#METABOLOMICS WORKBENCH michaelsa93_20151119_9055591_mwtab.txt DATATRACK_ID:428 efahy_20160115_125346 STUDY_ID:ST000317 ANALYSIS_ID:AN000503 PROJECT_ID:PR000256 VERSION 1 CREATED_ON January 15, 2016, 12:53 pm #PROJECT PR:PROJECT_TITLE Role of medium in bacterial growth PR:PROJECT_SUMMARY Experiment to test how different growth mediums affect bacterial growth. The PR:PROJECT_SUMMARY supernatants of 17 strains of bacteria (10 grown in one medium and 7 grown in PR:PROJECT_SUMMARY another medium) were submitted for metabolite analysis. PR:INSTITUTE University of California, Davis PR:DEPARTMENT Genome and Biomedical Sciences Facility PR:LABORATORY WCMC Metabolomics Core PR:LAST_NAME Fiehn PR:FIRST_NAME Oliver PR:ADDRESS 1315 Genome and Biomedical Sciences Facility, 451 Health Sciences Drive, Davis, PR:ADDRESS CA 95616 PR:EMAIL ofiehn@ucdavis.edu PR:PHONE (530) 754-8258 PR:FUNDING_SOURCE U24DK097154 #STUDY ST:STUDY_TITLE Role of medium in bacterial growth ST:STUDY_SUMMARY Experiment to test how different growth mediums affect bacterial growth. The ST:STUDY_SUMMARY supernatants of 17 strains of bacteria (10 grown in one medium and 7 grown in ST:STUDY_SUMMARY another medium) were submitted for metabolite analysis. ST:INSTITUTE University of California, Davis ST:DEPARTMENT Genome and Biomedical Sciences Facility ST:LABORATORY WCMC Metabolomics Core ST:LAST_NAME Fiehn ST:FIRST_NAME Oliver ST:ADDRESS 1315 Genome and Biomedical Sciences Facility, 451 Health Sciences Drive, Davis, ST:ADDRESS CA 95616 ST:EMAIL ofiehn@ucdavis.edu ST:PHONE (530) 754-8258 ST:NUM_GROUPS 4 ST:TOTAL_SUBJECTS 38 #SUBJECT SU:SUBJECT_TYPE Cells SU:SUBJECT_SPECIES Bacteria #SUBJECT_SAMPLE_FACTORS: SUBJECT(optional)[tab]SAMPLE[tab]FACTORS(NAME:VALUE pairs separated by |)[tab]Additional sample data SUBJECT_SAMPLE_FACTORS - SA001 Media type:E Label=E1 SUBJECT_SAMPLE_FACTORS - SA002 Media type:E Label=E2 SUBJECT_SAMPLE_FACTORS - SA003 Media type:E Label=E3 SUBJECT_SAMPLE_FACTORS - SA004 Media type:E Label=E4 SUBJECT_SAMPLE_FACTORS - SA005 Media type:E Label=E5 SUBJECT_SAMPLE_FACTORS - SA006 Media type:E Label=E6 SUBJECT_SAMPLE_FACTORS - SA007 Media type:E Label=E7 SUBJECT_SAMPLE_FACTORS - SA008 Media type:E Label=E8 SUBJECT_SAMPLE_FACTORS - SA009 Media type:E Label=E9 SUBJECT_SAMPLE_FACTORS - SA010 Media type:E Label=E10 SUBJECT_SAMPLE_FACTORS - SA011 Media type:E Label=E11 SUBJECT_SAMPLE_FACTORS - SA012 Media type:A Label=A1 SUBJECT_SAMPLE_FACTORS - SA013 Media type:A Label=A2 SUBJECT_SAMPLE_FACTORS - SA014 Media type:A Label=A3 SUBJECT_SAMPLE_FACTORS - SA015 Media type:A Label=A4 SUBJECT_SAMPLE_FACTORS - SA016 Media type:A Label=A5 SUBJECT_SAMPLE_FACTORS - SA017 Media type:A Label=A6 SUBJECT_SAMPLE_FACTORS - SA018 Media type:A Label=A7 SUBJECT_SAMPLE_FACTORS - SA019 Media type:A Label=A8 #COLLECTION CO:COLLECTION_SUMMARY - CO:SAMPLE_TYPE Spent culture supernatant #TREATMENT TR:TREATMENT_SUMMARY There are 2 treatments. Each sample is a supernatant from a different bacterial TR:TREATMENT_SUMMARY strain grown in culture.There are a total of 17 strains, 10 of which are grown TR:TREATMENT_SUMMARY in one type of medium and 7 are grown in another type of medium. Supernatants TR:TREATMENT_SUMMARY from the 2 types of media are also submitted for analysis. TR:TREATMENT_PROTOCOL_FILENAME StudyDesign_NadirMahmood_072914.pdf #SAMPLEPREP SP:SAMPLEPREP_SUMMARY 1. After quenching the cells add 1 X 106 dried cells to 1.5 ml eppendorff tube. SP:SAMPLEPREP_SUMMARY 2. Place the eppendorf tube with cells on dry ice for 20 minutes or til the SP:SAMPLEPREP_SUMMARY cells are completely frozen and ice for 20 minutes, till they are completely SP:SAMPLEPREP_SUMMARY thawed. Repeat this step twice. 3. Add 1ml of extraction solvent which has been SP:SAMPLEPREP_SUMMARY pre-chilled using the ThermoElectron Neslab RTE 740 cooling bath set to -20°C. SP:SAMPLEPREP_SUMMARY to the ependorff tube with cells. 4. Repeat step 2 twice with the extraction SP:SAMPLEPREP_SUMMARY solvent. 5. Vortex the sample for 10s and shake for 5min at 4°C using the SP:SAMPLEPREP_SUMMARY Orbital Mixing Chilling/Heating plate. Centrifuge samples for 2min at 14000 rcf SP:SAMPLEPREP_SUMMARY using the centrifuge Eppendorf 5415 D. 6. Aliquot two 500µL portions of the SP:SAMPLEPREP_SUMMARY supernatant. One for analysis and one for backup. Store one aliquot in the SP:SAMPLEPREP_SUMMARY -20°C freezer as a backup. 7. Evaporate one 500µL aliquot of the sample in the SP:SAMPLEPREP_SUMMARY Labconco Centrivap cold trap concentrator to complete dryness. 8. Submit to SP:SAMPLEPREP_SUMMARY derivatization. SP:SAMPLEPREP_PROTOCOL_FILENAME SOP_Extraction_of_Cell_pellets.pdf #CHROMATOGRAPHY CH:CHROMATOGRAPHY_SUMMARY UPLC CH:CHROMATOGRAPHY_TYPE Reversed phase CH:INSTRUMENT_NAME Unspecified CH:COLUMN_NAME Waters Acquity CSH C18 (100 x 2.1mm, 1.7um) CH:COLUMN_NAME 1.7um Pre-Column CH:FLOW_GRADIENT 15% B to 99% B CH:FLOW_RATE 0.6 mL/min CH:COLUMN_TEMPERATURE 65 C CH:METHODS_FILENAME Data Dictionary Fiehn laboratory_CSH QTOF lipidomics_05-29-2014.pdf CH:SOLVENT_A 60:40 Acetonitrile:Water +10mM Ammonium Formate +10mM Formic Acid CH:SOLVENT_B 9:1 Isopropanol:Acetonitrile +10mM Ammonium Formate +10mM Formic Acid CH:COLUMN_PRESSURE 450-850 bar CH:INTERNAL_STANDARD See data dictionary CH:RETENTION_TIME See data dictionary CH:SAMPLE_INJECTION 1.67 uL CH:ANALYTICAL_TIME 13 min CH:CAPILLARY_VOLTAGE 3500 CH:TIME_PROGRAM 15 min CH:WEAK_WASH_SOLVENT_NAME Isopropanol CH:WEAK_WASH_VOLUME 5 seconds CH:STRONG_WASH_SOLVENT_NAME Isopropanol CH:TARGET_SAMPLE_TEMPERATURE Autosampler temp 4 C CH:RANDOMIZATION_ORDER Excel #ANALYSIS AN:ANALYSIS_TYPE MS AN:SOFTWARE_VERSION MassHunter AN:DATA_FORMAT .d #MS MS:MS_COMMENTS - MS:INSTRUMENT_NAME Agilent 6530 QTOF MS:INSTRUMENT_TYPE QTOF MS:MS_TYPE ESI MS:ION_MODE POSITIVE MS:CAPILLARY_VOLTAGE 3500 MS:COLLISION_GAS Nitrogen MS:DRY_GAS_FLOW 8 l/min MS:DRY_GAS_TEMP 325 MS:FRAGMENT_VOLTAGE 120 MS:FRAGMENTATION_METHOD Auto MS/MS MS:ION_SOURCE_TEMPERATURE 325 MS:ION_SPRAY_VOLTAGE 1000 MS:IONIZATION Pos MS:PRECURSOR_TYPE Intact Molecule MS:REAGENT_GAS Nitrogen MS:SOURCE_TEMPERATURE 325 C MS:DESOLVATION_GAS_FLOW 11 l/min MS:DESOLVATION_TEMPERATURE 350 C MS:NEBULIZER 35 psig MS:OCTPOLE_VOLTAGE 750 MS:RESOLUTION_SETTING Extended Dynamic Range MS:SCAN_RANGE_MOVERZ 60-1700 Da MS:SCANNING_CYCLE 2 Hz MS:SCANNING_RANGE 60-1700 Da MS:SKIMMER_VOLTAGE 65 #MS_METABOLITE_DATA MS_METABOLITE_DATA:UNITS Peak height MS_METABOLITE_DATA_START Samples SA001 SA002 SA003 SA004 SA005 SA006 SA007 SA008 SA009 SA010 SA011 SA012 SA013 SA014 SA015 SA016 SA017 SA018 SA019 Factors Media type:E Media type:E Media type:E Media type:E Media type:E Media type:E Media type:E Media type:E Media type:E Media type:E Media type:E Media type:A Media type:A Media type:A Media type:A Media type:A Media type:A Media type:A Media type:A Acylcarnitine C16:0 173221 213742 14065 143452 261635 228986 77537 68621 90560 7712 317126 3021 4917 4746 4877 4264 3383 3888 3181 Acylcarnitine C18:0 411190 391565 56875 264359 498085 411083 370879 113147 90474 62760 530353 Acylcarnitine C18:1 189374 146135 8680 197113 178697 128292 27666 23234 16640 207585 Ceramide (d18:1/23:0) 18775 22740 19962 20905 24599 20336 10738 21672 19135 34802 Ceramide (d40:1) 13855 15657 15169 15204 15313 19811 14867 14715 27442 Ceramide (d42:1) 21356 25662 23643 22265 24085 29338 24905 7076 25763 22710 42765 DG (34:1) 35014 106823 27064 37675 35606 34760 30010 34845 44441 61877 68499 79711 27184 2189 74602 8025 DG (34:2) 11315 24920 11193 9835 20177 14496 14368 10915 17043 9753 26309 18895 13598 5986 2349 DG (36:2) 17907 27225 14517 19622 20104 17932 16527 17027 22490 19712 42033 73636 8748 17123 2854 LPC (16:0) 48178 60062 47520 547433 85104 21998 33551 17637 29375 19615 717481 LPC (16:1) 4398 7555 3243 47670 8482 3108 2560 2487 2600 48821 2258 3234 2245 3811 2056 LPC (18:0) 20214 16406 20592 88479 38398 9650 15203 7833 11081 7377 133613 2238 2486 3165 LPC (18:1) 159981 177978 148773 1631565 263456 61161 105497 51774 68579 47671 223637 2859 11705 3120 2062 LPC (22:6) 2120 3186 16219 2827 3208 3551 2913 3274 28417 2598 2856 2364 LPC (o-16:0) 78704 94772 89256 75833 77273 72043 62733 43255 106825 LPC (p-18:0) or LPC (o-18:1) 12680 10067 11908 10558 11915 11192 7616 15068 PC (32:0) 117005 45268 122125 110347 116266 142436 101114 102454 139125 111405 193045 2179 2336 2367 2639 2793 2174 2284 2059 PC (32:1) 564425 756464 564164 730007 3068 829434 547488 591376 674207 561001 4508 3820 2093 PC (32:2) 31673 40674 31940 35337 36393 35206 27592 30203 35641 22461 50191 PC (33:1) 324941 415588 325368 356274 299971 424637 296300 306339 355420 358147 410012 7875 13399 PC (34:1) 4328712 4583381 4340607 4679617 4105516 5508801 4051569 4008551 4723024 4494139 5526717 2081 5784 6751 2763 2185 2537 PC (34:2) 5589905 6042780 5646410 5486605 6897010 6249344 5418206 4928736 6819141 5241242 8841831 4881 6094 17058 5538 4719 2542 2009 PC (34:3) 493774 609579 433840 498691 495157 532273 409806 394695 522025 512351 612247 3325 3344 2121 2033 2252 2109 3107 3031 PC (35:2) 215472 257955 211438 217691 265234 258097 198952 177314 276776 222142 387326 5958 3402 3030 2740 6769 2823 2747 2471 PC (35:3) 45224 66712 48638 59003 62118 47275 52198 67344 PC (36:1) 986267 1001648 978050 990566 885896 1255210 815775 791867 1028216 922651 1667912 7065 8229 8271 8234 8223 8195 8049 8099 PC (36:2) 1438162 1490216 1428143 1332486 1645229 1641350 1285235 1145065 1754160 1291990 2592524 2700 4057 10989 3206 2914 2117 PC (36:4) 593057 723244 584022 602692 707914 743777 544431 1059942 4267 PC (37:2) 5741 6262 5661 6229 5727 6871 7488 4804 6291 5801 8549 11469 2171 15491 PC (38:2) 15931 16937 16371 13498 15933 18934 17604 14888 PC (38:3) 47524 52098 45130 42835 47227 53278 38788 36584 86295 PC (38:4) 124603 119376 121038 105981 134767 131697 107959 105383 144146 110249 216858 13771 14528 14059 17761 13672 15124 14051 14869 PC (38:5) 230535 290912 238592 233058 236693 290626 214395 213807 273777 227481 318773 7885 7208 7159 7390 6706 6528 6299 5822 PC (40:4) 6782 7214 6655 6758 6073 5831 8020 13382 PC (40:5) 28584 29926 25760 26040 32780 24457 27340 40605 PC (40:6) 16735 14226 14009 15691 13508 14150 14389 13794 14325 PC (o-32:0) 14713 12661 12369 12249 14289 11025 10175 14285 PC (p-32:0) or PC (o-32:1) 31484 128013 30461 29137 33894 37441 31791 26932 40776 58536 55800 3361 3560 3482 5199 3143 3257 2970 3315 PC (p-34:1) or PC (o-34:2) 1252097 1504534 1360093 1210190 1717111 1180047 1077088 1832503 PC (p-38:2) or PC (o-38:3) 15765 16598 15048 15688 16790 18904 12676 18053 15293 28630 PC (p-40:5) or PC (o-40:6) 28436 33979 28179 28903 32064 36861 25928 23357 34493 9198 51232 2491 90986 PC (p-40:6) or PC (o-40:7) 25963 31469 25886 28147 24698 23520 29365 27539 32780 PE (36:1) 45235 56132 49417 47955 45958 68203 43257 41395 55867 77540 82617 2011 4501 4421 2198 PE (p-36:2) or PE (o-36:3) 106886 126533 119376 105516 122487 145946 82711 130935 116286 238598 PE (p-38:4) or PE (o-38:5) 101284 147588 104719 95756 130148 133476 97108 81212 146312 142593 241306 3766 3500 3542 3620 3613 4040 3744 3649 SM (d32:1) 18196 16319 17137 18603 14928 15955 17653 11900 27910 SM (d33:1) 27381 32172 25973 29098 26335 28943 23834 22926 28278 21776 44613 SM (d34:1) 552672 643038 557198 551704 549637 622686 497353 550283 607714 509895 904209 3011 6035 4938 2455 2115 SM (d34:2) 20966 22122 18725 19395 21940 16881 18294 21448 12903 31139 SM (d36:1) 1049688 1127016 1055562 1291908 998916 928443 1270176 1648683 SM (d40:1) 107553 111961 112486 105415 134464 98268 93339 121553 190188 SM (d40:2) 21365 23003 21188 20458 20911 24837 17045 23961 19797 37293 SM (d41:1) 77421 83120 83101 85367 79926 106275 76018 93910 73448 143825 SM (d42:1) 114162 134395 122189 115159 116207 147668 104733 194657 SM (d42:2) 59119 57807 58605 56301 72410 51249 49623 65546 TG (42:1) 29067 43798 23455 14941 38518 26437 30429 32282 34791 26350 45341 TG (44:1) 132936 232178 95362 62516 134994 144624 126933 104675 161046 TG (44:2) 37366 57041 27687 40247 15391 38348 41630 37684 33982 50786 TG (46:0) 252434 298606 219935 273588 261446 233503 220377 300655 264326 224894 322267 11337 5965 4660 4952 4646 6362 4204 3955 TG (46:1) 808947 1012618 555466 849046 847634 605995 651314 855438 704164 645437 868882 5886 8198 5379 6049 4398 7576 5390 4405 TG (46:2) 238773 436938 164814 161848 242076 250158 196845 203691 262728 TG (46:3) 8757 16396 6915 6647 10645 9120 8659 7898 13137 TG (48:0) 276739 290668 340217 283469 500653 289549 7838 325876 288471 269661 360668 27364 25643 27704 23022 22772 25008 31088 22908 TG (48:1) 2960157 3172296 2274984 3111459 3150458 2445989 2590810 3201940 2814140 2414180 3165480 7276 9667 6529 8196 5942 10594 6264 6032 TG (48:2) 1938685 2582186 1354789 2133735 2061005 1403779 1734934 2154745 1745311 1672443 2075447 4694 6107 4245 4665 4149 5626 4177 TG (48:3) 246365 92382 94267 138752 143528 113466 117715 148208 TG (49:0) 113464 127019 100273 114368 123278 101104 89505 126406 119639 103565 142100 8812 5878 2786 3123 3078 3527 3136 2539 TG (49:1) 734517 860974 561451 711464 780543 582582 654312 823954 711218 615969 817049 2590 2886 2077 2377 2753 TG (49:2) 338372 561649 235267 366297 410406 239939 304264 382288 316222 312613 362499 2400 2008 TG (49:3) 45564 14516 23056 13705 19862 18415 18194 23562 TG (50:0) 297410 333505 323339 296461 266681 333835 248759 350753 303683 299409 396447 42420 38293 48268 39416 40725 41341 56805 41389 TG (50:1) 3716672 4089687 3337210 4121238 4153098 3525048 46413 4097914 3852678 3503104 4142404 12067 12810 8664 19128 10262 18374 10088 9051 TG (50:2) 4712361 5560641 3929888 5367548 5300880 4067474 4571224 5425562 4737269 4389231 5129958 7886 9932 6432 11964 7245 10014 6436 5970 TG (50:3) 774659 1166761 610647 935243 598920 778030 905767 757014 890936 TG (50:4) 35776 111806 72352 46051 60925 68560 54197 49245 68607 TG (51:2) 1610141 2106730 1207304 241185 250978 1238109 1524503 1891530 1655449 1412656 1721803 2514 2434 2725 2501 2329 2676 3314 2315 TG (51:3) 118737 252115 89998 139983 171207 84164 122015 144478 130194 121471 140086 TG (51:4) 12057 20892 12769 8734 10523 14824 11061 9856 12998 TG (52:0) 298199 370680 323337 325186 303695 342896 272996 378159 330622 304244 455194 41330 18728 23357 17838 19524 21695 27380 18707 TG (52:1) 4687745 5475503 4214475 5352965 5710161 4408421 4656527 5479114 5280476 4374089 5359893 8224 9460 6809 15593 7564 13804 7610 5810 TG (52:2) 9787357 11041749 8744837 10984004 11046641 8970283 255429 10834365 10383003 9423481 10179724 47200 30081 41557 72231 37602 48758 43684 41256 TG (52:3) 2917767 3736891 2526332 3409799 4063865 2545528 3163808 3584423 3388623 2799980 3397987 11021 10340 7034 27661 9831 15163 8287 6913 TG (52:4) 398711 674424 335579 482785 585862 321401 414573 509822 453287 361135 485473 6028 5026 2091 11096 2669 6955 2289 2022 TG (52:5) 13287 33527 17652 11857 15333 14696 12719 17591 TG (53:1) 98021 120602 78967 118666 150380 88160 100010 120005 120861 87987 124064 2070 2989 TG (53:3) 417228 568579 320170 572771 321226 445998 531850 468547 381951 482626 TG (53:4) 29722 61839 35531 44837 22410 31026 38432 31720 28436 35869 TG (54:1) 2318298 2950118 1989684 2866883 3246939 2137115 2373978 3003241 2774865 2198358 2913666 3379 4196 3073 6118 3322 5599 3402 2862 TG (54:2) 4723846 5420015 4100383 5208286 5534448 4148653 1505369 5476916 5028705 4332228 5224499 5254 5557 2396 24782 3004 14117 4935 TG (54:3) 2304706 2804273 2145459 2545943 2756791 2072541 235442 2686198 2530173 2274054 2580633 9445 8804 6331 69282 8116 34948 8963 6312 TG (54:4) 551598 713272 484055 614903 794200 461314 602033 682062 616034 504599 654685 4210 3520 2577 18903 3169 8962 2698 2449 TG (54:5) 65881 118609 55255 80769 97073 49397 67883 86008 71062 59610 83958 3997 2338 6405 3739 2040 TG (56:1) 46582 56679 36396 57535 66992 43601 45321 63133 60556 45311 65151 2149 2366 2376 3135 3202 2087 2110 TG (56:6) 14445 24092 20688 19338 14601 14741 21870 16240 13545 21665 TG (58:2) 11403 13032 8375 12495 14708 9766 11229 14302 12933 10245 13914 CSH_posESI #017 52596 63976 43546 58820 42477 48551 59755 52264 59670 CSH_posESI #042 2012 2251 2217 2100 2137 2184 2286 2099 2176 2112 2026 2034 CSH_posESI #098 25982 17360 16763 17375 15776 19877 18574 17954 19894 CSH_posESI #103 665448 824221 624582 649072 833598 180039 627176 544992 838072 677636 1215252 53903 27243 59251 4002 CSH_posESI #116 74996 69372 82031 82805 70324 81975 73977 122280 CSH_posESI #134 34154 23774 28563 26263 26969 30939 27143 28198 CSH_posESI #170 29611 18671 22026 22960 22007 23003 22892 21753 23651 CSH_posESI #211 25395 16790 20455 32244 23940 21346 21342 24139 23358 19702 22181 CSH_posESI #215 151343 222702 91084 149985 167996 95701 121167 156324 147930 116461 160598 2914 3038 2008 CSH_posESI #230 26113 38067 29396 36803 35708 33532 35198 35379 31720 CSH_posESI #261 68756 84572 69344 62458 113818 90398 59969 50415 114217 57596 222553 2070 CSH_posESI #270 232618 160108 216280 204197 244709 141976 186932 273923 174778 400581 CSH_posESI #275 57148 99757 66738 91926 87870 103627 61955 78577 119056 74802 174645 4782 16074 3646 CSH_posESI #285 11681 8342 11108 14985 10652 9826 15185 23412 CSH_posESI #286 15771 15521 15304 22535 19343 11390 13589 21237 14083 28267 CSH_posESI #288 28598 199616 35570 35407 29757 36810 24261 37025 34932 41429 12014 260882 122012 5259 109222 4206 16501 CSH_posESI #296 42953 57479 45840 41202 60068 51417 40995 33809 61369 44231 107801 141283 30505 13227 4242 CSH_posESI #298 69300 82088 78360 59048 78304 71749 68009 74511 CSH_posESI #304 47708 44659 46249 41413 52094 43290 43420 50665 0.50_114.07 745830 938710 889592 884884 891580 661635 872303 935271 0.51_162.11 57454 28442 32069 29831 28675 99290 25562 39648 0.52_146.09 99823 136967 158665 159970 140109 156265 73132 134841 150146 0.52_283.14 3207 13221 3120 11463 2955 2646 42739 44269 9960 10033 49097 10598 41446 42357 0.52_737.29 3760 2312 2077 4924 2139 2017 714441 638353 575205 678457 678493 0.52_205.10 150053 166241 173984 174075 178613 140046 153829 194500 7974 0.53_152.02 117594 154342 77235 100543 67541 78935 74898 76081 212576 106340 95466 13179 16294 12373 18885 17975 0.53_104.11 218530 12252 5337 24787 5039 6453 7033 4635 12753 5609 5936 124368 148632 9544 6692 85337 9365 136078 120709 0.53_480.21 3136 5523 5656 4726 5669 5541 6042 5156 5412 6050 37192 35927 20663 35946 39729 0.53_242.15 75328 92944 83735 82211 78641 87144 70473 87210 88637 0.53_521.17 2022 3476 2284 3150 4074 2257 208582 184176 163316 204189 218890 0.54_283.07 22593 309915 133598 9244 189266 140989 168492 303609 227624 134140 824949 771885 8835 9123 542778 7705 780067 805576 0.54_748.29 12220 4649 3820 22147 3617 3333 3516 5255 4272 3373 9003 7367 6782 8459 10310 0.54_627.35 63070 73910 89425 81592 91911 80116 52280 87797 81509 0.55_261.12 206951 245928 222373 219105 218957 238365 187843 223850 214937 0.56_132.10 335630 949365 889512 353793 908931 906678 34108 909300 832335 933863 1026404 60217 69319 142298 137735 88045 167392 71303 68640 0.56_156.04 112778 99508 34774 126516 32966 32675 46657 34817 179888 57591 49636 2567 11218 7923 12153 2140 0.56_665.31 66603 67510 78460 71237 96125 72008 46493 86426 79668 0.56_715.31 3667 4326 5599 4791 4658 6089 3462 4012 4301 86352 88247 26665 93124 104347 0.56_166.09 122072 406761 419630 122542 442019 424297 15589 449116 399986 459801 481084 7433 12287 23498 19029 20664 38751 11840 8982 0.56_197.13 114110 127632 119394 121064 120114 121814 110772 119017 122733 0.57_86.10 56229 160495 148496 61574 161386 151044 6096 155585 141958 159408 176421 11855 14100 25507 23220 16107 28921 13616 12888 0.57_927.44_0.56_949.42 8062 210847 107892 8030 182835 170536 247048 160567 164584 228467 175902 0.57_261.09 26039 58519 61471 75312 47660 1861409 1695916 38309 41976 1785549 39464 1837333 1881607 0.57_342.18 34548 150577 146770 18181 140368 126573 128688 143886 125955 134824 132826 6035 7897 3685 2235 6405 5828 0.57_911.46 250120 301198 479522 423728 466410 465077 109313 424828 402090 0.58_485.36 2404 4489 8165 2156 3751 28113 4361 2922 2891 3789 3139 3064 20659 10232 9058 13377 3284 0.58_759.27 8534 3351 3006 2481 2369 2738 3120 2374 2656 181925 170103 128511 183018 204525 0.58_477.21_0.57_499.20 13120 19606 7912 16088 14540 14127 2074 16110 16093 16674 15555 2879688 2798466 1755402 2751986 3091533 0.58_241.11 30010 9020 4513 3768 7368 2850 11276 8490 4821 3506 185528 184706 4522 4514 143835 4826 196125 198320 0.58_468.21 71992 87530 68853 63925 77398 85798 63249 73685 72263 0.58_114.09 4304 4037 78945 131194 5564 41259 2134 3236 0.63_649.32 6846 61057 113897 8759 115892 112187 110583 122730 33424 93876 120389 2783 7898 10515 10474 0.63_703.27 11597 25004 15793 9995 12879 13049 17120 16343 29197 15006 15636 7286 8086 3164 7448 7486 0.63_371.17 9919 5624 71002 5560 6454 5881 4684 5051 5717 2279 23080 3774 4189 2793 4724 20729 0.64_152.07 2036 9898 19864 2167 12043 9295 11155 7735 26854 11252 6625 5328 121541 80712 17635 77651 4855 4438 0.65_276.14 8947 41173 50214 8890 45107 46279 45081 49682 38661 48569 48742 2563 4303 5058 5398 4013 5639 3275 0.65_687.28 5338 23622 25940 7113 20038 20932 19405 25226 28652 18263 22045 10295 9264 7500 4996 8737 3613 5667 8260 0.66_505.29 6151 15882 12348 5833 15912 12259 17138 13876 10374 17317 12941 3590 4199 2572 2684 2973 3090 2815 2076 0.66_171.08 2749 2759 2280 3457 2584 3115 2248 2919 4209 3673 76255 59048 13172 50910 3188 3730 0.66_581.29 2555 5386 6850 3392 9516 6456 7231 3982 7330 6825 49446 18929 7497 65252 35193 15200 0.68_636.33 4834 21885 20815 8651 20515 17304 25647 17447 16538 23678 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15364 10776 7994 7710 8040 9430 3.66_1279.57 178288 15647 12667 365400 12887 13367 14204 13636 19204 13391 14309 23658 22792 13076 12486 14765 12753 25262 25808 3.66_734.37 49943 15090 12033 84299 12323 11464 13794 12911 14838 12559 15547 2024 2347 2008 3.67_659.27 159029 14291 14694 280678 13478 16097 13366 15093 19440 14359 14690 27096 27072 16379 15360 18313 15860 28300 30105 3.75_724.32 2938 2482 2869 2656 3255 7517 8543 10235 4786 2311 2906 3.75_774.56 18315 11444 15843 16288 14855 20226 8223 11482 16897 6795 24516 2397 3.76_675.68_3.76_697.66 10251 225508 31355 32830 294603 18632 505885 50660 21936 47439 93262 110945 29754 8202 30084 59812 172325 104713 39273 3.76_338.34 51030 379369 97869 101123 451755 68568 623600 123964 80497 120643 197850 223798 90740 44804 90743 138183 300341 202675 100768 3.98_587.51 2403 8112 2235 16232 27462 4785 6598 13267 5312 17299 2143 11938 13196 13968 9617 4.05_547.52 2368 9694 2704 6107 23033 6638 6913 14415 5687 3566 7117 2785 13874 18566 8119 4.44_711.54 3254 4479 2013 5268 5096 2407 4426 2380 2180 3384 2047 4.46_333.33 12067 20751 15135 11784 17829 13543 15152 17165 15175 13089 19211 4.50_549.49 63310 2066 2602 12594 36583 37530 18460 2349 7368 4.56_550.48 24325 2783 89191 2016 5200 14173 14375 7165 2842 4.58_661.48 8427 68329 7441 5662 9273 7054 9215 8287 7227 66504 8075 7615 7755 5191 5646 5377 5158 5805 5357 4.58_679.49 2670 23641 3213 4865 94757 3187 5535 3056 6516 55596 3027 3211 3336 3469 3279 3158 2710 2803 2667 4.59_575.49 5568 25386 5477 4301 7226 5858 6273 5220 6538 6679 6395 29207 51815 3261 2932 4501 3183 3460 3107 4.61_576.49 3166 10239 3227 2712 3241 2959 25328 2489 3447 3682 3296 12451 20755 2506 4.62_1116.83 2012 3260 2309 2057 2208 2061 2313 2021 2018 2098 2074 2098 2227 4.63_738.54 11073 22878 9528 11074 13660 11624 10024 8295 11018 9849 15244 9330 10271 5255 2129 4.64_625.52 15031 27948 15215 15333 16653 19558 14418 14783 19184 15295 21431 4.71_769.55 2975 5093 2505 2954 3226 2823 2546 2198 3259 2947 4442 5786 9632 4.73_739.55 6432 9465 4921 6204 6912 5400 5435 4162 5792 7324 8156 17247 4.78_715.55 12616 25973 11841 13834 34113 14271 13609 9746 14865 13447 20598 2062 4.80_714.54 26953 59799 25145 30131 34114 29072 27968 21756 31036 27086 49098 7312 4.83_731.54 19106 17625 8897 27956 28437 28034 12763 9209 32650 26287 23729 8211 4.86_725.56 52969 58726 48545 57315 49623 25948 40997 45013 82372 4.87_764.55 447959 547435 455070 523817 501591 561986 423054 480009 542862 452322 594741 4510 15953 4.87_790.58 52408 76315 58242 68133 67195 74921 50825 59569 78347 55390 84521 4101 4241 4338 4231 3529 3492 3630 3404 4.90_786.54 65761 45485 55621 75474 73200 38265 55024 63314 80837 4.95_729.58 182490 296916 251919 274455 313486 206835 235375 331207 4.96_751.56 23065 17083 22302 25967 23900 25016 11849 18120 25120 13643 36268 3624 2473 4.98_754.56 65525 57295 47521 80502 46377 68752 40233 51517 57273 41123 70276 2037 4.99_909.55 20300 23758 22357 24638 24747 25839 19874 22039 28459 21096 39116 50153 15328 8271 6768 4.99_910.56 11003 12238 11692 13652 14731 14257 10928 11776 15808 10869 20111 15626 5465 2777 2437 4.99_771.55 20667 32060 24189 28729 28092 30913 22391 24143 31415 20534 40849 42548 22207 19053 3316 5.00_794.57 9318 12316 9761 12555 10651 12603 5741 9935 13332 5171 16318 6948 2342 7891 5.00_913.58 7668 13865 8528 8911 8283 10946 7379 7250 10353 8899 13389 29331 11268 8954 4166 5.00_926.58 12111 17842 15545 12697 16017 13873 16207 13874 15067 5.05_551.50 81605 4142 3465 4774 18728 11630 3334 2135 20382 4649 5.06_804.55 67924 64080 55859 76342 73721 51445 49265 77394 53158 112533 5.06_904.59 29963 52370 37159 49612 54733 31920 41670 62846 41794 94752 18302 3536 5.08_830.57 31928 30729 29813 33330 35724 27602 26809 31491 27676 36420 5.08_778.57 22328 27968 23375 22369 23697 27863 22202 20246 25709 21982 28434 2043 4506 2059 5.11_940.61 70365 5121 5772 6803 7391 4513 10458 7569 4074 3488 3310 3512 2647 2585 5.13_952.60 69705 69844 66370 74746 73721 69978 66500 74615 73906 5.15_1498.13 16226 14199 17218 13213 15900 15259 10443 15431 17189 12557 16670 4021 5.18_792.58 21698 28328 19974 24254 20913 26435 337373 324433 26832 22895 31199 44610 11082 63746 5.18_1524.13 3541 4690 3544 2942 4116 3865 2094 2970 4009 2876 5157 3656 5.23_820.54 6300 3787 11881 3767 3523 2580 4357 2897 3013 5.24_749.54 7997 26489 8087 9173 7918 10888 8071 7977 8864 9146 10650 29512 14308 12684 2390 5.25_586.44 2780 3534 4138 2304 22471 21110 26343 2870 21724 3525 18641 25729 27934 28319 32289 3920 3856 22180 2343 5.25_776.56 4256 6807 4420 6632 4589 4408 4501 4230 5067 5214 12407 11630 3252 5.26_889.58 10582 8622 8167 10363 9756 8201 7308 11150 8048 5.27_775.56 5797 4080 8676 6457 11924 6202 3038 11757 11034 22721 6043 2800 5.29_775.58 5797 16058 8676 6457 9701 11924 6202 3038 11757 11034 22721 6043 2800 5.34_960.60 15328 13801 14923 17722 15819 14239 18843 14481 21075 5.34_814.57 50860 44284 42327 56752 54373 37365 40485 58676 48696 76658 5.35_986.62 10613 10768 9809 11146 11437 9978 9648 11290 11029 11681 5.46_629.55 26846 31964 29506 29492 28184 36219 25636 23821 33927 26921 42193 5.46_655.56 13015 12015 11137 15450 11266 9858 14503 10845 20502 5.47_851.57 22236 2652 2258 2788 3468 3195 3536 10271 64462 3512 2322 5.48_592.53_5.48_570.54 2153 2459 2112 29356 35800 527333 2277 4510 8719 9271 2525 2181 4328 4574 5.50_936.61 71989 67702 65862 81006 72363 72922 64326 58401 72096 66224 81489 163276 80503 13968 101369 5016 14406 5.51_936.65 71989 53556 65862 18648 72363 72922 56528 71642 59179 81209 163276 80503 13968 101369 5016 14406 5.52_865.58 21727 21105 23227 26370 19760 18619 25042 29809 4033 5.52_1212.82 5146 333187 5605 4968 5630 4592 6768 5264 4702 4972 297835 6741 6654 6664 6712 6531 6448 6094 5796 5.56_1510.14 13651 9909 13701 14699 3456 4298 11943 10446 17267 8626 31291 2501 2892 2692 2727 2386 2544 2505 2427 5.56_962.62 13837 12222 12567 12926 14454 12906 12527 11950 14159 11218 15632 107623 24846 3254 13086 2492 2928 5.58_605.55 183545 192180 190260 192388 173644 229557 9480 158542 203611 175534 249601 13005 2751 6839 5.58_938.62 31458 30755 31811 35954 30615 33184 18132 26432 34095 27125 35521 29023 13458 2741 17514 2734 5.59_717.58 9844 262520 12074 9515 12119 9502 5239 9624 14095 66243 10933 7898 7069 10952 15109 16613 7154 6446 13053 5.59_754.57 74386 55491 78783 82181 82193 93088 6854 62280 7723 49421 111293 6538 6467 7329 6705 6334 6312 5879 5951 5.60_954.61 67596 62612 74089 58067 73079 60719 66914 64869 5.61_790.56 55924 45168 31305 34975 65610 61774 26733 27353 35868 38136 83212 3878 3814 3573 3409 3083 3379 3966 3691 5.61_962.66 13837 12222 11976 12926 14454 12906 3106 10475 14159 11218 15632 107623 24846 3254 13086 2492 2928 5.62_812.57 17858 20472 7658 8505 47227 18683 38788 6839 20895 15718 11027 2490 2466 2052 2766 2097 2004 5.63_1520.16 26612 25811 30915 22723 46185 20922 27311 51295 5.65_794.59 100519 111491 108199 101732 138125 192145 149882 73061 184254 90464 183848 5989 3693 3526 3128 23616 3476 3020 3704 5.65_1511.12 163061 179096 168507 161341 153096 189157 152720 155315 170331 151144 189167 2070 2410 2328 2231 5.66_631.56 5565 5928 5676 5657 6066 7189 3477 5087 6865 6034 9824 5573 5.69_788.56 122777 116093 102881 125071 145567 109080 101610 80312 142795 120573 198721 3554 3566 3798 3591 3762 3785 3511 3504 5.71_967.62 45497 10713 2148 2184 6636 2475 2465 2365 5.74_538.52 10690 13142 12132 10378 10884 12615 12160 11098 10387 16263 5.79_792.59 372667 462946 370605 372198 21700 22150 337373 324433 423398 409518 531855 8929 8918 8890 9269 8831 8463 8278 8606 5.85_564.53 5324 7697 6036 5983 6309 7860 5912 5374 7454 10758 5.92_808.58 185804 127188 174672 190306 212236 201181 4140 142364 220166 105877 340261 3544 3872 3392 3459 3801 3354 3379 3538 5.93_724.53 94722 4773 101548 89754 4645 118732 87892 81176 114550 94876 163010 4153 5019 5578 5454 5758 5048 5061 3329 5.97_787.57 160463 99265 343220 228316 577655 343518 6613 121644 249947 155693 668354 6423 5913 5702 5999 5616 5879 5746 5590 5.98_742.56 3231040 3608094 3226541 137182 148482 3716791 3089570 2702113 3901434 3181060 5240302 146191 122534 129335 165721 94331 112114 152772 135059 5.99_452.36 17188 23245 19820 16771 15208 16750 16501 26039 15949 14606 16515 6.00_766.57 182296 167135 181544 218833 165173 245822 5072 136934 197693 158201 270186 2712 3616 2481 2642 2950 2839 2567 2565 6.00_1484.13 58100 33040 57410 60010 11515 10217 46383 37451 75402 27977 146864 12297 9418 11289 15641 7068 8336 13750 12100 6.01_795.59 48560 56787 46834 47133 62299 56117 9269 37235 65399 44277 111443 3161 3164 3169 2962 3036 2859 3630 3486 6.02_794.59 100519 111491 94471 35008 126598 115451 92678 73061 133829 90464 227794 5544 5613 5503 4276 5362 4733 6183 6479 6.02_774.58 159322 181161 162480 164769 153579 212384 27366 130988 181849 158528 246006 23289 16431 16154 15806 48906 15160 15896 14833 6.03_796.61 38333 42215 36791 41426 41727 48649 26788 22535 45592 34136 71045 3539 3651 3495 3464 3614 3444 3551 3571 6.03_764.55 234677 194233 215646 19941 21492 272096 3349 180715 266301 178978 399631 23330 21657 22799 26099 17509 20770 23866 22808 6.04_1356.01 48875 2468 2013 10102 24485 91102 2330 2191 2407 6.06_694.50 7934 33070 8337 7684 8054 7797 7584 89319 15190 295379 7545 8945 9144 9178 9111 9235 9985 8494 8833 6.08_746.58 345581 399623 360389 410892 327502 483720 43257 292670 385185 349856 530591 11797 11091 10478 10145 9022 9393 9911 8886 6.08_746.59 345581 399623 360389 410892 327502 483720 43257 292670 385185 349856 530591 11797 11091 10478 10145 9022 9393 9911 8886 6.08_768.57 24675 9674 21852 26292 23942 534537 7984 22234 576807 471956 784310 2911 3676 3170 3200 6602 2780 5509 6022 6.08_695.57 165776 2236 2790 3125 4081 24348 65091 220048 2069 4166 3916 3999 3906 4642 3596 4399 3822 6.14_778.56 32088 46681 36218 33997 35458 44810 31220 27695 41781 47723 60419 5203 5123 5417 5082 5212 5078 5202 5197 6.14_702.54 27881 30629 30880 27389 37933 26850 25449 34498 45368 6.32_982.65 12786 15625 11685 12975 10887 9957 14639 14771 24337 6.33_709.54 2227 266174 4459 2615 4154 3279 3859 4104 8114 2598 2461 5788 6284 6381 5433 6122 5153 5723 6.42_589.50 20105 15933 23681 19816 24999 31139 23164 20181 27790 19880 37999 23650 9708 19405 3633 6.44_548.54 17886 22875 20510 18793 20113 26040 19957 17616 23433 25770 6.46_588.53 49792 36652 62451 48186 65509 78836 59063 52710 67727 49278 97928 2444 2495 2244 2232 2292 2106 6.82_730.57 21109 22837 22152 20518 29128 19210 17441 24615 38017 6.86_809.65 9232 7885 6846 12221 7196 10073 6506 6505 9418 7.01_1186.02 3039 9743 2279 3093 2828 2894 3122 4079 7721 5876 3685 6077 7.05_633.49 10599 6267 4274 16423 5168 5512 5071 6401 6667 7291 8577 4831 8118 2210 7.05_1212.03 4692 14610 3369 5727 4945 4840 4866 6360 8529 11642 11334 3125 12139 7.53_837.68 8482 8432 11261 7442 10227 6827 6424 8849 14696 7.62_889.66 3166 11086 7011 5729 7577 2312 7036 5974 8.75_843.70 9965 4798 9713 7499 6416 6498 7024 6041 14016 9.15_599.50 11452 16828 10491 10375 20228 17328 14781 6488 17769 11599 55253 9.16_1471.96 11067 12085 9964 14216 14577 6015 15398 10281 35079 9.16_1449.98 28254 48688 28407 56368 48020 39657 49249 30343 167283 9.25_866.78_9.26_871.74 37839 52758 23008 27771 33088 31170 35455 25334 69100 9.46_847.69 2629 4098 2257 2979 3549 2439 434305 3001 2515 2456 3049 2311 9.69_1573.34 12744 17151 7229 8010 10435 12915 9431 9967 12859 9.73_839.65 12267 10602 11595 10293 13887 11975 12498 13435 9.75_767.70 45938 91832 29999 52731 57778 32267 3787 50041 42822 35717 57086 6548 6405 7011 6850 6767 6739 5644 5580 9.79_1469.30 3471 5106 3463 3638 4229 3398 3032 3543 2705 3504 2897 2952 3183 3469 3311 2745 2581 2542 9.83_1454.01 3270 13712 4324 3682 5628 6013 7009 3567 5063 4310 2182 9.88_780.71 21093 40754 15442 21435 23564 15948 21821 24822 16687 23737 4017 3440 3443 3254 3284 3419 3273 2875 9.92_875.72 13080 18789 5347 15706 16926 11115 13547 29777 13992 11613 15851 2227 9.93_827.65 8006 6602 12922 8698 7287 6733 8798 7019 8084 9.93_811.68_9.93_806.72 129690 70020 30086 47140 62940 69401 62697 59997 75250 9.99_927.80 11712 15139 11577 9362 9964 10693 10860 8341 20840 10.07_815.65 28279 17129 31932 20490 20124 19000 22576 21045 19101 22152 10.12_768.71 77319 103000 56379 80582 83050 60940 62469 86873 76694 62872 98530 6777 5058 3567 4211 3474 5685 3605 3143 10.15_521.46 15884 21205 9916 17058 11021 13806 17297 13849 17024 10.16_1629.40 64844 76620 48442 66399 50831 59443 57688 69169 10.16_997.74 19524 30934 13951 14487 16803 19176 17070 19885 10.26_924.79 7718 24092 7779 7095 19338 6673 5847 21870 8060 6987 7128 2486 2321 2383 2729 2245 2229 2352 2504 10.27_917.82 10107 13206 9108 9565 10730 8934 82538 11126 9254 8378 10047 7653 5182 5613 6999 4958 5208 5632 4643 10.29_954.85 13480 18573 9769 13591 15868 9938 12273 13493 12884 13134 10.29_914.81 29501 42920 25254 33965 40337 23521 29546 34622 32214 26165 33604 10.30_577.52 6623 51225 4482 7550 7168 5164 131997 7359 6501 7713 75145 4459 4174 10.32_1669.43 9831 11335 9447 11247 7624 8594 9808 9317 7903 10398 10.33_940.82 7435 6830 8599 6520 7630 9210 7864 8785 10.36_829.67 11131 6694 6685 11129 7348 8008 7162 8119 7163 7879 10.38_903.76 29046 37367 28499 32581 70132 48281 30507 62144 31700 26665 33554 3426 2581 8542 2149 4597 2289 10.39_1657.43 11217 15042 7712 12138 10201 12740 10119 10093 12368 10.40_603.53 11628 15940 2246 2439 71945 2244 12136 2242 2725 40637 10.41_1683.45 7775 10649 5360 9200 7499 8533 7585 7549 8308 10.44_881.70 16527 11286 12201 19425 16208 11491 12758 13819 13378 12142 13310 10.51_843.69 30108 19478 23872 35026 22474 24191 22156 24773 25064 24955 10.51_1607.42 20114 20223 18160 17157 17278 19976 19641 16567 23288 10.54_855.71 20636 14282 14804 25021 16022 15118 16072 16988 16595 15111 16131 4029 2551 4374 4453 4833 5762 3820 5172 10.55_869.70 31106 21139 36564 24579 22990 24541 26407 24310 24735 10.56_523.47 18777 21850 20262 20163 16220 15567 21347 17858 15821 21170 10.61_1025.77 50980 42274 32345 37927 42513 38734 38037 42353 10.62_575.50 34668 43092 39639 28105 34163 41057 35454 32841 37499 10.66_854.75 190145 194872 188971 200872 196719 181280 45806 198437 191547 186054 187363 7409 4340 8039 8286 7963 9261 6014 7764 10.66_1051.79 22328 31191 18372 23348 26117 24645 20374 25517 10.67_956.86 46974 50593 41990 48090 50116 50188 45548 47854 10.68_916.83 106318 117600 103553 112735 117436 115254 106893 112363 10.69_1077.80 4616 6696 4283 5108 5841 5729 5153 5339 10.71_982.88 10971 13750 10369 12165 13685 12775 10602 12801 10.74_810.75 87374 94921 64685 87777 88713 67275 69396 94371 95720 73344 104380 10319 4924 4740 4730 4448 5652 4013 4203 10.74_905.78 90724 167490 85396 95493 114604 86224 2967182 101839 99943 86622 100149 2754 3039 2235 14226 2941 7094 2587 10.76_906.79 56288 61679 53737 59194 68302 53472 61285 64364 59943 54399 60934 2645 2515 2243 9800 2278 4520 2696 2474 10.79_563.51 12595 17695 8918 9797 11936 14873 12818 11189 14105 10.81_589.52 8035 11356 5966 10143 5814 8087 10203 8393 6778 8855 10.81_1039.79 14382 20945 10535 16904 11206 12801 15682 14530 13372 14173 10.83_970.88 11159 14359 14577 9358 12066 12959 12173 10649 12424 10.91_1689.49 58894 60383 65507 58674 6305 61452 59091 67330 10.92_825.77 152972 159345 156479 160907 145185 165296 5282 179754 163772 150009 201695 15649 13873 14690 13487 12845 13775 17658 12938 11.00_851.79 2111762 2317166 1871276 2341989 2362849 1987613 22582 2334728 2179506 1976917 2341367 5184 4952 3654 7420 4397 6191 4208 3024 11.01_1053.80 64405 68696 67809 67920 59144 66150 65887 64684 11.06_914.82 9779 15376 8680 3008 14879 2210 16321 12884 11757 3883 12532 2180 2007 2984 2028 2250 2017 11.13_897.75 38111 43404 35169 39451 43789 27708 100010 41181 40697 35096 38614 2458 2528 5896 2759 4201 2225 2031 11.13_944.86 56567 60741 56839 58493 64493 44745 5445 61978 58812 51773 60981 2263 6549 11.17_890.80 1134559 1473957 880946 1340372 1578425 878596 1139595 1381892 1278755 965465 1272423 39851 29080 36622 39734 31994 32978 37765 37525 11.17_894.79 102660 56947 34487 13819 59207 40700 51174 55193 52203 28209 52319 4254 5058 5040 4525 4553 4805 6205 5554 11.18_584.56 4441 3358 4195 5764 4954 5062 5604 3802 3601 5313 3688 3220 4142 2879 2785 2630 11.18_890.79 1134559 1473957 880946 1340372 1578425 878596 32606 1381892 1278755 965465 1272423 39851 29080 36622 39734 31994 32978 37765 37525 11.24_895.79 186382 218507 170771 199266 225725 157148 199191 203185 204437 174656 195422 2812 2739 3173 2324 2690 2720 3246 2742 11.26_920.86 123523 126792 121788 129287 132499 121838 124139 127388 129611 119869 124955 4150 2406 3083 4337 2728 3128 3145 2908 11.38_1055.82 39931 35450 46200 45995 37801 40215 43955 44450 38740 44583 11.39_605.55 61458 50988 69275 76384 54061 75411 68877 55701 70547 11.39_1081.83 33857 29084 35540 36435 29307 36268 31207 35140 11.49_934.87 23091 26717 17966 25570 31264 19984 78619 28070 26997 20408 27748 4732 5275 6347 7622 5803 8286 4296 5185 11.52_866.82 80079 98522 75953 86384 94892 79688 2326 105662 92955 77019 116508 5384 2520 2269 2697 2830 3212 2452 2557 11.59_923.82 20919 23612 17028 23935 26349 17654 16937 25022 21789 18442 23796 2123 11.66_894.85 12647 127811 82454 103234 160141 11033 13085 14526 50595 12393 108520 2834 11.87_948.89 98758 117286 89658 10084 124173 7826 8050 114015 114170 91424 10673 2392 2541 2218 2885 2122 3316 2160 11.88_909.87 64727 154931 102290 74596 173822 109309 124229 82305 76348 70165 153472 20325 9704 8523 10013 9638 12530 9505 7974 11.93_908.86 103168 128653 107156 120364 120127 129677 97984 135817 126196 110278 185601 32485 14031 12847 16104 16776 20411 14770 13189 12.09_850.79 10777 12106 9256 11355 13223 10070 8984 12683 10738 10288 12149 2116 2315 2012 12.10_876.80 20776 22891 15974 21590 26888 17955 15942 22823 21305 19607 22397 2387 2176 3760 2665 2448 12.24_1193.06 5222 6921 4825 5014 4933 3617 11445 4395 5297 4818 3648 22179 2419 23617 15839 4316 10188 5517 12.62_1437.31 2601 19467 19617 2020 7993 5494 390973 7086 3816 5153 4357 24464 5510 20769 20696 20264 19150 19695 10748 12.63_729.65 7594 11290 11385 8641 6676 6129 141738 6989 5500 6087 5348 11699 4668 11544 10625 11162 10703 9969 6761 MS_METABOLITE_DATA_END #METABOLITES METABOLITES_START metabolite_name Identifier RT m/z Adduct InChI Key Molecular Formula Acylcarnitine C16:0 1.51_400.34 1.513 400.3382 [M+H]+ XOMRRQXKHMYMOC-OAQYLSRUSA-N C23H45NO4 Acylcarnitine C18:0 2.42_428.37 2.423 428.3731 [M+H]+ FNPHNLNTJNMAEE-HSZRJFAPSA-N C25H49NO4 Acylcarnitine C18:1 1.82_426.36 1.821 426.3571 [M+H]+ IPOLTUVFXFHAHI-SEYXRHQNSA-N C25H47NO4 Ceramide (d18:1/23:0) 8.14_636.63_8.14_658.61 8.1425 636.6288_658.6103 [M+H]+_[M+Na]+ NAJHAHQNQCNWOP-UHFFFAOYSA-N C41H81NO3 Ceramide (d40:1) 7.80_622.61 7.804 622.6128 [M+H]+ KEPQASGDXIEOIL-GLQCRSEXSA-N C40H79NO3 Ceramide (d42:1) 8.45_672.63_8.46_650.64 8.454 672.6264_650.6444 [M+Na]+_[M+H]+ ZJVVOYPTFQEGPH-AUTSUKAISA-N C42H83NO3 DG (34:1) 7.04_617.51_7.05_612.56 7.0455 617.5121_612.5562 [M+Na]+_[M+NH4]+ YEJYLHKQOBOSCP-OZKTZCCCSA-N C37H70O5 DG (34:2) 6.49_615.49 6.487 615.4949 [M+Na]+ SVXWJFFKLMLOHO-YAIZGCQRSA-N C37H68O5 DG (36:2) 7.12_643.53 7.117 643.5279 [M+Na]+ AFSHUZFNMVJNKX-LLWMBOQKSA-N C41H70O5 LPC (16:0) 1.59_496.34 1.592 496.3391 [M+H]+ ASWBNKHCZGQVJV-UHFFFAOYSA-N C24H50NO7P LPC (16:1) 1.37_494.33 1.367 494.3251 [M+H]+ LFUDDCMNKWEORN-ZXEGGCGDSA-N C24H48NO7P LPC (18:0) 2.36_524.37 2.365 524.3708 [M+H]+ IHNKQIMGVNPMTC-RUZDIDTESA-N C26H54NO7P LPC (18:1) 1.67_522.35 1.665 522.352 [M+H]+ YAMUFBLWGFFICM-PTGWMXDISA-N C26H52NO7P LPC (22:6) 1.29_568.34 1.285 568.3358 [M+H]+ LSOWKZULVQWMLY-APPDJCNMSA-N C30H50NO7P LPC (o-16:0) 1.86_482.36 1.864 482.3603 [M+H]+ VLBPIWYTPAXCFJ-XMMPIXPASA-N C24H52NO6P LPC (p-18:0) or LPC (o-18:1) 2.01_508.38 2.015 508.3755 [M+H]+ XWYSLMAMRKYUFH-HTOVTZSWSA-N C26H54NO6P PC (32:0) 5.59_734.57 5.587 734.5686 [M+H]+ KILNVBDSWZSGLL-KXQOOQHDSA-N C40H80NO8P PC (32:1) 4.91_732.55 4.909 732.5529 [M+H]+ QIBZFHLFHCIUOT-NPBIGWJUSA-N C40H78NO8P PC (32:2) 4.54_730.54 4.542 730.5384 [M+H]+ GPWHCUUIQMGELX-VHQDNGOZSA-N C40H76NO8P PC (33:1) 5.34_746.58 5.342 746.5771 [M+H]+ WUSDPFVBZAKNBL-IMZFPPOWSA-N C41H80NO8P PC (34:1) 5.65_760.58 5.646 760.5832 [M+H]+ WTJKGGKOPKCXLL-VYOBOKEXSA-N C42H82NO8P PC (34:2) 5.14_758.57 5.138 758.5689 [M+H]+ JLPULHDHAOZNQI-ZTIMHPMXSA-N C42H80NO8P PC (34:3) 4.89_756.55 4.892 756.5543 [M+H]+ SSQFWAKSSUYHFV-YVTPCJIFSA-N C40H80NO8P PC (35:2) 5.49_772.59 5.494 772.5896 [M+H]+ LNGBVAOHJZCRIL-GPDPEMMZSA-N C43H82NO8P PC (35:3) 4.92_770.57 4.924 770.5693 [M+H]+ CWPIHLOOVWJHLK-HEQWELKFSA-N C43H80NO8P PC (36:1) 6.19_788.61_6.21_810.59 6.2 788.6085_810.5941 [M+H]+_[M+Na]+ ATHVAWFAEPLPPQ-VRDBWYNSSA-N C44H86NO8P PC (36:2) 5.76_786.60 5.761 786.602 [M+H]+ SNKAWJBJQDLSFF-NVKMUCNASA-N C44H84NO8P PC (36:4) 5.05_782.57 5.048 782.5684 [M+H]+ VRXRAEQYIWJLSH-OCTHSLKYSA-N C47H86NO8P PC (37:2) 6.16_800.61 6.158 800.6116 [M+H]+ MCZUABDVGPPWPM-HJTCUGKVSA-N C45H86NO8P PC (38:2) 6.38_814.63 6.381 814.6331 [M+H]+ KXXLFCAPKGRXBT-FMJYHZMHSA-N C46H88NO8P PC (38:3) 5.96_812.61 5.958 812.6132 [M+H]+ KJDCENXZHMAYTN-VHWCKNCUSA-N C46H86NO8P PC (38:4) 5.69_810.61 5.694 810.6078 [M+H]+ PSVRFUPOQYJOOZ-QNPWAGBNSA-N C46H84NO8P PC (38:5) 5.11_808.58 5.113 808.5806 [M+H]+ STHWQCYHQJBDDB-SYONOARRSA-N C46H82NO8P PC (40:4) 6.15_838.63 6.155 838.6293 [M+H]+ YVFBVKJWPMCQQG-NRICRUJBSA-N C48H88NO8P PC (40:5) 5.72_836.61 5.719 836.6141 [M+H]+ UCKDHIBTSOLZAW-OMGITNNSSA-N C48H86NO8P PC (40:6) 5.12_834.60 5.12 834.5991 [M+H]+ UCQTXWKYRXXLSS-BLDRONNASA-N C48H84NO8P PC (o-32:0) 5.95_720.59 5.947 720.5862 [M+H]+ C40H82NO7P PC (p-32:0) or PC (o-32:1) 5.77_718.57 5.766 718.5714 [M+H]+ C40H80NO7P PC (p-34:1) or PC (o-34:2) 5.93_744.59 5.931 744.5863 [M+H]+ C42H82NO7P PC (p-38:2) or PC (o-38:3) 6.36_798.63 6.365 798.6344 [M+H]+ C46H88NO7P PC (p-40:5) or PC (o-40:6) 5.92_820.62 5.923 820.6162 [M+H]+ C48H86NO7P PC (p-40:6) or PC (o-40:7) 5.40_818.60 5.4 818.6025 [M+H]+ C48H84NO7P PE (36:1) 6.41_746.58 6.411 746.5753 [M+H]+ JQKOHRZNEOQNJE-ZZEZOPTASA-N C41H80NO8P PE (p-36:2) or PE (o-36:3) 6.29_728.56 6.288 728.5592 [M+H]+ C41H78NO7P PE (p-38:4) or PE (o-38:5) 6.11_752.55 6.114 752.5538 [M+H]+ C43H78NO7P SM (d32:1) 4.23_675.54 4.234 675.5426 [M+H]+ KYICBZWZQPCUMO-PSALXKTOSA-N C37H75N2O6P SM (d33:1) 4.53_689.56 4.529 689.558 [M+H]+ LQINJRUGTUOHGS-YPDYIYJKSA-N C38H77N2O6P SM (d34:1) 4.87_703.57 4.872 703.5735 [M+H]+ RWKUXQNLWDTSLO-GWQJGLRPSA-N C39H79N2O6P SM (d34:2) 4.33_701.56 4.333 701.5581 [M+H]+ YLWSJLLZUHSIEA-CKSUKHGVSA-N C39H77N2O6P SM (d36:1) 5.48_731.60 5.477 731.604 [M+H]+ LKQLRGMMMAHREN-YJFXYUILSA-N C41H83N2O6P SM (d40:1) 6.89_787.67 6.89 787.6678 [M+H]+ FJJANLYCZUNFSE-QVMKKYBKSA-N C45H91N2O6P SM (d40:2) 6.30_785.65 6.296 785.6493 [M+H]+ C45H89N2O6P SM (d41:1) 7.21_801.68 7.212 801.6842 [M+H]+ SXZWBNWTCVLZJN-ZIHSGIAZSA-N C46H93N2O6P SM (d42:1) 7.54_815.70 7.537 815.6993 [M+H]+ QEDPUVGSSDPBMD-XTAIVQBESA-N C47H95N2O6P SM (d42:2) 6.85_813.68 6.85 813.6841 [M+H]+ DACOGJMBYLZYDH-GXJPFUDISA-N C47H93N2O6P TG (42:1) 9.13_743.61_9.13_738.66 9.129 743.6148_738.6610 [M+Na]+_[M+NH4]+ PMWOTNASJLOLJE-BNQAGZCGSA-N C45H84O6 TG (44:1) 9.65_771.65_9.65_766.69 9.6475 771.6478_766.6929 [M+Na]+_[M+NH4]+ UZLGGKDLJGDGEY-WVSHCNQOSA-N C47H88O6 TG (44:2) 9.17_764.68_9.18_769.63 9.176 764.6763_769.6315 [M+NH4]+_[M+Na]+ LJXSUVSRRMQRRA-WHTYERKGSA-N C47H86O6 TG (46:0) 10.55_796.74 10.55 796.7386 [M+NH4]+ JWVXCFSNEOMSHH-UHFFFAOYSA-N C49H94O6 TG (46:1) 10.12_799.68_10.15_794.72 10.133 799.6793_794.7236 [M+Na]+_[M+NH4]+ RSDIQTNCDWUNDP-VHXPQNKSSA-N C49H92O6 TG (46:2) 9.68_797.66_9.68_792.71 9.6845 797.6645_792.7082 [M+Na]+_[M+NH4]+ XUEMVUXNOCIHLG-MOFPORNTSA-N C49H90O6 TG (46:3) 9.23_790.69 9.228 790.6923 [M+NH4]+ AQARPXOEHQBBQN-OJJDTYCWSA-N C49H88O6 TG (48:0) 10.89_824.77 10.889 824.7698 [M+NH4]+ PVNIQBQSYATKKL-UHFFFAOYSA-N C51H98O6 TG (48:1) 10.55_827.71_10.59_822.76 10.554_10.589 827.7116_822.7551 [M+Na]+_[M+NH4]+ FEKLSEFRUGWUOS-DLOIZKPKSA-N C51H96O6 TG (48:2) 10.18_820.74_10.19_825.70 10.183 820.7396_825.6958 [M+NH4]+_[M+Na]+ RUOVJPPUXXFZPC-YZEIBMOJSA-N C51H94O6 TG (48:3) 9.73_823.68_9.73_818.72 9.7275 823.6813_818.7240 [M+Na]+_[M+NH4]+ SKGWNZXOCSYJQL-BUTYCLJRSA-N C51H92O6 TG (49:0) 11.10_843.74_11.14_838.79 11.103_11.138 843.7427_838.7867 [M+Na]+_[M+NH4]+ TTWJTJMWHOYBPQ-ANFMRNGASA-N C52H100O6 TG (49:1) 10.76_836.77_10.77_841.73 10.7655 836.7703_841.7271 [M+NH4]+_[M+Na]+ VYYGQDOPVVYUKW-UKFBYESTSA-N C52H98O6 TG (49:2) 10.38_834.76_10.39_839.71 10.386 834.7550_839.7107 [M+NH4]+_[M+Na]+ QZYSUBAQYSVFNX-PSMULLBHSA-N C52H96O6 TG (49:3) 9.97_832.74 9.967 832.7391 [M+NH4]+ C52H94O6 TG (50:0) 11.32_852.80 11.317 852.8015 [M+NH4]+ QRJMBNGGFSPTQP-UHFFFAOYSA-N C53H102O6 TG (50:1) 10.97_855.74_11.00_850.78 10.9865 855.7445_850.7849 [M+Na]+_[M+NH4]+ YHMDGPZOSGBQRH-YYSBDVFPSA-N C53H100O6 TG (50:2) 10.60_853.73_10.62_848.77 10.608 853.7275_848.7706 [M+Na]+_[M+NH4]+ QEZWFCZNHWUARW-XQCAQTCHSA-N C53H98O6 TG (50:3) 10.19_846.75_10.22_851.71 10.204 846.7543_851.7126 [M+NH4]+_[M+Na]+ UFHNZOACKFBCOM-YXKNDSBASA-N C53H96O6 TG (50:4) 9.82_844.74_9.84_849.70 9.8315 844.7388_849.6978 [M+NH4]+_[M+Na]+ PVMBAGXWHHZKFP-JMPJWMFJSA-N C53H94O6 TG (51:2) 10.84_867.75_10.80_862.79 10.839_10.805 867.7486_862.7866 [M+Na]+_[M+NH4]+ NSNSZGBCOIKUBU-SZOKBDNISA-N C54H100O6 TG (51:3) 10.41_860.77 10.407 860.77 [M+NH4]+ ISSGPXMQOMAFMJ-DMGKHJLRSA-N C54H98O6 TG (51:4) 10.09_858.75 10.086 858.7547 [M+NH4]+ IIRQXNVLAXQEKB-KBEZCZBDSA-N C54H96O6 TG (52:0) 11.70_880.83 11.704 880.8334 [M+NH4]+ SDNYRTVJOFMYIW-OIVUAWODSA-N C55H106O6 TG (52:1) 11.36_883.78_11.38_878.82 11.369 883.7785_878.8153 [M+Na]+_[M+NH4]+ NPCZZYKITFKRQZ-RFBIWTDZSA-N C55H104O6 TG (52:2) 11.04_881.76_11.10_876.80 11.039_11.099 881.7602_876.7991 [M+Na]+_[M+NH4]+ JFISYPWOVQNHLS-NBHCHVEOSA-N C55H102O6 TG (52:3) 10.66_874.78_10.66_879.75 10.66 874.7848_879.7456 [M+NH4]+_[M+Na]+ KGLAHZTWGPHKFF-FBSASISJSA-N C55H100O6 TG (52:4) 10.29_877.73_10.29_872.77 10.291 877.7294_872.7691 [M+Na]+_[M+NH4]+ WHSWXEYWNPTUPW-HNJDVRDNSA-N C55H98O6 TG (52:5) 9.90_870.75 9.9 870.7534 [M+NH4]+ CQZAAIKPSLHIBC-KDJOUNIJSA-N C55H96O6 TG (53:1) 11.57_897.79 11.568 897.7915 [M+Na]+ WWJIBIGWKGFVAQ-JNSYTQKUSA-N C56H106O6 TG (53:3) 10.82_888.80 10.825 888.8013 [M+NH4]+ ZNQBEJJYVJSZLM-LEDQTTRKSA-N C56H102O6 TG (53:4) 10.49_886.79 10.495 886.7858 [M+NH4]+ BMSDHYZLQWTKSQ-LSJAAEOESA-N C56H100O6 TG (54:1) 11.73_906.85 11.734 906.8499 [M+NH4]+ YFFIQXNTTVSKJC-NZEOUKRFSA-N C57H108O6 TG (54:2) 11.41_904.83_11.43_909.79 11.4155 904.8315_909.7923 [M+NH4]+_[M+Na]+ RYNHWWNZNIGDAQ-WGSDILPMSA-N C57H106O6 TG (54:3) 11.04_902.82_11.06_907.78 11.05 902.8153_907.7783 [M+NH4]+_[M+Na]+ PHYFQTYBJUILEZ-IUPFWZBJSA-N C57H104O6 TG (54:4) 10.69_900.80 10.687 900.7977 [M+NH4]+ BRLGHZXETDWABO-NOFIOOQLSA-N C57H102O6 TG (54:5) 10.33_898.78 10.326 898.7829 [M+NH4]+ VVEBTVMJPTZDHO-YQFZQLSNSA-N C57H100O6 TG (56:1) 11.93_934.88 11.933 934.8816 [M+NH4]+ OCYFAHIHWCVZKS-FHSLLVMSSA-N C59H112O6 TG (56:6) 10.52_924.80 10.518 924.8003 [M+NH4]+ ZTNDRFCABXFVMY-WJTCTALZSA-N C59H102O6 TG (58:2) 11.93_960.89 11.928 960.8948 [M+NH4]+ GXWBCAVCOMAOHT-VMCJOIRWSA-N C61H114O6 CSH_posESI #017 10.59_549.49 10.585 549.4881 CSH_posESI #042 5.57_900.57 5.57 900.5728 CSH_posESI #098 9.69_813.64 9.687 813.6386 CSH_posESI #103 5.22_766.57 5.223 766.5681 CSH_posESI #116 9.57_880.72_9.57_885.68 9.5695 880.7205_885.6773 CSH_posESI #134 10.69_895.72 10.685 895.7159 CSH_posESI #170 10.22_867.68 10.22 867.6839 CSH_posESI #211 10.29_893.70 10.287 893.6997 CSH_posESI #215 10.36_808.74 10.355 808.7392 CSH_posESI #230 5.13_848.54 5.127 848.5382 CSH_posESI #261 5.14_1516.13 5.141 1516.1307 CSH_posESI #270 4.99_627.53 4.987 627.5344 CSH_posESI #275 4.97_887.56 4.973 887.5645 CSH_posESI #285 5.79_876.57 5.793 876.571 CSH_posESI #286 5.13_1159.83 5.133 1159.8339 CSH_posESI #288 5.03_577.52 5.028 577.5187 CSH_posESI #296 5.11_603.53 5.115 603.5344 CSH_posESI #298 11.01_603.53 11.012 603.5347 CSH_posESI #304 5.66_1533.11 5.658 1533.1067 0.50_114.07 0.50_114.07 0.496 114.0665 0.51_162.11 0.51_162.11 0.513 162.1117 0.52_146.09 0.52_146.09 0.517 146.0921 0.52_283.14 0.52_283.14 0.52 283.1438 0.52_737.29 0.52_737.29 0.523 737.2909 0.52_205.10 0.52_205.10 0.524 205.0973 0.53_152.02 0.53_152.02 0.525 152.0231 0.53_104.11 0.53_104.11 0.529 104.1065 0.53_480.21 0.53_480.21 0.53 480.2129 0.53_242.15 0.53_242.15 0.534 242.1499 0.53_521.17 0.53_521.17 0.534 521.1688 0.54_283.07 0.54_283.07 0.536 283.0651 0.54_748.29 0.54_748.29 0.539 748.2877 0.54_627.35 0.54_627.35 0.545 627.3484 0.55_261.12 0.55_261.12 0.546 261.1236 0.56_132.10 0.56_132.10 0.558 132.1016 0.56_156.04 0.56_156.04 0.56 156.0416 0.56_665.31 0.56_665.31 0.56 665.3066 0.56_715.31 0.56_715.31 0.56 715.3071 0.56_166.09 0.56_166.09 0.561 166.0877 0.56_197.13 0.56_197.13 0.561 197.1283 0.57_86.10 0.57_86.10 0.565 86.0963 0.57_927.44_0.56_949.42 0.57_927.44_0.56_949.42 0.5655 927.4359_949.4187 0.57_261.09 0.57_261.09 0.568 261.0896 0.57_342.18 0.57_342.18 0.569 342.1819 0.57_911.46 0.57_911.46 0.573 911.4624 0.58_485.36 0.58_485.36 0.576 485.3571 0.58_759.27 0.58_759.27 0.576 759.2735 0.58_477.21_0.57_499.20 0.58_477.21_0.57_499.20 0.577 477.2121_499.1977 0.58_241.11 0.58_241.11 0.579 241.1061 0.58_468.21 0.58_468.21 0.579 468.2128 0.58_114.09 0.58_114.09 0.581 114.0904 0.63_649.32 0.63_649.32 0.626 649.3244 0.63_703.27 0.63_703.27 0.628 703.2691 0.63_371.17 0.63_371.17 0.634 371.1718 0.64_152.07 0.64_152.07 0.641 152.0675 0.65_276.14 0.65_276.14 0.647 276.1354 0.65_687.28 0.65_687.28 0.647 687.2841 0.66_505.29 0.66_505.29 0.657 505.2902 0.66_171.08 0.66_171.08 0.663 171.0838 0.66_581.29 0.66_581.29 0.665 581.2882 0.68_636.33 0.68_636.33 0.676 636.3344 0.68_251.15 0.68_251.15 0.685 251.1534 0.69_485.21 0.69_485.21 0.692 485.2137 0.70_481.16 0.70_481.16 0.698 481.1617 0.70_349.19 0.70_349.19 0.704 349.1902 0.71_647.28 0.71_647.28 0.707 647.2812 0.72_329.14 0.72_329.14 0.721 329.1372 0.74_287.15 0.74_287.15 0.74 287.1479 0.74_289.16 0.74_289.16 0.74 289.1573 0.74_425.14 0.74_425.14 0.74 425.1365 0.74_371.23 0.74_371.23 0.742 371.2282 0.74_568.25 0.74_568.25 0.743 568.2548 0.75_393.21 0.75_393.21 0.751 393.2137 0.75_257.13 0.75_257.13 0.753 257.1337 0.76_393.18 0.76_393.18 0.756 393.1767 0.77_413.21 0.77_413.21 0.766 413.2083 0.77_404.21 0.77_404.21 0.774 404.2122 0.78_394.19 0.78_394.19 0.775 394.1858 0.78_641.27 0.78_641.27 0.779 641.2695 0.78_500.37 0.78_500.37 0.782 500.3706 0.80_275.13 0.80_275.13 0.802 275.126 0.81_323.15 0.81_323.15 0.806 323.1461 0.82_558.41 0.82_558.41 0.821 558.4141 0.82_318.19 0.82_318.19 0.823 318.188 0.83_269.14 0.83_269.14 0.826 269.1371 0.83_406.24 0.83_406.24 0.829 406.2382 0.83_636.32 0.83_636.32 0.829 636.3179 0.83_411.19 0.83_411.19 0.833 411.1938 0.83_749.44 0.83_749.44 0.835 749.443 0.84_520.32 0.84_520.32 0.837 520.3234 0.85_601.36 0.85_601.36 0.848 601.3591 0.85_301.15 0.85_301.15 0.852 301.154 0.87_579.37 0.87_579.37 0.866 579.3724 0.87_211.14 0.87_211.14 0.867 211.1427 0.87_727.39 0.87_727.39 0.867 727.3854 0.88_703.53 0.88_703.53 0.882 703.532 0.88_401.21_0.88_418.24 0.88_401.21_0.88_418.24 0.883 401.2149_418.2409 0.89_334.22 0.89_334.22 0.889 334.2185 0.89_418.24 0.89_418.24 0.891 418.2399 0.89_335.22 0.89_335.22 0.892 335.2154 0.89_432.28 0.89_432.28 0.895 432.2805 0.92_263.22_0.92_280.25 0.92_263.22_0.92_280.25 0.922 263.2202_280.2467 0.99_518.31 0.99_518.31 0.994 518.3085 1.02_244.23 1.02_244.23 1.024 244.2274 1.03_434.27 1.03_434.27 1.025 434.2735 1.09_327.16_1.08_322.20 1.09_327.16_1.08_322.20 1.0865 327.1572_322.201 1.09_273.15 1.09_273.15 1.093 273.1478 1.10_482.35 1.10_482.35 1.095 482.347 1.10_305.17 1.10_305.17 1.102 305.174 1.14_514.39 1.14_514.39 1.136 514.3926 1.14_732.54 1.14_732.54 1.136 732.544 1.14_440.23 1.14_440.23 1.14 440.2269 1.14_470.37 1.14_470.37 1.141 470.3666 1.15_269.20 1.15_269.20 1.147 269.1987 1.17_540.41 1.17_540.41 1.172 540.4092 1.21_748.54 1.21_748.54 1.207 748.5395 1.21_704.51 1.21_704.51 1.21 704.5138 1.23_422.25 1.23_422.25 1.234 422.2535 1.30_620.43 1.30_620.43 1.298 620.4335 1.30_398.33 1.30_398.33 1.303 398.3267 1.31_708.48 1.31_708.48 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9.995 927.799 10.07_815.65 10.07_815.65 10.075 815.6539 10.12_768.71 10.12_768.71 10.12 768.7075 10.15_521.46 10.15_521.46 10.153 521.4566 10.16_1629.40 10.16_1629.40 10.163 1629.4036 10.16_997.74 10.16_997.74 10.164 997.7409 10.26_924.79 10.26_924.79 10.26 924.7878 10.27_917.82 10.27_917.82 10.274 917.819 10.29_954.85 10.29_954.85 10.286 954.8465 10.29_914.81 10.29_914.81 10.287 914.8097 10.30_577.52 10.30_577.52 10.301 577.5184 10.32_1669.43 10.32_1669.43 10.323 1669.4331 10.33_940.82 10.33_940.82 10.329 940.8237 10.36_829.67 10.36_829.67 10.362 829.6703 10.38_903.76 10.38_903.76 10.383 903.755 10.39_1657.43 10.39_1657.43 10.391 1657.4328 10.40_603.53 10.40_603.53 10.397 603.5348 10.41_1683.45 10.41_1683.45 10.408 1683.4486 10.44_881.70 10.44_881.70 10.439 881.7029 10.51_843.69 10.51_843.69 10.51 843.6853 10.51_1607.42 10.51_1607.42 10.511 1607.4181 10.54_855.71 10.54_855.71 10.542 855.7055 10.55_869.70 10.55_869.70 10.555 869.7014 10.56_523.47 10.56_523.47 10.561 523.4725 10.61_1025.77 10.61_1025.77 10.61 1025.7733 10.62_575.50 10.62_575.50 10.619 575.5037 10.66_854.75 10.66_854.75 10.659 854.7467 10.66_1051.79 10.66_1051.79 10.659 1051.7894 10.67_956.86 10.67_956.86 10.668 956.8639 10.68_916.83 10.68_916.83 10.675 916.8268 10.69_1077.80 10.69_1077.80 10.689 1077.804 10.71_982.88 10.71_982.88 10.706 982.8802 10.74_810.75 10.74_810.75 10.736 810.7545 10.74_905.78 10.74_905.78 10.741 905.7801 10.76_906.79 10.76_906.79 10.764 906.7856 10.79_563.51 10.79_563.51 10.79 563.5072 10.81_589.52 10.81_589.52 10.807 589.5199 10.81_1039.79 10.81_1039.79 10.808 1039.789 10.83_970.88 10.83_970.88 10.835 970.8787 10.91_1689.49 10.91_1689.49 10.914 1689.4949 10.92_825.77 10.92_825.77 10.918 825.7732 11.00_851.79 11.00_851.79 11.001 851.7895 11.01_1053.80 11.01_1053.80 11.009 1053.8036 11.06_914.82 11.06_914.82 11.061 914.8155 11.13_897.75 11.13_897.75 11.131 897.7452 11.13_944.86 11.13_944.86 11.131 944.8593 11.17_890.80 11.17_890.80 11.17 890.8038 11.17_894.79 11.17_894.79 11.172 894.7859 11.18_584.56 11.18_584.56 11.176 584.5637 11.18_890.79 11.18_890.79 11.177 890.7929 11.24_895.79 11.24_895.79 11.245 895.7872 11.26_920.86 11.26_920.86 11.263 920.8554 11.38_1055.82 11.38_1055.82 11.377 1055.8178 11.39_605.55 11.39_605.55 11.387 605.5491 11.39_1081.83 11.39_1081.83 11.387 1081.8331 11.49_934.87 11.49_934.87 11.489 934.8673 11.52_866.82 11.52_866.82 11.524 866.8184 11.59_923.82 11.59_923.82 11.591 923.8226 11.66_894.85 11.66_894.85 11.661 894.848 11.87_948.89 11.87_948.89 11.867 948.894 11.88_909.87 11.88_909.87 11.879 909.8661 11.93_908.86 11.93_908.86 11.93 908.8638 12.09_850.79 12.09_850.79 12.091 850.7865 12.10_876.80 12.10_876.80 12.104 876.8019 12.24_1193.06 12.24_1193.06 12.239 1193.0611 12.62_1437.31 12.62_1437.31 12.619 1437.3149 12.63_729.65 12.63_729.65 12.633 729.6511 METABOLITES_END #END