0 B14R0.393 CCCCCCCCCCN(C)CCO SBB061606 [0,0,0,0,0,0|4,0,0]=4 1 B14R0.393 CCCCCCCCCCS(=O)CCO SBB001718 [0,0,0,0,0,0|3,0,0]=3 2 B14R0.393 CCCCCCCCCNC(=O)CC#N SBB049492 [0,0,0,0,0,0|3,0,1]=4 3 B13R0.2 CCCCCCCCCC(=O)OCC SBB061060 [1,0,0,0,0,0|0,0,0]=1 4 B13R0.147 CCCCCCCCCCC(=O)OC SBB060594 [1,0,0,0,0,0|0,0,0]=1 5 B13R0.147 CCCCCCCCCCC(Br)CBr SBB060500 [1,0,0,0,0,0|2,0,1]=4 6 B13R0.147 CCCCCCCCCCC(Cl)CCl SBB060454 [1,0,0,0,0,0|2,0,1]=4 7 B13R0.147 COC(=O)CCCCCCCCC=O SBB061580 [1,0,0,0,0,0|1,0,1]=3 8 B13R0.336 CCCCCCCCCCCCCCl SBB059960 [1,0,0,0,0,0|2,0,1]=4 9 B13R0.336 CCCCCCCCCCCCCN SBB070384 [1,0,0,0,0,0|2,0,1]=4 10 B13R0.336 CCCCCCCCCCCCCO SBB080806 [1,0,0,0,0,0|2,0,1]=4 11 B13R0.336 CCCCCCCCCCNCCC SBB059835 [1,0,0,0,0,0|2,0,0]=3 12 B13R0.336 CCCCCCCCCCNCCO SBB059780 [1,0,0,0,0,0|3,0,0]=4 13 B13R0.336 CCCCCCCCCCOCCCl SBB060221 [1,0,0,0,0,0|3,0,0]=4 14 B13R0.336 CCCCCCCCCCOCCO SBB060175 [1,0,0,0,0,0|3,0,0]=4 15 B13R0.336 CCCCCCCCCCSCCO SBB019381 [1,0,0,0,0,0|3,0,0]=4 16 B13R0.336 N(C)CCCCCCCCCCCC SBB058820 [1,0,0,0,0,0|2,0,1]=4 17 B13R0.336 [NH2+](CCCC)CCCCCCCCC SBB061638 [1,0,0,0,0,0|2,0,1]=4 18 B15R0.69 CCCCCCCCCOC(=O)CC(C)=O SBB060043 [0,1,0,0,0,0|2,0,1]=4 19 B15R0.111 CCOC(=O)CCCCCCCCC(=O)O SBB069512 [0,1,0,0,0,0|1,0,1]=3 20 B15R0.366 CCCCCCCCCCCC(=O)OCC SBB061073 [0,1,0,0,0,0|0,0,0]=1 21 B15R1.832 CCCCC1CC1CCCC(=O)OCC SBB020289 [0,0,0,1,0,0|0,0,0]=1 22 B12R0.1 CCCCCCCCC(=O)OCC SBB061355 [2,0,0,0,0,0|0,0,0]=2 23 B12R0.5 CCCCCCCCCCCCBr SBB059941 [2,0,0,0,0,0|1,0,1]=4 24 B12R0.5 CCCCCCCCCCCCCl SBB059959 [2,0,0,0,0,0|1,0,1]=4 25 B12R0.5 CCCCCCCCCCCCF SBB090835 [2,0,0,0,0,0|1,0,1]=4 26 B12R0.5 CCCCCCCCCCCCN SBB007640 [2,0,0,0,0,0|1,0,1]=4 27 B12R0.5 CCCCCCCCCCCCN SBB059988 [2,0,0,0,0,0|1,0,1]=4 28 B12R0.5 CCCCCCCCCCCCO SBB008734 [2,0,0,0,0,0|1,0,1]=4 29 B12R0.5 CCCCCCCCCCCCS SBB060132 [2,0,0,0,0,0|1,0,1]=4 30 B12R0.5 CCCCCCCCCCCNC SBB059830 [2,0,0,0,0,0|1,0,1]=4 31 B12R0.5 CCCCCCCCNCCCC SBB059768 [2,0,0,0,0,0|1,0,1]=4 32 B12R0.5 CCCCCCCCNCCOC SBB059794 [2,0,0,0,0,0|1,0,1]=4 33 B12R0.5 CCCCCCNCCCCCC SBB059818 [2,0,0,0,0,0|1,0,1]=4 34 B12R0.5 CCCCCCOCCCCCC SBB061195 [2,0,0,0,0,0|1,0,1]=4 35 B12R0.5 CCCCCCSCCCCCC SBB061018 [2,0,0,0,0,0|1,0,1]=4 36 B12R0.5 NCCCCCCCCCCCC SBB003344 [2,0,0,0,0,0|1,0,1]=4 37 B12R0.5 [NH2+](CCCC)CCCCCCCC SBB061639 [2,0,0,0,0,0|1,0,1]=4 38 B12R0.248 CCCCCCCCCC(=O)NN SBB030321 [2,0,0,0,0,0|2,0,0]=4 39 B12R0.248 CCCCCCCCCC(=O)OC SBB060318 [2,0,0,0,0,0|0,0,0]=2 40 B12R0.248 CCCCCCCCCC(O)CC SBB059910 [2,0,0,0,0,0|0,0,2]=4 41 B12R0.248 CCCCCCCCNC(=O)CCl SBB056847 [2,0,0,0,0,0|2,0,0]=4 42 B12R0.248 CCCCCCCCOC(=O)CC SBB060314 [2,0,0,0,0,0|1,0,0]=3 43 B12R0.248 CCCCCCCCOC(=O)CCl SBB060033 [2,0,0,0,0,0|2,0,0]=4 44 B12R0.234 C#CCCCCCCCCC(=O)O SBB008483 [2,0,0,0,0,0|0,0,2]=4 45 B12R0.234 C=CCCCCCCCCC(=O)O SBB009049 [2,0,0,0,0,0|0,0,2]=4 46 B12R0.234 CCCCCCCCCCC(=O)Cl SBB060536 [2,0,0,0,0,0|1,0,0]=3 47 B12R0.234 CCCCCCCCCCC(=O)O SBB058709 [2,0,0,0,0,0|0,0,0]=2 48 B12R0.234 CCCCCCCCCCC(C)O SBB060451 [2,0,0,0,0,0|0,0,2]=4 49 B12R0.234 CCCCCCCCCCN(C)C SBB060244 [2,0,0,0,0,0|2,0,0]=4 50 B12R0.234 CCCCCCCCCOC(C)=O SBB060586 [2,0,0,0,0,0|1,0,0]=3 51 B14R0.197 COC(=O)CCCCCCCC(=O)OC SBB060332 [1,1,0,0,0,0|1,0,1]=4 52 B14R0.337 CCCCCCCCCCCC(=O)NN SBB056837 [1,1,0,0,0,0|2,0,0]=4 53 B14R0.337 CCCCCCCCCCCC(=O)OC SBB058684 [1,1,0,0,0,0|0,0,0]=2 54 B14R0.337 CCCCCCCCCCOC(=O)CC SBB056766 [1,1,0,0,0,0|0,0,0]=2 55 B14R0.337 CCCCCCCCCCOC(=O)CCl SBB060034 [1,1,0,0,0,0|1,0,0]=3 56 B14R0.337 COC(=O)CCCCCCCCCCCl SBB072738 [1,1,0,0,0,0|0,0,0]=2 57 B14R0.392 CCCCCCCCCCCCCCBr SBB059942 [1,1,0,0,0,0|1,0,1]=4 58 B14R0.392 CCCCCCCCCCCCCCCl SBB059961 [1,1,0,0,0,0|1,0,1]=4 59 B14R0.392 CCCCCCCCCCCCCCN SBB059989 [1,1,0,0,0,0|1,0,1]=4 60 B14R0.392 CCCCCCCCCCCCCCO SBB060166 [1,1,0,0,0,0|1,0,1]=4 61 B14R0.392 CCCCCCCCCCCCCCS SBB060133 [1,1,0,0,0,0|1,0,1]=4 62 B14R0.392 CCCCCCCCCCCCNCC SBB059805 [1,1,0,0,0,0|1,0,1]=4 63 B14R0.392 CCCCCCCCCCCCSCC SBB061292 [1,1,0,0,0,0|0,1,1]=4 64 B14R0.392 CCCCCCCCCCCNCCC SBB059806 [1,1,0,0,0,0|1,0,1]=4 65 B14R0.392 CCCCCCCCCCCOCCO SBB061507 [1,1,0,0,0,0|0,0,1]=3 66 B14R0.392 CCCCCCCCCNCCCCC SBB059807 [1,1,0,0,0,0|1,0,1]=4 67 B14R0.392 CCCCCCCCNCCCCCC SBB059809 [1,1,0,0,0,0|1,0,1]=4 68 B14R0.392 CCCCCCCCOCCOCCO SBB060180 [1,1,0,0,0,0|1,0,1]=4 69 B14R0.392 CCCCCCCCOCCOCCS SBB056736 [1,1,0,0,0,0|1,0,1]=4 70 B14R0.392 CCCCCCCCSCCOCCO SBB057123 [1,1,0,0,0,0|1,0,1]=4 71 B14R0.392 CCCCCCCNCCCCCCC SBB059808 [1,1,0,0,0,0|1,0,1]=4 72 B14R0.392 CCCCCCCOCCCCCCC SBB061311 [1,1,0,0,0,0|1,0,1]=4 73 B14R0.392 CCCCCCCSCCCCCCC SBB060113 [1,1,0,0,0,0|1,0,1]=4 74 B14R0.392 [NH2+](C)CCCCCCCCCCCCC SBB059858 [1,1,0,0,0,0|1,0,1]=4 75 B14R0.392 [NH2+](CC)CCCCCCCCCCCC SBB061635 [1,1,0,0,0,0|1,0,1]=4 76 B14R0.392 [NH2+](CCC)CCCCCCCCCCC SBB059842 [1,1,0,0,0,0|1,0,1]=4 77 B14R0.392 [NH2+](CCCCC)CCCCCCCCC SBB059857 [1,1,0,0,0,0|1,0,1]=4 78 B14R0.394 CCCCCCCCCCCOC(C)=O SBB060587 [1,1,0,0,0,0|0,0,2]=4 79 B16R0.302 CCCCCCCCCCOC(=O)CC(C)=O SBB060044 [0,2,0,0,0,0|1,0,1]=4 80 B16R0.661 CCCCCCCCCCCC(=O)OCCC SBB060037 [0,2,0,0,0,0|0,0,0]=2 81 B14R1.26 CCCCCCCC1CCCC(=O)O1 SBB071496 [1,0,0,1,0,0|2,0,0]=4 82 B14R1.4408 O=C1CCCCCCCCCCCN1 SBB080680 [1,0,0,1,0,0|1,0,0]=3 83 B14R1.123 CCCCCCCCN1CCOCC1 SBB061036 [1,0,0,1,0,0|1,0,1]=4