22:6)_POS2087 8.521671181 792.5537835 PC(15:0_22:6)_POS2089 9.829398478 792.5537835 PC(15:0_22:6)_POS2090 10.47323919 792.5537835 PC(15:0_22:6)_POS2091 11.03730088 792.5537835 PC(16:0_14:1)_POS1744 8.505383593 726.5044285 PC(16:0_16:0)_POS1760 7.433 756.5513785 PC(16:0_16:0)_POS1767 12.234782 734.5694335 PC(16:0_16:1)_POS1780 9.19827431 732.5537835 PC(16:0_18:1)_POS1815 9.29 782.5670285 PC(16:0_18:2)_POS1838 3.253012532 780.5513785 PC(16:0_18:2)_POS1840 4.330980706 780.5513785 PC(16:0_18:3)+Na_899POS 516.7459634 778.5357285 PC(16:0_18:3)_POS1885 9.520343767 756.5537835 PC(16:0_20:2)_POS1949 3.33153398 808.5826785 PC(16:0_20:3)_POS1987 7.003 806.5670285 PC(16:0_20:4)+Na_990POS 542.1687145 804.5513785 PC(16:0_20:5)+Na_1007POS 476.874698 802.5357285 PC(16:0_20:5)_POS2041 5.850270496 780.5537835 PC(16:0_20:5)_POS2042 6.344800238 780.5537835 PC(16:0_22:6)+Na_1101POS 522.2984815 828.5513785 PC(16:0_22:6)_POS2165 3.269446321 828.5513785 PC(16:0_22:6)_POS2170 5.864553287 828.5513785 PC(16:1_16:1)_POS1787 8.947112921 730.5381335 PC(16:1_18:2)+Na_897POS 490.3063934 778.5357285 PC(16:1_22:6)_POS2217 9.008716269 804.5537835 PC(16:1e_20:0)_POS1942 11.58203768 796.6190635 PC(17:0_20:3)+H_1027POS 597.8822019 798.6007335 PC(17:0_22:6)+H_1142POS 553.7220154 820.5850835 PC(17:0_22:6)_POS2252 10.49161635 820.5850835 PC(17:1_18:0)_POS1904 11.25257744 796.5826785 PC(17:1_18:1)+H_921POS 612.9612737 772.5850835 PC(17:1_18:2)+H_925POS 531.1211392 770.5694335 PC(17:1_18:4)+Na_936POS 647.2108923 788.5200785 PC(17:1_20:4)+H_1038POS 513.9061308 794.5694335 PC(17:1_20:4)_POS2081 10.2710879 794.5694335 PC(17:1_20:5)+Na_1047POS 663.6867658 814.5357285 PC(17:1_22:6)_POS2256 8.545450396 818.5694335 PC(17:1_22:6)_POS2258 9.832 818.5694335 PC(18:0_14:0)+H_822POS 635.0909716 734.5694335 PC(18:0_16:0)_POS1806 8.009 784.5826785 PC(18:0_17:0)_POS1901 9.961 798.5983285 PC(18:0_18:1)+Na_941POS 681.0975648 810.5983285 PC(18:0_18:2)_POS1956 10.49284188 808.5826785 PC(18:0_18:3)+H_976POS 674.6718085 784.5850835 PC(18:0_20:1)+H_1049POS 328.7043025 816.6476835 PC(18:0_20:1)_POS2096 10.6697769 838.6296285 PC(18:0_20:3)+H_1057POS 644.3545607 812.6163835 PC(18:0_20:3)+Na_1056POS 644.3545607 834.5983285 PC(18:0_20:3)_POS2102 12.081 812.6163835 PC(18:0_20:4)_POS2107 3.234244196 832.5826785 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PE(41:5e)_POS2894 10.56761993 794.6058185 PE(42:11)_POS2900 7.792 810.5068335 PE(42:2e)_POS2905 13.77219889 814.6684185 PE(42:2)_POS2901 10.572 850.6296285 PE(42:2)_POS2902 11.132 828.6476835 PE(42:2)_POS2904 14.2095576 828.6476835 PE(42:3e)_POS2907 14.53561494 812.6527685 PE(42:4e)_POS2909 12.50173455 832.6190635 PE(42:5e)_POS2912 11.40545423 830.6034135 PE(42:7e)_POS2920 9.186 804.5901685 PE(42:9)_POS2927 9.806 814.5381335 PE(43:0e)_POS2929 14.862 854.6973135 PE(43:2e)_POS2930 13.10212153 828.6840685 PE(43:2e)_POS2932 14.868 828.6840685 PE(43:3e)_POS2933 14.86938187 826.6684185 PE(43:4e)_POS2934 13.589 846.6347135 PE(44:0e)_POS2935 14.53141987 868.7129635 PE(44:3e)_POS2939 14.53401395 840.6840685 PE(44:4e)_POS2941 13.503 860.6503635 PE(44:5e)_POS2943 12.44462831 858.6347135 PE(47:3)_POS2945 16.57 896.7102835 PE(60:2)_POS2947 17.4535838 1080.929383 PE(62:1)_POS2948 17.53842259 1110.976333 PE(62:2)_POS2949 17.489 1108.960683 PE(8:0e_10:1)_POS2459 1.68531832 502.2904135 PE(8:0e_8:0)_POS2441 4.296788523 454.2928185 PE(8:1e_10:0)_POS2461 2.656876506 502.2904135 PE(8:1e_10:0)_POS2462 3.303927347 502.2904135 PE(8:1e_10:0)_POS2463 4.322562218 502.2904135 PE(8:1e_10:0)_POS2464 5.921741422 502.2904135 PE(8:1e_10:0)_POS2465 9.515 502.2904135 PE(8:1e_10:0)_POS2466 10.65878505 502.2904135 PE(8:1e_10:1)+H_1254POS 106.4701748 478.2928185 PE(8:1e_10:2)+Na_1255POS 132.0985127 498.2591135 PE(8:1e_12:0)_POS2472 2.029915833 530.3217135 PE(8:1e_12:1)_POS2474 2.325616504 506.3241185 PE(8:1e_12:2)_POS2478 3.305518038 526.2904135 PE(8:1e_12:2)_POS2479 4.340809919 526.2904135 PE(8:1e_12:2)_POS2480 5.805 526.2904135 PE(8:1e_12:3)+H_1262POS 101.9481097 502.2928185 PE(8:1e_12:3)+Na_1261POS 101.9481097 524.2747635 PE(8:1e_12:3)+Na_1263POS 138.1875663 524.2747635 PE(8:1e_12:3)_POS2482 1.676268772 502.2928185 PE(8:1e_12:3)_POS2483 2.212198575 502.2928185 PE(8:1e_12:4)_POS2484 1.448 500.2771685 PE(8:1e_14:2)_POS2486 1.560688574 554.3217135 PE(8:1e_14:3)_POS2487 2.050080106 530.3241185 PG(14:3)+Na_1461POS 55.64545219 487.1703595 PG(16:0_18:2)_POS2970 4.9134071 764.5436135 PG(18:0)_POS2950 1.569353423 527.2979645 PG(18:1_18:2)+H_1483POS 462.1583344 773.5327145 PG(18:1_18:2)_POS2984 6.388 795.5146595 PG(18:1_22:4)+NH4_1496POS 497.52 842.5905635 PG(18:1_22:4)_POS3020 7.201094038 842.5905635 PG(18:1_22:6)+Na_1500POS 434.7831477 843.5146595 PG(18:1_22:6)+NH4_1499POS 434.7831477 838.5592635 PG(18:2_20:4)_POS3013 6.950422815 812.5436135 PG(18:2_22:6)+H_1504POS 382.5671152 819.5170645 PG(18:2_22:6)+NH4_1502POS 382.5671152 836.5436135 PG(20:3_18:2)_POS3005 6.684058556 814.5592635 PG(20:3e_24:1)_POS3067 7.633852268 891.6449445 PG(20:4e_23:1)_POS3049 6.883 875.6136445 PG(20:4e_24:1)_POS3068 7.471 889.6292945 PG(20:5_18:2)_POS3018 6.437 793.5014145 PG(20:5_22:6)+H_1509POS 382.5889906 841.5014145 PG(22:4_18:2)_POS3023 6.852982189 840.5749135 PG(22:4_20:4)_POS3044 5.984171867 864.5749135 PG(22:5_18:2)_POS3027 5.973574225 838.5592635 PG(22:5_22:6)+NH4_1517POS 392.934531 886.5592635 PG(22:6_22:6)+NH4_1521POS 356.2111844 884.5436135 PG(24:0_24:0)_POS3089 13.44877774 964.7940135 PG(24:1_20:2)_POS3065 6.493053535 907.6398595 PG(25:0_19:0)_POS3053 15.141 908.7314135 PG(26:0_16:0)_POS3037 13.50005685 880.7001135 PG(26:0_16:0)_POS3038 14.17 880.7001135 PG(26:1_18:2)_POS3066 13.496 885.6579145 PG(26:1)_POS2952 6.672 659.3894595 PG(27:0_19:0)_POS3072 13.14936436 936.7627135 PG(27:0_19:0)_POS3074 13.74418311 936.7627135 PG(27:0_19:0)_POS3075 14.50964531 936.7627135 PG(27:0_19:1)_POS3080 14.1552338 934.7470635 PG(27:0)_POS2954 6.251958399 670.4653635 PG(27:1_19:0)_POS3082 15.01861038 934.7470635 PG(28:0_18:2)_POS3084 13.57827614 915.7048645 PG(28:1_18:2)_POS3086 13.408 913.6892145 PG(28:1_22:1)_POS3104 14.3520509 988.7940135 PG(29:0_19:0)_POS3090 14.07751703 964.7940135 PG(29:0_19:0)_POS3091 14.52602555 964.7940135 PG(29:0_19:0)_POS3092 15.16159737 964.7940135 PG(29:0)_POS2955 6.252167432 698.4966635 PG(29:0)_POS2956 7.492283623 698.4966635 PG(29:1_19:0)_POS3093 12.97597454 962.7783635 PG(29:1_19:0)_POS3095 14.53607812 962.7783635 PG(29:1_19:1)_POS3097 12.96080433 960.7627135 PG(29:1_19:1)_POS3098 13.8045193 960.7627135 PG(29:2e)+NH4_1462POS 626.7812707 680.4860985 PG(29:2e)_POS2957 1.939 663.4595495 PG(29:2e)_POS2958 2.756 663.4595495 PG(29:2e)_POS2959 11.07 680.4860985 PG(29:3)_POS2960 6.705093816 675.4231645 PG(30:0_14:0)_POS3050 13.18902658 908.7314135 PG(30:0_16:0)_POS3078 15.694 936.7627135 PG(30:0_16:1)_POS3079 13.30363254 934.7470635 PG(30:0_18:1)_POS3096 15.09035934 962.7783635 PG(30:0_18:2)_POS3099 14.57460384 960.7627135 PG(30:0e)_POS2961 7.329 698.5330485 PG(30:1_18:1)_POS3100 15.09109022 960.7627135 PG(30:1_18:2)_POS3101 13.74543024 941.7205145 PG(30:1_18:2)_POS3102 14.40756298 958.7470635 PG(31:2e)+NH4_1464POS 627.1237736 708.5173985 PG(32:5)_POS2963 4.349739395 730.4653635 PG(32:7)_POS2964 4.923 731.3894595 PG(34:1)_POS2965 6.297 749.5327145 PG(34:1)_POS2966 7.754 771.5146595 PG(34:5)_POS2978 5.856355274 758.4966635 PG(34:6)_POS2979 4.545748028 756.4810135 PG(35:0_9:0)_POS3052 14.36062361 908.7314135 PG(35:1_9:0)_POS3056 14.014 906.7157635 PG(36:1_8:0)_POS3055 13.503 906.7157635 PG(37:1_11:0)_POS3094 13.82658912 962.7783635 PG(38:3)+NH4_1485POS 435.461224 818.5905635 PG(38:3)_POS2999 6.921372967 823.5459595 PG(38:4)_POS3000 6.429278648 816.5749135 PG(38:4)_POS3001 7.155 816.5749135 PG(40:1)_POS3019 13.365 850.6531635 PG(4:0_21:0)_POS2951 5.443 642.4340635 PG(40:6)_POS3022 6.253570535 840.5749135 PG(40:9)_POS3036 6.249612005 839.4833595 PG(44:0)_POS3051 13.72942263 891.7048645 PG(44:1)_POS3054 12.621 889.6892145 PG(44:1)_POS3057 14.682 906.7157635 PG(45:1)_POS3070 13.89231049 925.6868095 PG(46:2)_POS3085 14.274 932.7314135 PG(47:3)_POS3087 14.46260968 927.7048645 PG(47:4)_POS3088 13.76561032 925.6892145 PG(48:4)_POS3103 13.777 939.7048645 PG(50:3)_POS3105 14.66 986.7783635 phSM(t36:4)_POS5650 9.572 757.5490325 PI(11:0_23:1)_POS3108 6.85 859.5307045 PI(14:1e_22:1)_POS3123 8.189514125 871.5670895 PI(16:0_18:1)_POS3109 7.485 859.5307045 PI(16:0_18:2)+NH4_1538POS 484.1019829 852.5596585 PI(16:0_20:3)_POS3126 7.191 883.5307045 PI(16:0_20:4)+Na_1553POS 473.2630507 881.5150545 PI(16:0_20:4)+NH4_1551POS 473.2630507 876.5596585 PI(16:0_22:6)+Na_1576POS 455.8104517 905.5150545 PI(16:0_22:6)+NH4_1575POS 455.8104517 900.5596585 PI(17:0_18:1)_POS3114 8.067641987 873.5463545 PI(17:0_20:4)+H_1557POS 508.5238136 873.5487595 PI(18:0_18:1)+NH4_1544POS 607.32 882.6066085 PI(18:0_18:1)_POS3116 8.074 887.5620045 PI(18:0_18:2)+NH4_1547POS 552.5075623 880.5909585 PI(18:0_18:3)_POS3129 8.230649712 878.5753085 PI(18:0_20:3)+H_1561POS 574.1529138 889.5800595 PI(18:0_20:3)+NH4_1560POS 574.1529138 906.6066085 PI(18:0_20:3)_POS3140 9.941 906.6066085 PI(18:0_20:4)+H_1567POS 542.6236431 887.5644095 PI(18:0_20:4)+NH4_1566POS 542.6236431 904.5909585 PI(18:0_20:4)_POS3146 9.147791363 887.5644095 PI(18:0_22:6)+NH4_1586POS 525.1265318 928.5909585 PI(18:1_18:1)_POS3120 7.581189729 885.5463545 PI(18:1_18:2)+Na_1550POS 491.0124037 883.5307045 PI(18:1_18:2)+NH4_1549POS 491.0124037 878.5753085 PI(18:1_18:2)_POS3125 6.698 883.5307045 PI(18:1_20:2)_POS3137 7.722 906.6066085 PI(18:1_20:3)_POS3142 8.055674811 904.5909585 PI(18:1_20:4)+H_1570POS 480.1795565 885.5487595 PI(18:1_20:4)+Na_1571POS 480.1795565 907.5307045 PI(18:1_20:4)+NH4_1569POS 480.1795565 902.5753085 PI(18:1_22:4)_POS3161 7.586097957 930.6066085 PI(19:0_20:4)_POS3156 9.162726144 918.6066085 PI(28:1_10:3)+NH4_1563POS 477.2906074 904.5909585 PI(28:1_10:3)_POS3141 7.537332023 904.5909585 PI(34:2)+Na_1539POS 484.1019829 857.5150545 PI(38:5)_POS3151 8.684 902.5753085 PI(40:5)+NH4_1584POS 480.1811137 930.6066085 PI(40:5)_POS3163 9.794060858 930.6066085 PI(43:0)_POS3169 14.877 987.6872045 PI(8:0e_10:0)_POS3106 2.183 601.3347445 PI(8:1e_12:3)_POS3107 1.397539854 621.3034445 PIP(17:1_16:0)+H_1597POS 473.390588 903.4994425 PIP2(24:2)_POS3184 16.95 877.2912205 PIP2(49:0)_POS3185 10.733 1209.731825 PIP2(51:1)_POS3187 10.77 1252.774024 PIP3(21:0)_POS3189 16.129 897.2599585 PIP(36:4e)_POS3172 4.913 925.5201775 PIP(38:2)_POS3173 4.982924249 971.5620425 PIP(50:1)_POS3174 11.513 1163.747437 PIP(50:2)_POS3175 10.72134925 1161.731787 PIP(52:1)_POS3176 12.26716854 1191.778737 PIP(52:2)_POS3177 11.59960667 1189.763087 PIP(52:2)_POS3178 12.13468925 1189.763087 PIP(52:3)_POS3179 10.89127051 1187.747437 PIP(52:3)_POS3180 11.571 1187.747437 PS(10:1e_16:0)_POS3193 3.317 636.4234985 PS(10:1e_18:1)_POS3194 3.37 662.4391485 PS(12:0e_6:0)+H_1608POS 143.6768272 526.3139485 PS(14:0_21:0)_POS3199 8.102959895 800.5412085 PS(16:0_18:1)_POS3197 8.223 784.5099085 PS(16:0_18:2)_POS3198 4.814 782.4942585 PS(16:0_20:4)+H_1615POS 483.9907525 784.5123135 PS(16:0_20:4)+Na_1616POS 483.9907525 806.4942585 PS(16:0_20:4)_POS3221 8.219526529 784.5123135 PS(16:0_22:6)+H_1630POS 465.2350644 808.5123135 PS(16:0_22:6)+Na_1631POS 465.2350644 830.4942585 PS(16:2e_21:0)_POS3223 6.846366376 810.5619435 PS(18:0_16:1)_POS3196 7.798445575 784.5099085 PS(18:0_18:1)+H_1611POS 618.2733696 790.5592635 PS(18:0_18:1)_POS3205 8.189 812.5412085 PS(18:0_18:1)_POS3206 8.985908191 812.5412085 PS(18:0_18:1)_POS3207 9.925 790.5592635 PS(18:0_18:1)_POS3209 12.145 812.5412085 PS(18:0_18:1)_POS3210 12.94055399 812.5412085 PS(18:0_18:1)_POS3211 13.484 812.5412085 PS(18:0_18:1)_POS3212 13.992 812.5412085 PS(18:0_18:2)_POS3216 8.197768651 810.5255585 PS(18:0_18:2)_POS3217 9.337076024 788.5436135 PS(18:0_20:3)+H_1622POS 581.9752339 814.5592635 PS(18:0_20:3)_POS3230 7.827 836.5412085 PS(18:0_20:3)_POS3233 9.363 814.5592635 PS(18:0_20:3)_POS3235 12.20411932 836.5412085 PS(18:0_20:3)_POS3236 13.6080243 836.5412085 PS(18:0_20:3)_POS3237 14.50089646 836.5412085 PS(18:0_20:4)+H_1626POS 552.9304012 812.5436135 PS(18:0_20:4)_POS3241 9.538 812.5436135 PS(18:0_20:4)_POS3242 12.145 812.5436135 PS(18:0_20:4)_POS3243 12.889 812.5436135 PS(18:0_22:4)+H_1638POS 604.7313746 840.5749135 PS(18:0_22:4)_POS3253 9.645873495 840.5749135 PS(18:0_22:6)+H_1641POS 535.1319253 836.5436135 PS(18:0_22:6)_POS3258 7.680745046 836.5436135 PS(18:0_22:6)_POS3260 9.047049283 836.5436135 PS(18:0_22:6)_POS3261 10.54 836.5436135 PS(18:0_22:6)_POS3262 11.178 836.5436135 PS(18:0_22:6)_POS3263 12.891 836.5436135 PS(18:0_22:6)_POS3264 13.60862717 836.5436135 PS(18:0_22:6)_POS3265 14.50089646 836.5436135 PS(18:1_18:1)+Na_1612POS 489.2681206 810.5255585 PS(18:1_18:2)_POS3218 7.492975325 808.5099085 PS(18:1e_23:1)_POS3269 11.001 844.6425985 PS(18:2_23:1)+Na_1648POS 680.22 878.5881585 PS(18:3_11:4)_POS3195 4.920697447 680.3558135 PS(18:3_22:1)_POS3251 5.169 862.5568585 PS(18:3_22:1)_POS3252 6.335688385 862.5568585 PS(18:3e_17:1)_POS3204 5.792820863 778.4993435 PS(20:0_22:5)_POS3272 6.644315882 888.5725085 PS(20:0_22:6)_POS3274 5.962446187 864.5749135 PS(20:0e_20:4)_POS3254 9.342379303 826.5956485 PS(20:0e_22:6)_POS3276 5.861 850.5956485 PS(20:1_20:4)_POS3255 7.479 860.5412085 PS(20:2_22:4)_POS3275 6.908834235 864.5749135 PS(20:4e_19:1)_POS3248 6.827 810.5643485 PS(22:1_18:2)_POS3250 5.995503692 864.5725085 PS(22:1_20:4)_POS3271 5.912 888.5725085 PS(22:3e)_POS3192 2.060067612 576.3295985 PS(24:1_11:1)_POS3201 5.807648941 796.5099085 PS(24:1_11:2)_POS3203 6.959 772.5123135 PS(25:0_11:3)_POS3219 7.99 808.5099085 PS(26:1_11:4)_POS3224 5.799 796.5123135 PS(27:0_11:3)_POS3231 8.559172174 836.5412085 PS(27:0_11:3)_POS3232 8.871300903 836.5412085 PS(27:1_11:3)_POS3244 14.298 812.5436135 PS(31:1_6:0)_POS3222 5.905 826.5568585 PS(35:1_15:0)_POS3284 14.32557013 986.7783635 PS(35:1)_POS3200 5.92 798.5255585 PS(35:2)_POS3202 6.251 796.5099085 PS(36:1e)_POS3215 5.866 798.5619435 PS(38:1)_POS3225 7.108620997 840.5725085 PS(38:1)_POS3226 7.565955346 840.5725085 PS(38:1)_POS3227 8.583 840.5725085 PS(38:2)_POS3228 5.963 838.5568585 PS(38:3e)_POS3239 6.903 822.5619435 PS(40:10)+H_1637POS 484.68 828.4810135 PS(40:2)_POS3249 6.835432403 866.5881585 PS(40:6)+Na_1642POS 535.1319253 858.5255585 PS(40:6)_POS3257 5.068 858.5255585 PS(40:9)+Na_1646POS 464.8099407 852.4786085 PS(42:5)_POS3273 7.053 888.5725085 PS(42:7e)_POS3277 5.934 870.5619435 PS(44:6)_POS3279 6.300705962 914.5881585 PS(44:7)_POS3280 5.559262004 912.5725085 PS(46:5)_POS3281 6.814 922.6531635 PS(48:0)_POS3282 14.39849875 960.7627135 PS(50:2)_POS3285 13.095 984.7627135 PS(50:2)_POS3286 13.92001235 984.7627135 PS(50:2)_POS3287 14.582 984.7627135 PS(8:1e_12:2)_POS3190 2.056 548.2982985 PS(8:1e_12:3)+H_1609POS 88.16271345 546.2826485 PS(8:1e_12:3)_POS3191 1.579 546.2826485 SM(d14:0_18:2)_POS3293 6.006 673.5279025 SM(d14:0_24:4)_POS3325 9.597716775 753.5905025 SM(d18:0_23:6)_POS3355 10.18660133 791.6061525 SM(d18:1_19:0)_POS3321 12.17029549 745.6218025 SM(d18:1_21:0)_POS3328 13.25331135 773.6531025 SM(d18:1_21:1)_POS3330 12.12001401 771.6374525 SM(d18:1_23:0)_POS3348 15.463 801.6844025 SM(d18:1_23:3)+H_1694POS 715.9774609 795.6374525 SM(d18:1_23:3)_POS3354 11.39942003 795.6374525 SM(d18:1_24:1)_POS3374 12.95470864 813.6844025 SM(d18:1_24:3)_POS3386 11.99271003 809.6531025 SM(d19:1_24:2)_POS3394 12.88520671 825.6844025 SM(d20:1_21:1)+H_1693POS 711.1861849 799.6687525 SM(d20:1_24:3)_POS3405 12.29186807 837.6844025 SM(d30:1)_POS3289 5.822060073 647.5122525 SM(d31:1)_POS3290 6.471 661.5279025 SM(d33:1)+H_1659POS 492.7604094 689.5592025 SM(d34:0)+H_1660POS 559.6554182 705.5905025 SM(d34:1)+H_1661POS 531.937727 703.5748525 SM(d34:1)_POS3299 9.161916677 703.5748525 SM(d34:2)+H_1663POS 464.5056165 701.5592025 SM(d34:4)_POS3307 7.10910301 697.5279025 SM(d35:4)_POS3310 7.739086115 711.5435525 SM(d36:1)+H_1668POS 606.7477775 731.6061525 SM(d36:1)_POS3313 10.186828 731.6061525 SM(d36:3)_POS3317 7.627374863 727.5748525 SM(d36:4)+H_1671POS 530.6167797 725.5592025 SM(d36:4)_POS3318 8.462601868 725.5592025 SM(d36:5)_POS3319 7.312471027 723.5435525 SM(d38:1)+H_1675POS 680.348255 759.6374525 SM(d40:0)+H_1681POS 774.3008511 789.6844025 SM(d40:1)+H_1683POS 749.2323536 787.6687525 SM(d40:1)_POS3336 13.395 787.6687525 SM(d40:1)_POS3337 13.999 787.6687525 SM(d40:2)+H_1686POS 677.5901743 785.6531025 SM(d40:4)+H_1688POS 679.5279582 781.6218025 SM(d40:4)_POS3340 7.939 803.6037475 SM(d40:4)_POS3341 10.80869663 781.6218025 SM(d41:0)+H_1691POS 806.28 803.7000525 SM(d41:1)+H_1692POS 780.2073147 801.6844025 SM(d41:1)_POS3346 13.37385412 801.6844025 SM(d41:1)_POS3347 13.995 801.6844025 SM(d42:0)+H_1696POS 836.7409164 817.7157025 SM(d42:1)+H_1698POS 813.6328983 815.7000525 SM(d42:1)_POS3364 14.685 815.7000525 SM(d42:2)+H_1701POS 744.6044636 813.6844025 SM(d42:2)_POS3373 12.4362892 813.6844025 SM(d42:3)+H_1702POS 685.0157229 811.6687525 SM(d42:4)+H_1705POS 749.8237051 809.6531025 SM(d42:5)+H_1706POS 676.9914618 807.6374525 SM(d42:5)_POS3387 9.295547233 807.6374525 SM(d43:2)+H_1709POS 777.1138434 827.7000525 SM(d43:4)+H_1712POS 779.9513573 823.6687525 SM(d43:4)_POS3395 12.50732821 823.6687525 SM(d43:5)+H_1713POS 711.8359906 821.6531025 SM(d43:5)_POS3396 11.34877442 821.6531025 SM(d44:0)_POS3397 14.342 845.7470025 SM(d44:1)+H_1717POS 874.08 843.7313525 SM(d44:2)_POS3400 12.421 841.7157025 SM(d44:3)_POS3404 13.41909432 839.7000525 SM(d44:4)_POS3406 13.00730654 837.6844025 SM(d44:5)+H_1722POS 744.1557801 835.6687525 SM(d44:5)_POS3407 11.84952948 835.6687525 SM(d44:5)_POS3408 12.471 835.6687525 SM(d44:6)+H_1723POS 685.9991746 833.6531025 SM(d44:6)_POS3409 10.94259636 833.6531025 SM(t18:0_23:1)_POS3420 10.922 817.6793175 SM(t34:1)_POS3411 7.407 719.5697675 SM(t36:1)_POS3414 4.361 747.6010675 SM(t40:0)+H_1726POS 715.137044 805.6793175 SM(t40:1)_POS3416 10.94462383 803.6636675 SM(t40:5)_POS3417 9.937123603 795.6010675 SM(t40:6)_POS3418 9.184 793.5854175 SM(t41:0)+H_1728POS 748.6624579 819.6949675 SM(t42:0)+H_1729POS 781.4021017 833.7106175 SM(t42:1)+H_1732POS 711.472502 831.6949675 SM(t42:2)_POS3425 10.985 829.6793175 SM(t42:7)+H_1734POS 666.3 819.6010675 SPH(d12:0)+H_1735POS 62.5997696 218.2114555 SPH(d12:0)_POS3426 1.06115089 218.2114555 SPH(d14:0)+H_1736POS 66.92608877 246.2427555 SPH(d14:0)_POS3427 1.132023224 246.2427555 SPH(d14:0)_POS3428 2.099542945 246.2427555 SPH(d14:0)_POS3429 2.793 246.2427555 SPH(d14:0)_POS3430 3.299899243 246.2427555 SPH(d14:0)_POS3431 3.778 246.2427555 SPH(d14:0)_POS3432 4.342 246.2427555 SPH(d14:0)_POS3433 4.644282348 246.2427555 SPH(d14:0)_POS3434 5.761360204 246.2427555 SPH(d14:0)_POS3435 6.95 246.2427555 SPH(d16:0)+H_1737POS 75.22659278 274.2740555 SPH(d16:0)_POS3441 1.263388313 274.2740555 SPH(d16:1)+H_1754POS 82.89743513 272.2584055 SPH(d16:1)_POS3469 1.379153754 272.2584055 SPH(d17:0)+H_1755POS 80.09127395 288.2897055 SPH(d18:0)+H_1757POS 91.10793423 302.3053555 SPH(d18:0)_POS3470 1.469478391 302.3053555 SPH(d18:0)_POS3473 2.43263472 302.3053555 SPH(d18:0)_POS3474 3.246812776 302.3053555 SPH(d18:0)_POS3475 4.378114614 302.3053555 SPH(d18:0)_POS3476 5.901138878 302.3053555 SPH(d18:0)_POS3477 6.440620424 302.3053555 SPH(d18:0)_POS3478 7.100147911 302.3053555 SPH(d18:1)+H-H2O_POS3481 2.985 282.2791405 SPH(d18:1)+H-H2O_POS3482 11.055 282.2791405 SPH(d18:1)+H-H2O_POS3483 13.26923852 282.2791405 SPH(d18:1)+H-H2O_POS3484 14.295 282.2791405 SPH(d18:1)_POS3479 1.834061962 300.2897055 SPH(d18:2)+H_1764POS 106.3505648 298.2740555 SPH(d18:2)_POS3485 1.521921479 298.2740555 SPH(d19:0)+H_1765POS 101.2945019 316.3210055 SPH(d19:0)+H-H2O_1766POS 226.2496254 298.3104405 SPH(d19:0)+H-H2O_POS3486 3.772 298.3104405 SPH(d20:0)+H_1768POS 118.7601639 330.3366555 SPH(d20:0)+H-H2O_1769POS 297.1037159 312.3260905 SPH(d20:0)+H-H2O_1770POS 366.1430658 312.3260905 SPH(d20:0)_POS3487 1.878610486 330.3366555 SPH(d20:0)_POS3489 3.013230327 330.3366555 SPH(d21:0)+H-H2O_1771POS 345.78 326.3417405 SPH(d22:0)_POS3490 2.592611605 358.3679555 SPH(d22:1)_POS3509 2.057380724 356.3523055 SPH(d22:1)_POS3510 3.193957056 356.3523055 SPH(d22:2)_POS3511 1.744042058 354.3366555 SPH(d24:0)_POS3512 3.68507175 386.3992555 SPH(m18:0)_POS3513 2.023885473 286.3104405 SPH(m19:1)+H_1779POS 243.24 298.3104405 SPH(m20:0)_POS3514 2.794829645 314.3417405 SPH(m20:1)_POS3515 2.200150276 312.3260905 SPH(m22:0)_POS3516 4.421724579 342.3730405 SPH(t16:0)+H_1780POS 78.18 290.2689705 SPH(t16:0)_POS3517 1.133170329 290.2689705 SPH(t16:0)_POS3518 3.273619729 290.2689705 SPH(t16:0)_POS3519 4.396137924 290.2689705 SPH(t16:0)_POS3520 5.856 290.2689705 SPH(t16:0)_POS3521 14.323026 290.2689705 SPH(t16:0)_POS3522 17.973 290.2689705 SPH(t18:0)_POS3527 1.256180874 318.3002705 SPH(t18:0)_POS3528 1.761736412 318.3002705 SPH(t18:0)_POS3530 2.60494651 318.3002705 SPH(t18:0)_POS3532 3.271408658 318.3002705 SPH(t18:0)_POS3533 5.993130009 318.3002705 SPH(t20:0)+H-H2O_POS3535 3.719 328.3210055 SPH(t20:1)+H-H2O_POS3536 2.804 326.3053555 ST(d14:0_18:1+2O)_POS3537 5.975 801.5140915 ST(d18:1_22:0)_POS3540 8.419040187 864.6229125 ST(d18:1_24:0)_POS3542 11.453 892.6542125 ST(d18:1_24:1)_POS3544 10.392 890.6385625 ST(d19:1_26:0)_POS3547 15.59 951.7277115 ST(d36:2+O)_POS3538 8.476 844.5215225 ST(d37:3)_POS3539 8.244 835.5712115 ST(d40:2)_POS3541 7.274379711 862.6072625 ST(d42:3)_POS3545 7.69572367 888.6229125 ST(d42:5)_POS3546 6.856045055 906.5735575 StE(32:3)_POS3552 17.568 886.8374555 StE(34:4)_POS3553 17.558 912.8531055 StE(38:4)_POS3554 17.852 951.8891565 ST(m22:1_20:5)_POS3548 8.595318077 888.5629925 ST(t16:0_20:2)_POS3549 8.464164669 844.5215225 ST(t16:1_22:5)+NH4_1792POS 474.3 859.5348265 ST(t36:4)+NH4_1788POS 483.6206252 835.5348265 ST(t39:0+O)_POS3550 9.473 906.5946875 TG(10:0_10:0_10:4)_POS3590 5.511 547.3993165 TG(10:0_10:0_18:2)_POS3713 7.125 680.5823655 TG(10:0_10:3_14:2)_POS3640 6.092574544 601.4462665 TG(10:0_11:2_11:2)_POS3610 10.6207184 575.4306165 TG(10:0_11:2_12:1)_POS3614 7.330045351 608.4884655 TG(10:0_11:2_22:5)_POS3841 12.1553881 740.5823655 TG(10:0_14:0_18:1)_POS3799 14.39082368 738.6606155 TG(10:0_18:1_18:2)_POS3913 14.69442894 790.6919155 TG(10:0_18:2_18:2)_POS3916 14.7096726 788.6762655 TG(10:0_18:2_22:6)_POS4189 13.9364547 836.6762655 TG(10:0_18:3_22:6)_POS4190 13.38522834 834.6606155 TG(10:0_22:6_22:6)_POS4553 14.497 867.6497165 TG(11:0_10:0_16:1)_POS3698 12.9334028 668.5823655 TG(11:0_10:1_10:1)_POS3592 6.674 587.4282115 TG(11:0_12:1_12:3)_POS3649 6.856894829 634.5041155 TG(11:0_12:3_18:1)_POS3794 12.27401234 718.5980155 TG(11:0_16:0_18:1)_POS3873 15.90077613 780.7075655 TG(11:0_16:0_18:2)_POS3875 15.44654743 778.6919155 TG(11:0_16:0_22:6)_POS4044 14.6678158 826.6919155 TG(11:0_16:1_22:6)_POS4046 14.48568438 824.6762655 TG(11:0_18:1_22:5)_POS4237 15.82304655 854.7232155 TG(11:0_18:2_18:2)_POS3939 15.14652277 802.6919155 TG(11:0_18:2_22:6)_POS4241 14.52719418 850.6919155 TG(12:0_10:1_11:2)_POS3613 6.867866638 608.4884655 TG(12:0_10:1_18:2)_POS3762 13.103 706.5980155 TG(12:0_10:2_10:3)_POS3611 5.827912018 590.4415155 TG(12:0_11:3_18:2)_POS3796 11.994 716.5823655 TG(12:0_12:3_12:3)_POS3690 6.148 644.4884655 TG(12:0_18:2_18:2)_POS4003 14.80809974 816.7075655 TG(12:0_18:2_18:2)_POS4005 15.2514528 816.7075655 TG(12:0_18:2_18:3)_POS4007 14.78885931 814.6919155 TG(12:0_22:6_22:6)_POS4848 14.15170291 912.7075655 TG(12:0e_10:0_12:4)_POS3639 9.148650093 589.4826515 TG(12:0e_10:3_12:0)_POS3634 11.799 591.4983015 TG(12:0e_10:3_18:3)_POS3773 3.053652289 686.5718005 TG(12:0e_12:3_18:2)_POS3815 11.6807081 716.6187505 TG(12:0e_18:3_22:5)_POS4465 14.53820476 855.6836965 TG(12:0e_20:0_22:5)_POS4729 14.863788 889.7619465 TG(12:0e_20:1_22:5)_POS4760 15.43252027 887.7462965 TG(12:0e_6:0_18:3)_POS3668 11.54621196 619.5296015 TG(12:0e_6:0_18:3)_POS3669 11.988 619.5296015 TG(12:0e_6:0_18:3)_POS3670 12.95310459 619.5296015 TG(12:0e_6:0_20:3)+H_1903POS 871.3225387 647.5609015 TG(12:0e_6:0_20:4)_POS3725 11.94949519 645.5452515 TG(12:0e_6:0_20:4)_POS3726 12.895 662.5718005 TG(12:0e_6:0_20:5)_POS3732 12.055 643.5296015 TG(12:0e_6:0_22:5)_POS3768 11.67556423 671.5609015 TG(12:0e_6:0_22:5)_POS3769 12.187 671.5609015 TG(12:0e_6:0_22:6)_POS3775 11.59353311 669.5452515 TG(12:0e_8:0_22:5)_POS3817 14.0137368 699.5922015 TG(12:1e_10:0_22:6)_POS3870 12.64103635 740.6187505 TG(12:1e_10:1_22:5)_POS3869 12.065 740.6187505 TG(12:1e_10:2_11:3)_POS3621 7.326 571.4357015 TG(12:1e_10:2_18:2)_POS3767 10.314 693.5428465 TG(12:1e_10:3_15:0)_POS3700 12.56081277 631.5296015 TG(12:1e_10:4_20:5)_POS3802 9.284354106 689.5139515 TG(12:1e_12:3_18:2)_POS3820 11.58584653 714.6031005 TG(12:1e_12:4_18:2)_POS3825 10.92712582 712.5874505 TG(12:1e_12:4_18:3)_POS3829 10.29835542 693.5452515 TG(12:1e_14:4_14:4)_POS3787 9.294628675 680.5248505 TG(12:1e_14:4_23:0)_POS4043 14.03535235 819.6836965 TG(12:1e_18:0_22:6)_POS4462 14.609 835.7174015 TG(12:1e_20:0_22:5)_POS4759 14.89 887.7462965 TG(12:1e_22:6_24:2)_POS5232 13.66 937.7619465 TG(12:1e_6:0_18:1)_POS3661 10.84978898 643.5271965 TG(12:1e_6:0_18:1)_POS3662 12.04267202 621.5452515 TG(12:1e_6:0_18:3)_POS3678 7.5443629 617.5139515 TG(12:1e_6:0_18:3)_POS3679 10.19360268 617.5139515 TG(12:1e_6:0_18:3)_POS3680 10.78007181 617.5139515 TG(12:1e_6:0_18:4)+H_1882POS 692.9464921 615.4983015 TG(12:1e_6:0_18:4)_POS3687 6.814 615.4983015 TG(12:1e_6:0_18:4)_POS3688 9.508603197 615.4983015 TG(12:1e_6:0_20:3)_POS3724 11.36657194 645.5452515 TG(12:1e_6:0_20:4)_POS3729 9.337 660.5561505 TG(12:1e_6:0_20:4)_POS3733 12.559 643.5296015 TG(12:1e_6:0_20:5)_POS3736 9.905450516 641.5139515 TG(12:1e_6:0_20:5)_POS3737 11.121 641.5139515 TG(12:1e_6:0_22:3)_POS3766 14.07 673.5765515 TG(12:1e_6:0_22:4)+H_1932POS 814.4453689 671.5609015 TG(12:1e_6:0_22:4)_POS3770 13.0810233 671.5609015 TG(12:1e_6:0_22:5)+H_1934POS 761.4112912 669.5452515 TG(12:1e_6:0_22:5)_POS3774 11.08080288 669.5452515 TG(12:1e_6:0_22:5)_POS3776 12.194 669.5452515 TG(12:1e_6:0_22:6)_POS3781 10.49070241 667.5296015 TG(12:1e_6:0_22:6)_POS3782 11.39353228 667.5296015 TG(12:1e_6:0_22:6)_POS3783 11.97248677 667.5296015 TG(12:1e_8:0_22:5)_POS3821 11.98158408 714.6031005 TG(12:1e_8:0_22:6)_POS3827 12.38432142 695.5609015 TG(13:0_10:2_10:3)_POS3618 5.92719666 587.4306165 TG(13:0_10:3_11:3)_POS3641 5.552 621.4125615 TG(13:0_10:3_11:3)_POS3642 6.13 621.4125615 TG(14:0_11:1_22:6)_POS3942 13.555 796.6449655 TG(14:0_11:2_22:6)_POS3943 13.077 794.6293155 TG(14:0_14:1_20:5)_POS4013 15.269 795.6497165 TG(14:0_14:3_18:2)_POS3920 14.48885429 786.6606155 TG(14:0_18:2_18:2)_POS4171 15.79498479 844.7388655 TG(14:0_18:2_18:2)_POS4173 16.31875608 844.7388655 TG(14:0_18:2_18:3)+Na_2295POS 945.6678735 847.6786115 TG(14:0_18:2_18:3)+NH4_2294POS 945.6678735 842.7232155 TG(14:0_18:2_20:4)_POS4459 16.378 868.7388655 TG(14:0e_10:2_14:0)_POS3716 12.18620051 666.6031005 TG(14:0e_10:2_16:1)_POS3763 12.18397213 692.6187505 TG(14:0e_10:4_12:4)_POS3696 7.592570341 626.4779005 TG(14:0e_10:4_18:2)_POS3819 10.76243459 714.6031005 TG(14:0e_15:0_17:1)_POS3903 15.114 780.7439505 TG(14:0e_21:0_21:0)_POS4834 17.52897416 922.9161005 TG(14:1_10:3_11:2)_POS3655 6.638967368 613.4462665 TG(14:1_12:3_12:3)_POS3741 12.85404683 653.4775665 TG(14:1e_10:0_20:5)_POS3866 11.80033468 742.6344005 TG(14:1e_10:2_12:3)_POS3692 9.087 630.5092005 TG(14:1e_10:3_12:0)_POS3683 15.05745659 617.5139515 TG(14:1e_10:3_14:4)_POS3742 8.54232085 654.5092005 TG(14:1e_10:3_18:1)_POS3816 12.58066187 716.6187505 TG(14:1e_10:3_18:3)_POS3822 3.070326437 712.5874505 TG(14:1e_10:3_20:4)_POS3872 11.34110222 738.6031005 TG(14:1e_11:0_11:3)_POS3682 11.997 617.5139515 TG(14:1e_11:1_11:3)_POS3689 11.50602667 615.4983015 TG(14:1e_11:4_17:0)+H_1955POS 886.0600657 699.5922015 TG(14:1e_14:0_22:6)_POS4187 14.502 807.6861015 TG(14:1e_15:0_18:0)_POS3934 15.317 794.7596005 TG(14:1e_15:0_22:6)_POS4240 14.854 821.7017515 TG(14:1e_20:1_22:6)_POS5048 16.50944452 906.7909005 TG(14:1e_20:2_22:6)_POS5054 15.44990888 887.7487015 TG(14:1e_22:0_22:6)_POS5184 15.182 941.7932465 TG(14:1e_6:0_18:2)_POS3719 12.1903341 647.5609015 TG(14:1e_6:0_22:6)_POS3826 11.58677544 695.5609015 TG(14:1e_8:0_11:4)_POS3620 6.012 573.4513515 TG(14:1e_9:0_22:6)_POS3884 11.332 737.6078515 TG(15:0_10:1_18:2)_POS3835 14.01741775 748.6449655 TG(15:0_10:2_18:1)_POS3836 14.50531238 748.6449655 TG(15:0_14:1_22:6)_POS4238 15.02921571 852.7075655 TG(15:0_16:0_16:0)_POS3929 16.70652643 810.7545155 TG(15:0_16:0_18:1)_POS4023 16.70609924 836.7701655 TG(15:0_16:0_18:1)_POS4025 17.26 836.7701655 TG(15:0_16:0_18:1)_POS4026 17.803 836.7701655 TG(15:0_16:0_18:2)_POS4031 15.13297878 834.7545155 TG(15:0_16:0_18:2)_POS4032 16.38771961 834.7545155 TG(15:0_16:0_18:2)_POS4034 17.765 834.7545155 TG(15:0_16:0_22:6)_POS4517 16.09247755 882.7545155 TG(15:0_16:1_16:1)+NH4_2036POS 975.3929626 806.7232155 TG(15:0_16:1_18:2)_POS4039 14.43269199 832.7388655 TG(15:0_18:1_18:2)_POS4224 17.522 860.7701655 TG(15:0_18:1_20:5)_POS4515 14.644 882.7545155 TG(15:0_18:1_22:5)_POS4811 15.5980036 910.7858155 TG(15:0_18:2_18:2)_POS4232 16.04295584 858.7545155 TG(15:0_18:2_18:3)_POS4234 15.6844426 856.7388655 TG(15:0_18:2_20:5)_POS4521 16.553 880.7388655 TG(15:0_18:2_22:4)_POS4813 16.713 910.7858155 TG(15:0_18:2_22:5)_POS4817 15.00208783 908.7701655 TG(15:0_18:2_22:5)_POS4819 16.453 908.7701655 TG(15:0_18:2_22:6)_POS4821 15.69186778 906.7545155 TG(15:0_18:3_18:3)_POS4235 13.78447204 854.7232155 TG(15:0_18:3_22:6)_POS4825 15.20881486 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TG(16:1_14:1_18:2)+Na_2095POS 946.0921472 821.6629615 TG(16:1_14:1_18:2)+NH4_2094POS 946.0921472 816.7075655 TG(16:1_16:1_16:1)+Na_2088POS 963.1352899 823.6786115 TG(16:1_16:1_16:1)+NH4_2089POS 963.1352899 818.7232155 TG(16:1_16:1_17:1)+NH4_2115POS 976.5179574 832.7388655 TG(16:1_16:1_18:2)_POS4169 13.862 844.7388655 TG(16:1_16:1_18:2)_POS4174 17.491 844.7388655 TG(16:1_18:1_18:2)+NH4_2585POS 990.7291398 872.7701655 TG(16:1_18:1_21:0)_POS4790 16.53315048 918.8484155 TG(16:1_18:1_22:6)_POS5034 12.116 903.7436165 TG(16:1_18:1_22:6)_POS5039 15.97157436 920.7701655 TG(16:1_18:2_18:2)+Na_2611POS 969.7667659 875.7099115 TG(16:1_18:2_18:2)+NH4_2610POS 969.7667659 870.7545155 TG(16:1_18:2_18:3)+NH4_2623POS 953.9057132 868.7388655 TG(16:1_18:2_18:3)_POS4458 15.86250264 868.7388655 TG(16:1_18:2_22:6)_POS5051 15.36301983 918.7545155 TG(16:1_21:0_22:6)_POS5272 15.51203835 964.8327655 TG(16:1_22:6_22:6)_POS5308 15.47631689 966.7545155 TG(16:1_6:0_11:3)_POS3615 5.979305512 606.4728155 TG(16:1_6:0_17:1)_POS3745 13.09176609 694.5980155 TG(16:1_8:0_18:1)_POS3803 13.55641612 736.6449655 TG(16:1e_16:0_18:2)_POS4168 16.84299163 832.7752505 TG(16:1e_19:1_19:1)_POS4612 15.75959929 893.7932465 TG(16:1e_22:4_22:4)_POS5370 16.765 960.8378505 TG(16:1e_22:4_24:1)_POS5420 17.61027044 994.9161005 TG(16:2e_10:4_18:1)_POS3868 11.57060075 740.6187505 TG(16:2e_11:2_22:6)_POS4029 6.1 809.6054465 TG(16:2e_11:4_20:5)_POS3932 14.392 757.5765515 TG(16:2e_17:1_21:1)_POS4673 15.162 891.7775965 TG(16:2e_18:1_18:2)_POS4453 15.207 861.7306465 TG(16:2e_19:1_19:1)_POS4674 15.62144204 891.7775965 TG(16:2e_20:2_20:5)_POS5053 14.349 887.7487015 TG(17:0_10:4_20:5)_POS3944 9.389 775.5871165 TG(17:0_12:0_18:1)_POS3930 13.368 813.6942615 TG(17:0_18:1_18:1)_POS4480 17.01036869 890.8171155 TG(17:0_18:1_18:2)+NH4_2653POS 1017.472549 888.8014655 TG(17:0_18:1_18:2)_POS4491 15.74175254 888.8014655 TG(17:0_18:1_18:2)_POS4492 16.74380057 888.8014655 TG(17:0_18:1_18:2)_POS4494 17.73042686 888.8014655 TG(17:0_18:1_22:4)_POS5082 16.78701312 940.8327655 TG(17:0_18:1_22:5)_POS5083 15.48714297 938.8171155 TG(17:0_18:1_22:6)_POS5089 16.46438567 936.8014655 TG(17:0_18:2_18:2)_POS4506 15.25257109 886.7858155 TG(17:0_18:2_20:4)_POS4814 17.839 910.7858155 TG(17:0_18:2_22:5)_POS5087 15.04443516 936.8014655 TG(17:0_18:2_22:6)_POS5090 14.76085213 934.7858155 TG(17:0_18:2_22:6)_POS5091 15.9466074 934.7858155 TG(17:0_20:4_22:6)_POS5244 15.84852478 958.7858155 TG(17:0_22:5_22:5)_POS5373 15.23 986.8171155 TG(17:0_22:5_22:6)_POS5374 16.03945452 984.8014655 TG(17:0_22:6_22:6)_POS5375 15.51004261 982.7858155 TG(17:1_10:2_10:3)_POS3702 8.116 663.4595115 TG(17:1_10:2_11:4)_POS3739 6.514619512 675.4595115 TG(18:0_10:2_20:4)_POS4010 13.363 812.6762655 TG(18:0_10:4_19:0)_POS3938 14.199 802.6919155 TG(18:0_10:4_20:5)_POS4019 9.964 789.6027665 TG(18:0_11:3_14:1)_POS3837 12.84692432 746.6293155 TG(18:0_12:4_14:0)_POS3854 4.38772602 760.6449655 TG(18:0_14:4_18:2)_POS4182 10.321 845.6629615 TG(18:0_16:0_16:0)+Na_2152POS 1041.910619 857.7568615 TG(18:0_16:0_16:0)+Na_2162POS 1216.89716 857.7568615 TG(18:0_16:0_16:0)+NH4_2151POS 1041.910619 852.8014655 TG(18:0_16:0_16:0)_POS4049 17.16056455 852.8014655 TG(18:0_16:0_16:0)_POS4052 17.61393196 852.8014655 TG(18:0_16:0_17:0)+NH4_2305POS 1048.462615 866.8171155 TG(18:0_16:0_17:0)_POS4191 17.28055144 866.8171155 TG(18:0_16:0_18:0)+Na_2351POS 1055.330741 885.7881615 TG(18:0_16:0_18:0)+NH4_2350POS 1055.330741 880.8327655 TG(18:0_16:0_18:0)+NH4_2352POS 1081.500507 880.8327655 TG(18:0_16:0_18:0)_POS4245 17.1414384 880.8327655 TG(18:0_16:0_18:1)+Na_2379POS 1039.393116 883.7725115 TG(18:0_16:0_18:1)+Na_2383POS 1084.590234 883.7725115 TG(18:0_16:0_18:1)+Na_2389POS 1180.626507 883.7725115 TG(18:0_16:0_18:1)+Na_2391POS 1207.165607 883.7725115 TG(18:0_16:0_18:1)+NH4_2377POS 1039.393116 878.8171155 TG(18:0_16:0_18:1)_POS4255 14.59024439 883.7725115 TG(18:0_16:0_18:1)_POS4259 16.93260732 861.7905665 TG(18:0_16:0_18:1)_POS4262 17.18267522 878.8171155 TG(18:0_16:0_18:2)_POS4298 16.85794405 876.8014655 TG(18:0_16:0_18:2)_POS4303 17.73963647 881.7568615 TG(18:0_16:0_19:0)_POS4470 17.52138086 894.8484155 TG(18:0_16:0_20:1)_POS4533 14.9285233 906.8484155 TG(18:0_16:0_21:0)+NH4_2950POS 1041.996351 922.8797155 TG(18:0_16:0_22:0)+NH4_3004POS 1042.698495 936.8953655 TG(18:0_16:0_22:0)_POS4833 17.5875812 936.8953655 TG(18:0_16:0_23:0)+NH4_3144POS 1055.381809 950.9110155 TG(18:0_16:0_24:0)+NH4_3178POS 1055.170789 964.9266655 TG(18:0_16:1_20:5)_POS4738 5.603 879.7436165 TG(18:0_17:0_18:0)+NH4_2640POS 1061.731403 894.8484155 TG(18:0_17:0_18:1)+NH4_2645POS 1047.985567 892.8327655 TG(18:0_17:0_18:2)_POS4481 17.81471823 890.8171155 TG(18:0_18:0_18:0)+Na_2683POS 1067.392274 913.8194615 TG(18:0_18:0_18:0)+NH4_2682POS 1067.392274 908.8640655 TG(18:0_18:0_18:0)+NH4_2684POS 1059.207493 908.8640655 TG(18:0_18:0_18:0)_POS4529 17.62356937 908.8640655 TG(18:0_18:0_18:1)+Na_2694POS 1052.19615 911.8038115 TG(18:0_18:0_18:1)+NH4_2693POS 1052.19615 906.8484155 TG(18:0_18:0_18:1)_POS4535 17.17648617 906.8484155 TG(18:0_18:0_18:1)_POS4537 17.45013644 906.8484155 TG(18:0_18:0_19:0)+NH4_2951POS 1072.738976 922.8797155 TG(18:0_18:0_20:0)+NH4_3005POS 1068.040464 936.8953655 TG(18:0_18:0_20:2)+NH4_3027POS 1005.959261 932.8640655 TG(18:0_18:0_21:0)_POS5055 17.44306201 950.9110155 TG(18:0_18:1_18:1)_POS4565 17.14210136 904.8327655 TG(18:0_18:1_19:0)+NH4_2956POS 1031.069083 920.8640655 TG(18:0_18:1_19:0)_POS4782 16.91926142 920.8640655 TG(18:0_18:1_19:0)_POS4783 17.50171731 920.8640655 TG(18:0_18:1_20:0)+NH4_3012POS 1064.205529 934.8797155 TG(18:0_18:1_20:0)_POS4836 17.38231545 934.8797155 TG(18:0_18:1_20:1)_POS4855 16.51598836 932.8640655 TG(18:0_18:1_20:1)_POS4856 17.21645458 932.8640655 TG(18:0_18:1_20:1)_POS4858 17.37344454 932.8640655 TG(18:0_18:1_22:2)+NH4_3206POS 1009.351355 958.8797155 TG(18:0_18:1_22:3)+NH4_3212POS 990.8140192 956.8640655 TG(18:0_18:1_22:4)_POS5143 17.00944857 954.8484155 TG(18:0_18:1_22:5)+NH4_3221POS 1017.709709 952.8327655 TG(18:0_18:1_22:5)_POS5150 17.30398758 952.8327655 TG(18:0_18:1_22:6)_POS5171 17.75688299 950.8171155 TG(18:0_18:1_24:0)_POS5280 17.44534771 990.9423155 TG(18:0_18:1_24:0)_POS5281 17.98296978 990.9423155 TG(18:0_19:0_22:6)_POS5271 16.97356611 966.8484155 TG(18:0_20:4_22:6)_POS5284 16.03241006 972.8014655 TG(18:0_22:4_22:5)_POS5428 16.01557575 1002.848415 TG(18:0_22:4_22:6)_POS5389 16.44376911 1000.832765 TG(18:0_22:5_22:6)_POS5393 16.15820799 998.8171155 TG(18:0_22:6_24:1)_POS5460 17.29123817 1034.911015 TG(18:0_6:0_10:1)_POS3625 6.454 626.5354155 TG(18:0_6:0_18:0)_POS3797 10.254 745.6316615 TG(18:0e_10:2_11:4)_POS3751 11.002 677.5115465 TG(18:0e_10:4_12:4)_POS3785 7.38 665.5139515 TG(18:0e_15:0_16:0)_POS4022 17.413 824.8065505 TG(18:0e_16:0_16:0)_POS4057 17.5270786 838.8222005 TG(18:0e_18:0_18:2)_POS4574 17.52914365 890.8535005 TG(18:0e_18:1_20:1)_POS4863 17.70919054 918.8848005 TG(18:0e_18:1_22:6)_POS5185 16.98279051 936.8378505 TG(18:0e_22:6_22:6)_POS5397 15.1506271 965.7956515 TG(18:0e_22:6_24:0)_POS5459 17.8367998 1022.9474 TG(18:0e_22:6_24:1)_POS5461 17.75102195 1020.93175 TG(18:1_10:2_13:0)_POS3793 13.697204 720.6136655 TG(18:1_10:4_12:1)_POS3771 8.244 700.5510655 TG(18:1_11:2_12:1)_POS3795 12.86116797 718.5980155 TG(18:1_12:0_18:1)_POS3978 15.735 820.7388655 TG(18:1_12:0_18:2)_POS3996 15.25348619 818.7232155 TG(18:1_12:0_18:2)_POS3998 15.74439868 818.7232155 TG(18:1_13:0_18:2)_POS4040 15.99792541 832.7388655 TG(18:1_13:0_22:6)_POS4520 15.88797143 880.7388655 TG(18:1_17:1_18:2)+NH4_2655POS 999.2147955 886.7858155 TG(18:1_17:1_18:2)_POS4507 16.4289352 886.7858155 TG(18:1_17:1_20:3)_POS4806 17.561 912.8014655 TG(18:1_17:1_22:3)+NH4_3163POS 972.42 940.8327655 TG(18:1_17:1_22:6)+NH4_3171POS 982.3871729 934.7858155 TG(18:1_18:1_18:1)+NH4_2760POS 1025.212941 902.8171155 TG(18:1_18:1_18:1)_POS4596 16.88400342 902.8171155 TG(18:1_18:1_18:2)+Na_2804POS 1010.48664 905.7568615 TG(18:1_18:1_18:2)+NH4_2803POS 1010.48664 900.8014655 TG(18:1_18:1_18:2)+NH4_2805POS 1044.627 900.8014655 TG(18:1_18:1_18:2)+NH4_2818POS 1234.911763 900.8014655 TG(18:1_18:1_18:2)_POS4621 3.09803442 905.7568615 TG(18:1_18:1_18:2)_POS4624 4.370924499 905.7568615 TG(18:1_18:1_18:2)_POS4626 5.232757501 905.7568615 TG(18:1_18:1_18:2)_POS4628 5.855110647 905.7568615 TG(18:1_18:1_18:2)_POS4643 13.86838244 905.7568615 TG(18:1_18:1_18:2)_POS4649 16.65713181 900.8014655 TG(18:1_18:1_18:3)+H_2872POS 1238.717418 881.7592665 TG(18:1_18:1_21:0)+NH4_3155POS 1021.68 946.8797155 TG(18:1_18:1_21:0)_POS5070 16.8826432 946.8797155 TG(18:1_18:1_22:0)_POS5117 16.927 960.8953655 TG(18:1_18:1_22:4)_POS5148 16.75052396 952.8327655 TG(18:1_18:1_22:4)_POS5152 17.762 952.8327655 TG(18:1_18:1_22:5)_POS5160 4.055 950.8171155 TG(18:1_18:1_22:5)_POS5161 5.589132291 950.8171155 TG(18:1_18:1_22:5)_POS5162 6.267250493 950.8171155 TG(18:1_18:1_22:5)_POS5165 15.02318451 950.8171155 TG(18:1_18:1_22:6)+NH4_3231POS 994.6439471 948.8014655 TG(18:1_18:1_23:0)_POS5248 17.70335787 974.9110155 TG(18:1_18:1_23:1)_POS5251 16.8355694 972.8953655 TG(18:1_18:1_24:0)_POS5314 17.79796081 988.9266655 TG(18:1_18:1_24:2)+NH4_3279POS 1008.96 984.8953655 TG(18:1_18:2_18:2)+NH4_2859POS 1001.248754 898.7858155 TG(18:1_18:2_18:2)_POS4684 3.156696663 903.7412115 TG(18:1_18:2_18:2)_POS4686 3.553033609 903.7412115 TG(18:1_18:2_18:2)_POS4688 4.317110837 903.7412115 TG(18:1_18:2_18:2)_POS4690 5.068992188 903.7412115 TG(18:1_18:2_18:2)_POS4692 5.884068699 903.7412115 TG(18:1_18:2_18:2)_POS4694 6.468325514 903.7412115 TG(18:1_18:2_18:2)_POS4705 13.60061556 881.7592665 TG(18:1_18:2_18:2)_POS4708 14.82444856 881.7592665 TG(18:1_18:2_18:2)_POS4712 16.29176132 898.7858155 TG(18:1_18:2_18:3)+Na_2909POS 973.1803092 901.7255615 TG(18:1_18:2_18:3)+NH4_2907POS 973.1803092 896.7701655 TG(18:1_18:2_18:3)_POS4741 13.982 879.7436165 TG(18:1_18:2_18:3)_POS4744 15.88634447 896.7701655 TG(18:1_18:2_20:4)_POS4998 5.132 905.7592665 TG(18:1_18:2_21:0)_POS5075 16.57248502 944.8640655 TG(18:1_18:2_21:0)_POS5076 17.25862321 944.8640655 TG(18:1_18:2_21:1)_POS5079 17.01224501 942.8484155 TG(18:1_18:2_22:0)_POS5122 17.693 958.8797155 TG(18:1_18:2_22:1)_POS5130 16.24931476 956.8640655 TG(18:1_18:2_22:1)_POS5131 17.09008818 956.8640655 TG(18:1_18:2_22:2)_POS5142 16.55541527 954.8484155 TG(18:1_18:2_22:3)_POS5147 15.94252137 952.8327655 TG(18:1_18:2_22:4)+Na_3227POS 999.3701494 955.7725115 TG(18:1_18:2_22:4)+NH4_3226POS 999.3701494 950.8171155 TG(18:1_18:2_22:4)_POS5164 13.82678223 950.8171155 TG(18:1_18:2_22:4)_POS5166 15.61471455 950.8171155 TG(18:1_18:2_22:4)_POS5167 16.41325776 950.8171155 TG(18:1_18:2_22:5)+NH4_3230POS 967.4149138 948.8014655 TG(18:1_18:2_22:5)_POS5197 16.06214445 948.8014655 TG(18:1_18:2_22:6)+NH4_3235POS 967.1099746 946.7858155 TG(18:1_18:2_22:6)_POS5217 14.13647829 946.7858155 TG(18:1_18:2_22:6)_POS5221 15.95914898 946.7858155 TG(18:1_18:2_22:6)_POS5223 16.38465681 946.7858155 TG(18:1_18:2_22:6)_POS5224 17.063 946.7858155 TG(18:1_18:2_22:6)_POS5225 17.80165551 946.7858155 TG(18:1_18:2_23:0)_POS5252 17.50121212 972.8953655 TG(18:1_18:2_23:1)_POS5256 16.634 970.8797155 TG(18:1_18:2_23:1)_POS5257 17.27537378 970.8797155 TG(18:1_18:2_24:0)_POS5319 17.59879154 986.9110155 TG(18:1_18:2_24:1)+NH4_3280POS 1053.059884 984.8953655 TG(18:1_18:2_24:1)_POS5322 17.38230109 984.8953655 TG(18:1_18:2_24:1)_POS5323 17.95358393 984.8953655 TG(18:1_18:2_24:2)_POS5327 17.20750839 982.8797155 TG(18:1_18:3_21:1)_POS5081 15.84410882 940.8327655 TG(18:1_20:2_22:6)_POS5359 15.54002983 974.8171155 TG(18:1_20:2_22:6)_POS5361 17.82863938 974.8171155 TG(18:1_20:4_22:6)+NH4_3263POS 957.8067685 970.7858155 TG(18:1_20:4_24:1)_POS5418 17.2995547 1008.895365 TG(18:1_20:5_22:6)+H_3268POS 976.421338 951.7436165 TG(18:1_22:1_22:6)_POS5424 16.83036826 1004.864065 TG(18:1_22:4_22:6)_POS5392 15.86465153 998.8171155 TG(18:1_22:5_22:6)_POS5395 16.06331769 996.8014655 TG(18:1_22:5_24:0)_POS5458 17.47910592 1036.926665 TG(18:1_22:6_22:6)_POS5399 15.35644384 994.7858155 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TG(18:2_17:1_18:2)_POS4514 17.129 884.7701655 TG(18:2_17:1_22:6)_POS5092 15.59258211 932.7701655 TG(18:2_18:2_18:2)_POS4739 7.735 896.7701655 TG(18:2_18:2_18:2)_POS4742 14.81004483 896.7701655 TG(18:2_18:2_18:2)_POS4746 16.30208815 896.7701655 TG(18:2_18:2_20:4)+Na_3129POS 969.1481446 925.7255615 TG(18:2_18:2_20:4)+NH4_3130POS 969.1481446 920.7701655 TG(18:2_18:2_20:4)_POS5032 4.29716416 920.7701655 TG(18:2_18:2_21:0)_POS5078 16.23515249 942.8484155 TG(18:2_18:2_22:6)_POS5102 15.53513082 944.7701655 TG(18:2_18:2_22:6)_POS5104 16.372 944.7701655 TG(18:2_18:2_22:6)_POS5105 16.83 944.7701655 TG(18:2_18:2_23:1)_POS5264 17.04682799 968.8640655 TG(18:2_20:4_22:6)_POS5295 14.82977949 968.7701655 TG(18:2_20:4_22:6)_POS5297 15.49898916 968.7701655 TG(18:2_21:0_23:0)_POS5408 17.374 1016.957965 TG(18:2_22:6_22:6)_POS5400 15.10649604 992.7701655 TG(18:2e_16:0_18:2)_POS4431 16.85869156 858.7909005 TG(18:2e_18:0_22:4)_POS5157 17.19042575 938.8535005 TG(18:2e_18:2_22:0)_POS5140 17.50564544 942.8848005 TG(18:2e_19:0_19:1)_POS4872 17.52594477 916.8691505 TG(18:2e_19:0_23:0)_POS5316 17.52554044 974.9474005 TG(18:3_10:1_12:4)_POS3784 6.652804579 701.4751615 TG(18:3_10:2_11:4)+H_1918POS 626.82 663.4619165 TG(18:3_10:3_10:4)_POS3712 10.02120706 664.4571655 TG(18:3_11:3_22:5)_POS4202 14.682 844.6449655 TG(18:3_12:1_18:2)_POS4011 14.39383082 812.6762655 TG(18:3_12:1_22:6)_POS4271 13.55607131 860.6762655 TG(18:3_13:0_18:2)_POS4042 15.17609709 828.7075655 TG(18:3_13:0_22:6)_POS4526 14.59943988 876.7075655 TG(18:3_14:2_18:2)_POS4185 14.72726887 838.6919155 TG(18:3_17:1_18:2)_POS4516 15.6781575 882.7545155 TG(18:3_17:1_22:6)_POS5062 15.13869783 930.7545155 TG(18:3_18:2_18:2)+Na_2935POS 965.1383077 899.7099115 TG(18:3_18:2_18:2)+NH4_2934POS 965.1383077 894.7545155 TG(18:3_18:2_18:2)_POS4762 13.323 877.7279665 TG(18:3_18:2_18:2)_POS4764 15.56748336 894.7545155 TG(18:3_18:2_18:2)_POS4766 16.56493355 894.7545155 TG(18:3_18:2_18:3)+NH4_2941POS 944.0456704 892.7388655 TG(18:3_18:2_20:4)+Na_3139POS 948.0072838 923.7099115 TG(18:3_18:2_20:4)+NH4_3140POS 948.0072838 918.7545155 TG(18:3_18:2_20:5)_POS4844 14.98948584 916.7388655 TG(18:3_18:2_20:5)_POS4845 15.496 899.7123165 TG(18:3_18:2_22:5)_POS5099 15.09824809 944.7701655 TG(18:3_18:2_22:6)_POS5107 14.62012515 942.7545155 TG(18:3_18:2_22:6)_POS5108 15.10873918 942.7545155 TG(18:3_20:5_22:6)_POS5309 14.42905131 964.7388655 TG(18:3_22:5_22:5)_POS5398 14.92874817 994.7858155 TG(18:3_22:5_22:6)+H_3311POS 965.3170533 975.7436165 TG(18:3_22:6_22:6)_POS5402 14.61025669 990.7545155 TG(18:3e_10:3_10:3)_POS3743 8.072926108 652.4935505 TG(18:3e_11:3_22:5)_POS4203 14.69064091 835.6210965 TG(18:3e_13:0_19:1)_POS4178 14.60671633 835.7149965 TG(18:3e_17:1_19:1)_POS4730 15.88739402 889.7619465 TG(18:3e_18:1_22:5)_POS5234 16.03 915.7800015 TG(18:3e_18:4_19:1)+Na_2992POS 1241.921873 897.7306465 TG(18:3e_18:4_19:1)_POS4824 16.86347253 897.7306465 TG(18:3e_19:0_20:3)_POS5086 14.898 929.7932465 TG(18:3e_19:1_19:1)_POS4951 15.43763307 917.7932465 TG(18:3e_6:0_12:0)_POS3667 11.12160937 619.5296015 TG(18:3e_8:0_8:0)_POS3633 9.96112565 591.4983015 TG(18:4_15:0_22:6)_POS4786 14.63367833 902.7232155 TG(18:4_16:0_18:2)_POS4456 15.43178838 868.7388655 TG(18:4_16:0_20:5)+H_2947POS 956.691615 873.6966665 TG(18:4_17:1_18:2)_POS4519 15.4560092 880.7388655 TG(18:4_18:0_18:1)_POS4700 11.586 903.7412115 TG(18:4_18:1_18:1)_POS4736 4.229333219 901.7255615 TG(18:4_18:1_18:1)_POS4737 4.631 901.7255615 TG(18:4_18:2_18:2)_POS4773 15.2580572 892.7388655 TG(18:4_18:2_18:3)_POS4776 14.13681497 890.7232155 TG(18:4_18:2_18:3)_POS4777 14.95378087 890.7232155 TG(18:4_18:2_20:5)+H_3021POS 940.2791157 897.6966665 TG(18:4_18:2_20:5)_POS4846 14.62765446 914.7232155 TG(18:4_18:2_22:6)_POS5112 14.62847263 940.7388655 TG(18:4_18:2_24:2)_POS5344 13.961 981.7881615 TG(18:4_18:3_18:3)_POS4545 13.40747351 888.7075655 TG(18:4_18:3_18:4)_POS4548 7.644089017 891.6473115 TG(18:4_18:3_22:6)_POS5113 14.13268513 938.7232155 TG(18:4_18:4_18:4)_POS4552 7.466042436 889.6316615 TG(18:4_18:4_20:5)_POS4850 13.208 910.6919155 TG(18:4_20:5_22:6)_POS5311 13.80550052 962.7232155 TG(18:4_22:6_22:6)_POS5404 14.04297776 988.7388655 TG(18:4_6:0_14:0)_POS3723 12.85483374 676.5510655 TG(18:4_8:0_18:2)_POS3862 12.251 756.6136655 TG(18:4_9:0_10:2)_POS3701 5.919 663.4595115 TG(18:4_9:0_9:0)_POS3677 12.85828766 631.4932165 TG(19:0_18:1_18:1)_POS4791 17.26201256 918.8484155 TG(19:0_18:1_18:2)_POS4793 17.03483443 916.8327655 TG(19:0_18:1_18:2)_POS4794 17.766 916.8327655 TG(19:0_18:1_22:6)_POS5273 16.77365676 964.8327655 TG(19:1_16:0_18:1)_POS4479 16.17170627 890.8171155 TG(19:1_18:1_18:1)_POS4792 16.19497195 916.8327655 TG(19:1_18:1_18:2)+NH4_2969POS 1017.244638 914.8171155 TG(19:1_18:1_18:2)_POS4797 15.80155351 914.8171155 TG(19:1_18:1_18:2)_POS4798 16.74516527 914.8171155 TG(19:1_18:1_18:2)_POS4799 17.309 914.8171155 TG(19:1_18:1_20:5)_POS5088 15.49295519 936.8014655 TG(19:1_18:1_22:6)_POS5275 15.15432797 962.8171155 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TG(20:1_18:1_18:2)_POS4896 16.86663185 933.7881615 TG(20:1_18:1_18:2)_POS4899 17.02309049 928.8327655 TG(20:1_18:1_20:1)_POS5121 17.15405974 958.8797155 TG(20:1_18:1_22:4)_POS5332 16.99800761 980.8640655 TG(20:1_18:1_22:6)_POS5346 16.46928616 976.8327655 TG(20:1_18:1_22:6)_POS5347 17.31280982 976.8327655 TG(20:1_18:1_24:0)_POS5409 17.96859955 1016.957965 TG(20:1_18:2_22:6)_POS5360 16.15799376 974.8171155 TG(20:1_22:4_22:6)_POS5441 16.39163408 1026.848415 TG(20:1_22:5_22:6)_POS5443 16.14046999 1024.832765 TG(20:1_22:6_22:6)_POS5444 15.49676373 1022.817115 TG(20:1_22:6_22:6)_POS5445 16.03653481 1022.817115 TG(20:1_6:0_10:3)_POS3671 6.629886404 631.4932165 TG(20:2_20:2_20:2)+NH4_3285POS 984.0010514 980.8640655 TG(20:2_22:6_22:6)_POS5446 15.14033181 1020.801465 TG(20:2_22:6_22:6)_POS5447 15.61581886 1020.801465 TG(20:2e_11:2_22:5)_POS4528 13.521 867.6836965 TG(20:2e_12:3_17:1)_POS4045 14.836 795.6861015 TG(20:2e_12:4_12:4)_POS3845 2.385727674 734.5718005 TG(20:2e_18:0_20:1)_POS5129 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TG(9:0_14:1_20:4)_POS3839 13.97146746 727.5871165 TG(9:0_18:1_18:2)_POS3876 14.0010418 776.6762655 TG(9:0_18:2_18:2)_POS3878 14.40292904 774.6606155 TG(9:0_18:2_18:3)_POS3879 13.44084049 772.6449655 WE(12:0_17:3)_POS5607 6.609464349 450.4305555 WE(18:4_14:1)_POS5609 5.173 488.4462055 WE(20:0)_POS5581 3.074 330.3366555 WE(2:0_16:2)_POS5575 1.708425913 298.2740555 WE(2:0_16:3)+NH4_3422POS 92.79077122 296.2584055 WE(2:0_16:3)_POS5576 1.492851025 296.2584055 WE(2:0_16:4)_POS5577 1.619 277.2162065 WE(2:0_18:1)_POS5582 3.760742741 328.3210055 WE(2:0_20:2)+NH4_3511POS 179.5849088 354.3366555 WE(2:0_20:2)_POS5593 2.617537879 354.3366555 WE(2:0_20:3)+NH4_3525POS 136.6826069 352.3210055 WE(2:0_23:3)_POS5603 5.047 394.3679555 WE(2:0_25:3)_POS5604 5.631 422.3992555 WE(2:0_25:3)_POS5605 6.451 422.3992555 WE(2:0_26:3)_POS5606 6.006 436.4149055 WE(20:4_16:2)+H_3532POS 845.6570275 525.4666065 WE(21:0_15:2)_POS5610 17.43 533.5292065 WE(21:1)_POS5584 2.089666507 342.3366555 WE(22:0)_POS5587 1.434 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630.6183555 WE(25:1)_POS5600 4.088578721 398.3992555 WE(25:4_20:0)_POS5633 13.492 655.6387565 WE(25:6_17:3)_POS5631 17.917 603.5135565 WE(26:6_21:4)_POS5634 14.16060149 688.6027055 WE(27:2)+H_3529POS 309.3 407.3883565 WE(3:0_14:1)_POS5574 4.284 269.2475065 WE(3:0_16:3)_POS5580 3.673018575 293.2475065 WE(3:0_17:3)_POS5583 2.210142669 324.2897055 WE(3:0_19:3)_POS5594 2.199304544 352.3210055 WE(3:0_20:3)_POS5598 1.791168152 366.3366555 WE(3:0_22:2)_POS5601 2.953437599 396.3836055 WE(3:0_22:3)_POS5602 2.315427186 394.3679555 WE(3:0_26:4)+H_3530POS 200.8933225 431.3883565 WE(30:6_26:6)_POS5635 13.58647676 793.6857065 WE(30:6_26:6)_POS5636 17.95670039 793.6857065 WE(4:0_15:2)_POS5579 4.707 295.2631565 WE(5:0_14:1)_POS5578 5.953118798 297.2788065 WE(5:0_16:4)+H_3504POS 276.0802828 319.2631565 WE(5:0_16:4)_POS5585 4.26353982 319.2631565 WE(6:0_16:4)_POS5595 5.002264597 333.2788065 WE(9:0_13:0)_POS5589 5.886939302 358.3679555 ZyE(10:0)_POS5637 14.126 539.4822565 ZyE(11:0)_POS5638 14.66880065 553.4979065 ZyE(20:5)_POS5639 13.23428533 686.5870555 ZyE(24:7)_POS5641 14.15745449 738.6183555 ZyE(33:6)_POS5642 14.618 866.7748555 ZyE(34:3)_POS5644 17.5729164 886.8374555 ZyE(36:4)_POS5647 17.554 912.8531055 ZyE(37:2)_POS5648 16.766 913.8735065 METABOLITES_END #END