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[0,1,0,0,0,0|1,0,1]=3 283 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)NC AIFCHEM-94601208152 [0,1,0,0,0,0|2,0,0]=3 284 B17R0.12415 CCCCCCCCCCN(C)CCC(=O)OC AIFCHEM-5774110101 [0,1,0,0,0,0|1,0,0]=2 285 B17R0.12415 CCCCCCCCCNC(C)CCC(=O)OC AIFCHEM-6143577336 [0,1,0,0,0,0|1,0,0]=2 286 B17R0.12415 CCCCCCCCCN[C@@H](C)CCC(=O)OC AIFCHEM-5797364620 [0,1,0,0,0,0|1,0,0]=2 287 B17R0.12415 CCCCCCCCNCC(=O)NCC(=O)OC AIFCHEM-5886328524 [0,1,0,0,0,0|2,0,1]=4 288 B17R0.12415 CCCCCCCCOCC(=O)NCC(=O)OC AIFCHEM-6217689677 [0,1,0,0,0,0|2,0,1]=4 289 B17R0.12415 COC(=O)CCC(C)NCCCCCCCCO AIFCHEM-6483536035 [0,1,0,0,0,0|2,0,0]=3 290 B17R0.13601 CCCCCCCCCCCN(C)CC(=O)NC AIFCHEM-94608441323 [0,1,0,0,0,0|2,0,0]=3 291 B17R0.13601 CCCCCCCCCCNC(=O)CC(=O)OC AIFCHEM-94549709185 [0,1,0,0,0,0|1,0,1]=3 292 B17R0.13601 CCCCCCCCCCNC(C)CC(=O)NC AIFCHEM-94602597790 [0,1,0,0,0,0|2,0,0]=3 293 B17R0.13601 CCCCCCCCCCNC(C)CC(=O)OC AIFCHEM-6061145121 [0,1,0,0,0,0|1,0,0]=2 294 B17R0.13601 CCCCCCCCCCN[C@@H](C)CC(=O)OC AIFCHEM-5718581653 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AIFCHEM-5728850452 [0,0,0,1,0,0|2,0,1]=4 343 B17R1.10688 CCCCCCCCCCN[C@H]1C[C@H](C1)OC AIFCHEM-6142007147 [0,0,0,1,0,0|2,0,1]=4 344 B17R1.24374 COC(=O)CCCCCNCC1CCCN1C AIFCHEM-5717444915 [0,0,0,1,0,0|2,0,0]=3 345 B17R1.24374 COC(=O)CCCCCNC[C@@H]1CCCN1C AIFCHEM-5965451254 [0,0,0,1,0,0|2,0,0]=3 346 B17R1.24374 COC(=O)CCCCCNC[C@H]1CCCN1C AIFCHEM-5637932088 [0,0,0,1,0,0|2,0,0]=3 347 B17R1.24374 COC(=O)CCCCNCCC1CCCN1C AIFCHEM-6168296834 [0,0,0,1,0,0|2,0,0]=3 348 B17R1.26687 COC(=O)CCOCCOCCNCC1CC1 AIFCHEM-94583090276 [0,0,0,1,0,0|3,0,0]=4 349 B17R1.27076 CCN1CCCC1CNCCCCC(=O)OC AIFCHEM-6240834518 [0,0,0,1,0,0|2,0,0]=3 350 B17R1.27076 CCN1CCC[C@H]1CNCCCCC(=O)OC AIFCHEM-6143921240 [0,0,0,1,0,0|2,0,0]=3 351 B14R0.392 CCCCCCCCCCCCNCC AIFCHEM-94536254560 [2,0,0,0,0,0|1,0,1]=4 352 B14R0.392 CCCCCCCCCCCNCCC AIFCHEM-5814836258 [2,0,0,0,0,0|1,0,1]=4 353 B14R0.392 CCCCCCCCCCCNCCO AIFCHEM-6481424133 [2,0,0,0,0,0|1,0,1]=4 354 B14R0.392 CCCCCCCCCCNCCCC AIFCHEM-94570969793 [2,0,0,0,0,0|1,0,1]=4 355 B14R0.392 CCCCCCCCCCNCCCO AIFCHEM-6438232739 [2,0,0,0,0,0|1,0,1]=4 356 B14R0.392 CCCCCCCCCCNCCOC AIFCHEM-6016377314 [2,0,0,0,0,0|1,0,0]=3 357 B14R0.392 CCCCCCCCCCNCCSC AIFCHEM-5813336843 [2,0,0,0,0,0|1,1,0]=4 358 B14R0.392 CCCCCCCCCNCCCCC AIFCHEM-94522650639 [2,0,0,0,0,0|1,0,1]=4 359 B14R0.392 CCCCCCCCCNCCCCO AIFCHEM-6503049567 [2,0,0,0,0,0|1,0,1]=4 360 B14R0.392 CCCCCCCCCNCCCOC AIFCHEM-94598886369 [2,0,0,0,0,0|1,0,0]=3 361 B14R0.392 CCCCCCCCCNCCCSC AIFCHEM-94546173474 [2,0,0,0,0,0|1,1,0]=4 362 B14R0.392 CCCCCCCCNCCCCCC AIFCHEM-6128865148 [2,0,0,0,0,0|1,0,1]=4 363 B14R0.392 CCCCCCCCNCCCCCO AIFCHEM-5822818925 [2,0,0,0,0,0|1,0,1]=4 364 B14R0.392 CCCCCCCNCCCCCCO AIFCHEM-94589458804 [2,0,0,0,0,0|1,0,1]=4 365 B14R0.392 CCCCCCCNCCOCCOC AIFCHEM-94589457590 [2,0,0,0,0,0|2,0,0]=4 366 B14R0.392 CCCCCNCCCCCCCCO AIFCHEM-94551428975 [2,0,0,0,0,0|1,0,1]=4 367 B14R0.392 CCCCNCCCCCCCCCO AIFCHEM-94523028389 [2,0,0,0,0,0|1,0,1]=4 368 B14R0.392 CCCNCCCCCCCCCCO AIFCHEM-94569015942 [2,0,0,0,0,0|1,0,1]=4 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AIFCHEM-6438917615 [1,1,0,0,0,0|2,0,0]=4 535 B16R0.1820 CC(CCCCC(=O)O)NCCCCCCO AIFCHEM-6499770804 [1,1,0,0,0,0|2,0,0]=4 536 B16R0.1820 CCCCCCCCC(C)NCCCC(=O)N AIFCHEM-5922073733 [1,1,0,0,0,0|2,0,0]=4 537 B16R0.1820 CCCCCCCCC(C)NCCCC(=O)O AIFCHEM-5644157110 [1,1,0,0,0,0|1,0,0]=3 538 B16R0.1820 CCCCCCCCC(C)NCCNC(=O)C AIFCHEM-5954080358 [1,1,0,0,0,0|2,0,0]=4 539 B16R0.1820 CCCCCCCCC(C)NCCNC(=O)O AIFCHEM-94535748295 [1,1,0,0,0,0|2,0,0]=4 540 B16R0.1820 CCCCCCCCC(C)NCCOC(=O)C AIFCHEM-5645697014 [1,1,0,0,0,0|2,0,0]=4 541 B16R0.1820 CCCCCCCCN(C)CCCSC(=O)C AIFCHEM-94560864732 [1,1,0,0,0,0|2,0,0]=4 542 B16R0.3183 CC(CCC(=O)O)NCCCCCCCCO AIFCHEM-6436486872 [1,1,0,0,0,0|2,0,0]=4 543 B16R0.3183 CCCCCCCCCCC(=O)NCC(=O)C AIFCHEM-6074962045 [1,1,0,0,0,0|1,0,1]=4 544 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)O AIFCHEM-6045506753 [1,1,0,0,0,0|1,0,0]=3 545 B16R0.3183 CCCCCCCCCNC(C)CCC(=O)O AIFCHEM-94590976534 [1,1,0,0,0,0|1,0,0]=3 546 B16R0.3183 CCCCCCCCCNC(C)COC(=O)C AIFCHEM-94599171542 [1,1,0,0,0,0|2,0,0]=4 547 B16R0.3288 CC(C)CCCNCCCCCCCC(=O)O AIFCHEM-5694774564 [1,1,0,0,0,0|1,0,0]=3 548 B16R0.3288 CC(C)CCNCCCCCCCCC(=O)O AIFCHEM-6131990301 [1,1,0,0,0,0|1,0,0]=3 549 B16R0.3288 CC(C)CNCCCCCCCCCC(=O)O AIFCHEM-6162087309 [1,1,0,0,0,0|1,0,0]=3 550 B16R0.3288 CC(C)OCCNCCCCCCCC(=O)O AIFCHEM-6282411814 [1,1,0,0,0,0|2,0,0]=4 551 B16R0.3288 CC(O)CCNCCCCCCCCC(=O)O AIFCHEM-94577734761 [1,1,0,0,0,0|1,0,0]=3 552 B16R0.3288 CC(O)CNCCCCCCCCCC(=O)O AIFCHEM-94558284645 [1,1,0,0,0,0|1,0,0]=3 553 B16R0.3288 CN(C)CCCNCCCCCCCC(=O)O AIFCHEM-94584126129 [1,1,0,0,0,0|2,0,0]=4 554 B16R0.3288 C[C@@H](O)CNCCCCCCCCCC(=O)O AIFCHEM-6492967912 [1,1,0,0,0,0|1,0,0]=3 555 B16R0.3288 C[C@H](O)CCNCCCCCCCCC(=O)O AIFCHEM-94544713027 [1,1,0,0,0,0|1,0,0]=3 556 B16R0.3288 C[C@H](O)CNCCCCCCCCCC(=O)O AIFCHEM-6492765742 [1,1,0,0,0,0|1,0,0]=3 557 B16R0.3288 O=C(O)CCCCCCCCCNCC(F)F AIFCHEM-6063009264 [1,1,0,0,0,0|2,0,0]=4 558 B16R0.3288 O=C(O)CCCCCCCCNCCC(F)F AIFCHEM-6231352942 [1,1,0,0,0,0|2,0,0]=4 559 B18R0.41 CCCCCCCC(=O)NCCCCC(=O)OCC AIFCHEM-6154796160 [0,2,0,0,0,0|1,0,1]=4 560 B18R0.41 CCCCCCCN(C)CCCCCC(=O)OCC AIFCHEM-5998578310 [0,2,0,0,0,0|1,0,0]=3 561 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC AIFCHEM-94571773086 [0,2,0,0,0,0|1,0,1]=4 562 B18R0.41 CCOC(=O)CCCCCN(C)CCCCCCO AIFCHEM-94534165020 [0,2,0,0,0,0|2,0,0]=4 563 B18R0.101 CCCCCCCCC(=O)NCCCCC(=O)OC AIFCHEM-5596130136 [0,2,0,0,0,0|0,0,1]=3 564 B18R0.101 CCCCCCCCC(C)CNCCCC(=O)OC AIFCHEM-6091117140 [0,2,0,0,0,0|0,0,0]=2 565 B18R0.101 CCCCCCCCC(C)CNCCNC(=O)CC AIFCHEM-94532524267 [0,2,0,0,0,0|2,0,0]=4 566 B18R0.101 CCCCCCCCC(C)NCCCCC(=O)OC AIFCHEM-5594827895 [0,2,0,0,0,0|0,0,0]=2 567 B18R0.101 CCCCCCCCN(C)CCCCCC(=O)OC AIFCHEM-5803778781 [0,2,0,0,0,0|0,0,0]=2 568 B18R0.101 COC(=O)CCCCNC(=O)CCCCCCCO AIFCHEM-5621230446 [0,2,0,0,0,0|1,0,1]=4 569 B18R0.13741 CCC(C)CCCCC(=O)NCCCCC(=O)OC AIFCHEM-5621895715 [0,2,0,0,0,0|1,0,1]=4 570 B18R0.19121 CCCCCCCC(C)C(=O)NCCCC(=O)OC AIFCHEM-94574197947 [0,2,0,0,0,0|1,0,1]=4 571 B18R0.19451 CCCCCCC(C)C(=O)NCCCCC(=O)OC AIFCHEM-5611454299 [0,2,0,0,0,0|1,0,1]=4 572 B18R0.19451 CCCCCCC(O)C(=O)NCCCCC(=O)OC AIFCHEM-5621189570 [0,2,0,0,0,0|1,0,1]=4 573 B18R0.19488 CCCCCCCN(CC)CCCCCC(=O)OC AIFCHEM-94542695017 [0,2,0,0,0,0|1,0,0]=3 574 B18R0.19586 CCCCC(C)CCC(=O)NCCCCC(=O)OC AIFCHEM-5595846658 [0,2,0,0,0,0|1,0,1]=4 575 B18R0.100 CCCCCCCCC(=O)NCCCC(=O)OCC AIFCHEM-5973776647 [0,2,0,0,0,0|1,0,1]=4 576 B18R0.100 CCCCCCCCC(C)CNCCC(=O)OCC AIFCHEM-6038320652 [0,2,0,0,0,0|1,0,0]=3 577 B18R0.100 CCCCCCCCC(C)NCCCC(=O)OCC AIFCHEM-5982048314 [0,2,0,0,0,0|1,0,0]=3 578 B18R0.100 CCCCCCCCN(C)CCCCC(=O)OCC AIFCHEM-5880351932 [0,2,0,0,0,0|1,0,0]=3 579 B18R0.139 CCCCCCC(C)NC(=O)CCCCC(=O)OC AIFCHEM-94531844377 [0,2,0,0,0,0|1,0,1]=4 580 B18R0.139 CCCCCCC(C)NC(C)CCCCC(=O)OC AIFCHEM-94531832761 [0,2,0,0,0,0|1,0,0]=3 581 B18R0.139 CCCCCC[C@@H](C)NC(=O)CCCCC(=O)OC AIFCHEM-6115162888 [0,2,0,0,0,0|1,0,1]=4 582 B18R0.139 CCCCCC[C@H](C)NC(=O)CCCCC(=O)OC AIFCHEM-5798250739 [0,2,0,0,0,0|1,0,1]=4 583 B18R0.3072 CCCCCCCCC(C)CNCCC(=O)N(C)C AIFCHEM-5866740271 [0,2,0,0,0,0|2,0,0]=4 584 B18R0.6441 CCCCCCCCC(=O)N(C)CCCC(=O)OC AIFCHEM-5607638905 [0,2,0,0,0,0|1,0,1]=4 585 B18R0.6441 CCCCCCCCN(C)C(=O)CCCC(=O)OC AIFCHEM-5824506871 [0,2,0,0,0,0|1,0,1]=4 586 B18R0.6725 CCCCCCCCC(C)CNC(C)CC(=O)OC AIFCHEM-6019527808 [0,2,0,0,0,0|1,0,0]=3 587 B18R0.6725 CCCCCCCCC(C)CN[C@@H](C)CC(=O)OC AIFCHEM-5765133166 [0,2,0,0,0,0|1,0,0]=3 588 B18R0.6725 CCCCCCCCC(C)CN[C@H](C)CC(=O)OC AIFCHEM-5946955929 [0,2,0,0,0,0|1,0,0]=3 589 B18R0.6725 CCCCCCCCC(C)NC[C@H](C)NC(=O)OC AIFCHEM-6109663054 [0,2,0,0,0,0|2,0,0]=4 590 B18R0.11627 CCCCCCCCCC(=O)NCCCC(=O)OC AIFCHEM-6091764062 [0,2,0,0,0,0|0,0,1]=3 591 B18R0.11627 CCCCCCCCCC(C)NCCCC(=O)OC AIFCHEM-6117611129 [0,2,0,0,0,0|0,0,0]=2 592 B18R0.11627 CCCCCCCCCC(C)NCCNC(=O)CC AIFCHEM-94532522491 [0,2,0,0,0,0|2,0,0]=4 593 B18R0.11627 CCCCCCCCNC(C)CCCCC(=O)OC AIFCHEM-94561932873 [0,2,0,0,0,0|0,0,0]=2 594 B18R0.11627 COC(=O)CCCCC(C)NCCCCCCCO AIFCHEM-6425434388 [0,2,0,0,0,0|1,0,0]=3 595 B18R0.11627 COC(=O)CCCCC(C)NCCCOCCCO AIFCHEM-6502211997 [0,2,0,0,0,0|2,0,0]=4 596 B18R0.11627 COC(=O)CCCNC(=O)CCCCCCCCO AIFCHEM-6183571465 [0,2,0,0,0,0|1,0,1]=4 597 B18R0.15644 COC(=O)CCCCC(C)NCCCCCN(C)C AIFCHEM-5603960917 [0,2,0,0,0,0|2,0,0]=4 598 B18R0.15644 COC(=O)CCCNC(=O)CCCCCCC(C)C AIFCHEM-6091161414 [0,2,0,0,0,0|1,0,1]=4 599 B18R0.19890 CCCCCCCCC(=O)N[C@@H](C)CCC(=O)OC AIFCHEM-5860205962 [0,2,0,0,0,0|1,0,1]=4 600 B18R0.19890 CCCCCCCCC(C)CN(C)CCC(=O)NC AIFCHEM-94601209927 [0,2,0,0,0,0|2,0,0]=4 601 B18R0.19890 CCCCCCCCC(C)CN(C)CCC(=O)OC AIFCHEM-5711174936 [0,2,0,0,0,0|1,0,0]=3 602 B18R0.20937 CCCCCCCCC(C)CNCC(C)C(=O)OC AIFCHEM-5867260559 [0,2,0,0,0,0|1,0,0]=3 603 B18R0.20937 CCCCCCCCC(C)CNCC(O)C(=O)OC AIFCHEM-6508731706 [0,2,0,0,0,0|1,0,0]=3 604 B18R0.20937 CCCCCCCCC(C)CNC[C@H](O)C(=O)OC AIFCHEM-6491344821 [0,2,0,0,0,0|1,0,0]=3 605 B18R0.137 CCCCCCC(=O)NCCCCCC(=O)OCC AIFCHEM-94521987643 [0,2,0,0,0,0|1,0,1]=4 606 B18R0.137 CCCCCCC(C)NCCCCCC(=O)OCC AIFCHEM-94531833408 [0,2,0,0,0,0|1,0,0]=3 607 B18R0.137 CCCCCCN(C)CCCCCCC(=O)OCC AIFCHEM-6039989822 [0,2,0,0,0,0|1,0,0]=3 608 B18R0.137 CCCCCC[C@@H](C)NCCCCCC(=O)OCC AIFCHEM-6114018331 [0,2,0,0,0,0|1,0,0]=3 609 B18R0.137 CCCCCC[C@H](C)NCCCCCC(=O)OCC AIFCHEM-5820691163 [0,2,0,0,0,0|1,0,0]=3 610 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC AIFCHEM-94522658468 [0,2,0,0,0,0|1,0,1]=4 611 B18R0.137 CCOC(=O)CCCCCCN(C)CCCCCO AIFCHEM-6408184712 [0,2,0,0,0,0|2,0,0]=4 612 B18R0.6552 CCCC[C@@H](C)NC(=O)CCCCCCC(=O)OC AIFCHEM-94596960540 [0,2,0,0,0,0|1,0,1]=4 613 B18R0.12071 COC(=O)CCCCCCC(=O)NCCCC(C)C AIFCHEM-5738412283 [0,2,0,0,0,0|1,0,1]=4 614 B18R0.12071 COC(=O)CCCCCNC(=O)CCCCC(C)C AIFCHEM-5604337968 [0,2,0,0,0,0|1,0,1]=4 615 B18R0.19335 CCCCCCCC(=O)NCCCCCC(=O)OC AIFCHEM-5665031217 [0,2,0,0,0,0|0,0,1]=3 616 B18R0.19335 CCCCCCCC(C)NCCCCCC(=O)OC AIFCHEM-5594480563 [0,2,0,0,0,0|0,0,0]=2 617 B18R0.19335 CCCCCCNC(=O)CCCCCCC(=O)OC AIFCHEM-94571773609 [0,2,0,0,0,0|0,0,1]=3 618 B18R0.19335 CCOCCCNC(=O)CCCCCCC(=O)OC AIFCHEM-6253859521 [0,2,0,0,0,0|1,0,1]=4 619 B18R0.19335 COC(=O)CCCCCNC(=O)CCCCCCO AIFCHEM-5647408704 [0,2,0,0,0,0|1,0,1]=4 620 B18R0.19335 COCCCCCC(=O)NCCCCCC(=O)OC AIFCHEM-94534413436 [0,2,0,0,0,0|1,0,1]=4 621 B18R0.19959 CCCCCC(C)C(=O)NCCCCCC(=O)OC AIFCHEM-5646697417 [0,2,0,0,0,0|1,0,1]=4 622 B18R0.19959 CCCCCC(O)C(=O)NCCCCCC(=O)OC AIFCHEM-5665006034 [0,2,0,0,0,0|1,0,1]=4 623 B18R0.19959 CCCCCN(C)C(=O)CCCCCCC(=O)OC AIFCHEM-6103244514 [0,2,0,0,0,0|1,0,1]=4 624 B18R0.110 C#CCC(=O)NCCCCCCCCCCCCC AIFCHEM-94552340248 [0,2,0,0,0,0|1,0,1]=4 625 B18R0.110 CC#CC(=O)NCCCCCCCCCCCCC AIFCHEM-94552343069 [0,2,0,0,0,0|1,0,0]=3 626 B18R0.110 CCCCCCCCCCCCCNC(=O)CC#N AIFCHEM-94552341540 [0,2,0,0,0,0|1,0,1]=4 627 B18R0.110 CCCCCCCCCCCCCNC(=O)CCO AIFCHEM-94552342355 [0,2,0,0,0,0|1,0,0]=3 628 B18R0.110 CCCCCCCCCCCCCNC(=O)COC AIFCHEM-94552343306 [0,2,0,0,0,0|0,0,0]=2 629 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC AIFCHEM-94552340382 [0,2,0,0,0,0|0,1,0]=3 630 B18R0.110 CCCCCCCCCCCCCNC(C)COC AIFCHEM-94552334064 [0,2,0,0,0,0|1,0,1]=4 631 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC AIFCHEM-5856221861 [0,2,0,0,0,0|1,0,0]=3 632 B18R0.110 CCCCCCCCCCCCNCC(=O)OCC AIFCHEM-5593068813 [0,2,0,0,0,0|0,0,0]=2 633 B18R0.110 CCCCCCCCCCCCNCC(O)COC AIFCHEM-6387450729 [0,2,0,0,0,0|0,0,2]=4 634 B18R0.110 CCCCCCCCCCCNCCC(=O)OCC AIFCHEM-6056667086 [0,2,0,0,0,0|0,0,0]=2 635 B18R0.110 CCCCCCCCCNCCCCC(=O)OCC AIFCHEM-6134674755 [0,2,0,0,0,0|0,0,0]=2 636 B18R0.110 CCCCCCCCNCCCCCC(=O)OCC AIFCHEM-5863473069 [0,2,0,0,0,0|0,0,0]=2 637 B18R0.110 CCCCCCCNCCCCCCC(=O)OCC AIFCHEM-94589457376 [0,2,0,0,0,0|0,0,0]=2 638 B18R0.110 CCCCOCCCNCCCCCC(=O)OCC AIFCHEM-5909337526 [0,2,0,0,0,0|1,0,0]=3 639 B18R0.110 CCNCCCCCCCCCCCC(=O)OCC AIFCHEM-94537422482 [0,2,0,0,0,0|0,0,0]=2 640 B18R0.110 CCOC(=O)CCCCCCNCCCCCC#N AIFCHEM-5862903743 [0,2,0,0,0,0|1,0,1]=4 641 B18R0.110 CCOC(=O)CCCCCCNCCCCCCO AIFCHEM-6510700915 [0,2,0,0,0,0|1,0,0]=3 642 B18R0.110 CCOC(=O)CCCCCCNCCCOCCO AIFCHEM-6389870947 [0,2,0,0,0,0|2,0,0]=4 643 B18R0.110 CCOC(=O)CCCCCCNCCOCCOC AIFCHEM-5876344694 [0,2,0,0,0,0|2,0,0]=4 644 B18R0.110 CCOC(=O)CCCCCNCCCCCCCO AIFCHEM-6409057449 [0,2,0,0,0,0|1,0,0]=3 645 B18R0.110 CCOC(=O)CCCCCNCCCOCCCO AIFCHEM-6504787175 [0,2,0,0,0,0|2,0,0]=4 646 B18R0.110 CCOC(=O)CCCCNCCCCCCCCO AIFCHEM-6435815416 [0,2,0,0,0,0|1,0,0]=3 647 B18R0.114 COC(=O)CCCCCCCCCCCNC(=O)C AIFCHEM-94605353159 [0,2,0,0,0,0|0,0,1]=3 648 B18R0.114 COC(=O)CCCCCCCCCCNCC(C)C AIFCHEM-94572979227 [0,2,0,0,0,0|0,0,0]=2 649 B18R0.114 COC(=O)CCCCCCCNCCCSC(=O)C AIFCHEM-94560871010 [0,2,0,0,0,0|1,0,1]=4 650 B18R0.114 COC(=O)CCCCCCNCCCCOC(=O)C AIFCHEM-5842950537 [0,2,0,0,0,0|1,0,1]=4 651 B18R0.114 COC(=O)CCCCCNCCCCCCC(=O)O AIFCHEM-94596325823 [0,2,0,0,0,0|1,0,1]=4 652 B18R0.114 COC(=O)CCCCCNCCCCCNC(=O)C AIFCHEM-5997570010 [0,2,0,0,0,0|1,0,1]=4 653 B18R0.114 COC(=O)CCCCNCCCCCCCC(=O)O AIFCHEM-5674598020 [0,2,0,0,0,0|1,0,1]=4 654 B18R0.114 COC(=O)CCCCNCCCCCCSC(=O)C AIFCHEM-6270516788 [0,2,0,0,0,0|1,0,1]=4 655 B18R0.114 COC(=O)CCCNCCCCCCCCC(=O)O AIFCHEM-6117523271 [0,2,0,0,0,0|1,0,1]=4 656 B18R0.114 COC(=O)CCNCCCCCCCCCC(=O)O AIFCHEM-6108284994 [0,2,0,0,0,0|1,0,1]=4 657 B18R0.126 CCCCCCC(=O)NCCCCCCC(=O)OC AIFCHEM-94521984631 [0,2,0,0,0,0|0,0,1]=3 658 B18R0.126 CCCCCCC(C)NCCCCCCC(=O)OC AIFCHEM-5842905661 [0,2,0,0,0,0|0,0,0]=2 659 B18R0.126 CCCCCNC(=O)CCCCCCCC(=O)OC AIFCHEM-94552827887 [0,2,0,0,0,0|0,0,1]=3 660 B18R0.126 CCCCOCC(=O)NCCCCCCC(=O)OC AIFCHEM-5828970579 [0,2,0,0,0,0|1,0,1]=4 661 B18R0.126 CCOCCNC(=O)CCCCCCCC(=O)OC AIFCHEM-94548612946 [0,2,0,0,0,0|1,0,1]=4 662 B18R0.126 CCSCCNC(=O)CCCCCCCC(=O)OC AIFCHEM-94566124584 [0,2,0,0,0,0|1,0,1]=4 663 B18R0.126 COC(=O)CCCCCCCC(=O)NCCCSC AIFCHEM-94529060894 [0,2,0,0,0,0|1,0,1]=4 664 B18R0.126 COC(=O)CCCCCCNC(=O)CCCCCO AIFCHEM-5844061780 [0,2,0,0,0,0|1,0,1]=4 665 B18R0.126 COCCCNC(=O)CCCCCCCC(=O)OC AIFCHEM-5644738140 [0,2,0,0,0,0|1,0,1]=4 666 B18R0.171 C#CC(=O)NCCCCCCCCCCCCCC AIFCHEM-94525195950 [0,2,0,0,0,0|1,0,1]=4 667 B18R0.171 CCCCCCCCCCCCCCNC(=O)CC AIFCHEM-94526504397 [0,2,0,0,0,0|1,0,0]=3 668 B18R0.171 CCCCCCCCCCCCCCNC(=O)CO AIFCHEM-94532679602 [0,2,0,0,0,0|2,0,0]=4 669 B18R0.171 CCCCCCCCCCCCNCCC(=O)OC AIFCHEM-6174018877 [0,2,0,0,0,0|0,0,0]=2 670 B18R0.171 CCCCCCCCCCCNCCCC(=O)OC AIFCHEM-94592445390 [0,2,0,0,0,0|0,0,0]=2 671 B18R0.171 CCCCCCCCCCCNCCNC(=O)CC AIFCHEM-94532522493 [0,2,0,0,0,0|1,0,0]=3 672 B18R0.171 CCCCCCCCCCNCCCCC(=O)OC AIFCHEM-5603753496 [0,2,0,0,0,0|0,0,0]=2 673 B18R0.171 CCCCCCCCCNCCCCCC(=O)OC AIFCHEM-6178196920 [0,2,0,0,0,0|0,0,0]=2 674 B18R0.171 CCCCCCCCNCCCCCCC(=O)OC AIFCHEM-5827976416 [0,2,0,0,0,0|0,0,0]=2 675 B18R0.171 CCCCCCCNCCCCCCCC(=O)OC AIFCHEM-94589462829 [0,2,0,0,0,0|0,0,0]=2 676 B18R0.171 CCCCCCCNCCOCCOCC(=O)OC AIFCHEM-94589455605 [0,2,0,0,0,0|1,0,0]=3 677 B18R0.171 CCCCCNCCCCCCCCCC(=O)OC AIFCHEM-94551427377 [0,2,0,0,0,0|0,0,0]=2 678 B18R0.171 CCCCNCCCCCCCCCCC(=O)OC AIFCHEM-94523036203 [0,2,0,0,0,0|0,0,0]=2 679 B18R0.171 CCCNCCCCCCCCCCCC(=O)OC AIFCHEM-94569018653 [0,2,0,0,0,0|0,0,0]=2 680 B18R0.171 COC(=O)CCCCCCCCCNCCCSC AIFCHEM-94546177078 [0,2,0,0,0,0|0,0,0]=2 681 B18R0.171 COC(=O)CCCCCNCCCCCCCCO AIFCHEM-6483439273 [0,2,0,0,0,0|0,0,0]=2 682 B18R0.171 COC(=O)CCCCCNCCOCCOCCF AIFCHEM-5797379558 [0,2,0,0,0,0|2,0,0]=4 683 B18R0.171 COC(=O)CCCCCNCCOCCOCCO AIFCHEM-94521654477 [0,2,0,0,0,0|2,0,0]=4 684 B18R0.171 COC(=O)CCCCNCCCCCCCCCO AIFCHEM-6439540721 [0,2,0,0,0,0|0,0,0]=2 685 B18R0.171 COC(=O)CCCCNCCCOCCOCCO AIFCHEM-6405807300 [0,2,0,0,0,0|2,0,0]=4 686 B18R0.171 COC(=O)CCCNCCCCCCCCCCO AIFCHEM-94592439367 [0,2,0,0,0,0|0,0,0]=2 687 B18R0.171 COC(=O)CCOCCOCCNCCCCCO AIFCHEM-94583092618 [0,2,0,0,0,0|2,0,0]=4 688 B18R0.171 COCCOCCOCCNCCCCC(=O)OC AIFCHEM-6234459058 [0,2,0,0,0,0|2,0,0]=4 689 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)C AIFCHEM-94545047447 [0,2,0,0,0,0|1,0,0]=3 690 B18R0.174 CCCCCCCCCCCCCNC(=O)C(C)O AIFCHEM-94552343241 [0,2,0,0,0,0|1,0,0]=3 691 B18R0.174 CCCCCCCCCCCCCNC(=O)[C@@H](C)O AIFCHEM-94552336214 [0,2,0,0,0,0|1,0,0]=3 692 B18R0.174 CCCCCCCCCCCCCNC(=O)[C@H](C)O AIFCHEM-94552344238 [0,2,0,0,0,0|1,0,0]=3 693 B18R0.174 CCCCCCCCCCCCNCC(=O)N(C)C AIFCHEM-5653380892 [0,2,0,0,0,0|1,0,0]=3 694 B18R0.174 CCCCCCCCCCCNCCC(=O)N(C)C AIFCHEM-5808600385 [0,2,0,0,0,0|1,0,0]=3 695 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)NC AIFCHEM-94608441324 [0,2,0,0,0,0|1,0,0]=3 696 B18R0.175 CCCCCCCCCCCCN(C)CC(=O)OC AIFCHEM-6060914292 [0,2,0,0,0,0|0,0,0]=2 697 B18R0.175 CCCCCCCCCCCNC(=O)CC(=O)OC AIFCHEM-94549714814 [0,2,0,0,0,0|0,0,1]=3 698 B18R0.175 CCCCCCCCCCCNC(C)CC(=O)NC AIFCHEM-94602604793 [0,2,0,0,0,0|1,0,0]=3 699 B18R0.175 CCCCCCCCCCCNC(C)CC(=O)OC AIFCHEM-6083825805 [0,2,0,0,0,0|0,0,0]=2 700 B18R0.175 CCCCCCCCCCCN[C@@H](C)CC(=O)OC AIFCHEM-5718557795 [0,2,0,0,0,0|0,0,0]=2 701 B18R0.175 CCCCCCCCCCCN[C@H](C)CC(=O)OC AIFCHEM-5946642282 [0,2,0,0,0,0|0,0,0]=2 702 B18R0.175 CNC(=O)CC(C)NCCCCCCCCCCO AIFCHEM-94602598770 [0,2,0,0,0,0|2,0,0]=4 703 B18R0.175 COC(=O)CC(C)NCCCCCCCCCCO AIFCHEM-6506995829 [0,2,0,0,0,0|1,0,0]=3 704 B18R0.189 CCCCCCCCCCCCCC(=O)N(C)CC AIFCHEM-94563268166 [0,2,0,0,0,0|1,0,0]=3 705 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)C#N AIFCHEM-94584709468 [0,2,0,0,0,0|2,0,0]=4 706 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)CC AIFCHEM-94584457037 [0,2,0,0,0,0|2,0,0]=4 707 B18R0.189 CCCCCCCCCCCCNC(=O)C(C)OC AIFCHEM-94584708057 [0,2,0,0,0,0|1,0,0]=3 708 B18R0.189 CCCCCCCCCCCCNC(=O)C(O)CC AIFCHEM-94584709232 [0,2,0,0,0,0|2,0,0]=4 709 B18R0.189 CCCCCCCCCCCCNC(=O)C(O)CO AIFCHEM-94584462432 [0,2,0,0,0,0|2,0,0]=4 710 B18R0.189 CCCCCCCCCCCCNC(=O)[C@@H](C)CC AIFCHEM-94584459214 [0,2,0,0,0,0|2,0,0]=4 711 B18R0.189 CCCCCCCCCCCCNC(=O)[C@@H](C)OC AIFCHEM-5626946671 [0,2,0,0,0,0|1,0,0]=3 712 B18R0.189 CCCCCCCCCCCCNC(=O)[C@@H](O)CC AIFCHEM-94584461536 [0,2,0,0,0,0|2,0,0]=4 713 B18R0.189 CCCCCCCCCCCCNC(=O)[C@H](C)CC AIFCHEM-5616627249 [0,2,0,0,0,0|2,0,0]=4 714 B18R0.189 CCCCCCCCCCCCNC(=O)[C@H](C)OC AIFCHEM-5616273912 [0,2,0,0,0,0|1,0,0]=3 715 B18R0.189 CCCCCCCCCCCCNC(=O)[C@H](O)CC AIFCHEM-94536259231 [0,2,0,0,0,0|2,0,0]=4 716 B18R0.189 CCCCCCCCCCCCNC(C)C(=O)NC AIFCHEM-5807720740 [0,2,0,0,0,0|1,0,0]=3 717 B18R0.189 CCCCCCCCCCCCNC(C)C(=O)OC AIFCHEM-5795182254 [0,2,0,0,0,0|0,0,0]=2 718 B18R0.189 CCCCCCCCCCCCN[C@@H](C)C(=O)NC AIFCHEM-5901668356 [0,2,0,0,0,0|1,0,0]=3 719 B18R0.189 CCCCCCCCCCCCN[C@@H](C)C(=O)OC AIFCHEM-5758065611 [0,2,0,0,0,0|0,0,0]=2 720 B18R0.189 CCCCCCCCCCCCN[C@H](C)C(=O)NC AIFCHEM-6039535791 [0,2,0,0,0,0|1,0,0]=3 721 B18R0.189 CCCCCCCCCCCCN[C@H](C)C(=O)OC AIFCHEM-5774267940 [0,2,0,0,0,0|0,0,0]=2 722 B18R0.189 CCCCCCCCCCCNCC(=O)N(C)OC AIFCHEM-6044036905 [0,2,0,0,0,0|1,0,0]=3 723 B18R0.189 CCCCCCCCCCCNCC(C)C(=O)OC AIFCHEM-5816953100 [0,2,0,0,0,0|0,0,0]=2 724 B18R0.189 CCCCCCCCCCCNCC(O)C(=O)OC AIFCHEM-6491765177 [0,2,0,0,0,0|0,0,0]=2 725 B18R0.189 CCCCCCCCCCCNC[C@H](O)C(=O)OC AIFCHEM-6491034614 [0,2,0,0,0,0|0,0,0]=2 726 B18R0.189 CCCCCCCCCCNCC[C@H](O)C(=O)OC AIFCHEM-6496600490 [0,2,0,0,0,0|0,0,0]=2 727 B18R0.1436 CCCC(C)NCCCCCCCCCC(=O)OC AIFCHEM-94606112585 [0,2,0,0,0,0|0,0,0]=2 728 B18R0.1436 CCOC(=O)CCCCCCNCCCC(=O)OC AIFCHEM-6117391080 [0,2,0,0,0,0|1,0,1]=4 729 B18R0.1436 CCOC(=O)CCCCCNCCCCC(=O)OC AIFCHEM-5837925131 [0,2,0,0,0,0|1,0,1]=4 730 B18R0.1436 CCOC(=O)CCCCNCCCCCC(=O)OC AIFCHEM-6154378063 [0,2,0,0,0,0|1,0,1]=4 731 B18R0.1436 COC(=O)CCCCCCCCCNC(=O)CCO AIFCHEM-6018120993 [0,2,0,0,0,0|1,0,1]=4 732 B18R0.1436 COC(=O)CCCCCCCCCNC(=O)CSC AIFCHEM-6074804818 [0,2,0,0,0,0|1,0,1]=4 733 B18R0.1436 COC(=O)CCCCCCCCCNC(C)CCO AIFCHEM-6011965019 [0,2,0,0,0,0|1,0,0]=3 734 B18R0.1436 COCC(=O)NCCCCCCCCCC(=O)OC AIFCHEM-6017696766 [0,2,0,0,0,0|1,0,1]=4 735 B18R0.1436 COCC(C)NCCCCCCCCCC(=O)OC AIFCHEM-6037452708 [0,2,0,0,0,0|1,0,0]=3 736 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)CC AIFCHEM-94536648223 [0,2,0,0,0,0|1,0,1]=4 737 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)NC AIFCHEM-94562548084 [0,2,0,0,0,0|1,0,1]=4 738 B18R0.7795 CCCCCCCCCCCC(=O)NCC(=O)OC AIFCHEM-6234995218 [0,2,0,0,0,0|0,0,1]=3 739 B18R0.7795 CCCCCCCCCCCC(C)NCC(=O)NC AIFCHEM-5912262262 [0,2,0,0,0,0|1,0,0]=3 740 B18R0.7795 CCCCCCCCCCCC(C)NCC(=O)OC AIFCHEM-6234416350 [0,2,0,0,0,0|0,0,0]=2 741 B18R0.7795 CCCCCCCCCCCC(C)NCC(C)OC AIFCHEM-5811532589 [0,2,0,0,0,0|1,0,1]=4 742 B18R0.7795 CCCCCCCCCCCC(C)NC[C@@H](C)OC AIFCHEM-94608840330 [0,2,0,0,0,0|1,0,1]=4 743 B18R0.7795 CCCCCCCCCCCC(C)NC[C@H](C)OC AIFCHEM-94588784236 [0,2,0,0,0,0|1,0,1]=4 744 B18R0.7795 CCCCCCCCCCCN(C)CCC(=O)NC AIFCHEM-94601208153 [0,2,0,0,0,0|1,0,0]=3 745 B18R0.7795 CCCCCCCCCCCN(C)CCC(=O)OC AIFCHEM-5713253979 [0,2,0,0,0,0|0,0,0]=2 746 B18R0.7795 CCCCCCCCCCNC(=O)CNC(=O)OC AIFCHEM-5663191997 [0,2,0,0,0,0|1,0,1]=4 747 B18R0.7795 CCCCCCCCCCNC(C)CCC(=O)OC AIFCHEM-5662967113 [0,2,0,0,0,0|0,0,0]=2 748 B18R0.7795 CCCCCCCCCCN[C@@H](C)CCC(=O)OC AIFCHEM-5797863508 [0,2,0,0,0,0|0,0,0]=2 749 B18R0.7795 COC(=O)CCC(C)NCCCCCCCCCO AIFCHEM-6486940424 [0,2,0,0,0,0|1,0,0]=3 750 B18R0.15765 CCC(=O)NCCCCCCCCCCC(=O)OC AIFCHEM-94526506037 [0,2,0,0,0,0|0,0,1]=3 751 B18R0.15765 CCC(C)CNCCCCCCCCCC(=O)OC AIFCHEM-6038651654 [0,2,0,0,0,0|0,0,0]=2 752 B18R0.15765 COC(=O)CCCCCCCCCCNC(=O)CO AIFCHEM-94532681242 [0,2,0,0,0,0|1,0,1]=4 753 B18R0.15765 COC(=O)CCCCCCCCCNCC(O)CO AIFCHEM-6038699177 [0,2,0,0,0,0|1,0,0]=3 754 B18R0.15765 COC(=O)CCCCCCCCCNC[C@H](O)CO AIFCHEM-94590558785 [0,2,0,0,0,0|1,0,0]=3 755 B18R0.15765 COC(=O)CCCCCCCNCCCC(=O)OC AIFCHEM-94592445854 [0,2,0,0,0,0|1,0,1]=4 756 B18R0.15765 COC(=O)CCCCCCNCCCCC(=O)OC AIFCHEM-5843061662 [0,2,0,0,0,0|1,0,1]=4 757 B18R0.15765 COC(=O)CCCCCNCCCCCC(=O)OC AIFCHEM-5627258977 [0,2,0,0,0,0|1,0,1]=4 758 B18R0.17427 CCCCCCCCCCC(=O)NCCC(=O)OC AIFCHEM-6131801887 [0,2,0,0,0,0|0,0,1]=3 759 B18R0.17427 CCCCCCCCCCN(C)CCCC(=O)OC AIFCHEM-5598444904 [0,2,0,0,0,0|0,0,0]=2 760 B18R0.17427 CCCCCCCCCNC(=O)CCCC(=O)CC AIFCHEM-94552433419 [0,2,0,0,0,0|1,0,1]=4 761 B18R0.17427 CCCCCCCCCNC(=O)CCCC(=O)OC AIFCHEM-6163862231 [0,2,0,0,0,0|0,0,1]=3 762 B18R0.17427 CCCCCCCCCNC(=O)CSCC(=O)OC AIFCHEM-6144079676 [0,2,0,0,0,0|1,0,1]=4 763 B18R0.17427 CCCCCCCCCNC(C)CCCC(=O)OC AIFCHEM-6154841990 [0,2,0,0,0,0|0,0,0]=2 764 B18R0.17427 CCCCCCCCOCC(=O)NCCC(=O)OC AIFCHEM-6150581837 [0,2,0,0,0,0|1,0,1]=4 765 B18R0.17427 COC(=O)CCCC(C)NCCCCCCCCO AIFCHEM-6472346763 [0,2,0,0,0,0|1,0,0]=3 766 B18R0.17427 COC(=O)CCNC(=O)CCCCCCCCCO AIFCHEM-6150413036 [0,2,0,0,0,0|1,0,1]=4 767 B18R0.19358 CCCCCCCCCCCNCCC(C)(C)OC AIFCHEM-5875601992 [0,2,0,0,0,0|1,0,1]=4 768 B18R0.19859 CCCCC(C)NCCOCCOCCC(=O)OC AIFCHEM-94541398049 [0,2,0,0,0,0|2,0,0]=4 769 B18R0.19859 CCCNC(=O)CCCCCCCCCC(=O)OC AIFCHEM-94521378048 [0,2,0,0,0,0|0,0,1]=3 770 B18R0.19859 COC(=O)CCCCCCCCCC(=O)NCCF AIFCHEM-5802099678 [0,2,0,0,0,0|1,0,1]=4 771 B18R0.19913 CCCCCCCCCCCCNCC(CO)OC AIFCHEM-6439992980 [0,2,0,0,0,0|0,0,2]=4 772 B18R0.19913 CCCCCCCCCCCCNCC(OC)OC AIFCHEM-94536253228 [0,2,0,0,0,0|0,0,2]=4 773 B18R0.19913 CCCCCCCCCCNCCCC(OC)OC AIFCHEM-94526289859 [0,2,0,0,0,0|0,0,2]=4 774 B18R0.20486 CCCCCC(=O)NCCCCCCCC(=O)OC AIFCHEM-94585556586 [0,2,0,0,0,0|0,0,1]=3 775 B18R0.20486 CCCCCC(C)NCCCCCCCC(=O)OC AIFCHEM-94564413040 [0,2,0,0,0,0|0,0,0]=2 776 B18R0.20486 CCCCCC(C)NCCOCCOCC(=O)OC AIFCHEM-94564405816 [0,2,0,0,0,0|2,0,0]=4 777 B18R0.20486 CCCCNC(=O)CCCCCCCCC(=O)OC AIFCHEM-94570984388 [0,2,0,0,0,0|0,0,1]=3 778 B18R0.20486 CCCOCC(=O)NCCCCCCCC(=O)OC AIFCHEM-5831427794 [0,2,0,0,0,0|1,0,1]=4 779 B18R0.20486 COC(=O)CCCCCCCCC(=O)NCCSC AIFCHEM-94598933463 [0,2,0,0,0,0|1,0,1]=4 780 B18R0.20486 COC(=O)CCCCCCCNC(C)CCCC#N AIFCHEM-94560947866 [0,2,0,0,0,0|1,0,1]=4 781 B18R0.20486 COCCNC(=O)CCCCCCCCC(=O)OC AIFCHEM-6039354874 [0,2,0,0,0,0|1,0,1]=4 782 B18R0.45 CCCCCCCCCCCN(C)CC(=O)OCC AIFCHEM-5841153284 [0,2,0,0,0,0|1,0,0]=3 783 B18R0.45 CCCCCCCCCCNC(C)CC(=O)OCC AIFCHEM-5694981801 [0,2,0,0,0,0|1,0,0]=3 784 B18R0.45 CCCCCCCCCCN[C@@H](C)CC(=O)OCC AIFCHEM-6078051787 [0,2,0,0,0,0|1,0,0]=3 785 B18R0.45 CCOC(=O)CC(C)NCCCCCCCCCO AIFCHEM-94544055203 [0,2,0,0,0,0|2,0,0]=4 786 B18R0.161 CCOC(=O)CCCCCCNC[C@H](C)CCCO AIFCHEM-94603290330 [0,2,0,0,0,0|2,0,0]=4 787 B18R0.166 CCCCCC(=O)NCCCCCCC(=O)OCC AIFCHEM-94585552222 [0,2,0,0,0,0|1,0,1]=4 788 B18R0.166 CCCCCC(C)NCCCCCCC(=O)OCC AIFCHEM-94564407587 [0,2,0,0,0,0|1,0,0]=3 789 B18R0.166 CCCCNC(=O)CCCCCCCC(=O)OCC AIFCHEM-5752210421 [0,2,0,0,0,0|1,0,1]=4 790 B18R0.177 CC#CC(=O)N(C)CCCCCCCCCCCC AIFCHEM-5919129535 [0,2,0,0,0,0|2,0,0]=4 791 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CCO AIFCHEM-5920333312 [0,2,0,0,0,0|2,0,0]=4 792 B18R0.177 CCCCCCCCCCCCN(C)C(=O)COC AIFCHEM-5899403216 [0,2,0,0,0,0|1,0,0]=3 793 B18R0.177 CCCCCCCCCCCCN(C)C(=O)CSC AIFCHEM-5919350156 [0,2,0,0,0,0|1,1,0]=4 794 B18R0.177 CCCCCCCCCCCNC(C)C(=O)OCC AIFCHEM-5886046604 [0,2,0,0,0,0|1,0,0]=3 795 B18R0.177 CCCCCCCCCCCN[C@@H](C)C(=O)NCC AIFCHEM-94595321699 [0,2,0,0,0,0|2,0,0]=4 796 B18R0.177 CCCCCCCCCCCN[C@@H](C)C(=O)OCC AIFCHEM-5796990723 [0,2,0,0,0,0|1,0,0]=3 797 B18R0.177 CCCCCCCCCCCN[C@@H](C)C(=O)SCC AIFCHEM-5725395533 [0,2,0,0,0,0|1,1,0]=4 798 B18R0.177 CCCCCCCCCCNCC(C)C(=O)OCC AIFCHEM-5626790303 [0,2,0,0,0,0|1,0,0]=3 799 B18R0.177 CCOC(=O)C(C)CNCCCCCCCCCO AIFCHEM-6501250775 [0,2,0,0,0,0|2,0,0]=4 800 B18R0.220 CCCCCCCCCCCCCC(=O)NC(C)C AIFCHEM-94520549694 [0,2,0,0,0,0|1,0,0]=3 801 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)C AIFCHEM-94536262012 [0,2,0,0,0,0|2,0,0]=4 802 B18R0.220 CCCCCCCCCCCCNC(=O)CC(C)O AIFCHEM-5684553592 [0,2,0,0,0,0|2,0,0]=4 803 B18R0.220 CCCCCCCCCCCCNC(=O)CC(F)F AIFCHEM-5684374564 [0,2,0,0,0,0|2,0,0]=4 804 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C AIFCHEM-5684412073 [0,2,0,0,0,0|2,0,0]=4 805 B18R0.220 CCCCCCCCCCCCNC(=O)C[C@@H](C)O AIFCHEM-94584709408 [0,2,0,0,0,0|2,0,0]=4 806 B18R0.220 CCCCCCCCCCCCNC(=O)C[C@H](C)O AIFCHEM-94584709347 [0,2,0,0,0,0|2,0,0]=4 807 B18R0.3155 C#CCCC(=O)NCCCCCCCCCCCC AIFCHEM-94536262845 [0,2,0,0,0,0|2,0,0]=4 808 B18R0.3155 C#CCNC(=O)CCCCCCCCCCCCC AIFCHEM-6196106311 [0,2,0,0,0,0|1,0,0]=3 809 B18R0.3155 C/C=C/CC(=O)NCCCCCCCCCCCC AIFCHEM-94584704724 [0,2,0,0,0,0|2,0,0]=4 810 B18R0.3155 CCC#CC(=O)NCCCCCCCCCCCC AIFCHEM-94584463380 [0,2,0,0,0,0|2,0,0]=4 811 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCC AIFCHEM-94521379079 [0,2,0,0,0,0|1,0,0]=3 812 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF AIFCHEM-5853829791 [0,2,0,0,0,0|1,0,0]=3 813 B18R0.3155 CCCCCCCCCCCCNC(=O)C#CCO AIFCHEM-5684500273 [0,2,0,0,0,0|2,0,0]=4 814 B18R0.3155 CCCCCCCCCCCCNC(=O)CCC#N AIFCHEM-94584458903 [0,2,0,0,0,0|2,0,0]=4 815 B18R0.3155 CCCCCCCCCCCCNC(=O)CCCC AIFCHEM-94534101661 [0,2,0,0,0,0|2,0,0]=4 816 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC AIFCHEM-94536260174 [0,2,0,0,0,0|1,0,0]=3 817 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC AIFCHEM-5615676105 [0,2,0,0,0,0|1,1,0]=4 818 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC AIFCHEM-94584709419 [0,2,0,0,0,0|1,0,0]=3 819 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC AIFCHEM-94580214708 [0,2,0,0,0,0|1,1,0]=4 820 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCF AIFCHEM-5895698639 [0,2,0,0,0,0|2,0,0]=4 821 B18R0.11638 CCCCCCCCCC(=O)NCCC(=O)OCC AIFCHEM-6017648963 [0,2,0,0,0,0|1,0,1]=4 822 B18R0.11638 CCCCCCCCCC(C)CNCC(=O)NCC AIFCHEM-94601553646 [0,2,0,0,0,0|2,0,0]=4 823 B18R0.11638 CCCCCCCCCC(C)NCCC(=O)OCC AIFCHEM-6037086234 [0,2,0,0,0,0|1,0,0]=3 824 B18R0.11638 CCCCCCCCCN(C)CCCC(=O)OCC AIFCHEM-5944271712 [0,2,0,0,0,0|1,0,0]=3 825 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC AIFCHEM-5796575741 [0,2,0,0,0,0|1,0,1]=4 826 B18R0.11638 CCCCCCCCNC(C)CCCC(=O)OCC AIFCHEM-94560921211 [0,2,0,0,0,0|1,0,0]=3 827 B18R0.11638 CCCCOCCCNC(C)CCCC(=O)OCC AIFCHEM-94560922371 [0,2,0,0,0,0|2,0,0]=4 828 B18R0.11638 CCOC(=O)CCCC(C)NCCCCCCCO AIFCHEM-94560923405 [0,2,0,0,0,0|2,0,0]=4 829 B18R0.19210 CCCCCCCCCCC(=O)NCC(=O)OCC AIFCHEM-5663790337 [0,2,0,0,0,0|1,0,1]=4 830 B18R0.19210 CCCCCCCCCNC(C)CCC(=O)OCC AIFCHEM-6154951005 [0,2,0,0,0,0|1,0,0]=3 831 B18R0.19210 CCOC(=O)CCC(C)NCCCCCCCCO AIFCHEM-6395773634 [0,2,0,0,0,0|2,0,0]=4 832 B18R0.19354 CCOC(=O)CCCCCCNCCCCN(C)C AIFCHEM-94602183857 [0,2,0,0,0,0|2,0,0]=4 833 B18R0.19354 CCOC(=O)CCCCCNCCCCCN(C)C AIFCHEM-5659272812 [0,2,0,0,0,0|2,0,0]=4 834 B18R0.213 COC(=O)CCCCCCNC(C)CCCC(C)C AIFCHEM-5828598227 [0,2,0,0,0,0|1,0,0]=3 835 B18R0.245 CCCC(C)CC(=O)NCCCCCCC(=O)OC AIFCHEM-5828930282 [0,2,0,0,0,0|1,0,1]=4 836 B18R0.245 CCCC(C)NC(=O)CCCCCCCC(=O)OC AIFCHEM-94560480167 [0,2,0,0,0,0|1,0,1]=4 837 B18R0.245 CCC[C@@H](C)NC(=O)CCCCCCCC(=O)OC AIFCHEM-6011265038 [0,2,0,0,0,0|1,0,1]=4 838 B18R0.245 CCC[C@H](C)NC(=O)CCCCCCCC(=O)OC AIFCHEM-5614235337 [0,2,0,0,0,0|1,0,1]=4 839 B18R0.6678 CCCCC(C)C(=O)NCCCCCCC(=O)OC AIFCHEM-5885434701 [0,2,0,0,0,0|1,0,1]=4 840 B18R0.6965 CCCCCC(CC)NCCCCCCC(=O)OC AIFCHEM-94563174937 [0,2,0,0,0,0|1,0,0]=3 841 B18R0.13485 CCC(C)CCC(=O)NCCCCCCC(=O)OC AIFCHEM-5843096015 [0,2,0,0,0,0|1,0,1]=4 842 B18R0.13485 CCC(C)CNC(=O)CCCCCCCC(=O)OC AIFCHEM-94534480173 [0,2,0,0,0,0|1,0,1]=4 843 B18R0.3149 CCCCCCCCCCCNC(CC)C(=O)OC AIFCHEM-5604298253 [0,2,0,0,0,0|1,0,0]=3 844 B18R0.3149 CCCCCCCCCCCNC(CO)C(=O)OC AIFCHEM-6499032724 [0,2,0,0,0,0|1,0,0]=3 845 B18R0.3149 CCCCCCCCCCCN[C@@H](CC)C(=O)OC AIFCHEM-5790298996 [0,2,0,0,0,0|1,0,0]=3 846 B18R0.3149 CCCCCCCCCCCN[C@@H](CO)C(=O)OC AIFCHEM-6460193531 [0,2,0,0,0,0|1,0,0]=3 847 B18R0.3149 CCCCCCCCCCCN[C@H](CC)C(=O)OC AIFCHEM-6104753230 [0,2,0,0,0,0|1,0,0]=3 848 B18R0.3149 CCCCCCCCCCCN[C@H](CO)C(=O)OC AIFCHEM-6507585655 [0,2,0,0,0,0|1,0,0]=3 849 B18R0.11196 CCCCCCCCCCCN(C)[C@@H](C)C(=O)OC AIFCHEM-94548157897 [0,2,0,0,0,0|1,0,0]=3 850 B18R0.11196 CCCCCCCCCCNC(=O)C(C)C(=O)OC AIFCHEM-5604778828 [0,2,0,0,0,0|1,0,1]=4 851 B18R0.13763 CCCCCCCCCCCNC(C)(C)C(=O)OC AIFCHEM-5943585105 [0,2,0,0,0,0|1,0,0]=3 852 B18R0.13763 CCCCCCCCCCNCC(C)(C)C(=O)OC AIFCHEM-5603831337 [0,2,0,0,0,0|1,0,0]=3 853 B18R0.13763 COC(=O)C(C)(C)CNCCCCCCCCCO AIFCHEM-6486804694 [0,2,0,0,0,0|2,0,0]=4 854 B18R0.16162 CCN(C)C(=O)CCCCCCCCCC(=O)OC AIFCHEM-94563267135 [0,2,0,0,0,0|1,0,1]=4 855 B18R0.16162 COC(=O)CCCCCCNCC[C@@H](O)[C@@H](O)CO AIFCHEM-5842798255 [0,2,0,0,0,0|2,0,0]=4 856 B18R0.16162 COC(=O)CCCCCCNCC[C@H](O)[C@H](O)CO AIFCHEM-5820487627 [0,2,0,0,0,0|2,0,0]=4 857 B18R0.17443 CCCCCCCCCCC(=O)NC(C)C(=O)OC AIFCHEM-5795935988 [0,2,0,0,0,0|1,0,1]=4 858 B18R0.17443 CCCCCCCCCCC(=O)N[C@@H](C)C(=O)OC AIFCHEM-5729864535 [0,2,0,0,0,0|1,0,1]=4 859 B18R0.17443 CCCCCCCCCCC(=O)N[C@H](C)C(=O)OC AIFCHEM-5774561829 [0,2,0,0,0,0|1,0,1]=4 860 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)C AIFCHEM-94545052135 [0,2,0,0,0,0|2,0,0]=4 861 B18R0.19787 CCCCCCCCCCCCN(C)C(=O)C(C)O AIFCHEM-94540234672 [0,2,0,0,0,0|2,0,0]=4 862 B18R0.19822 CCCCCCCCCC(=O)NCC(C)C(=O)OC AIFCHEM-5853024497 [0,2,0,0,0,0|1,0,1]=4 863 B18R0.19822 CCCCCCCCCC(C)CNC(C)C(=O)NC AIFCHEM-94601551019 [0,2,0,0,0,0|2,0,0]=4 864 B18R0.19822 CCCCCCCCCC(C)CN[C@@H](C)C(=O)NC AIFCHEM-94601553549 [0,2,0,0,0,0|2,0,0]=4 865 B18R0.19822 CCCCCCCCCC(C)CN[C@@H](C)C(=O)OC AIFCHEM-94601549202 [0,2,0,0,0,0|1,0,0]=3 866 B18R0.19822 CCCCCCCCCC(C)CN[C@H](C)C(=O)NC AIFCHEM-94601553553 [0,2,0,0,0,0|2,0,0]=4 867 B18R0.19822 CCCCCCCCCC(C)CN[C@H](C)C(=O)OC AIFCHEM-94601545464 [0,2,0,0,0,0|1,0,0]=3 868 B18R0.19822 CCCCCCCCCC(C)NCC(C)C(=O)OC AIFCHEM-5788876374 [0,2,0,0,0,0|1,0,0]=3 869 B18R0.19822 CCCCCCCCCC(C)NCC(O)C(=O)OC AIFCHEM-6506908136 [0,2,0,0,0,0|1,0,0]=3 870 B18R0.19822 CCCCCCCCCC(C)NC[C@H](O)C(=O)OC AIFCHEM-6499663238 [0,2,0,0,0,0|1,0,0]=3 871 B18R0.118 COC(=O)CCCCCCCCCC(=O)NC(C)C AIFCHEM-94520548663 [0,2,0,0,0,0|1,0,1]=4 872 B18R0.1598 CCCC(C)C(=O)NCCCCCCCC(=O)OC AIFCHEM-5804933330 [0,2,0,0,0,0|1,0,1]=4 873 B18R0.3150 CCCCCCCCCCCCCN(CC)C(=O)C AIFCHEM-98289010524 [0,2,0,0,0,0|2,0,0]=4 874 B18R0.13323 CCC(CC)NCCCCCCCCCC(=O)OC AIFCHEM-94538322833 [0,2,0,0,0,0|1,0,0]=3 875 B18R0.13323 CCC(CO)NCCCCCCCCCC(=O)OC AIFCHEM-6017211797 [0,2,0,0,0,0|1,0,0]=3 876 B18R0.13323 CCN(CC)CCCCNCCCCCC(=O)OC AIFCHEM-6046113186 [0,2,0,0,0,0|2,0,0]=4 877 B18R0.13323 COC(=O)CCCCCCCCCNC(CO)CO AIFCHEM-94606739850 [0,2,0,0,0,0|2,0,0]=4 878 B18R0.15771 COC(=O)CCCCCCCCC(=O)NCC(C)C AIFCHEM-94563733685 [0,2,0,0,0,0|1,0,1]=4 879 B18R0.15771 COC(=O)CCCCCCCNC(C)CCC(C)C AIFCHEM-94561179099 [0,2,0,0,0,0|1,0,0]=3 880 B18R0.15771 COC(=O)CCCCCCCNC(C)CCN(C)C AIFCHEM-5865033646 [0,2,0,0,0,0|2,0,0]=4 881 B18R0.16003 CCC(C)CC(=O)NCCCCCCCC(=O)OC AIFCHEM-5831614109 [0,2,0,0,0,0|1,0,1]=4 882 B18R0.16003 CC[C@H](C)CC(=O)NCCCCCCCC(=O)OC AIFCHEM-5872694670 [0,2,0,0,0,0|1,0,1]=4 883 B18R0.11632 CCCCCCCCCC(C)NCCC(=O)N(C)C AIFCHEM-5787171855 [0,2,0,0,0,0|2,0,0]=4 884 B18R0.19809 CCCCCCCCCC(=O)NC(C)CC(=O)OC AIFCHEM-6020871555 [0,2,0,0,0,0|1,0,1]=4 885 B18R0.19809 CCCCCCCCCC(=O)N[C@@H](C)CC(=O)OC AIFCHEM-5773662517 [0,2,0,0,0,0|1,0,1]=4 886 B18R0.19809 CCCCCCCCCC(=O)N[C@H](C)CC(=O)OC AIFCHEM-5961571273 [0,2,0,0,0,0|1,0,1]=4 887 B18R0.19809 CCCCCCCCCC(C)CN(C)CC(=O)NC AIFCHEM-94608441267 [0,2,0,0,0,0|2,0,0]=4 888 B18R0.19809 CCCCCCCCCC(C)CN(C)CC(=O)OC AIFCHEM-94601544729 [0,2,0,0,0,0|1,0,0]=3 889 B18R0.19809 CCCCCCCCCC(C)N[C@@H](C)CC(=O)OC AIFCHEM-5765206933 [0,2,0,0,0,0|1,0,0]=3 890 B18R0.19809 CCCCCCCCCC(C)N[C@H](C)CC(=O)OC AIFCHEM-94564415951 [0,2,0,0,0,0|1,0,0]=3 891 B18R0.19809 CCCCCCCCNC(=O)CC(C)CC(=O)OC AIFCHEM-5823652266 [0,2,0,0,0,0|1,0,1]=4 892 B18R0.20144 CCCCCCCCCC(=O)N(C)CCC(=O)OC AIFCHEM-5774432438 [0,2,0,0,0,0|1,0,1]=4 893 B18R0.15767 COC(=O)CCCCCCCCCNC(=O)C(C)C AIFCHEM-94545044284 [0,2,0,0,0,0|1,0,1]=4 894 B18R0.15767 COC(=O)CCCCCCCCCNC(=O)C(C)O AIFCHEM-94540227381 [0,2,0,0,0,0|1,0,1]=4 895 B18R0.15767 COC(=O)CCCCCCCCCNC(=O)[C@@H](C)O AIFCHEM-6037928832 [0,2,0,0,0,0|1,0,1]=4 896 B18R0.15767 COC(=O)CCCCCCCCCNC(=O)[C@H](C)O AIFCHEM-6057268900 [0,2,0,0,0,0|1,0,1]=4 897 B18R0.15767 COC(=O)CCCCCCCCCNC(C)C(C)C AIFCHEM-94522504297 [0,2,0,0,0,0|1,0,0]=3 898 B18R0.15767 COC(=O)CCCCCCCCCNC(C)C(C)O AIFCHEM-94547066104 [0,2,0,0,0,0|1,0,0]=3 899 B18R0.15767 COC(=O)CCCCCCCCCNC(C)C(F)F AIFCHEM-94548671198 [0,2,0,0,0,0|2,0,0]=4 900 B18R0.7561 CCC(CCC(=O)OC)CNCCCCCCCO AIFCHEM-6409705347 [0,2,0,0,0,0|2,0,0]=4 901 B18R0.7561 CCC(CCC(=O)OC)NCCCCCCCCO AIFCHEM-6483392730 [0,2,0,0,0,0|2,0,0]=4 902 B18R0.7561 CCCCCCCCCCN(CC)CCC(=O)NC AIFCHEM-94518722941 [0,2,0,0,0,0|2,0,0]=4 903 B18R0.7561 CCCCCCCCCCN(CC)CCC(=O)OC AIFCHEM-94574559359 [0,2,0,0,0,0|1,0,0]=3 904 B18R0.7561 CCCCCCCCNCC(CC)CCC(=O)OC AIFCHEM-94578163117 [0,2,0,0,0,0|1,0,0]=3 905 B18R0.7561 CCCCOCCCNCC(CC)CCC(=O)OC AIFCHEM-5965419091 [0,2,0,0,0,0|2,0,0]=4 906 B18R0.19180 CCCCCCCCCCC(=O)N(C)CC(=O)OC AIFCHEM-6021153968 [0,2,0,0,0,0|1,0,1]=4 907 B18R0.19180 CCCCCCCCCCN(C)C(=O)CC(=O)OC AIFCHEM-94549714990 [0,2,0,0,0,0|1,0,1]=4 908 B18R0.186 CCCCCCCCCCCN(C)CC(=O)N(C)C AIFCHEM-6127107386 [0,2,0,0,0,0|2,0,0]=4 909 B18R0.72222 CCCCCCCCCCNC(C)(C)CC(=O)OC AIFCHEM-5602497342 [0,2,0,0,0,0|1,0,0]=3 910 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)C AIFCHEM-5627127249 [0,2,0,0,0,0|2,0,0]=4 911 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)O AIFCHEM-94584709191 [0,2,0,0,0,0|2,0,0]=4 912 B16R1.643 CCCCCCCCCCN1CCCOC1 AIFCHEM-5716063484 [1,0,0,1,0,0|1,0,1]=4 913 B16R1.1418 CCCCCCCNC1CCCCC1OC AIFCHEM-94589459125 [1,0,0,1,0,0|1,0,1]=4 914 B16R1.3891 CCCCCCCCCCCNC1COC1 AIFCHEM-94539429304 [1,0,0,1,0,0|1,0,1]=4 915 B16R1.3891 CCCCCCCCCCNCC1COC1 AIFCHEM-5895099549 [1,0,0,1,0,0|1,0,1]=4 916 B16R1.17458 COCCCNC1CCCCCCCCC1 AIFCHEM-94590929869 [1,0,0,1,0,0|1,0,1]=4 917 B16R1.642 CCCCCCCCCNC1CNC(=O)C1 AIFCHEM-6163717134 [1,0,0,1,0,0|2,0,0]=4 918 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 AIFCHEM-6133616970 [1,0,0,1,0,0|2,0,0]=4 919 B16R1.1095 COC(=O)CCCNCCCN1CCCC1 AIFCHEM-94592439366 [1,0,0,1,0,0|2,0,0]=4 920 B16R1.1166 COC(=O)CCCCCNC1CCCCC1 AIFCHEM-94601789784 [1,0,0,1,0,0|1,0,0]=3 921 B16R1.1166 COC(=O)CCCCCNC1CCCSC1 AIFCHEM-5646480628 [1,0,0,1,0,0|2,0,0]=4 922 B16R1.1166 COC(=O)CCCCCNC1CCSCC1 AIFCHEM-5664538863 [1,0,0,1,0,0|2,0,0]=4 923 B16R1.1166 COC(=O)CCCCNCC1CCOCC1 AIFCHEM-94579839148 [1,0,0,1,0,0|2,0,0]=4 924 B16R1.1353 COC(=O)CCCCCN1CCCC1CO AIFCHEM-6509350656 [1,0,0,1,0,0|2,0,0]=4 925 B16R1.1353 COC(=O)CCCCCN1CCC[C@@H]1CO AIFCHEM-6442034073 [1,0,0,1,0,0|2,0,0]=4 926 B16R1.1353 COC(=O)CCCCCN1CCC[C@H]1CO AIFCHEM-6411763629 [1,0,0,1,0,0|2,0,0]=4 927 B16R1.3258 COC(=O)CCCCCCCNC1CCC1 AIFCHEM-94576057603 [1,0,0,1,0,0|1,0,0]=3 928 B16R1.3258 COC(=O)CCCCCCCNC1CSC1 AIFCHEM-5804556552 [1,0,0,1,0,0|2,0,0]=4 929 B16R1.3907 CCCCCCCN1CCCC1C(=O)OC AIFCHEM-94582030359 [1,0,0,1,0,0|1,0,0]=3 930 B16R1.3907 CCCCCCCN1CCC[C@@H]1C(=O)OC AIFCHEM-94589461570 [1,0,0,1,0,0|1,0,0]=3 931 B16R1.3907 CCCCCCCN1CCC[C@H]1C(=O)OC AIFCHEM-94589455808 [1,0,0,1,0,0|1,0,0]=3 932 B16R1.4250 COC(=O)C1CCCCCC1NCCCO AIFCHEM-94523164439 [1,0,0,1,0,0|2,0,0]=4 933 B16R1.6695 CCCN1CCCC1CSCCC(=O)OC AIFCHEM-94569010933 [1,0,0,1,0,0|2,0,0]=4 934 B16R1.16924 COC(=O)CCCNCC1CCCCCC1 AIFCHEM-94532081622 [1,0,0,1,0,0|1,0,0]=3 935 B16R1.57 CCC1CCCCC1NCCCNC(=O)C AIFCHEM-94531735405 [1,0,0,1,0,0|2,0,0]=4 936 B16R1.290 CC(=O)NCCCCNC1CCCCC1C AIFCHEM-94585141453 [1,0,0,1,0,0|2,0,0]=4 937 B16R1.596 CC(=O)NCCCCNCC1CCCCC1 AIFCHEM-94585137303 [1,0,0,1,0,0|2,0,0]=4 938 B16R1.596 O=C(O)CCCCCCNC1CCCCC1 AIFCHEM-94601799461 [1,0,0,1,0,0|1,0,0]=3 939 B16R1.596 O=C(O)CCCCCNCC1CCCCC1 AIFCHEM-5895701807 [1,0,0,1,0,0|1,0,0]=3 940 B16R1.1275 CC(=O)NCCCCCNCC1CCCC1 AIFCHEM-94565857072 [1,0,0,1,0,0|2,0,0]=4 941 B16R1.1275 O=C(O)CCCCCCCNC1CCOC1 AIFCHEM-5927265824 [1,0,0,1,0,0|2,0,0]=4 942 B16R1.1275 O=C(O)CCCCCCCN[C@@H]1CCOC1 AIFCHEM-5859064525 [1,0,0,1,0,0|2,0,0]=4 943 B16R1.1275 O=C(O)CCCCCCCN[C@H]1CCOC1 AIFCHEM-5841549159 [1,0,0,1,0,0|2,0,0]=4 944 B16R1.1275 O=C(O)CCCCCCNCC1CCCC1 AIFCHEM-5735981509 [1,0,0,1,0,0|1,0,0]=3 945 B16R1.1275 O=C(O)NCCCCCCNC1CCCC1 AIFCHEM-94541521163 [1,0,0,1,0,0|2,0,0]=4 946 B16R1.1352 CCC1CCCC1NCCCCCC(=O)O AIFCHEM-5916520014 [1,0,0,1,0,0|1,0,0]=3 947 B16R1.1352 CCC1CCCC1NCCCCNC(=O)C AIFCHEM-94585140889 [1,0,0,1,0,0|2,0,0]=4 948 B16R1.3900 CCCCCCCN1CCSCC1C(=O)O AIFCHEM-94589465150 [1,0,0,1,0,0|2,0,0]=4 949 B16R1.6690 CCCCCCCCN1CCCC1C(=O)N AIFCHEM-94548054952 [1,0,0,1,0,0|2,0,0]=4 950 B16R1.6690 CCCCCCCCN1CCC[C@H]1C(=O)N AIFCHEM-94534025851 [1,0,0,1,0,0|2,0,0]=4 951 B16R1.7037 O=C(O)C1CCCCCN1CCCCCO AIFCHEM-5674545377 [1,0,0,1,0,0|2,0,0]=4 952 B16R1.8667 C[C@@H]1C[C@H]1CNCCCCCCCC(=O)O AIFCHEM-94599419813 [1,0,0,1,0,0|1,0,0]=3 953 B16R1.8667 C[C@@H]1C[C@H]1NCCCCCCCCC(=O)O AIFCHEM-94559008183 [1,0,0,1,0,0|1,0,0]=3 954 B16R1.8667 O=C(O)CCCCCCCCNC1CC1F AIFCHEM-94597360111 [1,0,0,1,0,0|2,0,0]=4 955 B16R1.8667 O=C(O)CCCCCCCCN[C@@H]1C[C@@H]1F AIFCHEM-6081681037 [1,0,0,1,0,0|2,0,0]=4 956 B16R1.8667 O=C(O)CCCCCCCCN[C@@H]1C[C@H]1F AIFCHEM-5808935465 [1,0,0,1,0,0|2,0,0]=4 957 B16R1.8667 O=C(O)CCCCCCCCN[C@H]1C[C@@H]1F AIFCHEM-6046756099 [1,0,0,1,0,0|2,0,0]=4 958 B16R1.12272 CC(=O)OCCNC1CCCCCCCC1 AIFCHEM-5598115488 [1,0,0,1,0,0|2,0,0]=4 959 B16R1.12272 O=C(O)CCCNC1CCCCCCCC1 AIFCHEM-5677445100 [1,0,0,1,0,0|1,0,0]=3 960 B16R1.12321 O=C(O)CCCCCCCNCC1CCC1 AIFCHEM-5836235053 [1,0,0,1,0,0|1,0,0]=3 961 B16R1.12321 O=C(O)CCCCCCCNCC1CCO1 AIFCHEM-94567679905 [1,0,0,1,0,0|2,0,0]=4 962 B16R1.12321 O=C(O)CCCCCCCNC[C@H]1CCO1 AIFCHEM-5718411143 [1,0,0,1,0,0|2,0,0]=4 963 B16R1.12354 O=C(O)CCCNCC1CCCCCCC1 AIFCHEM-94592422829 [1,0,0,1,0,0|1,0,0]=3 964 B16R1.17540 CCCCCCCCCN1CCC1C(=O)O AIFCHEM-5725299899 [1,0,0,1,0,0|1,0,0]=3 965 B16R1.17540 CCCCCCCCCN1CC[C@@H]1C(=O)O AIFCHEM-6135629642 [1,0,0,1,0,0|1,0,0]=3 966 B16R1.17540 CCCCCCCCCN1CC[C@H]1C(=O)O AIFCHEM-6245648569 [1,0,0,1,0,0|1,0,0]=3 967 B16R1.18063 O=C(O)CCCCCCCCCNC1CC1 AIFCHEM-94573316856 [1,0,0,1,0,0|1,0,0]=3 968 B16R1.18063 O=C(O)CCCCCCCCNCC1CC1 AIFCHEM-5911289323 [1,0,0,1,0,0|1,0,0]=3 969 B16R1.18063 O=C(O)CCCCCCCNCCC1CC1 AIFCHEM-5784106545 [1,0,0,1,0,0|1,0,0]=3 970 B16R1.18095 CC(=O)OCCCCNC1CCCCCC1 AIFCHEM-5654926408 [1,0,0,1,0,0|2,0,0]=4 971 B16R1.18095 CC(=O)SCCCNCC1CCCCCC1 AIFCHEM-94532084718 [1,0,0,1,0,0|2,0,0]=4 972 B16R1.18095 O=C(O)CCCCCNC1CCCCCC1 AIFCHEM-94529612978 [1,0,0,1,0,0|1,0,0]=3 973 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 AIFCHEM-6188836751 [1,0,0,1,0,0|1,0,0]=3 974 B18R1.4108 CCCCCCCN1CCCC(C1)CC(=O)OC AIFCHEM-94589456620 [0,1,0,1,0,0|1,0,0]=3 975 B18R1.4108 CCCCCCCN1CCC[C@H](C1)CC(=O)OC AIFCHEM-94589465097 [0,1,0,1,0,0|1,0,0]=3 976 B18R1.23136 COC(=O)CCCCCN1CCCC(C1)CCO AIFCHEM-6494403622 [0,1,0,1,0,0|2,0,0]=4 977 B18R1.1136 CCCCCCCCC(C)N[C@H]1CCC(=O)NC1 AIFCHEM-94579124649 [0,1,0,1,0,0|2,0,0]=4 978 B18R1.7248 CCC1COCCN1C(C)CCCCC(=O)OC AIFCHEM-5608356029 [0,1,0,1,0,0|2,0,0]=4 979 B18R1.7248 CC[C@@H]1COCCN1C(C)CCCCC(=O)OC AIFCHEM-94591341728 [0,1,0,1,0,0|2,0,0]=4 980 B18R1.7248 CC[C@H]1COCCN1C(C)CCCCC(=O)OC AIFCHEM-94531750095 [0,1,0,1,0,0|2,0,0]=4 981 B18R1.37215 COC(=O)CCCNC1CCCCCCCCC1 AIFCHEM-94590921651 [0,1,0,1,0,0|0,0,0]=2 982 B18R1.39727 CCC1CCCC(C1)NCCCCCC(=O)OC AIFCHEM-5646990664 [0,1,0,1,0,0|1,0,0]=3 983 B18R1.39727 COC(=O)CCCCCNC1CCCC(C1)SC AIFCHEM-5664680084 [0,1,0,1,0,0|2,0,0]=4 984 B18R1.27 CCCCCCCCCNCC1CNC(=O)CO1 AIFCHEM-6215277921 [0,1,0,1,0,0|2,0,0]=4 985 B18R1.27 O=C1CCC(CN1)NCCCCCCCCCO AIFCHEM-6468445633 [0,1,0,1,0,0|2,0,0]=4 986 B18R1.681 CCCCCCCCCCN1CCNC(=O)[C@@H]1C AIFCHEM-6280573491 [0,1,0,1,0,0|2,0,0]=4 987 B18R1.681 CCCCCCCCCCN1CCNC(=O)[C@H]1C AIFCHEM-5650422787 [0,1,0,1,0,0|2,0,0]=4 988 B18R1.1160 COC(=O)CCCCNCCCCN1CCCC1 AIFCHEM-6152229695 [0,1,0,1,0,0|1,0,0]=3 989 B18R1.1224 COC(=O)CCCCCCCNC1CCCCC1 AIFCHEM-94601797599 [0,1,0,1,0,0|0,0,0]=2 990 B18R1.1224 COC(=O)CCCCCCCNC1CCSCC1 AIFCHEM-5804542560 [0,1,0,1,0,0|1,0,0]=3 991 B18R1.1224 COC(=O)CCCCCCNCC1CCSCC1 AIFCHEM-5828517285 [0,1,0,1,0,0|1,0,0]=3 992 B18R1.1224 COC(=O)CCCCCNCCC1CCCCC1 AIFCHEM-5664580653 [0,1,0,1,0,0|0,0,0]=2 993 B18R1.1224 COC(=O)CCCCCNCCN1CCCCC1 AIFCHEM-94531651673 [0,1,0,1,0,0|1,0,0]=3 994 B18R1.1224 COC(=O)CCCCCNCCN1CCSCC1 AIFCHEM-94571540193 [0,1,0,1,0,0|2,0,0]=4 995 B18R1.1224 COC(=O)CCCNCCCCN1CCOCC1 AIFCHEM-94592444332 [0,1,0,1,0,0|2,0,0]=4 996 B18R1.1260 CCCCCCCCCCCNC1CNC(=O)C1 AIFCHEM-5716204382 [0,1,0,1,0,0|1,0,0]=3 997 B18R1.1260 CCCCCCCCCCCN[C@@H]1COC(=O)C1 AIFCHEM-6114012692 [0,1,0,1,0,0|0,0,0]=2 998 B18R1.1260 CCCCCCCCCCCN[C@H]1CNC(=O)C1 AIFCHEM-6108599051 [0,1,0,1,0,0|1,0,0]=3 999 B18R1.1260 CCCCCCCCCCCN[C@H]1COC(=O)C1 AIFCHEM-5630797774 [0,1,0,1,0,0|0,0,0]=2 1000 B18R1.1260 CCCCCCCCCCNCC1CCC(=O)N1 AIFCHEM-94607755713 [0,1,0,1,0,0|2,0,0]=4 1001 B18R1.1260 CCCCCCCCCCNCC1CNC(=O)C1 AIFCHEM-6133760188 [0,1,0,1,0,0|1,0,0]=3 1002 B18R1.1260 CCCCCCCCCCNC[C@@H]1CCC(=O)N1 AIFCHEM-94588860006 [0,1,0,1,0,0|2,0,0]=4 1003 B18R1.1260 CCCCCCCCCCNC[C@H]1CCC(=O)N1 AIFCHEM-5926539921 [0,1,0,1,0,0|2,0,0]=4 1004 B18R1.1260 O=C1CC(CN1)NCCCCCCCCCCO AIFCHEM-6509115586 [0,1,0,1,0,0|2,0,0]=4 1005 B18R1.4934 COC(=O)CCCCCN1CCCCC1CCO AIFCHEM-6446413760 [0,1,0,1,0,0|1,0,0]=3 1006 B18R1.4934 COC(=O)CCCCCN1CCCC[C@@H]1CCO AIFCHEM-6507430782 [0,1,0,1,0,0|1,0,0]=3 1007 B18R1.4934 COC(=O)CCCCCN1CCCC[C@H]1CCO AIFCHEM-6402908248 [0,1,0,1,0,0|1,0,0]=3 1008 B18R1.5429 CCCCCCCCCCCCNCC1CCO1 AIFCHEM-94567673900 [0,1,0,1,0,0|1,0,1]=4 1009 B18R1.5429 CCCCCCCCCCCCNC[C@@H]1CCO1 AIFCHEM-5846520965 [0,1,0,1,0,0|1,0,1]=4 1010 B18R1.5429 CCCCCCCCCCCCNC[C@H]1CCO1 AIFCHEM-5719256410 [0,1,0,1,0,0|1,0,1]=4 1011 B18R1.5445 CCCCCCCCCN1CCCC1C(=O)OC AIFCHEM-94582030814 [0,1,0,1,0,0|0,0,0]=2 1012 B18R1.5445 CCCCCCCCCN1CCC[C@@H]1C(=O)OC AIFCHEM-94558650601 [0,1,0,1,0,0|0,0,0]=2 1013 B18R1.5445 CCCCCCCCCN1CCC[C@H]1C(=O)OC AIFCHEM-5951018858 [0,1,0,1,0,0|0,0,0]=2 1014 B18R1.5445 CCCCCCCCN[C@H]1CCC[C@H]1C(=O)OC AIFCHEM-5646773528 [0,1,0,1,0,0|0,0,0]=2 1015 B18R1.13155 CCCCCCCCCCCN1CCC(C1)OC AIFCHEM-94564285649 [0,1,0,1,0,0|1,0,1]=4 1016 B18R1.13155 CCCCCCCCCCCN1CC[C@@H](C1)OC AIFCHEM-5642226145 [0,1,0,1,0,0|1,0,1]=4 1017 B18R1.13155 CCCCCCCCCCCN1CC[C@H](C1)OC 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AIFCHEM-94526001917 [0,1,0,1,0,0|1,0,0]=3 1088 B18R1.1059 COC(=O)CCCCNCCC1CCN(CC1)C AIFCHEM-6003870401 [0,1,0,1,0,0|2,0,0]=4 1089 B18R1.10265 COC(=O)CCC(C)NCCOC1CCCCC1 AIFCHEM-6135864146 [0,1,0,1,0,0|2,0,0]=4 1090 B18R1.10265 COC(=O)CNC(=O)CCCCC1CCCCC1 AIFCHEM-6234754623 [0,1,0,1,0,0|1,0,1]=4 1091 B18R1.119270 CCCCCCCCN1C[C@@H](C[C@@H]1C(=O)OC)F AIFCHEM-6040464494 [0,1,0,1,0,0|1,0,0]=3 1092 B18R1.119270 CCCCCCCCN1C[C@@H](C[C@H]1C(=O)OC)F AIFCHEM-94534952338 [0,1,0,1,0,0|1,0,0]=3 1093 B18R1.119270 CCCCCCCCN1C[C@H](C[C@@H]1C(=O)OC)F AIFCHEM-5871710931 [0,1,0,1,0,0|1,0,0]=3 1094 B18R1.119270 CCCCCCCCN1C[C@H](C[C@H]1C(=O)OC)F AIFCHEM-5985962640 [0,1,0,1,0,0|1,0,0]=3 1095 B18R1.769 COC(=O)CC(C)NCCCN1CCCCC1C AIFCHEM-6197641610 [0,1,0,1,0,0|2,0,0]=4 1096 B18R1.34999 CCCCCCCCCCCN1CC(=O)N(C1)C AIFCHEM-6033099203 [0,1,0,1,0,0|2,0,0]=4 1097 B18R1.34999 CCCCCCCCCCNC1CC(=O)N(C1)C AIFCHEM-94594781199 [0,1,0,1,0,0|2,0,0]=4 1098 B18R1.34999 CCCCCCCCCNCC1CC(=O)N(C1)C AIFCHEM-5861065767 [0,1,0,1,0,0|2,0,0]=4 1099 B18R1.94701 CCCCCCCCN1CC[C@@H]([C@@H]1C(=O)OC)O AIFCHEM-6391063016 [0,1,0,1,0,0|1,0,0]=3 1100 B18R1.52661 CN(C)C(=O)CCNC1CCCCCCCCC1 AIFCHEM-94590924653 [0,1,0,1,0,0|2,0,0]=4 1101 B18R1.33923 COC(=O)CCCCCN1CCOCC1C(C)C AIFCHEM-5916961737 [0,1,0,1,0,0|2,0,0]=4 1102 B18R1.33923 COC(=O)CCCCCN1CCOC[C@@H]1C(C)C AIFCHEM-5827548451 [0,1,0,1,0,0|2,0,0]=4 1103 B18R1.33923 COC(=O)CCCCCN1CCOC[C@H]1C(C)C AIFCHEM-5770689582 [0,1,0,1,0,0|2,0,0]=4 1104 B18R1.33923 COC(=O)CCCCN[C@@H]1CCCC[C@H]1N(C)C AIFCHEM-5794413996 [0,1,0,1,0,0|2,0,0]=4 1105 B18R1.33923 COC(=O)CCCCN[C@H]1CCCC[C@@H]1N(C)C AIFCHEM-6079898459 [0,1,0,1,0,0|2,0,0]=4 1106 B18R2.2616 COC(=O)CC1COCCN1C2CCCCC2 AIFCHEM-94601785168 [0,0,0,2,0,0|2,0,0]=4 1107 B18R2.2616 COC(=O)C[C@H]1COCCN1C2CCCCC2 AIFCHEM-94601789293 [0,0,0,2,0,0|2,0,0]=4 1108 B18R2.95686 COC(=O)CCCCNC1CCN2C1CCC2 AIFCHEM-5683159780 [0,0,0,2,0,0|2,0,0]=4 1109 B18R2.101717 COC(=O)CCCCCN1CC2CC1CN2C AIFCHEM-94531316029 [0,0,0,2,0,0|2,0,0]=4 1110 B18R2.101717 COC(=O)CCCCCN1C[C@@H]2C[C@H]1CN2C AIFCHEM-6043007142 [0,0,0,2,0,0|2,0,0]=4 1111 B18R2.9309 COC(=O)C1CCCCC1NC2CCCOC2 AIFCHEM-5847068877 [0,0,0,2,0,0|2,0,0]=4 1112 B18R2.9309 COC(=O)C1CCCCC1N[C@@H]2CCCOC2 AIFCHEM-94588267947 [0,0,0,2,0,0|2,0,0]=4 1113 B18R2.9309 COC(=O)C1CCCCC1N[C@H]2CCCOC2 AIFCHEM-6122113003 [0,0,0,2,0,0|2,0,0]=4 1114 B18R2.9309 COC(=O)C1CCCCN1CC2CCOCC2 AIFCHEM-94569142521 [0,0,0,2,0,0|2,0,0]=4 1115 B18R2.9309 COC(=O)[C@@H]1CCCCN1CC2CCOCC2 AIFCHEM-6117509897 [0,0,0,2,0,0|2,0,0]=4 1116 B18R2.9309 COC(=O)[C@@H]1CCCC[C@@H]1NC2CCCOC2 AIFCHEM-94522131421 [0,0,0,2,0,0|2,0,0]=4 1117 B18R2.9309 COC(=O)[C@H]1CCCCN1CC2CCOCC2 AIFCHEM-6212949254 [0,0,0,2,0,0|2,0,0]=4 1118 B18R2.9485 CNC(=O)[C@H]1CCCN1CCC2CCCCC2 AIFCHEM-94603765516 [0,0,0,2,0,0|2,0,0]=4 1119 B18R2.9485 COC(=O)C1CCCC1NCC2CCOCC2 AIFCHEM-94579834518 [0,0,0,2,0,0|2,0,0]=4 1120 B18R2.9485 COC(=O)C1COCC1NCC2CCCCC2 AIFCHEM-5742394628 [0,0,0,2,0,0|2,0,0]=4 1121 B18R2.9485 COC(=O)[C@@H]1CCC[C@@H]1NCC2CCOCC2 AIFCHEM-5646586437 [0,0,0,2,0,0|2,0,0]=4 1122 B18R2.9586 COC(=O)C[C@@H]1CCCN1CC2CCCCC2 AIFCHEM-5822699224 [0,0,0,2,0,0|1,0,0]=3 1123 B18R2.9586 COC(=O)C[C@@H]1CCCN1CC2CCSCC2 AIFCHEM-5844900849 [0,0,0,2,0,0|2,0,0]=4 1124 B18R2.9469 COC(=O)CCCN1CCN2CCCCC2C1 AIFCHEM-94592442217 [0,0,0,2,0,0|2,0,0]=4 1125 B18R2.9469 COC(=O)CCCN1CCN2CCCC[C@@H]2C1 AIFCHEM-94592437533 [0,0,0,2,0,0|2,0,0]=4 1126 B18R2.9515 COC(=O)C1CCCCN1C2CCCCC2O AIFCHEM-6171213246 [0,0,0,2,0,0|2,0,0]=4 1127 B18R2.9515 COC(=O)[C@@H]1CCCCN1C2CCCCC2O AIFCHEM-6117304779 [0,0,0,2,0,0|2,0,0]=4 1128 B18R2.9515 COC(=O)[C@H]1CCCCN1C2CCCCC2O AIFCHEM-6212899865 [0,0,0,2,0,0|2,0,0]=4 1129 B18R2.96614 COC(=O)[C@@H]1CCC[C@@H]1NC2CCOCC2C AIFCHEM-5646816812 [0,0,0,2,0,0|2,0,0]=4 1130 B18R2.98018 COC(=O)C[C@@H]1CCCN1C2CCCCC2O AIFCHEM-5850536482 [0,0,0,2,0,0|2,0,0]=4 1131 B18R2.918366 COC(=O)CCCCCNC1CC2CCC1C2 AIFCHEM-5646969194 [0,0,0,2,0,0|1,0,0]=3 1132 B18R2.918366 COC(=O)CCCCCN[C@@H]1C[C@H]2CC[C@@H]1C2 AIFCHEM-94578179399 [0,0,0,2,0,0|1,0,0]=3 1133 B18R2.101468 COC(=O)CCCNC1CCC2CCC1N2C AIFCHEM-94592439351 [0,0,0,2,0,0|2,0,0]=4 1134 B18R2.9577 COC(=O)C1CCCC1NC[C@@H]2CCCN2C AIFCHEM-94585426830 [0,0,0,2,0,0|2,0,0]=4 1135 B18R2.97776 COC(=O)C1CCCC1NC2CCCCCC2 AIFCHEM-5655792832 [0,0,0,2,0,0|1,0,0]=3 1136 B18R2.97776 COC(=O)[C@@H]1CCC[C@@H]1NC2CCCCCC2 AIFCHEM-94529604450 [0,0,0,2,0,0|1,0,0]=3 1137 B18R2.708757 COC(=O)C1CCN1C2CCCCCCCC2 AIFCHEM-5993619559 [0,0,0,2,0,0|1,0,0]=3