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OCCCCCN[C@@H]1COCC[C@H]1O AIFCHEM-94604672277 [0,1,0,1,0,0|2,0,0]=4 554 B14R1.882 OCCCCCN[C@H]1CCOC[C@@H]1O AIFCHEM-6482808960 [0,1,0,1,0,0|2,0,0]=4 555 B14R1.882 OCCCCCN[C@H]1COCC[C@@H]1O AIFCHEM-94606105133 [0,1,0,1,0,0|2,0,0]=4 556 B14R1.939 CSCCC(C)N1CCCCC1CO AIFCHEM-6396043343 [0,1,0,1,0,0|2,0,0]=4 557 B14R1.939 CSCCC(C)N1CCCC[C@@H]1CO AIFCHEM-6391239873 [0,1,0,1,0,0|2,0,0]=4 558 B14R1.939 CSCCC(C)N1CCCC[C@H]1CO AIFCHEM-94551685762 [0,1,0,1,0,0|2,0,0]=4 559 B14R1.3768 CC(NCCCCCCO)C1CCC1 AIFCHEM-6503695459 [0,1,0,1,0,0|1,0,0]=3 560 B14R1.4731 CCCCNCCCC1(OCCO1)C AIFCHEM-94523040521 [0,1,0,1,0,0|2,0,0]=4 561 B14R1.14 CCCCCCCN1CCC(CC1)C AIFCHEM-94595726337 [0,1,0,1,0,0|2,0,0]=4 562 B14R1.14 CCCCCCNC1CCC(CC1)O AIFCHEM-94575432678 [0,1,0,1,0,0|2,0,0]=4 563 B14R1.14 OCCCCCNC1CCC(CC1)F AIFCHEM-94526004074 [0,1,0,1,0,0|1,0,0]=3 564 B14R1.483 CCC(C)CN1CCCCC1CCO AIFCHEM-6418923710 [0,1,0,1,0,0|1,0,0]=3 565 B14R1.483 CCC(C)CN1CCCC[C@@H]1CCO AIFCHEM-6506536862 [0,1,0,1,0,0|1,0,0]=3 566 B14R1.483 CCC(C)CN1CCCC[C@H]1CCO AIFCHEM-94599265292 [0,1,0,1,0,0|1,0,0]=3 567 B14R1.716 O=C(CO)NCCCC1CCCCC1 AIFCHEM-5937835201 [0,1,0,1,0,0|1,0,1]=4 568 B14R1.716 OC[C@@H](F)CNCCC1CCCCC1 AIFCHEM-94577440326 [0,1,0,1,0,0|1,0,0]=3 569 B14R1.716 OC[C@H](F)CNCCC1CCCCC1 AIFCHEM-6395313620 [0,1,0,1,0,0|1,0,0]=3 570 B14R1.789 CCC(C)C1CCCCC1NCCO AIFCHEM-6411479203 [0,1,0,1,0,0|1,0,0]=3 571 B14R1.837 CC(CO)CCNC1CCCCC1O AIFCHEM-6388157064 [0,1,0,1,0,0|2,0,0]=4 572 B14R1.863 CCC1CCCCC1NCC(O)CO AIFCHEM-6404860606 [0,1,0,1,0,0|1,0,0]=3 573 B14R1.863 CCC1CCCCC1NC[C@@H](O)CO AIFCHEM-6434498538 [0,1,0,1,0,0|1,0,0]=3 574 B14R1.863 CCC1CCCCC1NC[C@H](O)CO AIFCHEM-6427583451 [0,1,0,1,0,0|1,0,0]=3 575 B14R1.1224 CC(CF)NC1CCCCCCCC1 AIFCHEM-6108869878 [0,1,0,1,0,0|2,0,0]=4 576 B14R1.1224 CCC(C)CN1CCCCCCCC1 AIFCHEM-94559694733 [0,1,0,1,0,0|2,0,0]=4 577 B14R1.1224 C[C@@H](CF)NC1CCCCCCCC1 AIFCHEM-6033284640 [0,1,0,1,0,0|2,0,0]=4 578 B14R1.1224 C[C@H](CF)NC1CCCCCCCC1 AIFCHEM-6168952484 [0,1,0,1,0,0|2,0,0]=4 579 B14R1.1586 CCC(C)CNCC1CCCCCC1 AIFCHEM-94532086884 [0,1,0,1,0,0|2,0,0]=4 580 B14R1.2392 CSCCCN1CCCCC(C1)CO AIFCHEM-94546189296 [0,1,0,1,0,0|2,0,0]=4 581 B14R1.6522 CCCCCCCCCNC1(CC1)C AIFCHEM-6154568173 [0,1,0,1,0,0|2,0,0]=4 582 B14R1.38 CC(NCCCCO)C1CCOCC1 AIFCHEM-6503131514 [0,1,0,1,0,0|2,0,0]=4 583 B14R1.38 CN(CCCCCO)C1CCCOC1 AIFCHEM-6448298648 [0,1,0,1,0,0|2,0,0]=4 584 B14R1.92 CCCCCNC(=O)CC1CCCO1 AIFCHEM-94552828389 [0,1,0,1,0,0|1,0,1]=4 585 B14R1.1254 CCCCCNC1CCCCCCC1 AIFCHEM-94522653963 [0,1,0,1,0,0|1,0,0]=3 586 B14R1.1254 COCCNCC1CCCCCCC1 AIFCHEM-94592412025 [0,1,0,1,0,0|1,0,0]=3 587 B14R1.1254 CSCCNCC1CCCCCCC1 AIFCHEM-94592417261 [0,1,0,1,0,0|1,1,0]=4 588 B14R1.3360 CC1OCCC1N(C)CCCCCO AIFCHEM-6474968185 [0,1,0,1,0,0|2,0,0]=4 589 B14R1.3360 CCCCCCC(C)N1CCCC1C AIFCHEM-5762953969 [0,1,0,1,0,0|2,0,0]=4 590 B14R1.3360 CCCCCCC(C)N1CCC[C@@H]1C AIFCHEM-94569861309 [0,1,0,1,0,0|2,0,0]=4 591 B14R1.3360 CCCCCCC(C)N1CCC[C@H]1C AIFCHEM-6065667782 [0,1,0,1,0,0|2,0,0]=4 592 B14R1.3684 CCCCCCC(=O)NCC1CCO1 AIFCHEM-94521992215 [0,1,0,1,0,0|1,0,1]=4 593 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 AIFCHEM-94521985531 [0,1,0,1,0,0|1,0,1]=4 594 B14R1.3684 CCCCCCC(=O)NC[C@H]1CCO1 AIFCHEM-94521985527 [0,1,0,1,0,0|1,0,1]=4 595 B14R1.3684 CCCCCCC(C)NCC1CCO1 AIFCHEM-94567673865 [0,1,0,1,0,0|1,0,0]=3 596 B14R1.3684 CCCCCCC(C)NC[C@@H]1CCO1 AIFCHEM-5873747467 [0,1,0,1,0,0|1,0,0]=3 597 B14R1.3684 CCCCCCC(C)NC[C@H]1CCO1 AIFCHEM-5694928491 [0,1,0,1,0,0|1,0,0]=3 598 B14R1.3684 O=C(CCCCCO)NCC1CCC1 AIFCHEM-94536869261 [0,1,0,1,0,0|1,0,1]=4 599 B14R1.3686 CCCCCCC(C)N[C@@H]1CC[C@H]1O AIFCHEM-6453001625 [0,1,0,1,0,0|1,0,0]=3 600 B14R1.62 CCCCCCCN1CCC[C@H]1C#N AIFCHEM-94589461607 [0,1,0,1,0,0|1,0,1]=4 601 B14R1.476 CCC1COCCN1CCCCCO AIFCHEM-5616840936 [0,1,0,1,0,0|1,0,0]=3 602 B14R1.476 CCCCCNC1CCCCC1C#N AIFCHEM-94522653791 [0,1,0,1,0,0|1,0,1]=4 603 B14R1.476 CCCCCNC1CCOCC1OC AIFCHEM-94552822311 [0,1,0,1,0,0|2,0,0]=4 604 B14R1.476 CCOCCNC1CCCCC1CC AIFCHEM-94548606385 [0,1,0,1,0,0|2,0,0]=4 605 B14R1.476 CC[C@@H]1COCCN1CCCCCO AIFCHEM-94591343243 [0,1,0,1,0,0|1,0,0]=3 606 B14R1.476 CC[C@H]1COCCN1CCCCCO AIFCHEM-94531751610 [0,1,0,1,0,0|1,0,0]=3 607 B14R1.787 CCCCN1CCCCC1CCOC AIFCHEM-94523029146 [0,1,0,1,0,0|1,0,0]=3 608 B14R1.787 N#CCCC1CCCCC1NCCO AIFCHEM-94577779051 [0,1,0,1,0,0|1,0,1]=4 609 B14R1.911 CCCCCC1CCCC1NCCC AIFCHEM-94555804441 [0,1,0,1,0,0|1,0,0]=3 610 B14R1.2352 CCCCNCCN1CCCCCC1 AIFCHEM-94523038599 [0,1,0,1,0,0|2,0,0]=4 611 B14R1.6533 CSCCNC1CCCCCCCC1 AIFCHEM-5865257802 [0,1,0,1,0,0|1,1,0]=4 612 B14R1.6533 OCCCNC1CCCCCCCC1 AIFCHEM-6447243750 [0,1,0,1,0,0|0,0,0]=2 613 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 AIFCHEM-94585551084 [0,1,0,1,0,0|1,0,1]=4 614 B14R1.86 CCCCCC(=O)NC[C@H]1CCCO1 AIFCHEM-94585556122 [0,1,0,1,0,0|1,0,1]=4 615 B14R1.86 CCCCCC(C)NCC1OCCO1 AIFCHEM-94564409370 [0,1,0,1,0,0|2,0,0]=4 616 B14R1.158 CN(CCCCO)CC1CCOCC1 AIFCHEM-6474008474 [0,1,0,1,0,0|2,0,0]=4 617 B14R1.3001 CN(CCCCO)C1CCCCCC1 AIFCHEM-94529612838 [0,1,0,1,0,0|1,0,0]=3 618 B14R1.4517 CN(CCCCCCO)CC1CCC1 AIFCHEM-94534165130 [0,1,0,1,0,0|1,0,0]=3 619 B14R1.8088 CCCCCNCC1(CCCCC1)O AIFCHEM-94524046450 [0,1,0,1,0,0|2,0,0]=4 620 B14R2.14 OCC1CCCN1C2CCSCC2 AIFCHEM-6498701625 [0,0,0,2,0,0|2,0,0]=4 621 B14R2.14 OC[C@@H]1CCCN1C2CCSCC2 AIFCHEM-6481557450 [0,0,0,2,0,0|2,0,0]=4 622 B14R2.14 OC[C@H]1CCCN1C2CCCSC2 AIFCHEM-94607706977 [0,0,0,2,0,0|2,0,0]=4 623 B14R2.14 OC[C@H]1CCCN1C2CCSCC2 AIFCHEM-94607705054 [0,0,0,2,0,0|2,0,0]=4 624 B14R2.24 C[C@@H]1CCCCN1C2CCCCC2 AIFCHEM-94601788970 [0,0,0,2,0,0|2,0,0]=4 625 B14R2.24 C[C@H]1CCCCN1C2CCCCC2 AIFCHEM-94601790263 [0,0,0,2,0,0|2,0,0]=4 626 B14R2.49 FC1CC1NCCC2CCCCC2 AIFCHEM-5864984220 [0,0,0,2,0,0|2,0,0]=4 627 B14R2.49 F[C@@H]1C[C@H]1NCCC2CCCCC2 AIFCHEM-5880938590 [0,0,0,2,0,0|2,0,0]=4 628 B14R2.49 F[C@H]1C[C@@H]1NCCC2CCCCC2 AIFCHEM-6046883776 [0,0,0,2,0,0|2,0,0]=4 629 B14R2.49 F[C@H]1C[C@H]1NCCC2CCCCC2 AIFCHEM-6010754086 [0,0,0,2,0,0|2,0,0]=4 630 B14R2.78 OC[C@@H]1CCN1CC2CCCCC2 AIFCHEM-94538001156 [0,0,0,2,0,0|1,0,0]=3 631 B14R2.78 OC[C@H]1CCN1CC2CCCCC2 AIFCHEM-94554356292 [0,0,0,2,0,0|1,0,0]=3 632 B14R2.101 C1CCC(CC1)CNC2CCCC2 AIFCHEM-94542375175 [0,0,0,2,0,0|2,0,0]=4 633 B14R2.101 C1CCC(OC1)CNC2CCSC2 AIFCHEM-94560314434 [0,0,0,2,0,0|2,0,0]=4 634 B14R2.101 C1CSCC(C1)NC[C@@H]2CCCO2 AIFCHEM-5782033409 [0,0,0,2,0,0|2,0,0]=4 635 B14R2.101 C1CSCC(C1)NC[C@H]2CCCO2 AIFCHEM-5666709758 [0,0,0,2,0,0|2,0,0]=4 636 B14R2.3019 C1CC(CCO1)CNCC2CCO2 AIFCHEM-94567677682 [0,0,0,2,0,0|2,0,0]=4 637 B14R2.3019 C1CC(CCO1)CNC[C@@H]2CCO2 AIFCHEM-5863878636 [0,0,0,2,0,0|2,0,0]=4 638 B14R2.3019 C1CC(CCO1)CNC[C@H]2CCO2 AIFCHEM-5776642150 [0,0,0,2,0,0|2,0,0]=4 639 B14R2.3019 C1CCC(CC1)CNCC2CCO2 AIFCHEM-94567675851 [0,0,0,2,0,0|1,0,0]=3 640 B14R2.3019 C1CCC(CC1)CNC[C@@H]2CCO2 AIFCHEM-5810018691 [0,0,0,2,0,0|1,0,0]=3 641 B14R2.3019 C1CCC(CC1)CNC[C@H]2CCO2 AIFCHEM-5776738235 [0,0,0,2,0,0|1,0,0]=3 642 B14R2.13702 CCCCCCNC1CCC2C1C2 AIFCHEM-94575435349 [0,0,0,2,0,0|2,0,0]=4 643 B14R2.13702 OCCCCCNC1CCC2C1C2 AIFCHEM-6512211142 [0,0,0,2,0,0|1,0,0]=3 644 B14R2.98 CCC1CCCCN1C2CCCC2 AIFCHEM-94541521464 [0,0,0,2,0,0|2,0,0]=4 645 B14R2.98 OCC1CCCCN1C2CCOC2 AIFCHEM-6396364354 [0,0,0,2,0,0|2,0,0]=4 646 B14R2.98 OC[C@@H]1CCCCN1C2CCOC2 AIFCHEM-94551685036 [0,0,0,2,0,0|2,0,0]=4 647 B14R2.98 OC[C@H]1CCCCN1C2CCOC2 AIFCHEM-6464404245 [0,0,0,2,0,0|2,0,0]=4 648 B14R2.50 OC1CCCCC1NC2CCCC2 AIFCHEM-94571778202 [0,0,0,2,0,0|1,0,0]=3 649 B14R2.50 O[C@@H]1CCCC[C@@H]1NC2CCCC2 AIFCHEM-94582892775 [0,0,0,2,0,0|1,0,0]=3 650 B14R2.50 O[C@@H]1CCCC[C@H]1NC2CCCC2 AIFCHEM-94543568946 [0,0,0,2,0,0|1,0,0]=3 651 B14R2.50 O[C@@H]1COCC[C@H]1NC2CCCC2 AIFCHEM-94541522115 [0,0,0,2,0,0|2,0,0]=4 652 B14R2.50 O[C@H]1CCCC[C@@H]1NC2CCCC2 AIFCHEM-94541530718 [0,0,0,2,0,0|1,0,0]=3 653 B14R2.50 O[C@H]1CCCC[C@H]1NC2CCCC2 AIFCHEM-94541523561 [0,0,0,2,0,0|1,0,0]=3 654 B14R2.50 O[C@H]1COCC[C@@H]1NC2CCCC2 AIFCHEM-94541517848 [0,0,0,2,0,0|2,0,0]=4 655 B14R2.50 O[C@H]1COCC[C@H]1NC2CCCC2 AIFCHEM-94541521638 [0,0,0,2,0,0|2,0,0]=4 656 B14R2.83 CCC1CCCC1NC2CCCC2 AIFCHEM-94542376941 [0,0,0,2,0,0|2,0,0]=4 657 B14R2.322 C1CO[C@@H](C1)CNCC2CCOC2 AIFCHEM-94573411276 [0,0,0,2,0,0|2,0,0]=4 658 B14R2.322 C1CO[C@H](C1)CNCC2CCOC2 AIFCHEM-5649160884 [0,0,0,2,0,0|2,0,0]=4 659 B14R2.384 CC1OCCC1NC[C@@H]2CCCO2 AIFCHEM-5720540742 [0,0,0,2,0,0|2,0,0]=4 660 B14R2.384 CC1OCCC1NC[C@H]2CCCO2 AIFCHEM-5599436015 [0,0,0,2,0,0|2,0,0]=4 661 B14R2.9707 OCCCCCN1CC2CCC1C2 AIFCHEM-5874418659 [0,0,0,2,0,0|1,0,0]=3 662 B14R2.168 CCC1CCCC1NC[C@@H]2C[C@H]2C AIFCHEM-94599417525 [0,0,0,2,0,0|2,0,0]=4 663 B14R2.170 CC1CCCC1N2CCCC2CO AIFCHEM-6492587772 [0,0,0,2,0,0|1,0,0]=3 664 B14R2.170 CC1CCCC1N2CCC[C@@H]2CO AIFCHEM-6450426966 [0,0,0,2,0,0|1,0,0]=3 665 B14R2.170 CC1CCCC1N2CCC[C@H]2CO AIFCHEM-6481455086 [0,0,0,2,0,0|1,0,0]=3 666 B14R2.1110 CCC1CCCC1N[C@@H]2CC[C@H]2O AIFCHEM-6453368620 [0,0,0,2,0,0|1,0,0]=3 667 B14R2.3563 CCC1CCCC1NCC2CCC2 AIFCHEM-5699114179 [0,0,0,2,0,0|2,0,0]=4 668 B14R2.9704 OCCCCNC1CCC1C2CC2 AIFCHEM-6505395549 [0,0,0,2,0,0|1,0,0]=3 669 B14R2.20741 OCCOCCN1CCC12CCC2 AIFCHEM-94551833995 [0,0,0,2,0,0|2,0,0]=4 670 B14R2.67 CCCCN1CC2CCCCC2C1 AIFCHEM-94523034808 [0,0,0,2,0,0|2,0,0]=4 671 B14R2.67 CCCCN1C[C@H]2CCCC[C@H]2C1 AIFCHEM-94523032627 [0,0,0,2,0,0|2,0,0]=4 672 B14R2.296 CC1CCCC1N2CCCC[C@@H]2C AIFCHEM-5979190210 [0,0,0,2,0,0|2,0,0]=4 673 B14R2.296 CC1CCCC1N2CCCC[C@H]2C AIFCHEM-5742981983 [0,0,0,2,0,0|2,0,0]=4 674 B14R2.662 CC1COCCC1N[C@@H]2CC[C@H]2O AIFCHEM-6444489294 [0,0,0,2,0,0|2,0,0]=4 675 B14R2.662 OC1CCCCC1N[C@@H]2CC[C@H]2O AIFCHEM-6443499787 [0,0,0,2,0,0|2,0,0]=4 676 B14R2.1091 OC[C@@H]1CCN1C2CCCCC2O AIFCHEM-94538003153 [0,0,0,2,0,0|2,0,0]=4 677 B14R2.1091 OC[C@H]1CCN1C2CCCCC2O AIFCHEM-94554358289 [0,0,0,2,0,0|2,0,0]=4 678 B14R2.36014 OCCCCNC1CCCC2C1C2 AIFCHEM-6511693436 [0,0,0,2,0,0|1,0,0]=3 679 B14R2.12797 C1CCCC(CC1)CNC2CCC2 AIFCHEM-94576053983 [0,0,0,2,0,0|2,0,0]=4 680 B14R2.12804 C1CCCC(CCC1)NC2CCC2 AIFCHEM-94537766298 [0,0,0,2,0,0|2,0,0]=4 681 B14R2.12798 C1CCCC(CC1)CNCC2CC2 AIFCHEM-94532081856 [0,0,0,2,0,0|2,0,0]=4