0 B14R0.337 CCCCCCCCCCCC(=O)NN SBB056837 [0,0,0,0,0,0|2,0,0]=2 1 B14R0.337 CCCCCCCCCCCC(=O)OC SBB058684 [0,0,0,0,0,0|0,0,0]=0 2 B14R0.337 CCCCCCCCCCCC(Cl)CCl SBB060214 [0,0,0,0,0,0|3,0,1]=4 3 B14R0.337 CCCCCCCCCCOC(=O)CC SBB056766 [0,0,0,0,0,0|2,0,0]=2 4 B14R0.337 CCCCCCCCCCOC(=O)CCl SBB060034 [0,0,0,0,0,0|3,0,0]=3 5 B14R0.337 COC(=O)CCCCCCCCCCCl SBB072738 [0,0,0,0,0,0|1,0,0]=1 6 B13R0.54 CCCCCCCCCCCC(=O)Cl SBB060016 [1,0,0,0,0,0|1,0,0]=2 7 B13R0.54 CCCCCCCCCCCC(=O)O SBB060023 [1,0,0,0,0,0|0,0,0]=1 8 B13R0.54 CCCCCCCCCCCC(N)=O SBB061051 [1,0,0,0,0,0|1,0,0]=2 9 B13R0.54 CCCCCCCCCCCN(C)C SBB061365 [1,0,0,0,0,0|2,0,0]=3 10 B13R0.54 CCCCCCCCCCNC(N)=S SBB017790 [1,0,0,0,0,0|2,1,0]=4 11 B13R0.54 CCCCCCCCCCOC(C)=O SBB058677 [1,0,0,0,0,0|1,0,0]=2 12 B13R0.54 CCCCCCCCSCCC(=O)O SBB000583 [1,0,0,0,0,0|1,0,0]=2 13 B13R0.54 CCCCSCCCCCCC(=O)O SBB001713 [1,0,0,0,0,0|1,0,0]=2 14 B13R0.54 NCCCCCCCCCCC(=O)O SBB058716 [1,0,0,0,0,0|1,0,0]=2 15 B13R0.54 O=C(O)CCCCCCCCCCBr SBB061375 [1,0,0,0,0,0|1,0,0]=2 16 B13R0.147 CCCCCCCCCCC(=O)OC SBB060594 [1,0,0,0,0,0|0,0,0]=1 17 B13R0.147 COC(=O)CCCCCCCCC=O SBB061580 [1,0,0,0,0,0|1,0,1]=3 18 B13R0.336 C=CCCCCCCCCCCCC SBB008940 [1,0,0,0,0,0|1,0,2]=4 19 B13R0.336 CCCCCCCCCCCCC#N SBB016935 [1,0,0,0,0,0|2,0,1]=4 20 B13R0.336 CCCCCCCCCCCCCCl SBB059960 [1,0,0,0,0,0|2,0,1]=4 21 B13R0.336 CCCCCCCCCCCCCN SBB070384 [1,0,0,0,0,0|2,0,1]=4 22 B13R0.336 CCCCCCCCCCCCCO SBB080806 [1,0,0,0,0,0|2,0,1]=4 23 B13R0.336 CCCCCCCCCCNCCC SBB059835 [1,0,0,0,0,0|2,0,1]=4 24 B13R0.336 N(C)CCCCCCCCCCCC SBB058820 [1,0,0,0,0,0|1,0,1]=3 25 B13R0.336 [NH2+](CCCC)CCCCCCCCC SBB061638 [1,0,0,0,0,0|2,0,1]=4 26 B15R0.84 CCCCCCCCCCCC(=O)N(C)C SBB008021 [0,1,0,0,0,0|1,0,0]=2 27 B15R0.172 COC(=O)CCCCCCCCC(=O)OC SBB060773 [0,1,0,0,0,0|1,0,1]=3 28 B15R0.366 CCCCCCCCCCCC(=O)OCC SBB061073 [0,1,0,0,0,0|0,0,0]=1 29 B12R0.5 C=CCCCCCCCCCCC SBB009033 [2,0,0,0,0,0|0,0,1]=3 30 B12R0.5 CCCCCCCCCCCC=O SBB059874 [2,0,0,0,0,0|0,0,0]=2 31 B12R0.5 CCCCCCCCCCCCBr SBB059941 [2,0,0,0,0,0|1,0,1]=4 32 B12R0.5 CCCCCCCCCCCCCl SBB059959 [2,0,0,0,0,0|1,0,1]=4 33 B12R0.5 CCCCCCCCCCCCF SBB090835 [2,0,0,0,0,0|1,0,1]=4 34 B12R0.5 CCCCCCCCCCCCN SBB007640 [2,0,0,0,0,0|1,0,1]=4 35 B12R0.5 CCCCCCCCCCCCN SBB059988 [2,0,0,0,0,0|1,0,1]=4 36 B12R0.5 CCCCCCCCCCCCO SBB008734 [2,0,0,0,0,0|0,0,1]=3 37 B12R0.5 CCCCCCCCCCCCS SBB060132 [2,0,0,0,0,0|0,1,1]=4 38 B12R0.5 CCCCCCCCCCCNC SBB059830 [2,0,0,0,0,0|1,0,0]=3 39 B12R0.5 CCCCCCCCCCNC=O SBB061177 [2,0,0,0,0,0|1,0,0]=3 40 B12R0.5 CCCCCCCCCSCCO SBB019265 [2,0,0,0,0,0|1,0,1]=4 41 B12R0.5 CCCCCCCCNCCCC SBB059768 [2,0,0,0,0,0|1,0,1]=4 42 B12R0.5 CCCCCCCCNCCOC SBB059794 [2,0,0,0,0,0|1,0,0]=3 43 B12R0.5 CCCCCCNCCCCCC SBB059818 [2,0,0,0,0,0|1,0,1]=4 44 B12R0.5 CCCCCCOCCCCCC SBB061195 [2,0,0,0,0,0|1,0,1]=4 45 B12R0.5 CCCCCCSCCCCCC SBB061018 [2,0,0,0,0,0|1,0,1]=4 46 B12R0.5 NCCCCCCCCCCCC SBB003344 [2,0,0,0,0,0|1,0,1]=4 47 B12R0.5 OCCCCCCCCCCCBr SBB061556 [2,0,0,0,0,0|1,0,1]=4 48 B12R0.5 [NH2+](CCCC)CCCCCCCC SBB061639 [2,0,0,0,0,0|1,0,1]=4 49 B12R0.234 C#CCCCCCCCCC(=O)O SBB008483 [2,0,0,0,0,0|0,0,2]=4 50 B12R0.234 C=CCCCCCCCCC(=O)O SBB009049 [2,0,0,0,0,0|0,0,2]=4 51 B12R0.234 CCCCCCCCCCC(=O)Cl SBB060536 [2,0,0,0,0,0|1,0,0]=3 52 B12R0.234 CCCCCCCCCCC(=O)O SBB058709 [2,0,0,0,0,0|0,0,0]=2 53 B12R0.234 CCCCCCCCCCC(C)O SBB060451 [2,0,0,0,0,0|0,0,2]=4 54 B12R0.234 CCCCCCCCCCN(C)C SBB060244 [2,0,0,0,0,0|2,0,0]=4 55 B12R0.234 CCCCCCCCCOC(C)=O SBB060586 [2,0,0,0,0,0|1,0,0]=3 56 B12R0.248 CCCCCCCCCC(=O)NN SBB030321 [2,0,0,0,0,0|2,0,0]=4 57 B12R0.248 CCCCCCCCCC(=O)OC SBB060318 [2,0,0,0,0,0|0,0,0]=2 58 B12R0.248 CCCCCCCCOC(=O)CC SBB060314 [2,0,0,0,0,0|2,0,0]=4 59 B14R0.68 O=C(O)CCCCCCCCCC(=O)O SBB069138 [1,1,0,0,0,0|1,0,1]=4 60 B14R0.305 O=C(O)CCCCCCCCC(O)CO SBB056632 [1,1,0,0,0,0|1,0,0]=3 61 B14R0.344 CCCCCCCCS(=O)CCC(=O)O SBB001707 [1,1,0,0,0,0|1,0,0]=3 62 B14R0.391 CCCCCCCCOC(=O)CC(C)=O SBB060041 [1,1,0,0,0,0|1,0,1]=4 63 B14R0.394 CCCCCCCCCCCCC(=O)O SBB069518 [1,1,0,0,0,0|0,0,0]=2 64 B14R0.394 CCCCCCCCCCCCN(C)C SBB059992 [1,1,0,0,0,0|2,0,0]=4 65 B14R0.394 CCCCCCCCCCCOC(C)=O SBB060587 [1,1,0,0,0,0|0,0,0]=2 66 B14R0.394 NCCCCCCCCCCCC(=O)O SBB058890 [1,1,0,0,0,0|0,0,0]=2 67 B14R0.394 O=C(O)CCCCCCCCCCCBr SBB061618 [1,1,0,0,0,0|0,0,0]=2 68 B14R0.394 O=C(O)CCCCCCCCCCCO SBB061512 [1,1,0,0,0,0|0,0,0]=2 69 B14R0.394 [NH+](C)(C)CCCCCCCCCCCC SBB061538 [1,1,0,0,0,0|2,0,0]=4 70 B14R0.197 COC(=O)CCCCCCCC(=O)OC SBB060332 [1,1,0,0,0,0|1,0,1]=4 71 B14R0.393 CCCCCCCCCCS(=O)CCO SBB001718 [1,1,0,0,0,0|2,0,0]=4 72 B14R0.392 CCCCCCCCCCCCCCBr SBB059942 [1,1,0,0,0,0|1,0,1]=4 73 B14R0.392 CCCCCCCCCCCCCCCl SBB059961 [1,1,0,0,0,0|1,0,1]=4 74 B14R0.392 CCCCCCCCCCCCCCN SBB059989 [1,1,0,0,0,0|1,0,1]=4 75 B14R0.392 CCCCCCCCCCCCCCO SBB060166 [1,1,0,0,0,0|1,0,1]=4 76 B14R0.392 CCCCCCCCCCCCCCS SBB060133 [1,1,0,0,0,0|1,0,1]=4 77 B14R0.392 CCCCCCCCCCCCNCC SBB059805 [1,1,0,0,0,0|1,0,1]=4 78 B14R0.392 CCCCCCCCCCCCSCC SBB061292 [1,1,0,0,0,0|0,1,1]=4 79 B14R0.392 CCCCCCCCCCCNCCC SBB059806 [1,1,0,0,0,0|1,0,1]=4 80 B14R0.392 CCCCCCCCCCCOCCO SBB061507 [1,1,0,0,0,0|2,0,0]=4 81 B14R0.392 CCCCCCCCCNCCCCC SBB059807 [1,1,0,0,0,0|1,0,1]=4 82 B14R0.392 CCCCCCCCNCCCCCC SBB059809 [1,1,0,0,0,0|1,0,1]=4 83 B14R0.392 CCCCCCCNCCCCCCC SBB059808 [1,1,0,0,0,0|1,0,1]=4 84 B14R0.392 CCCCCCCOCCCCCCC SBB061311 [1,1,0,0,0,0|1,0,1]=4 85 B14R0.392 CCCCCCCSCCCCCCC SBB060113 [1,1,0,0,0,0|1,0,1]=4 86 B14R0.392 [NH2+](C)CCCCCCCCCCCCC SBB059858 [1,1,0,0,0,0|1,0,1]=4 87 B14R0.392 [NH2+](CC)CCCCCCCCCCCC SBB061635 [1,1,0,0,0,0|1,0,1]=4 88 B14R0.392 [NH2+](CCC)CCCCCCCCCCC SBB059842 [1,1,0,0,0,0|1,0,1]=4 89 B14R0.392 [NH2+](CCCCC)CCCCCCCCC SBB059857 [1,1,0,0,0,0|1,0,1]=4 90 B16R0.221 CCCCCCCCCCCCCC(=O)NN SBB056978 [0,2,0,0,0,0|2,0,0]=4 91 B16R0.221 CCCCCCCCCCCCCC(=O)OC SBB058686 [0,2,0,0,0,0|0,0,0]=2 92 B16R0.221 CCCCCCCCCCCCNC(=O)CCl SBB056860 [0,2,0,0,0,0|2,0,0]=4 93 B16R0.221 CCCCCCCCCCCCOC(=O)CBr SBB060036 [0,2,0,0,0,0|2,0,0]=4 94 B16R0.221 CCCCCCCCCCCCOC(=O)CCl SBB060035 [0,2,0,0,0,0|2,0,0]=4 95 B16R0.302 CCCCCCCCCCCC(=O)NC(N)=S SBB057094 [0,2,0,0,0,0|1,0,1]=4 96 B16R0.302 CCCCCCCCCCOC(=O)CC(C)=O SBB060044 [0,2,0,0,0,0|2,0,0]=4 97 B16R0.661 CCCCCCCCCCCC(=O)OCCC SBB060037 [0,2,0,0,0,0|0,0,0]=2 98 B14R1.26 CCCCCCCC1CCCC(=O)O1 SBB071496 [1,0,0,1,0,0|0,0,0]=2 99 B14R1.4408 O=C1CCCCCCCCCCCN1 SBB080680 [1,0,0,1,0,0|1,0,0]=3 100 B14R1.4728 CCCCCCCCC1CC1C(=O)O SBB001548 [1,0,0,1,0,0|0,0,0]=2 101 B14R1.6414 O=C(O)C1CCCCCCCCCC1 SBB069116 [1,0,0,1,0,0|0,0,0]=2