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CCCCCCCCCCCNC(C)COC(=O)C AIFCHEM-94599184175 [0,2,0,0,0,0|2,0,0]=4 580 B18R0.19354 CC(CCO)NCCCCCCCCCCC(=O)O AIFCHEM-6012203595 [0,2,0,0,0,0|2,0,0]=4 581 B18R0.19354 CCCC(C)NCCCCCCCCCCC(=O)O AIFCHEM-94606115788 [0,2,0,0,0,0|1,0,0]=3 582 B18R0.19354 COCC(C)NCCCCCCCCCCC(=O)O AIFCHEM-6082074453 [0,2,0,0,0,0|2,0,0]=4 583 B18R0.19354 COCC(O)CNCCCCCCCCCC(=O)O AIFCHEM-6474695303 [0,2,0,0,0,0|2,0,0]=4 584 B18R0.11621 CCCCCCCCC(C)CNCCCCCC#N AIFCHEM-5809027478 [0,2,0,0,0,0|1,0,1]=4 585 B18R0.11621 CCCCCCCCC(C)CNCCCCCCO AIFCHEM-6497675687 [0,2,0,0,0,0|0,0,2]=4 586 B18R0.11621 CCCCCCCCC(C)NCCCCCCCO AIFCHEM-6461254517 [0,2,0,0,0,0|0,0,2]=4 587 B18R0.11621 CCCCCCCCCC(C)CNCCCCC#N AIFCHEM-94601546462 [0,2,0,0,0,0|1,0,1]=4 588 B18R0.11621 CCCCCCCCCC(C)CNCCCCCC AIFCHEM-94601545354 [0,2,0,0,0,0|1,0,1]=4 589 B18R0.11621 CCCCCCCCCC(C)CNCCCCCO AIFCHEM-94601549217 [0,2,0,0,0,0|0,0,2]=4 590 B18R0.11621 CCCCCCCCCC(C)NCCCCCCO AIFCHEM-6499922944 [0,2,0,0,0,0|0,0,2]=4 591 B18R0.11621 CCCCCCCCCN(C)CCCCCCCC AIFCHEM-5804384584 [0,2,0,0,0,0|1,0,1]=4 592 B18R0.11621 CCCCCCCCNC(C)CCCCCCCC AIFCHEM-5848598822 [0,2,0,0,0,0|1,0,1]=4 593 B18R0.110 CCCC(C)NCCCCCCCCCCCCO AIFCHEM-94606120997 [0,2,0,0,0,0|0,0,2]=4 594 B18R0.110 CCCCCCCCCCCCCCN(C)CCC AIFCHEM-5801255908 [0,2,0,0,0,0|1,0,1]=4 595 B18R0.110 CCCCCCCCCCCCCCN(C)CCO AIFCHEM-94548502252 [0,2,0,0,0,0|0,0,2]=4 596 B18R0.110 CCCCCCCCCCCCCNC(C)CCC AIFCHEM-94552329602 [0,2,0,0,0,0|1,0,1]=4 597 B18R0.110 CCCCCCCCCCCCCNC(C)CCO AIFCHEM-94552334081 [0,2,0,0,0,0|0,0,2]=4 598 B18R0.110 CCCCCCCCCCCCCNC(C)COC AIFCHEM-94552334064 [0,2,0,0,0,0|2,0,0]=4 599 B18R0.110 CCCCCCCCCCCCNCC(O)COC AIFCHEM-6387450729 [0,2,0,0,0,0|2,0,0]=4 600 B18R0.221 CCCCCCCCCCCCCCCCNCC AIFCHEM-94537415437 [0,2,0,0,0,0|1,0,1]=4 601 B18R0.221 CCCCCCCCCCCCCCCNCCC AIFCHEM-94569016381 [0,2,0,0,0,0|1,0,1]=4 602 B18R0.221 CCCCCCCCCCCCCCCNCCO AIFCHEM-6411035263 [0,2,0,0,0,0|0,0,2]=4 603 B18R0.221 CCCCCCCCCCCCCCNCCC#N AIFCHEM-5719366703 [0,2,0,0,0,0|1,0,1]=4 604 B18R0.221 CCCCCCCCCCCCCCNCCCC AIFCHEM-94523034190 [0,2,0,0,0,0|1,0,1]=4 605 B18R0.221 CCCCCCCCCCCCCCNCCCO AIFCHEM-94523160960 [0,2,0,0,0,0|0,0,2]=4 606 B18R0.221 CCCCCCCCCCCCCCNCCOC AIFCHEM-5989988349 [0,2,0,0,0,0|0,0,2]=4 607 B18R0.221 CCCCCCCCCCCCCCNCCSC AIFCHEM-94598919292 [0,2,0,0,0,0|0,1,1]=4 608 B18R0.221 CCCCCCCCCCCCCNCCCCC AIFCHEM-94551431272 [0,2,0,0,0,0|1,0,1]=4 609 B18R0.221 CCCCCCCCCCCCCNCCCSC AIFCHEM-94546180973 [0,2,0,0,0,0|0,1,1]=4 610 B18R0.221 CCCCCCCCCCCCNCCCCC#N AIFCHEM-94558537211 [0,2,0,0,0,0|1,0,1]=4 611 B18R0.221 CCCCCCCCCCCCNCCCCCC AIFCHEM-6128933885 [0,2,0,0,0,0|1,0,1]=4 612 B18R0.221 CCCCCCCCCCCCNCCCCCO AIFCHEM-94584453538 [0,2,0,0,0,0|0,0,2]=4 613 B18R0.221 CCCCCCCCCCCCNCCCOCC AIFCHEM-6208828229 [0,2,0,0,0,0|1,0,1]=4 614 B18R0.221 CCCCCCCCCCCCNCCOCCO AIFCHEM-94566167223 [0,2,0,0,0,0|0,0,2]=4 615 B18R0.221 CCCCCCCCCCCCNCCSCCO AIFCHEM-6469136447 [0,2,0,0,0,0|0,0,2]=4 616 B18R0.221 CCCCCCCCCCCNCCCCCC#N AIFCHEM-5862931424 [0,2,0,0,0,0|1,0,1]=4 617 B18R0.221 CCCCCCCCCCCNCCCCCCC AIFCHEM-94589462365 [0,2,0,0,0,0|1,0,1]=4 618 B18R0.221 CCCCCCCCCCCNCCCCCCO AIFCHEM-6499705691 [0,2,0,0,0,0|0,0,2]=4 619 B18R0.221 CCCCCCCCCCCNCCCOCCO AIFCHEM-6448707886 [0,2,0,0,0,0|0,0,2]=4 620 B18R0.221 CCCCCCCCCCCNCCOCCOC AIFCHEM-5876438508 [0,2,0,0,0,0|2,0,0]=4 621 B18R0.221 CCCCCCCCCCNCCCCCCCC AIFCHEM-5626555634 [0,2,0,0,0,0|1,0,1]=4 622 B18R0.221 CCCCCCCCCCNCCCCCCCO AIFCHEM-6408946649 [0,2,0,0,0,0|0,0,2]=4 623 B18R0.221 CCCCCCCCCCNCCCOCCCC AIFCHEM-5928138374 [0,2,0,0,0,0|1,0,1]=4 624 B18R0.221 CCCCCCCCCCNCCCOCCCO AIFCHEM-6504385887 [0,2,0,0,0,0|0,0,2]=4 625 B18R0.221 CCCCCCCCCNCCCCCCCCC AIFCHEM-6143444905 [0,2,0,0,0,0|1,0,1]=4 626 B18R0.221 CCCCCCCCCNCCCCCCCCO AIFCHEM-6395959870 [0,2,0,0,0,0|0,0,2]=4 627 B18R0.221 CCCCCCCCNCCCCCCCCCO AIFCHEM-6486914325 [0,2,0,0,0,0|0,0,2]=4 628 B18R0.221 CCCCCCCNCCCCCCCCCCO AIFCHEM-94589456342 [0,2,0,0,0,0|0,0,2]=4 629 B18R0.221 CCCCCNCCCCCCCCCCCCO AIFCHEM-94551435789 [0,2,0,0,0,0|0,0,2]=4 630 B18R0.221 CSCCCNCCCCCCCCCCCCO AIFCHEM-94546185490 [0,2,0,0,0,0|0,0,2]=4 631 B18R0.3155 CCCCCCCCCCCCCC(C)NCCC AIFCHEM-94521368372 [0,2,0,0,0,0|1,0,1]=4 632 B18R0.3155 CCCCCCCCCCCCCC(C)NCCF AIFCHEM-5827600172 [0,2,0,0,0,0|1,0,1]=4 633 B18R0.3155 CCCCCCCCCCCCCC(C)NCCO AIFCHEM-6463358510 [0,2,0,0,0,0|0,0,2]=4 634 B18R0.3155 CCCCCCCCCCCCNC(C)CCCC AIFCHEM-94541406178 [0,2,0,0,0,0|1,0,1]=4 635 B18R0.3155 CCCCCCCCCCCCNC(C)CCCO AIFCHEM-94575405051 [0,2,0,0,0,0|0,0,2]=4 636 B18R0.3155 CCCCCCCCCCCCNC(C)CCSC AIFCHEM-94536252368 [0,2,0,0,0,0|2,0,0]=4 637 B18R0.3155 CCCCCCCCCCCCN[C@@H](C)CCCO AIFCHEM-6463455348 [0,2,0,0,0,0|0,0,2]=4 638 B18R0.3155 CCCCCCCCCCCCN[C@H](C)CCCC AIFCHEM-94596948580 [0,2,0,0,0,0|1,0,1]=4 639 B18R0.3155 CCCCCCCCCCCCN[C@H](C)CCCO AIFCHEM-6458670932 [0,2,0,0,0,0|0,0,2]=4 640 B18R0.3155 CCCCCCCCCCCNC[C@H](C)CCCO AIFCHEM-6433689916 [0,2,0,0,0,0|0,0,2]=4 641 B18R0.7792 CCCCCCC(C)NCCCCCCCCCO AIFCHEM-6474083548 [0,2,0,0,0,0|0,0,2]=4 642 B18R0.7792 CCCCCCCCCCCC(C)NCCCCC AIFCHEM-94522654564 [0,2,0,0,0,0|1,0,1]=4 643 B18R0.7792 CCCCCCCCCCCC(C)NCCCCO AIFCHEM-6511734185 [0,2,0,0,0,0|0,0,2]=4 644 B18R0.7792 CCCCCCCCCCCC(C)NCCCOC AIFCHEM-94598890294 [0,2,0,0,0,0|2,0,0]=4 645 B18R0.7792 CCCCCCCCCCCC(C)NCCCSC AIFCHEM-94529055135 [0,2,0,0,0,0|2,0,0]=4 646 B18R0.7792 CCCCCCCCCCCN(C)CCCCCC AIFCHEM-6058036687 [0,2,0,0,0,0|1,0,1]=4 647 B18R0.7792 CCCCCCCCCCCN(C)CCCCCO AIFCHEM-6457560414 [0,2,0,0,0,0|0,0,2]=4 648 B18R0.7792 CCCCCCCCCCNC(C)CCCCCC AIFCHEM-5603673392 [0,2,0,0,0,0|1,0,1]=4 649 B18R0.7792 CCCCCCCCCCN[C@@H](C)CCCCCC AIFCHEM-5801637394 [0,2,0,0,0,0|1,0,1]=4 650 B18R0.17438 CCCCCCCC(C)NCCCCCCCCO AIFCHEM-6466184545 [0,2,0,0,0,0|0,0,2]=4 651 B18R0.17438 CCCCCCCCCCN(C)CCCCCCC AIFCHEM-5999701379 [0,2,0,0,0,0|1,0,1]=4 652 B18R0.17438 CCCCCCCCCCN(C)CCCCCCO AIFCHEM-94534162417 [0,2,0,0,0,0|0,0,2]=4 653 B18R0.17438 CCCCCCCCCNC(C)CCCCCCC AIFCHEM-6142825563 [0,2,0,0,0,0|1,0,1]=4 654 B18R0.19788 CCCCCC(C)NCCCCCCCCCCO AIFCHEM-94564406553 [0,2,0,0,0,0|0,0,2]=4 655 B18R0.19788 CCCCCCCCCCCCC(=O)NCOC=O AIFCHEM-94595117117 [0,2,0,0,0,0|1,0,1]=4 656 B18R0.19788 CCCCCCCCCCCCC(C)NCCCC AIFCHEM-5725294456 [0,2,0,0,0,0|1,0,1]=4 657 B18R0.19788 CCCCCCCCCCCCC(C)NCCCO AIFCHEM-6437766253 [0,2,0,0,0,0|0,0,2]=4 658 B18R0.19788 CCCCCCCCCCCCC(C)NCCOC AIFCHEM-6047865895 [0,2,0,0,0,0|2,0,0]=4 659 B18R0.19788 CCCCCCCCCCCCC(C)NCCSC AIFCHEM-94598921141 [0,2,0,0,0,0|2,0,0]=4 660 B18R0.19788 CCCCCCCCCCCCN(C)CCCCC AIFCHEM-6095830065 [0,2,0,0,0,0|1,0,1]=4 661 B18R0.19788 CCCCCCCCCCCCN(C)CCCCO AIFCHEM-6420534703 [0,2,0,0,0,0|0,0,2]=4 662 B18R0.19788 CCCCCCCCCCCCN(C)CCCSC AIFCHEM-94546186716 [0,2,0,0,0,0|2,0,0]=4 663 B18R0.19788 CCCCCCCCCCCNC(C)CCCC#N AIFCHEM-94560947402 [0,2,0,0,0,0|1,0,1]=4 664 B18R0.19788 CCCCCCCCCCCNC(C)CCCCC AIFCHEM-94564412576 [0,2,0,0,0,0|1,0,1]=4 665 B16R1.643 CCCCCCCCNCC1CCCCC1 AIFCHEM-94561932870 [1,0,0,1,0,0|1,0,1]=4 666 B16R1.643 OCCCCCCNCCC1CCCCC1 AIFCHEM-6500041303 [1,0,0,1,0,0|1,0,1]=4 667 B16R1.1193 CCCCCCCCCNC[C@@H]1CCCO1 AIFCHEM-5738163046 [1,0,0,1,0,0|1,0,1]=4 668 B16R1.1193 CCCCCCCCCNC[C@H]1CCCO1 AIFCHEM-5666840174 [1,0,0,1,0,0|1,0,1]=4 669 B16R1.1193 OCCCCCCCCNCC1CCCC1 AIFCHEM-6466182683 [1,0,0,1,0,0|1,0,1]=4 670 B16R1.1218 CCCCCCCCNC1CCCNC1=O AIFCHEM-5929673432 [1,0,0,1,0,0|2,0,0]=4 671 B16R1.1218 CCCCCCCCN[C@@H]1CCCNC1=O AIFCHEM-6282655664 [1,0,0,1,0,0|2,0,0]=4 672 B16R1.1219 CCCCCCCCCN1CCC[C@H]1CF AIFCHEM-6242174614 [1,0,0,1,0,0|2,0,0]=4 673 B16R1.1418 CCC1CCCCC1NCCCCCCO AIFCHEM-6497998419 [1,0,0,1,0,0|1,0,1]=4 674 B16R1.3890 CCCCCCCCCCCNC1CC1F AIFCHEM-5804508921 [1,0,0,1,0,0|2,0,0]=4 675 B16R1.3890 CCCCCCCCCCCN[C@@H]1C[C@@H]1F AIFCHEM-6032260936 [1,0,0,1,0,0|2,0,0]=4 676 B16R1.3890 CCCCCCCCCCCN[C@@H]1C[C@H]1C AIFCHEM-94559005733 [1,0,0,1,0,0|1,0,1]=4 677 B16R1.3890 CCCCCCCCCCCN[C@@H]1C[C@H]1F AIFCHEM-5880874761 [1,0,0,1,0,0|2,0,0]=4 678 B16R1.3890 CCCCCCCCCCCN[C@H]1C[C@@H]1F AIFCHEM-6062316670 [1,0,0,1,0,0|2,0,0]=4 679 B16R1.3890 CCCCCCCCCCNC[C@@H]1C[C@H]1C AIFCHEM-94599413806 [1,0,0,1,0,0|1,0,1]=4 680 B16R1.3891 CCCCCCCCCCCCN1CCC1 AIFCHEM-94604918960 [1,0,0,1,0,0|1,0,1]=4 681 B16R1.3891 CCCCCCCCCCCNC1CCC1 AIFCHEM-94576057139 [1,0,0,1,0,0|1,0,1]=4 682 B16R1.3891 CCCCCCCCCCNCC1CCC1 AIFCHEM-5756989342 [1,0,0,1,0,0|1,0,1]=4 683 B16R1.3891 CCCCCCCCCCNCC1CCO1 AIFCHEM-94567673898 [1,0,0,1,0,0|1,0,1]=4 684 B16R1.3891 CCCCCCCCCCNC[C@@H]1CCO1 AIFCHEM-5846502763 [1,0,0,1,0,0|1,0,1]=4 685 B16R1.3891 CCCCCCCCCCNC[C@H]1CCO1 AIFCHEM-5776881830 [1,0,0,1,0,0|1,0,1]=4 686 B16R1.3891 OCCCCCCCCCCNC1CCC1 AIFCHEM-94576051116 [1,0,0,1,0,0|1,0,1]=4 687 B16R1.3891 OCCCCCCCCCNCC1CCC1 AIFCHEM-6511318513 [1,0,0,1,0,0|1,0,1]=4 688 B16R1.6680 CCCCCCCCCCN1CCCC1C AIFCHEM-5724645224 [1,0,0,1,0,0|1,0,1]=4 689 B16R1.6680 CCCCCCCCCCN1CCC[C@@H]1C AIFCHEM-94569861342 [1,0,0,1,0,0|1,0,1]=4 690 B16R1.6680 CCCCCCCCCCN1CCC[C@H]1C AIFCHEM-6034861783 [1,0,0,1,0,0|1,0,1]=4 691 B16R1.6680 CCCCCCCCCNC1CCSC1=O AIFCHEM-6241454725 [1,0,0,1,0,0|2,0,0]=4 692 B16R1.6680 CCCCCCCCCN[C@@H]1CCSC1=O AIFCHEM-6273963434 [1,0,0,1,0,0|2,0,0]=4 693 B16R1.6688 CCCCCCCCCCN[C@@H]1CC[C@H]1O AIFCHEM-6468188312 [1,0,0,1,0,0|1,0,1]=4 694 B16R1.17455 CCCCCCCCCCCCNC1CC1 AIFCHEM-6186059314 [1,0,0,1,0,0|1,0,1]=4 695 B16R1.17455 CCCCCCCCCCCNCC1CC1 AIFCHEM-6083797580 [1,0,0,1,0,0|1,0,1]=4 696 B16R1.17455 CCCCCCCCCCNCCC1CC1 AIFCHEM-5697367410 [1,0,0,1,0,0|1,0,1]=4 697 B16R1.17455 OCCCCCCCCCCNCC1CC1 AIFCHEM-6492773210 [1,0,0,1,0,0|1,0,1]=4 698 B16R1.17458 OCCCCNC1CCCCCCCCC1 AIFCHEM-94590921873 [1,0,0,1,0,0|1,0,1]=4 699 B18R1.1108 CCCCCCCCCCNC1CCNC(=O)C1 AIFCHEM-5604014941 [0,1,0,1,0,0|2,0,0]=4 700 B18R1.1257 CCC1CCCCC1NCCCCCCC(=O)O AIFCHEM-5737241119 [0,1,0,1,0,0|1,0,0]=3 701 B18R1.1260 CCCCCCCCCCCNC1CNC(=O)C1 AIFCHEM-5716204382 [0,1,0,1,0,0|2,0,0]=4 702 B18R1.1260 CCCCCCCCCCCN[C@@H]1COC(=O)C1 AIFCHEM-6114012692 [0,1,0,1,0,0|2,0,0]=4 703 B18R1.1260 CCCCCCCCCCCN[C@H]1CNC(=O)C1 AIFCHEM-6108599051 [0,1,0,1,0,0|2,0,0]=4 704 B18R1.1260 CCCCCCCCCCCN[C@H]1COC(=O)C1 AIFCHEM-5630797774 [0,1,0,1,0,0|2,0,0]=4 705 B18R1.1260 CCCCCCCCCCNCC1CCC(=O)N1 AIFCHEM-94607755713 [0,1,0,1,0,0|1,0,0]=3 706 B18R1.1260 CCCCCCCCCCNCC1CNC(=O)C1 AIFCHEM-6133760188 [0,1,0,1,0,0|2,0,0]=4 707 B18R1.1260 CCCCCCCCCCNC[C@@H]1CCC(=O)N1 AIFCHEM-94588860006 [0,1,0,1,0,0|1,0,0]=3 708 B18R1.1260 CCCCCCCCCCNC[C@H]1CCC(=O)N1 AIFCHEM-5926539921 [0,1,0,1,0,0|1,0,0]=3 709 B18R1.5428 CCCCCCCCCCCCNC[C@@H]1C[C@H]1C AIFCHEM-94599413808 [0,1,0,1,0,0|1,0,1]=4 710 B18R1.5438 CCCCCCCCCN1CCCCC1C(=O)O AIFCHEM-94570330171 [0,1,0,1,0,0|1,0,0]=3 711 B18R1.5438 CCCCCCCCCN1CCCC[C@@H]1C(=O)O AIFCHEM-6090986032 [0,1,0,1,0,0|1,0,0]=3 712 B18R1.5438 CCCCCCCCCN1CCCC[C@H]1C(=O)O AIFCHEM-94556193449 [0,1,0,1,0,0|1,0,0]=3 713 B18R1.10471 CC1CCCC1NCCCCCCCCC(=O)O AIFCHEM-5707612029 [0,1,0,1,0,0|1,0,0]=3 714 B18R1.10471 CC1SCCC1NCCCCCCCCC(=O)O AIFCHEM-5756763055 [0,1,0,1,0,0|2,0,0]=4 715 B18R1.10603 O=C(O)CCCCCCCCNC1CCOCC1 AIFCHEM-94537962125 [0,1,0,1,0,0|2,0,0]=4 716 B18R1.13035 CCCCCCCCCCCCCCNC1CC1 AIFCHEM-94573313150 [0,1,0,1,0,0|1,0,1]=4 717 B18R1.13035 CCCCCCCCCCCCCNCC1CC1 AIFCHEM-94552330877 [0,1,0,1,0,0|1,0,1]=4 718 B18R1.13035 CCCCCCCCCCCCNCCC1CC1 AIFCHEM-5763917088 [0,1,0,1,0,0|1,0,1]=4 719 B18R1.13035 OCCCCCCCCCCCCNCC1CC1 AIFCHEM-6449959395 [0,1,0,1,0,0|0,0,2]=4 720 B18R1.13145 CCCCCCCCCCCN1CCC1C(=O)O AIFCHEM-5694547480 [0,1,0,1,0,0|1,0,0]=3 721 B18R1.13145 CCCCCCCCCCCN1CC[C@@H]1C(=O)O AIFCHEM-6108924502 [0,1,0,1,0,0|1,0,0]=3 722 B18R1.13145 CCCCCCCCCCCN1CC[C@H]1C(=O)N AIFCHEM-94567083272 [0,1,0,1,0,0|1,0,0]=3 723 B18R1.13145 CCCCCCCCCCCN1CC[C@H]1C(=O)O AIFCHEM-6274078687 [0,1,0,1,0,0|1,0,0]=3 724 B18R1.13830 C[C@@H]1C[C@H]1CNCCCCCCCCCC(=O)O AIFCHEM-94599417936 [0,1,0,1,0,0|1,0,0]=3 725 B18R1.17819 O=C(O)CCCCCCCCCN[C@@H]1CC[C@H]1O AIFCHEM-6453145137 [0,1,0,1,0,0|2,0,0]=4 726 B18R1.20697 O=C(O)CCCCCCCCCNC1CCCC1 AIFCHEM-94542377352 [0,1,0,1,0,0|1,0,0]=3 727 B18R1.20697 O=C(O)CCCCCCCCCNC1CCOC1 AIFCHEM-5965489571 [0,1,0,1,0,0|2,0,0]=4 728 B18R1.20697 O=C(O)CCCCCCCCCNC1CCSC1 AIFCHEM-6210156851 [0,1,0,1,0,0|2,0,0]=4 729 B18R1.20697 O=C(O)CCCCCCCCCN[C@@H]1CCOC1 AIFCHEM-5799472821 [0,1,0,1,0,0|2,0,0]=4 730 B18R1.20697 O=C(O)CCCCCCCCCN[C@H]1CCOC1 AIFCHEM-94585470439 [0,1,0,1,0,0|2,0,0]=4 731 B18R1.20697 O=C(O)CCCCCCCCNCC1CCCC1 AIFCHEM-5745938012 [0,1,0,1,0,0|1,0,0]=3 732 B18R1.20697 O=C(O)CCCCCCCCNCC1CCOC1 AIFCHEM-5888028389 [0,1,0,1,0,0|2,0,0]=4 733 B18R1.20697 O=C(O)CCCCCCCCNC[C@@H]1CCCO1 AIFCHEM-5738069407 [0,1,0,1,0,0|2,0,0]=4 734 B18R1.20697 O=C(O)CCCCCCCCNC[C@@H]1CCOC1 AIFCHEM-94530318667 [0,1,0,1,0,0|2,0,0]=4 735 B18R1.20697 O=C(O)CCCCCCCCNC[C@H]1CCCO1 AIFCHEM-5599980797 [0,1,0,1,0,0|2,0,0]=4 736 B18R1.20697 O=C(O)CCCCCCCCNC[C@H]1CCOC1 AIFCHEM-5993349841 [0,1,0,1,0,0|2,0,0]=4 737 B18R1.20697 O=C(O)CCCCCCCNCCN1CCCC1 AIFCHEM-5713457384 [0,1,0,1,0,0|2,0,0]=4 738 B18R1.20745 O=C(O)CCCCCCCCCCNCC1CC1 AIFCHEM-6055677346 [0,1,0,1,0,0|1,0,0]=3 739 B18R1.21005 O=C(O)CCCCNC1CCCCCCCCC1 AIFCHEM-94590931492 [0,1,0,1,0,0|1,0,0]=3 740 B18R1.21181 O=C(O)CCCCCCCCCCNC1CCC1 AIFCHEM-94576051313 [0,1,0,1,0,0|1,0,0]=3 741 B18R1.21181 O=C(O)CCCCCCCCCCNC1COC1 AIFCHEM-6086644067 [0,1,0,1,0,0|2,0,0]=4 742 B18R1.21181 O=C(O)CCCCCCCCCNCC1CCC1 AIFCHEM-94536866248 [0,1,0,1,0,0|1,0,0]=3 743 B18R1.21181 O=C(O)CCCCCCCCCNCC1CCO1 AIFCHEM-94567678028 [0,1,0,1,0,0|2,0,0]=4 744 B18R1.21181 O=C(O)CCCCCCCCCNCC1COC1 AIFCHEM-5948411545 [0,1,0,1,0,0|2,0,0]=4 745 B18R1.21181 O=C(O)CCCCCCCCCNC[C@@H]1CCO1 AIFCHEM-5863759528 [0,1,0,1,0,0|2,0,0]=4 746 B18R1.21181 O=C(O)CCCCCCCCCNC[C@H]1CCO1 AIFCHEM-5694519592 [0,1,0,1,0,0|2,0,0]=4 747 B18R1.21929 CCCCCCCCCCN1CCCC1C(=O)O AIFCHEM-6144615158 [0,1,0,1,0,0|1,0,0]=3 748 B18R1.21929 CCCCCCCCCCN1CCC[C@@H]1C(=O)O AIFCHEM-6007761104 [0,1,0,1,0,0|1,0,0]=3 749 B18R1.21929 CCCCCCCCCCN1CCC[C@H]1C(=O)O AIFCHEM-5761609417 [0,1,0,1,0,0|1,0,0]=3 750 B18R1.36890 O=C(O)CCOCCNC1CCCCCCCC1 AIFCHEM-5894721494 [0,1,0,1,0,0|2,0,0]=4 751 B18R1.38081 CCC1CCCC1NCCCCCCSC(=O)C AIFCHEM-6270539944 [0,1,0,1,0,0|2,0,0]=4 752 B18R1.39787 O=C(O)CCCCCCCCCN1CC[C@@H]1CO AIFCHEM-94554358469 [0,1,0,1,0,0|2,0,0]=4 753 B18R1.39787 O=C(O)CCCCCCCCCN1CC[C@H]1CO AIFCHEM-94538003333 [0,1,0,1,0,0|2,0,0]=4 754 B18R1.40541 CCCCCCCCCCN1CCCNC(=O)C1 AIFCHEM-5698590924 [0,1,0,1,0,0|2,0,0]=4 755 B18R1.174647 O=C(O)CCOCCNCC1CCCCCCC1 AIFCHEM-94592415546 [0,1,0,1,0,0|2,0,0]=4 756 B18R1.13038 N#CCCCCCNC1CCCCCCCCC1 AIFCHEM-94590926393 [0,1,0,1,0,0|1,0,1]=4 757 B18R1.292 CCCCCCCCCCCCNC1CCCC1 AIFCHEM-94584450335 [0,1,0,1,0,0|1,0,1]=4 758 B18R1.292 CCCCCCCCCCCCNC1CCOC1 AIFCHEM-94584698087 [0,1,0,1,0,0|2,0,0]=4 759 B18R1.292 CCCCCCCCCCCCNC1CCSC1 AIFCHEM-94584695407 [0,1,0,1,0,0|2,0,0]=4 760 B18R1.292 CCCCCCCCCCCCN[C@@H]1CCOC1 AIFCHEM-5878358600 [0,1,0,1,0,0|2,0,0]=4 761 B18R1.292 CCCCCCCCCCCCN[C@H]1CCOC1 AIFCHEM-5836451770 [0,1,0,1,0,0|2,0,0]=4 762 B18R1.292 CCCCCCCCCCCNCC1CCCC1 AIFCHEM-6177090857 [0,1,0,1,0,0|1,0,1]=4 763 B18R1.292 CCCCCCCCCCCNCC1CCOC1 AIFCHEM-5933561075 [0,1,0,1,0,0|2,0,0]=4 764 B18R1.292 CCCCCCCCCCCNC[C@@H]1CCCO1 AIFCHEM-5767569030 [0,1,0,1,0,0|0,0,2]=4 765 B18R1.292 CCCCCCCCCCCNC[C@@H]1CCOC1 AIFCHEM-94530316217 [0,1,0,1,0,0|2,0,0]=4 766 B18R1.292 CCCCCCCCCCCNC[C@H]1CCCO1 AIFCHEM-5622338306 [0,1,0,1,0,0|0,0,2]=4 767 B18R1.292 CCCCCCCCCCCNC[C@H]1CCOC1 AIFCHEM-6066167303 [0,1,0,1,0,0|2,0,0]=4 768 B18R1.292 OCCCCCCCCCCNCC1CCCC1 AIFCHEM-6507070745 [0,1,0,1,0,0|0,0,2]=4 769 B18R1.317 CCCCCCCCCCCN1CCCC[C@@H]1C AIFCHEM-94588082025 [0,1,0,1,0,0|1,0,1]=4 770 B18R1.317 CCCCCCCCCCCN1CCCC[C@H]1C AIFCHEM-5720943313 [0,1,0,1,0,0|1,0,1]=4 771 B18R1.317 CCCCCCCCCCNC1CCCCC1C AIFCHEM-5597813967 [0,1,0,1,0,0|1,0,1]=4 772 B18R1.317 CCCCCCCCCCNC1CCCNC1=O AIFCHEM-94588886868 [0,1,0,1,0,0|1,0,0]=3 773 B18R1.317 CCCCCCCCCCN[C@@H]1CCCC[C@@H]1C AIFCHEM-94605781688 [0,1,0,1,0,0|1,0,1]=4 774 B18R1.317 CCCCCCCCCCN[C@@H]1CCCC[C@H]1C AIFCHEM-5784729620 [0,1,0,1,0,0|1,0,1]=4 775 B18R1.317 CCCCCCCCCCN[C@@H]1CCCC[C@H]1F AIFCHEM-5846780599 [0,1,0,1,0,0|1,0,1]=4 776 B18R1.317 CCCCCCCCCCN[C@@H]1CCCNC1=O AIFCHEM-6196201010 [0,1,0,1,0,0|1,0,0]=3 777 B18R1.317 CCCCCCCCCCN[C@H]1CCCC[C@H]1C AIFCHEM-5788838010 [0,1,0,1,0,0|1,0,1]=4 778 B18R1.317 CCCCCCCCCCN[C@H]1CCCNC1=O AIFCHEM-6168173906 [0,1,0,1,0,0|1,0,0]=3 779 B18R1.318 CCC1CCCC1NCCCCCCCCCO AIFCHEM-6500361341 [0,1,0,1,0,0|0,0,2]=4 780 B18R1.318 CCCCCCCCCCCN1CCCC1CC AIFCHEM-5816965269 [0,1,0,1,0,0|1,0,1]=4 781 B18R1.318 CCCCCCCCCCCN1CCCC1CO AIFCHEM-6509310794 [0,1,0,1,0,0|0,0,2]=4 782 B18R1.318 CCCCCCCCCCCN1CCC[C@@H]1CO AIFCHEM-6441941789 [0,1,0,1,0,0|0,0,2]=4 783 B18R1.318 CCCCCCCCCCCN1CCC[C@H]1C#N AIFCHEM-6440837139 [0,1,0,1,0,0|1,0,1]=4 784 B18R1.318 CCCCCCCCCCCN1CCC[C@H]1CF AIFCHEM-6202911629 [0,1,0,1,0,0|1,0,1]=4 785 B18R1.318 CCCCCCCCCCCN1CCC[C@H]1CO AIFCHEM-6463470156 [0,1,0,1,0,0|0,0,2]=4 786 B18R1.318 CCCCCCCCCCNC1CCCC1CC AIFCHEM-5603761416 [0,1,0,1,0,0|1,0,1]=4 787 B18R1.1261 CCCCCCCCCCCCN1CCCOC1 AIFCHEM-5756493883 [0,1,0,1,0,0|2,0,0]=4 788 B18R1.1261 CCCCCCCCCCCNC1CCCCC1 AIFCHEM-94601797135 [0,1,0,1,0,0|1,0,1]=4 789 B18R1.1261 CCCCCCCCCCCNC1CCCOC1 AIFCHEM-94589543846 [0,1,0,1,0,0|2,0,0]=4 790 B18R1.1261 CCCCCCCCCCCNC1CCCSC1 AIFCHEM-6017878220 [0,1,0,1,0,0|2,0,0]=4 791 B18R1.1261 CCCCCCCCCCCN[C@@H]1CCCOC1 AIFCHEM-94588264530 [0,1,0,1,0,0|2,0,0]=4 792 B18R1.1261 CCCCCCCCCCNCC1CCCCC1 AIFCHEM-5603851760 [0,1,0,1,0,0|1,0,1]=4 793 B18R1.1261 CCCCCCCCCCNCC1CCCCO1 AIFCHEM-94560314876 [0,1,0,1,0,0|0,0,2]=4 794 B18R1.1261 CCCCCCCCCCNCC1CCCOC1 AIFCHEM-5846413497 [0,1,0,1,0,0|2,0,0]=4 795 B18R1.1261 OCCCCCCCCCCNC1CCCCC1 AIFCHEM-94601791112 [0,1,0,1,0,0|0,0,2]=4 796 B18R1.1261 OCCCCCCCCCNCC1CCCCC1 AIFCHEM-6511348590 [0,1,0,1,0,0|0,0,2]=4 797 B18R1.1261 OCCCCCCCCNCCC1CCCCC1 AIFCHEM-6483532483 [0,1,0,1,0,0|0,0,2]=4 798 B18R1.1280 O=C1CCCCCN1CCCNCCCCCO AIFCHEM-6141908881 [0,1,0,1,0,0|2,0,0]=4 799 B18R1.4113 CCCCCCCCCCN1CCCCC1CC AIFCHEM-5812043998 [0,1,0,1,0,0|1,0,1]=4 800 B18R1.4113 CCCCCCCCCCN1CCCCC1CO AIFCHEM-6461287161 [0,1,0,1,0,0|0,0,2]=4 801 B18R1.4113 CCCCCCCCCCN1CCCC[C@@H]1CO AIFCHEM-6464421227 [0,1,0,1,0,0|0,0,2]=4 802 B18R1.4113 CCCCCCCCCCN1CCCC[C@H]1CO AIFCHEM-94551682798 [0,1,0,1,0,0|0,0,2]=4 803 B18R1.5429 CCCCCCCCCCCCCCN1CCC1 AIFCHEM-6042242199 [0,1,0,1,0,0|1,0,1]=4 804 B18R1.5429 CCCCCCCCCCCCCNC1CCC1 AIFCHEM-94576052005 [0,1,0,1,0,0|1,0,1]=4 805 B18R1.5429 CCCCCCCCCCCCCNC1COC1 AIFCHEM-94552334533 [0,1,0,1,0,0|2,0,0]=4 806 B18R1.5429 CCCCCCCCCCCCNCC1CCC1 AIFCHEM-94584452780 [0,1,0,1,0,0|1,0,1]=4 807 B18R1.5429 CCCCCCCCCCCCNCC1CCO1 AIFCHEM-94567673900 [0,1,0,1,0,0|0,0,2]=4 808 B18R1.5429 CCCCCCCCCCCCNCC1COC1 AIFCHEM-5941308486 [0,1,0,1,0,0|2,0,0]=4 809 B18R1.5429 CCCCCCCCCCCCNC[C@@H]1CCO1 AIFCHEM-5846520965 [0,1,0,1,0,0|0,0,2]=4 810 B18R1.5429 CCCCCCCCCCCCNC[C@H]1CCO1 AIFCHEM-5719256410 [0,1,0,1,0,0|0,0,2]=4 811 B18R1.5429 OCCCCCCCCCCCCNC1CCC1 AIFCHEM-94576056522 [0,1,0,1,0,0|0,0,2]=4 812 B18R1.8759 CCCCCCCCN1CCCCC1CCOC AIFCHEM-6064389596 [0,1,0,1,0,0|2,0,0]=4 813 B18R1.8770 CCCCCC1CCCC1NCCCCCCO AIFCHEM-94555813820 [0,1,0,1,0,0|0,0,2]=4 814 B18R1.13144 CCCCCCCCCCNC1CCCCCC1 AIFCHEM-5669915523 [0,1,0,1,0,0|1,0,1]=4 815 B18R1.13144 CCCCCCCCCNCC1CCCCCC1 AIFCHEM-94532081150 [0,1,0,1,0,0|1,0,1]=4 816 B18R1.21916 CC1CCCC1NCCCCCCCCCCO AIFCHEM-6507069349 [0,1,0,1,0,0|0,0,2]=4 817 B18R1.21916 CCCCCCCCCCCCN1CCCC1C AIFCHEM-5729141619 [0,1,0,1,0,0|1,0,1]=4 818 B18R1.21916 CCCCCCCCCCCCN1CCC[C@@H]1C AIFCHEM-5650764003 [0,1,0,1,0,0|1,0,1]=4 819 B18R1.21916 CCCCCCCCCCCCN1CCC[C@H]1C AIFCHEM-6031014881 [0,1,0,1,0,0|1,0,1]=4 820 B18R1.21916 CCCCCCCCCCCNC1CCCC1C AIFCHEM-6079288186 [0,1,0,1,0,0|1,0,1]=4 821 B18R1.21916 CCCCCCCCCCCNC1CCCC1O AIFCHEM-6484471021 [0,1,0,1,0,0|0,0,2]=4 822 B18R1.21916 CCCCCCCCCCCNC1CCNC1=O AIFCHEM-5749599802 [0,1,0,1,0,0|1,0,0]=3 823 B18R1.21916 CCCCCCCCCCCNC1CCOC1=O AIFCHEM-5952244224 [0,1,0,1,0,0|1,0,0]=3 824 B18R1.21916 CCCCCCCCCCCNC1CCSC1=O AIFCHEM-6265142253 [0,1,0,1,0,0|1,0,0]=3 825 B18R1.21916 CCCCCCCCCCCNC1CONC1=O AIFCHEM-5753123020 [0,1,0,1,0,0|2,0,0]=4 826 B18R1.21916 CCCCCCCCCCCN[C@@H]1CCC[C@@H]1O AIFCHEM-94584443384 [0,1,0,1,0,0|0,0,2]=4 827 B18R1.21916 CCCCCCCCCCCN[C@@H]1CCC[C@H]1O AIFCHEM-94519722072 [0,1,0,1,0,0|0,0,2]=4 828 B18R1.21916 CCCCCCCCCCCN[C@@H]1CCNC1=O AIFCHEM-94577676778 [0,1,0,1,0,0|1,0,0]=3 829 B18R1.21916 CCCCCCCCCCCN[C@@H]1CCOC1=O AIFCHEM-5731257192 [0,1,0,1,0,0|1,0,0]=3 830 B18R1.21916 CCCCCCCCCCCN[C@@H]1CCSC1=O AIFCHEM-6219767302 [0,1,0,1,0,0|1,0,0]=3 831 B18R1.21916 CCCCCCCCCCCN[C@@H]1CONC1=O AIFCHEM-5666160397 [0,1,0,1,0,0|2,0,0]=4 832 B18R1.21916 CCCCCCCCCCCN[C@H]1CCC[C@@H]1O AIFCHEM-6505067283 [0,1,0,1,0,0|0,0,2]=4 833 B18R1.21916 CCCCCCCCCCCN[C@H]1CCC[C@H]1O AIFCHEM-94557832711 [0,1,0,1,0,0|0,0,2]=4 834 B18R1.21916 CCCCCCCCCCCN[C@H]1CCOC1=O AIFCHEM-6159883732 [0,1,0,1,0,0|1,0,0]=3 835 B18R1.21916 CCCCCCCCCCCN[C@H]1CONC1=O AIFCHEM-5682355903 [0,1,0,1,0,0|2,0,0]=4 836 B18R1.21916 CCCCCCCCCCNCC1CCCN1C AIFCHEM-5757422604 [0,1,0,1,0,0|2,0,0]=4 837 B18R1.21916 CCCCCCCCCCNC[C@@H]1CCCN1C AIFCHEM-5965464253 [0,1,0,1,0,0|2,0,0]=4 838 B18R1.21916 CCCCCCCCCCNC[C@H]1CCCN1C AIFCHEM-5615730139 [0,1,0,1,0,0|2,0,0]=4 839 B18R1.21916 CCCCCCCCCNCCC1CCCN1C AIFCHEM-6168414060 [0,1,0,1,0,0|2,0,0]=4 840 B18R1.21916 CCCCCCCCCNCCN1CCNC1=O AIFCHEM-6280567990 [0,1,0,1,0,0|2,0,0]=4 841 B18R1.21917 CCCCCCCCCCCCN1CC[C@@H]1CO AIFCHEM-94554354341 [0,1,0,1,0,0|0,0,2]=4 842 B18R1.21917 CCCCCCCCCCCCN1CC[C@H]1CO AIFCHEM-94537999205 [0,1,0,1,0,0|0,0,2]=4 843 B18R1.21926 CCCCCCCCCCCCN[C@@H]1CC[C@H]1O AIFCHEM-6444648569 [0,1,0,1,0,0|0,0,2]=4 844 B18R1.23376 CCCCCNC1CCCCCCCCCCC1 AIFCHEM-94522655593 [0,1,0,1,0,0|1,0,1]=4 845 B18R1.35418 CCCCCCCCCN1CCCCCCCC1 AIFCHEM-94559688999 [0,1,0,1,0,0|1,0,1]=4 846 B18R1.35418 CCCCCCCCNC1CCCCCCCC1 AIFCHEM-94578161285 [0,1,0,1,0,0|1,0,1]=4 847 B18R1.40540 CCCCCCCCCCN1CCC[C@@H]1COC AIFCHEM-5978549995 [0,1,0,1,0,0|2,0,0]=4 848 B18R1.40540 CCCCCCCCCCN1CCC[C@H]1COC AIFCHEM-6099443554 [0,1,0,1,0,0|2,0,0]=4 849 B18R1.40549 CCCCCCCCCCN1CCCCCCC1 AIFCHEM-6068860996 [0,1,0,1,0,0|1,0,1]=4 850 B18R1.40549 CCCCCCCCCNC1CCCCCCC1 AIFCHEM-6091660931 [0,1,0,1,0,0|1,0,1]=4 851 B18R1.40549 CCCCCCCCNCC1CCCCCCC1 AIFCHEM-94561935691 [0,1,0,1,0,0|1,0,1]=4 852 B18R1.10541 CCCCCCCC(C)NC1CCCCNC1=O AIFCHEM-94590041316 [0,1,0,1,0,0|2,0,0]=4 853 B18R1.10541 CCCCCCCC(C)N[C@@H]1CCCCNC1=O AIFCHEM-5767789200 [0,1,0,1,0,0|2,0,0]=4 854 B18R1.10541 CCCCCCCC(C)N[C@H]1CCCCNC1=O AIFCHEM-94608735825 [0,1,0,1,0,0|2,0,0]=4 855 B18R1.7234 CCCCCCC(C)NC1CCCCCNC1=O AIFCHEM-94586807083 [0,1,0,1,0,0|2,0,0]=4 856 B18R2.4724 O=C1NCCCCCC1NCC2CCCCC2 AIFCHEM-94586809069 [0,0,0,2,0,0|2,0,0]=4 857 B18R2.6133 O=C1CCCCCN1CCCNC2CCCC2 AIFCHEM-94541524829 [0,0,0,2,0,0|2,0,0]=4 858 B18R2.6239 CC1CCCCC1NC2CCCCCNC2=O AIFCHEM-94586811399 [0,0,0,2,0,0|2,0,0]=4 859 B18R2.32593 O=C1NCCCC1NC2CCCCCCCC2 AIFCHEM-94588889805 [0,0,0,2,0,0|2,0,0]=4 860 B18R2.32593 O=C1NCCC[C@@H]1NC2CCCCCCCC2 AIFCHEM-6150467845 [0,0,0,2,0,0|2,0,0]=4 861 B18R2.32593 O=C1NCCC[C@H]1NC2CCCCCCCC2 AIFCHEM-6255216531 [0,0,0,2,0,0|2,0,0]=4 862 B18R2.61001 O=C1SCC[C@H]1NC2CCCCCCCCC2 AIFCHEM-94590919593 [0,0,0,2,0,0|2,0,0]=4