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[0,2,0,0,0,0|1,0,1]=4 633 B21R0.34 CCCCCCCCCCCCCCC(C)NCC[C@H](C)O AIFCHEM-94544712307 [0,2,0,0,0,0|1,0,1]=4 634 B21R0.34 CCCCCCCCCCCCCCN(C)CCCC(=O)O AIFCHEM-6177810097 [0,2,0,0,0,0|0,0,0]=2 635 B21R0.34 CCCCCCCCCCCCCNC(=O)CCCC(=O)C AIFCHEM-94552341032 [0,2,0,0,0,0|1,0,1]=4 636 B21R0.34 CCCCCCCCCCCCCNC(C)CCCC(=O)O AIFCHEM-94552332550 [0,2,0,0,0,0|0,0,0]=2 637 B21R0.34 CCCCCCCCCCCCCNC(C)CCOC(=O)C AIFCHEM-94552329376 [0,2,0,0,0,0|2,0,0]=4 638 B21R0.2972 CCCCCCCCCCCCCC(C)NCC(C)C(=O)O AIFCHEM-5902665852 [0,2,0,0,0,0|1,0,0]=3 639 B21R0.2972 CCCCCCCCCCCCCC(C)NCC(O)C(=O)O AIFCHEM-6440161385 [0,2,0,0,0,0|1,0,0]=3 640 B21R0.2972 CCCCCCCCCCCCCC(C)NC[C@@H](C)C(=O)O AIFCHEM-94558215944 [0,2,0,0,0,0|1,0,0]=3 641 B21R0.2972 CCCCCCCCCCCCCC(C)NC[C@H](C)C(=O)O AIFCHEM-5738679339 [0,2,0,0,0,0|1,0,0]=3 642 B21R0.2972 CCCCCCCCCCCCCC(C)NC[C@H](O)C(=O)O AIFCHEM-6398268339 [0,2,0,0,0,0|1,0,0]=3 643 B21R0.2978 CCCCCCCCCCCCN(C)C(C)CCCC(=O)O AIFCHEM-5918508555 [0,2,0,0,0,0|1,0,0]=3 644 B21R0.25505 CCCCCCCCCCCCCC(=O)NCCC(=O)OC AIFCHEM-6131561328 [0,2,0,0,0,0|1,0,1]=4 645 B21R0.25505 CCCCCCCCCCCCCC(C)NCCC(=O)OC AIFCHEM-6131543255 [0,2,0,0,0,0|1,0,0]=3 646 B21R0.25505 CCCCCCCCCCCCNC(=O)CCCC(=O)OC AIFCHEM-94584704435 [0,2,0,0,0,0|1,0,1]=4 647 B21R0.25505 CCCCCCCCCCCCNC(C)CCCC(=O)OC AIFCHEM-94584450982 [0,2,0,0,0,0|1,0,0]=3 648 B21R0.36662 CCCCCCCCCCCCCC(C)N[C@@H](C)CC(=O)O AIFCHEM-94577117115 [0,2,0,0,0,0|1,0,0]=3 649 B21R0.36662 CCCCCCCCCCCCCC(C)N[C@H](C)CC(=O)O AIFCHEM-5610687031 [0,2,0,0,0,0|1,0,0]=3 650 B21R0.39809 CC(C)CCCCCCCCCCCN(C)CCCC(=O)O AIFCHEM-94596088199 [0,2,0,0,0,0|1,0,0]=3 651 B21R0.14440 O=C(O)CCCCCCCCCCNCC[C@@H](O)[C@@H](O)CO AIFCHEM-6012393119 [0,2,0,0,0,0|2,0,0]=4 652 B21R0.14440 O=C(O)CCCCCCCCCCNCC[C@H](O)[C@H](O)CO AIFCHEM-6012383681 [0,2,0,0,0,0|2,0,0]=4 653 B21R0.39806 CC(C)CCCCCCCCCCCNCC(O)CC(=O)O AIFCHEM-94535476035 [0,2,0,0,0,0|1,0,0]=3 654 B21R0.39806 CC(C)CCCCCCCCCCCNC[C@@H](O)CC(=O)O AIFCHEM-6479635810 [0,2,0,0,0,0|1,0,0]=3 655 B21R0.39806 CC(C)CCCCCCCCCCCNC[C@H](O)CC(=O)O AIFCHEM-6496345190 [0,2,0,0,0,0|1,0,0]=3 656 B21R0.85 CCCCCCCCCCCCCCCCN(C)CC(=O)O AIFCHEM-5659480276 [0,2,0,0,0,0|0,0,0]=2 657 B21R0.85 CCCCCCCCCCCCCCCCN(C)CC(C)O AIFCHEM-6472831623 [0,2,0,0,0,0|1,0,1]=4 658 B21R0.85 CCCCCCCCCCCCCCCNC(=O)CC(=O)N AIFCHEM-5887818588 [0,2,0,0,0,0|1,0,1]=4 659 B21R0.85 CCCCCCCCCCCCCCCN[C@@H](C)CC(=O)O AIFCHEM-94577117422 [0,2,0,0,0,0|0,0,0]=2 660 B21R0.85 CCCCCCCCCCCCCCCN[C@H](C)CC(=O)O AIFCHEM-5625138790 [0,2,0,0,0,0|0,0,0]=2 661 B21R0.85 CCCCCCCCCCCCCCNC[C@@H](O)CC(=O)O AIFCHEM-6401179919 [0,2,0,0,0,0|0,0,0]=2 662 B21R0.85 CCCCCCCCCCCCCCNC[C@H](O)CC(=O)O AIFCHEM-6493404114 [0,2,0,0,0,0|0,0,0]=2 663 B21R0.2970 CCCCCCCCCCCCCCCN(C)[C@@H](C)C(=O)O AIFCHEM-5600987740 [0,2,0,0,0,0|1,0,0]=3 664 B21R0.2970 CCCCCCCCCCCCCCCN(C)[C@H](C)C(=O)O AIFCHEM-5741825165 [0,2,0,0,0,0|1,0,0]=3 665 B21R0.9297 CCCCCCCCCCCCCCCN(CC)CC(=O)O AIFCHEM-5773342162 [0,2,0,0,0,0|1,0,0]=3 666 B21R0.9297 CCCCCCCCCCCCCCN[C@@H](CC)CC(=O)O AIFCHEM-6117322172 [0,2,0,0,0,0|1,0,0]=3 667 B21R0.9297 CCCCCCCCCCCCCCN[C@H](CO)CC(=O)O AIFCHEM-6442218419 [0,2,0,0,0,0|1,0,0]=3 668 B21R0.25371 CCCCCCCCCCCCC(C)NCC(O)CC(=O)O AIFCHEM-94535471647 [0,2,0,0,0,0|1,0,0]=3 669 B21R0.25371 CCCCCCCCCCCCC(C)NC[C@@H](O)CC(=O)O AIFCHEM-6479479394 [0,2,0,0,0,0|1,0,0]=3 670 B21R0.25371 CCCCCCCCCCCCC(C)NC[C@H](O)CC(=O)O AIFCHEM-6496105399 [0,2,0,0,0,0|1,0,0]=3 671 B21R0.25524 CCCCCCCCCCCCCCNC(C)(C)CC(=O)O AIFCHEM-5612057355 [0,2,0,0,0,0|1,0,0]=3 672 B21R0.32102 CC(CC(=O)O)C(C)NCCCCCCCCCCCCO AIFCHEM-6450068762 [0,2,0,0,0,0|2,0,0]=4 673 B21R0.36393 CCCCCCCCCCCCCCCN(C)CC(=O)NC AIFCHEM-94608443903 [0,2,0,0,0,0|2,0,0]=4 674 B21R0.36393 CCCCCCCCCCCCCCCN(C)CC(=O)OC AIFCHEM-5996143404 [0,2,0,0,0,0|1,0,0]=3 675 B21R0.36393 CCCCCCCCCCCCCCNC(=O)CC(=O)OC AIFCHEM-94549709183 [0,2,0,0,0,0|1,0,1]=4 676 B21R0.36393 CCCCCCCCCCCCCCNC(C)CC(=O)OC AIFCHEM-6060956380 [0,2,0,0,0,0|1,0,0]=3 677 B21R0.36393 CCCCCCCCCCCCCCN[C@@H](C)CC(=O)OC AIFCHEM-5699098499 [0,2,0,0,0,0|1,0,0]=3 678 B21R0.36393 CCCCCCCCCCCCCCN[C@H](C)CC(=O)OC AIFCHEM-94564416376 [0,2,0,0,0,0|1,0,0]=3 679 B21R0.2907 C#CCC(=O)NCCCCCCCCCCCCCCCC AIFCHEM-5622697506 [0,2,0,0,0,0|2,0,0]=4 680 B21R0.2907 CC#CC(=O)NCCCCCCCCCCCCCCCC AIFCHEM-5621848233 [0,2,0,0,0,0|2,0,0]=4 681 B21R0.2907 CCCCCCCCCCCCCCCCCN(C)CCO AIFCHEM-6475139171 [0,2,0,0,0,0|2,0,0]=4 682 B21R0.2907 CCCCCCCCCCCCCCCCNC(=O)CC#N AIFCHEM-94559912955 [0,2,0,0,0,0|2,0,0]=4 683 B21R0.2907 CCCCCCCCCCCCCCCCNC(=O)CCO AIFCHEM-5599742603 [0,2,0,0,0,0|1,0,0]=3 684 B21R0.2907 CCCCCCCCCCCCCCCCNC(=O)COC AIFCHEM-5666059508 [0,2,0,0,0,0|1,0,0]=3 685 B21R0.2907 CCCCCCCCCCCCCCCCNC(=O)CSC AIFCHEM-5599787029 [0,2,0,0,0,0|1,1,0]=4 686 B21R0.2907 CCCCCCCCCCCCCCCNCC(=O)NCC AIFCHEM-5844747262 [0,2,0,0,0,0|2,0,0]=4 687 B21R0.2907 CCCCCCCCCCCCCCCNCC(=O)OCC AIFCHEM-5643636402 [0,2,0,0,0,0|1,0,0]=3 688 B21R0.2907 CCCCCCCCCCCCCCNCCC(=O)OCC AIFCHEM-6037054370 [0,2,0,0,0,0|1,0,0]=3 689 B21R0.2907 CCCCCCCCCCCCNCCCCC(=O)OCC AIFCHEM-5677360445 [0,2,0,0,0,0|1,0,0]=3 690 B21R0.2907 CCCCCCCCCCCNCCCCCC(=O)OCC AIFCHEM-6043548221 [0,2,0,0,0,0|1,0,0]=3 691 B21R0.2907 CCCCCCCCCCNCCCCCCC(=O)OCC AIFCHEM-5736872548 [0,2,0,0,0,0|1,0,0]=3 692 B21R0.2907 CCCCCNCCCCCCCCCCCC(=O)OCC AIFCHEM-94551434006 [0,2,0,0,0,0|1,0,0]=3 693 B21R0.2907 CCOC(=O)CCCCCCCCCCCNCCCSC AIFCHEM-94599492615 [0,2,0,0,0,0|2,0,0]=4 694 B21R0.2907 CCOC(=O)CCCCCCNCCCCCCCCCO AIFCHEM-6484928950 [0,2,0,0,0,0|2,0,0]=4 695 B21R0.2907 CCOC(=O)CCCCCNCCCCCCCCCCO AIFCHEM-6508944452 [0,2,0,0,0,0|2,0,0]=4 696 B21R0.2929 CCCCCCCCCC(=O)NCCCCCCC(=O)OC AIFCHEM-5843500490 [0,2,0,0,0,0|1,0,1]=4 697 B21R0.2929 CCCCCCCCCC(C)CNCCCCCC(=O)OC AIFCHEM-94601547553 [0,2,0,0,0,0|1,0,0]=3 698 B21R0.2929 CCCCCCCCCC(C)NCCCCCCC(=O)OC AIFCHEM-5820683334 [0,2,0,0,0,0|1,0,0]=3 699 B21R0.2929 CCCCCCCCNC(=O)CCCCCCCC(=O)OC AIFCHEM-5796227058 [0,2,0,0,0,0|1,0,1]=4 700 B21R0.2973 CCCCCCCCCCCCCCCNC(C)C(=O)NC AIFCHEM-5862518191 [0,2,0,0,0,0|2,0,0]=4 701 B21R0.2973 CCCCCCCCCCCCCCCNC(C)C(=O)OC AIFCHEM-5794799488 [0,2,0,0,0,0|1,0,0]=3 702 B21R0.2973 CCCCCCCCCCCCCCCN[C@@H](C)C(=O)NC AIFCHEM-5953606863 [0,2,0,0,0,0|2,0,0]=4 703 B21R0.2973 CCCCCCCCCCCCCCCN[C@@H](C)C(=O)OC AIFCHEM-5757773968 [0,2,0,0,0,0|1,0,0]=3 704 B21R0.2973 CCCCCCCCCCCCCCCN[C@H](C)C(=O)NC AIFCHEM-6039389268 [0,2,0,0,0,0|2,0,0]=4 705 B21R0.2973 CCCCCCCCCCCCCCCN[C@H](C)C(=O)OC AIFCHEM-5774253531 [0,2,0,0,0,0|1,0,0]=3 706 B21R0.2973 CCCCCCCCCCCCCCNCC(O)C(=O)OC AIFCHEM-6506251678 [0,2,0,0,0,0|1,0,0]=3 707 B21R0.2973 CCCCCCCCCCCCCCNC[C@H](O)C(=O)OC AIFCHEM-6498291282 [0,2,0,0,0,0|1,0,0]=3 708 B21R0.9167 CCCCCCCCCCCC(=O)NCCCCC(=O)OC AIFCHEM-5620614125 [0,2,0,0,0,0|1,0,1]=4 709 B21R0.9167 CCCCCCCCCCCC(C)NCCCCC(=O)OC AIFCHEM-5683159898 [0,2,0,0,0,0|1,0,0]=3 710 B21R0.9167 CCCCCCCCCCNC(=O)CCCCCC(=O)OC AIFCHEM-5627043402 [0,2,0,0,0,0|1,0,1]=4 711 B21R0.16361 CCCCC(=O)NCCCCCCCCCCCC(=O)OC AIFCHEM-94534108025 [0,2,0,0,0,0|1,0,1]=4 712 B21R0.16361 CCCCC(C)NCCCCCCCCCCCC(=O)OC AIFCHEM-94541400539 [0,2,0,0,0,0|1,0,0]=3 713 B21R0.16361 CCCNC(=O)CCCCCCCCCCCCC(=O)OC AIFCHEM-94521378722 [0,2,0,0,0,0|1,0,1]=4 714 B21R0.16361 COC(=O)CCCCCCCCCCCNC(C)CCSC AIFCHEM-5846494442 [0,2,0,0,0,0|2,0,0]=4 715 B21R0.18597 CCCCCCCCCCC(=O)NCCCCCC(=O)OC AIFCHEM-5648258016 [0,2,0,0,0,0|1,0,1]=4 716 B21R0.18597 CCCCCCCCCNC(=O)CCCCCCC(=O)OC AIFCHEM-6143638481 [0,2,0,0,0,0|1,0,1]=4 717 B21R0.23597 CCCCCC(=O)NCCCCCCCCCCC(=O)OC AIFCHEM-94585552219 [0,2,0,0,0,0|1,0,1]=4 718 B21R0.23597 CCCCCC(C)NCCCCCCCCCCC(=O)OC AIFCHEM-94564407584 [0,2,0,0,0,0|1,0,0]=3 719 B21R0.24664 COC(=O)CCCCCCCCCCCNCCC(C)SC AIFCHEM-5846631827 [0,2,0,0,0,0|2,0,0]=4 720 B21R0.25376 CCCCCCCCCCCCC(C)NCCCC(=O)OC AIFCHEM-6131200135 [0,2,0,0,0,0|1,0,0]=3 721 B21R0.25376 CCCCCCCCCCCCN(C)CCCCC(=O)OC AIFCHEM-5898909311 [0,2,0,0,0,0|1,0,0]=3 722 B21R0.25376 CCCCCCCCCCCNC(=O)CCCCC(=O)OC AIFCHEM-6079392338 [0,2,0,0,0,0|1,0,1]=4 723 B21R0.25376 CCCCCCCCCCCNC(C)CCCCC(=O)OC AIFCHEM-5997689856 [0,2,0,0,0,0|1,0,0]=3 724 B21R0.25376 COC(=O)CCCCC(C)NCCCCCCCCCCO AIFCHEM-6492923987 [0,2,0,0,0,0|2,0,0]=4 725 B21R0.30140 COC(=O)CCCCCCCNCCCCCCCC(=O)O AIFCHEM-5805796116 [0,2,0,0,0,0|1,0,1]=4 726 B21R0.30140 COC(=O)CCCCCCNCCCCCCCCC(=O)O AIFCHEM-5828546973 [0,2,0,0,0,0|1,0,1]=4 727 B21R0.30140 COC(=O)CCCCCNCCCCCCCCCC(=O)O AIFCHEM-5664579533 [0,2,0,0,0,0|1,0,1]=4 728 B21R0.30140 COC(=O)CCCCNCCCCCCCCCCC(=O)O AIFCHEM-6034442740 [0,2,0,0,0,0|1,0,1]=4 729 B21R0.30140 COC(=O)CCCNCCCCCCCCCCCC(=O)O AIFCHEM-94592444989 [0,2,0,0,0,0|1,0,1]=4 730 B21R0.30140 COC(=O)CCCNCCCCCCCCCCCC(C)C AIFCHEM-6117815672 [0,2,0,0,0,0|1,0,0]=3 731 B21R0.32104 CCCCCCCCCCCCCCC(=O)NCC(=O)OC AIFCHEM-6234601343 [0,2,0,0,0,0|1,0,1]=4 732 B21R0.32104 CCCCCCCCCCCCCCC(C)NCC(=O)NC AIFCHEM-5946365511 [0,2,0,0,0,0|2,0,0]=4 733 B21R0.32104 CCCCCCCCCCCCCCC(C)NCC(=O)OC AIFCHEM-6213766299 [0,2,0,0,0,0|1,0,0]=3 734 B21R0.32104 CCCCCCCCCCCCCCN(C)CCC(=O)NC AIFCHEM-94601208576 [0,2,0,0,0,0|2,0,0]=4 735 B21R0.32104 CCCCCCCCCCCCCCN(C)CCC(=O)OC AIFCHEM-5773900904 [0,2,0,0,0,0|1,0,0]=3 736 B21R0.32104 CCCCCCCCCCCCCNC(=O)CCC(=O)OC AIFCHEM-94552341660 [0,2,0,0,0,0|1,0,1]=4 737 B21R0.32104 CCCCCCCCCCCCCNC(C)CCC(=O)OC AIFCHEM-94552334275 [0,2,0,0,0,0|1,0,0]=3 738 B21R0.32104 COC(=O)CCC(C)NCCCCCCCCCCCCO AIFCHEM-6410279540 [0,2,0,0,0,0|2,0,0]=4 739 B21R0.36766 C#CC(=O)NCCCCCCCCCCCCCCCCC AIFCHEM-94525198876 [0,2,0,0,0,0|1,0,0]=3 740 B21R0.36766 CCCCCCCCCCCCCCCCCNC(=O)CC AIFCHEM-94582595829 [0,2,0,0,0,0|1,0,0]=3 741 B21R0.36766 CCCCCCCCCCCCCCCCCNC(=O)CO AIFCHEM-94532682528 [0,2,0,0,0,0|0,0,0]=2 742 B21R0.36766 CCCCCCCCCCCCCCCCCNC(C)CO AIFCHEM-6410728092 [0,2,0,0,0,0|1,0,1]=4 743 B21R0.36766 CCCCCCCCCCCCCCCCCN[C@@H](C)CO AIFCHEM-6418470038 [0,2,0,0,0,0|1,0,1]=4 744 B21R0.36766 CCCCCCCCCCCCCCCCCN[C@H](C)CO AIFCHEM-6394677051 [0,2,0,0,0,0|1,0,1]=4 745 B21R0.36766 CCCCCCCCCCCCCCCCNCC(=O)OC AIFCHEM-6212803322 [0,2,0,0,0,0|0,0,0]=2 746 B21R0.36766 CCCCCCCCCCCCCCCCNCC(C)CO AIFCHEM-94540295240 [0,2,0,0,0,0|1,0,1]=4 747 B21R0.36766 CCCCCCCCCCCCCCCCNCC(O)CC AIFCHEM-6401300412 [0,2,0,0,0,0|1,0,1]=4 748 B21R0.36766 CCCCCCCCCCCCCCCCNCC(O)CO AIFCHEM-5598068807 [0,2,0,0,0,0|0,0,2]=4 749 B21R0.36766 CCCCCCCCCCCCCCCCNC[C@@H](C)OC AIFCHEM-94608840548 [0,2,0,0,0,0|1,0,1]=4 750 B21R0.36766 CCCCCCCCCCCCCCCCNC[C@@H](F)CO AIFCHEM-6395159203 [0,2,0,0,0,0|1,0,1]=4 751 B21R0.36766 CCCCCCCCCCCCCCCCNC[C@@H](O)CO AIFCHEM-6482578240 [0,2,0,0,0,0|0,0,2]=4 752 B21R0.36766 CCCCCCCCCCCCCCCCNC[C@H](C)OC AIFCHEM-94588784454 [0,2,0,0,0,0|1,0,1]=4 753 B21R0.36766 CCCCCCCCCCCCCCCCNC[C@H](F)CO AIFCHEM-94577440728 [0,2,0,0,0,0|1,0,1]=4 754 B21R0.36766 CCCCCCCCCCCCCCCCNC[C@H](O)CC AIFCHEM-6462569773 [0,2,0,0,0,0|1,0,1]=4 755 B21R0.36766 CCCCCCCCCCCCCCCCNC[C@H](O)CO AIFCHEM-6452761433 [0,2,0,0,0,0|0,0,2]=4 756 B21R0.36766 CCCCCCCCCCCCCCCNCCC(=O)OC AIFCHEM-6173895436 [0,2,0,0,0,0|0,0,0]=2 757 B21R0.36766 CCCCCCCCCCCCCCCNCCC(C)CO AIFCHEM-6480815110 [0,2,0,0,0,0|1,0,1]=4 758 B21R0.36766 CCCCCCCCCCCCCCNCCCC(=O)OC AIFCHEM-6131454822 [0,2,0,0,0,0|0,0,0]=2 759 B21R0.36766 CCCCCCCCCCCCCCNCCNC(=O)CC AIFCHEM-94532522916 [0,2,0,0,0,0|2,0,0]=4 760 B21R0.36766 CCCCCCCCCCCCCNCCCCC(=O)OC AIFCHEM-94552334141 [0,2,0,0,0,0|0,0,0]=2 761 B21R0.36766 CCCCCCCCCCCCNCCCCCC(=O)OC AIFCHEM-94584700613 [0,2,0,0,0,0|0,0,0]=2 762 B21R0.36766 CCCCCCCCCCCNCCCCCCC(=O)OC AIFCHEM-5828596617 [0,2,0,0,0,0|0,0,0]=2 763 B21R0.36766 CCCCCCCCCCNCCOCCOCC(=O)OC AIFCHEM-5695848232 [0,2,0,0,0,0|2,0,0]=4 764 B21R0.36766 CCCCCCCCCNCCOCCOCCC(=O)OC AIFCHEM-94583089570 [0,2,0,0,0,0|2,0,0]=4 765 B21R0.36766 CCCCCCCCNCCCCCCCCCC(=O)OC AIFCHEM-6074618361 [0,2,0,0,0,0|0,0,0]=2 766 B21R0.36766 CCCCCCCNCCCCCCCCCCC(=O)OC AIFCHEM-94589457373 [0,2,0,0,0,0|0,0,0]=2 767 B21R0.36766 COC(=O)CCCCCCCCCCCNCCCCCO AIFCHEM-5846380290 [0,2,0,0,0,0|1,0,0]=3 768 B21R0.36766 COC(=O)CCCCNCCCCCCCCCCCCO AIFCHEM-6475715738 [0,2,0,0,0,0|1,0,0]=3 769 B21R0.36769 CCCCCCCCCCCCCCCCNC(=O)C(C)C AIFCHEM-94545043949 [0,2,0,0,0,0|2,0,0]=4 770 B21R0.36769 CCCCCCCCCCCCCCCCNC(=O)C(C)O AIFCHEM-94540227046 [0,2,0,0,0,0|1,0,0]=3 771 B21R0.36769 CCCCCCCCCCCCCCCCNC(=O)[C@H](C)O AIFCHEM-5666176214 [0,2,0,0,0,0|1,0,0]=3 772 B21R0.36769 CCCCCCCCCCCCCCCCNC(C)C(=O)N AIFCHEM-6249259323 [0,2,0,0,0,0|1,0,0]=3 773 B21R0.36769 CCCCCCCCCCCCCCCCNC(C)C(=O)O AIFCHEM-5965175545 [0,2,0,0,0,0|0,0,0]=2 774 B21R0.36769 CCCCCCCCCCCCCCCCNC(C)C(C)O AIFCHEM-94547065688 [0,2,0,0,0,0|1,0,1]=4 775 B21R0.36769 CCCCCCCCCCCCCCCCNC(O)C(=O)O AIFCHEM-5593419439 [0,2,0,0,0,0|0,0,0]=2 776 B21R0.36769 CCCCCCCCCCCCCCCCN[C@@H](C)C(=O)N AIFCHEM-5724358862 [0,2,0,0,0,0|1,0,0]=3 777 B21R0.36769 CCCCCCCCCCCCCCCCN[C@@H](C)C(=O)O AIFCHEM-5704936225 [0,2,0,0,0,0|0,0,0]=2 778 B21R0.36769 CCCCCCCCCCCCCCCCN[C@H](C)C(=O)N AIFCHEM-5944527470 [0,2,0,0,0,0|1,0,0]=3 779 B21R0.36769 CCCCCCCCCCCCCCCNCC(=O)N(C)C AIFCHEM-5683820869 [0,2,0,0,0,0|2,0,0]=4 780 B21R0.36769 CCCCCCCCCCCCCCCNCC(C)C(=O)O AIFCHEM-5964204640 [0,2,0,0,0,0|0,0,0]=2 781 B21R0.36769 CCCCCCCCCCCCCCCNCC(O)C(=O)O AIFCHEM-6440057698 [0,2,0,0,0,0|0,0,0]=2 782 B21R0.36769 CCCCCCCCCCCCCCCNC[C@@H](C)C(=O)O AIFCHEM-5799520141 [0,2,0,0,0,0|0,0,0]=2 783 B21R0.36769 CCCCCCCCCCCCCCCNC[C@H](C)C(=O)O AIFCHEM-5715492306 [0,2,0,0,0,0|0,0,0]=2 784 B21R0.36769 CCCCCCCCCCCCCCCNC[C@H](O)C(=O)O AIFCHEM-6473114953 [0,2,0,0,0,0|0,0,0]=2 785 B21R0.36769 CCCCCCCCCCCCCCNCCC(=O)N(C)C AIFCHEM-5863541815 [0,2,0,0,0,0|2,0,0]=4 786 B21R0.36769 CCCCCCCCCCCCCCNCCC(O)C(=O)O AIFCHEM-6432492091 [0,2,0,0,0,0|0,0,0]=2 787 B21R0.36769 CCCCCCCCCCCCCCNCC[C@H](O)C(=O)O AIFCHEM-6387645532 [0,2,0,0,0,0|0,0,0]=2 788 B21R0.37037 CCCCCCNC(=O)CCCCCCCCCC(=O)OC AIFCHEM-94575443865 [0,2,0,0,0,0|1,0,1]=4 789 B21R0.9296 CCCCCCCCCCCCCCCCN(CC)C(=O)C AIFCHEM-98290659499 [0,2,0,0,0,0|2,0,0]=4 790 B21R0.9296 CCCCCCCCCCCCCCCNC(CC)C(=O)N AIFCHEM-5717813135 [0,2,0,0,0,0|2,0,0]=4 791 B21R0.9296 CCCCCCCCCCCCCCCNC(CC)C(=O)O AIFCHEM-6144026737 [0,2,0,0,0,0|1,0,0]=3 792 B21R0.9296 CCCCCCCCCCCCCCCNC(CO)C(=O)O AIFCHEM-6439043187 [0,2,0,0,0,0|1,0,0]=3 793 B21R0.9296 CCCCCCCCCCCCCCCN[C@@H](CC)C(=O)N AIFCHEM-5935835074 [0,2,0,0,0,0|2,0,0]=4 794 B21R0.9296 CCCCCCCCCCCCCCCN[C@@H](CC)C(=O)O AIFCHEM-5621902519 [0,2,0,0,0,0|1,0,0]=3 795 B21R0.9296 CCCCCCCCCCCCCCCN[C@@H](CO)C(=O)N AIFCHEM-6449893269 [0,2,0,0,0,0|2,0,0]=4 796 B21R0.9296 CCCCCCCCCCCCCCCN[C@@H](CO)C(=O)O AIFCHEM-6482291591 [0,2,0,0,0,0|1,0,0]=3 797 B21R0.9296 CCCCCCCCCCCCCCCN[C@H](CC)C(=O)N AIFCHEM-5966162218 [0,2,0,0,0,0|2,0,0]=4 798 B21R0.9296 CCCCCCCCCCCCCCCN[C@H](CC)C(=O)O AIFCHEM-5617050617 [0,2,0,0,0,0|1,0,0]=3 799 B21R0.9296 CCCCCCCCCCCCCCCN[C@H](CO)C(=O)N AIFCHEM-6467498316 [0,2,0,0,0,0|2,0,0]=4 800 B21R0.9296 CCCCCCCCCCCCCCCN[C@H](CO)C(=O)O AIFCHEM-6500305443 [0,2,0,0,0,0|1,0,0]=3 801 B21R0.22911 CC(C)CCCCCCCCCCCNCCC(O)C(=O)O AIFCHEM-6412462233 [0,2,0,0,0,0|1,0,0]=3 802 B21R0.22911 CC(C)CCCCCCCCCCCNCC[C@H](O)C(=O)O AIFCHEM-6388425228 [0,2,0,0,0,0|1,0,0]=3 803 B21R0.36403 CC(CC(C)C(=O)O)NCCCCCCCCCCCCO AIFCHEM-94605221047 [0,2,0,0,0,0|2,0,0]=4 804 B21R0.36403 CCCCCCCCCCCCCCC(C)NC(C)C(=O)N AIFCHEM-6267549746 [0,2,0,0,0,0|2,0,0]=4 805 B21R0.36403 CCCCCCCCCCCCCCC(C)NC(C)C(=O)O AIFCHEM-5927059876 [0,2,0,0,0,0|1,0,0]=3 806 B21R0.36403 CCCCCCCCCCCCCCC(C)NC(O)C(=O)O AIFCHEM-5633131475 [0,2,0,0,0,0|1,0,0]=3 807 B21R0.36403 CCCCCCCCCCCCCCC(C)N[C@@H](C)C(=O)N AIFCHEM-5735272437 [0,2,0,0,0,0|2,0,0]=4 808 B21R0.36403 CCCCCCCCCCCCCCC(C)N[C@@H](C)C(=O)O AIFCHEM-5705409356 [0,2,0,0,0,0|1,0,0]=3 809 B21R0.36403 CCCCCCCCCCCCCCC(C)N[C@H](C)C(=O)N AIFCHEM-5952593803 [0,2,0,0,0,0|2,0,0]=4 810 B21R0.36403 CCCCCCCCCCCCCCC(C)N[C@H](C)C(=O)O AIFCHEM-5953910659 [0,2,0,0,0,0|1,0,0]=3 811 B21R0.37123 CCCCCCCCCCCCCCNCC(C)(C)C(=O)N AIFCHEM-5616677822 [0,2,0,0,0,0|2,0,0]=4 812 B21R0.37123 CCCCCCCCCCCCCCNCC(C)(C)C(=O)O AIFCHEM-5702007884 [0,2,0,0,0,0|1,0,0]=3 813 B21R0.22913 CC(C)CCC(C)NCCCCCCCCCCCC(=O)O AIFCHEM-94576121599 [0,2,0,0,0,0|1,0,0]=3 814 B21R0.22913 CC(C)CCCCCCCCCCCNC(C)CCC(=O)O AIFCHEM-6248042662 [0,2,0,0,0,0|1,0,0]=3 815 B21R0.25385 CCCCCCCCCCCCC(C)NC(C)CCC(=O)O AIFCHEM-6278862834 [0,2,0,0,0,0|1,0,0]=3 816 B21R0.25419 CCCCCCCCCCCCCCN(C)CCS(=O)(=O)O AIFCHEM-5715423748 [0,2,0,0,0,0|2,0,0]=4 817 B21R0.36773 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[0,2,0,0,0,0|0,0,0]=2 829 B21R0.25377 CCCCCCCCCCCCC(C)NCCCNC(=O)C AIFCHEM-94531734132 [0,2,0,0,0,0|2,0,0]=4 830 B21R0.25377 CCCCCCCCCCCCC(C)NCCOCC(=O)O AIFCHEM-94563714690 [0,2,0,0,0,0|1,0,0]=3 831 B21R0.25377 CCCCCCCCCCCCN(C)CCCCOC(=O)C AIFCHEM-5976030358 [0,2,0,0,0,0|2,0,0]=4 832 B21R0.25377 CCCCCCCCCCCNC(C)CCCCCC(=O)O AIFCHEM-5997610266 [0,2,0,0,0,0|0,0,0]=2 833 B21R0.31974 CC(CCCCC(=O)O)C(C)NCCCCCCCCCO AIFCHEM-6503632696 [0,2,0,0,0,0|2,0,0]=4 834 B21R0.31974 CCCCCCCCCCNC(C)C(C)CCCCC(=O)O AIFCHEM-5662862307 [0,2,0,0,0,0|1,0,0]=3 835 B21R0.32985 CCCCCCCCCCN(C)CCCCCCCC(=O)O AIFCHEM-94561122533 [0,2,0,0,0,0|0,0,0]=2 836 B21R0.25508 CCCCCCCCCCCCCC(=O)NCCCC(=O)N AIFCHEM-5922576538 [0,2,0,0,0,0|1,0,1]=4 837 B21R0.25508 CCCCCCCCCCCCCC(=O)NCCNC(=O)O AIFCHEM-94535756395 [0,2,0,0,0,0|1,0,1]=4 838 B21R0.25508 CCCCCCCCCCCCCC(C)NCCCC(=O)N AIFCHEM-5922209433 [0,2,0,0,0,0|1,0,0]=3 839 B21R0.25508 CCCCCCCCCCCCCC(C)NCCCC(=O)O AIFCHEM-5678081064 [0,2,0,0,0,0|0,0,0]=2 840 B21R0.25508 CCCCCCCCCCCCCC(C)NCCNC(=O)C AIFCHEM-5964273897 [0,2,0,0,0,0|2,0,0]=4 841 B21R0.25508 CCCCCCCCCCCCCC(C)NCCNC(=O)N AIFCHEM-5814694632 [0,2,0,0,0,0|2,0,0]=4 842 B21R0.25508 CCCCCCCCCCCCCC(C)NCCNC(=O)O AIFCHEM-94535745688 [0,2,0,0,0,0|1,0,0]=3 843 B21R0.25508 CCCCCCCCCCCCCC(C)NCCOC(=O)C AIFCHEM-5621241548 [0,2,0,0,0,0|2,0,0]=4 844 B21R0.25508 CCCCCCCCCCCCNC(=O)CCCCC(=O)C AIFCHEM-94584461317 [0,2,0,0,0,0|1,0,1]=4 845 B21R0.25508 CCCCCCCCCCCCNC(C)CCCCC(=O)O AIFCHEM-5625245180 [0,2,0,0,0,0|0,0,0]=2 846 B21R0.25508 CCCCCCCCCCCCNC(C)CCCOC(=O)C AIFCHEM-5684246726 [0,2,0,0,0,0|2,0,0]=4 847 B21R0.294 CCOC(=O)CCCCCCNCCCCCCCC(=O)O AIFCHEM-94557842715 [0,2,0,0,0,0|1,0,1]=4 848 B21R0.294 CCOC(=O)CCCCCNCCCCCCCCC(=O)O AIFCHEM-5837862933 [0,2,0,0,0,0|1,0,1]=4 849 B21R0.294 CCOC(=O)CCCCNCCCCCCCCCC(=O)O AIFCHEM-6212021072 [0,2,0,0,0,0|1,0,1]=4 850 B21R0.8702 CCN(CC)CCCCNCCCCCCCCCC(=O)O AIFCHEM-6000262674 [0,2,0,0,0,0|2,0,0]=4 851 B21R0.81 CC(=O)OCCCCNCCCCCCCCCCCCO AIFCHEM-6475811883 [0,2,0,0,0,0|2,0,0]=4 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AIFCHEM-6246801593 [0,2,0,0,0,0|1,0,0]=3 877 B21R0.81 CCCCCCCCCCCNCCOCCOCC(=O)O AIFCHEM-94520998658 [0,2,0,0,0,0|1,0,0]=3 878 B21R0.81 CCCCCCCCCCNCCCCCCCCC(=O)O AIFCHEM-5746180420 [0,2,0,0,0,0|0,0,0]=2 879 B21R0.81 CCCCCCCCCCNCCOCCOCCC(=O)O AIFCHEM-5896517211 [0,2,0,0,0,0|1,0,0]=3 880 B21R0.81 CCCCCCCCCNCCCCCCCCCC(=O)O AIFCHEM-6187379666 [0,2,0,0,0,0|0,0,0]=2 881 B21R0.81 CCCCCCCCNCCCCCCCCCCC(=O)O AIFCHEM-6012090924 [0,2,0,0,0,0|0,0,0]=2 882 B21R0.81 CCCCCCCCNCCOCCOCCOCC(=O)O AIFCHEM-6281943419 [0,2,0,0,0,0|2,0,0]=4 883 B21R0.81 CCCCCCCNCCCCCCCCCCCC(=O)O AIFCHEM-94589461964 [0,2,0,0,0,0|0,0,0]=2 884 B21R0.81 CCCCCCCNCCOCCOCCOCCC(=O)O AIFCHEM-94589462918 [0,2,0,0,0,0|2,0,0]=4 885 B21R0.81 COCCOCCOCCNCCCCCCCCC(=O)O AIFCHEM-6276690194 [0,2,0,0,0,0|2,0,0]=4 886 B21R0.81 O=C(O)CCCCCCCCCNCCCCCCCCO AIFCHEM-6395164234 [0,2,0,0,0,0|0,0,0]=2 887 B21R0.81 O=C(O)CCCCCCCCCNCCOCCOCCF AIFCHEM-5857447636 [0,2,0,0,0,0|2,0,0]=4 888 B21R0.81 O=C(O)CCCCCCCCCNCCOCCOCCO AIFCHEM-6463829765 [0,2,0,0,0,0|2,0,0]=4 889 B21R0.81 O=C(O)CCCCCCCCNCCCCCCCCCO AIFCHEM-6500291569 [0,2,0,0,0,0|0,0,0]=2 890 B21R0.81 O=C(O)CCCCCCCCNCCCOCCOCCO AIFCHEM-6480529613 [0,2,0,0,0,0|2,0,0]=4 891 B21R0.81 O=C(O)CCCCCCCNCCCCCCCCCCO AIFCHEM-6505777285 [0,2,0,0,0,0|0,0,0]=2 892 B21R0.9014 CC(=O)NCCCCCNCCCCCCCCCC(=O)O AIFCHEM-94565855599 [0,2,0,0,0,0|1,0,1]=4 893 B21R0.9014 CC(=O)NCCCNCCCCCCCCCCCC(C)C AIFCHEM-94531737040 [0,2,0,0,0,0|2,0,0]=4 894 B21R0.9014 CC(=O)SCCCCCCNCCCCCCCCC(=O)O AIFCHEM-6270628624 [0,2,0,0,0,0|1,0,1]=4 895 B21R0.9014 CC(=O)SCCCNCCCCCCCCCCCC(=O)O AIFCHEM-94576125646 [0,2,0,0,0,0|1,0,1]=4 896 B21R0.9014 CC(C)CCCCCCCCCCCNCCCCC(=O)N AIFCHEM-5955900360 [0,2,0,0,0,0|1,0,0]=3 897 B21R0.9014 CC(C)CCCCCCCCCCCNCCCCC(=O)O AIFCHEM-94585283099 [0,2,0,0,0,0|0,0,0]=2 898 B21R0.9014 CC(C)CCCCCCCCCCCNCCOCC(=O)O AIFCHEM-6190122893 [0,2,0,0,0,0|1,0,0]=3 899 B21R0.9014 O=C(O)CCCCCCCCCNCCCCCCC(=O)O AIFCHEM-5743141630 [0,2,0,0,0,0|1,0,1]=4 900 B21R0.9014 O=C(O)CCCCCCCCNCCCCCCCC(=O)O AIFCHEM-5811803905 [0,2,0,0,0,0|1,0,1]=4 901 B21R0.9168 CCCCCCCCCCCC(C)NCCCCCC(=O)O AIFCHEM-94574978392 [0,2,0,0,0,0|0,0,0]=2 902 B21R0.9168 CCCCCCCCCCCC(C)NCCCCNC(=O)C AIFCHEM-94585141518 [0,2,0,0,0,0|2,0,0]=4 903 B21R0.9168 CCCCCCCCCCCC(C)NCCOCCC(=O)O AIFCHEM-5949161395 [0,2,0,0,0,0|1,0,0]=3 904 B21R0.9168 CCCCCNCCCCCC(=O)NCCCCCC(=O)O AIFCHEM-94551429396 [0,2,0,0,0,0|1,0,1]=4 905 B21R0.9287 CCCCCCCCC(C)CNCCCCCCCC(=O)O AIFCHEM-94557841161 [0,2,0,0,0,0|0,0,0]=2 906 B21R0.9287 CCCCCCCCC(C)CNCCCCCCNC(=O)O AIFCHEM-94538180811 [0,2,0,0,0,0|1,0,0]=3 907 B21R0.9287 CCCCCCCCC(C)CNCCCCCCSC(=O)C AIFCHEM-6278710588 [0,2,0,0,0,0|2,0,0]=4 908 B21R0.9287 CCCCCCCCC(C)NCCOCCOCCC(=O)O AIFCHEM-5916591176 [0,2,0,0,0,0|2,0,0]=4 909 B21R0.9287 CCCCCCCCN(C)CCCCCCCCCC(=O)O AIFCHEM-5880287649 [0,2,0,0,0,0|0,0,0]=2 910 B21R0.18619 CCCCCCC(C)NCCCCCCCCCCC(=O)O AIFCHEM-6012166449 [0,2,0,0,0,0|0,0,0]=2 911 B21R0.36326 CC(CCCC#N)NCCCCCCCCCCCC(=O)O AIFCHEM-94576121403 [0,2,0,0,0,0|1,0,1]=4 912 B21R0.36326 CCCCCC(C)NCCCCCCCCCCCC(=O)O AIFCHEM-94564412175 [0,2,0,0,0,0|0,0,0]=2 913 B21R0.36399 CCCCCCCCCCCCCCCCNCC(C)(C)O AIFCHEM-6464968778 [0,2,0,0,0,0|1,0,1]=4 914 B21R0.36399 CCCCCCCCCCCCCCCNCCC(C)(C)O AIFCHEM-6467862246 [0,2,0,0,0,0|1,0,1]=4 915 B21R0.36399 CCCCCCCCCCCCCCCNCCS(=O)(=O)C AIFCHEM-5848102863 [0,2,0,0,0,0|1,0,1]=4 916 B21R0.36399 CCCCCCCCCCCCCCCNCCS(=O)(=O)N AIFCHEM-6413343155 [0,2,0,0,0,0|1,0,1]=4 917 B21R0.36399 CCCCCCCCCCCCCCCNCCS(=O)(=O)O AIFCHEM-5713628213 [0,2,0,0,0,0|1,0,0]=3 918 B21R0.36399 CCCCCCCCCCCCCCNCCCS(=O)(=O)C AIFCHEM-6002721267 [0,2,0,0,0,0|1,0,1]=4 919 B21R0.36399 CCCCCCCCCCCCCCNCCCS(=O)(=O)O AIFCHEM-5642996375 [0,2,0,0,0,0|1,0,0]=3 920 B21R0.32153 CCCCCCCN(CC)CCCCCCCCCC(=O)O AIFCHEM-94542694383 [0,2,0,0,0,0|1,0,0]=3 921 B21R0.39788 CC(C)CCCCCCCCCCCNCCCS(=O)(=O)O AIFCHEM-5652483849 [0,2,0,0,0,0|2,0,0]=4 922 B19R1.274 CCCCCCCCCCCNCC1CCC(=O)N1 AIFCHEM-5621145657 [1,0,0,1,0,0|2,0,0]=4 923 B19R1.274 CCCCCCCCCCCNC[C@@H]1CCC(=O)N1 AIFCHEM-94588860007 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