0 B10R0.1 CCOC(=O)CCCCCN 77390 [0,0,0,0,0,0|3,0,0]=3 1 B10R0.1 CCOC(=O)COCCCO S11911 [0,0,0,0,0,0|4,0,0]=4 2 B9R0.5 CCOC(=O)CCCNC AB10379 [1,0,0,0,0,0|2,0,0]=3 3 B9R0.5 CCOC(=O)CNCCN FD21627 [1,0,0,0,0,0|3,0,0]=4 4 B9R0.46 CCCCCC[C@@H](C)CC T72672 [1,0,0,0,0,0|2,0,1]=4 5 B9R0.46 CCOCCNC(=O)CCl A50975 [1,0,0,0,0,0|3,0,0]=4 6 B9R0.46 COCCCCC(=O)OC AC9127 [1,0,0,0,0,0|3,0,0]=4 7 B11R0.4 CCC\C=C\CCC(=O)OCC E70248 [0,1,0,0,0,0|2,0,1]=4 8 B11R0.4 CCOC(=O)COCCCCO AT19862 [0,1,0,0,0,0|2,0,0]=3 9 B11R0.176 CCOC(=O)CCCCN(C)C AC6409 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.16 CCCC(=O)C1CCNCC1 F16039 [0,0,0,1,0,0|2,0,0]=3 11 B11R1.16 CCNC(=O)N1CCNCC1 AT22987 [0,0,0,1,0,0|3,0,0]=4 12 B11R1.16 CCOC(=O)[C@H]1CCCNC1 56329 [0,0,0,1,0,0|3,0,0]=4 13 B11R1.16 COCC(=O)N1CCNCC1 P10687 [0,0,0,1,0,0|3,0,0]=4 14 B11R1.24 CCCC[C@H]1CC(=O)CCN1 S11327 [0,0,0,1,0,0|2,0,0]=3 15 B11R1.30 CCOC(=O)C[C@H]1CCCN1 F14054 [0,0,0,1,0,0|3,0,0]=4 16 B11R1.30 CCOC(=O)C[C@H]1CCCN1 F14113 [0,0,0,1,0,0|3,0,0]=4 17 B11R1.30 NCCC(=O)NC1CCCC1 F21050 [0,0,0,1,0,0|2,0,0]=3 18 B11R1.180 CNCCCN1CCOC1=O AT18748 [0,0,0,1,0,0|3,0,0]=4 19 B11R1.199 CCOC(=O)[C@H]1CCC[C@@H]1N 98153 [0,0,0,1,0,0|3,0,0]=4 20 B11R1.199 CCOC(=O)[C@H]1CCC[C@@H]1N AC7745 [0,0,0,1,0,0|3,0,0]=4 21 B11R1.199 CCOC(=O)[C@H]1CNC[C@@H]1C 72681 [0,0,0,1,0,0|3,0,0]=4 22 B11R1.289 CCOC(=O)CCC1CCC1 F52482 [0,0,0,1,0,0|2,0,0]=3 23 B11R1.290 CCOC(=O)CCNC1CC1 AC6776 [0,0,0,1,0,0|3,0,0]=4 24 B8R0.4 CCC#CCCCCC T72039 [2,0,0,0,0,0|0,0,2]=4 25 B8R0.6 CNC(=O)OCCCN AT13711 [2,0,0,0,0,0|2,0,0]=4 26 B8R0.7 CC(=O)NCCCCN S12336 [2,0,0,0,0,0|2,0,0]=4 27 B8R0.7 CNCCCNC(C)=O C78307 [2,0,0,0,0,0|2,0,0]=4 28 B10R0.2 CCCC(=O)CC(=O)CCC AC4162 [1,1,0,0,0,0|0,0,1]=3 29 B10R0.2 CCC[C@H](N)CC(=O)OCC N12292 [1,1,0,0,0,0|1,0,0]=3 30 B10R0.91 CCCCC[C@@H](O)CCCC T70997 [1,1,0,0,0,0|0,0,2]=4 31 B12R0.1 CCCCCC\C=C\C(=O)OCC AC9668 [0,2,0,0,0,0|2,0,0]=4 32 B12R0.95 CCCOC(=O)NCCCN(C)C A12333 [0,2,0,0,0,0|2,0,0]=4 33 B10R1.10 CCC[C@H]1CC(=O)CCN1 C75784 [1,0,0,1,0,0|1,0,0]=3 34 B10R1.11 CCOC(=O)[C@@H]1CCCS1 98589 [1,0,0,1,0,0|2,0,0]=4 35 B10R1.11 CCOC(=O)[C@H]1CCNC1 AC7559 [1,0,0,1,0,0|2,0,0]=4 36 B10R1.11 CCOC(=O)[C@H]1CCSC1 W10963 [1,0,0,1,0,0|2,0,0]=4 37 B10R1.11 NCCC(=O)N1CCCC1 C78391 [1,0,0,1,0,0|2,0,0]=4 38 B10R1.11 O=C(CCCl)N1CCCC1 C78373 [1,0,0,1,0,0|2,0,0]=4 39 B10R1.19 CCN1CCCNCC1=O AT20058 [1,0,0,1,0,0|2,0,0]=4 40 B10R1.19 N#C[C@H]1CCCCCC1=O AC9253 [1,0,0,1,0,0|1,0,1]=4 41 B10R1.29 CCCC[C@H]1CCCC1=O O10708 [1,0,0,1,0,0|0,0,0]=2 42 B10R1.29 COCC[C@H]1CCNC1=O AT19072 [1,0,0,1,0,0|2,0,0]=4 43 B10R1.29 N#CCC[C@H]1CCCC1=O AC8276 [1,0,0,1,0,0|1,0,1]=4 44 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CO AT10667 [1,0,0,1,0,0|2,0,0]=4 45 B10R1.135 CCOC(=O)[C@H]1C[C@@H]1CO AT11298 [1,0,0,1,0,0|2,0,0]=4 46 B10R1.137 CCNC(=O)OC1CNC1 AT23015 [1,0,0,1,0,0|2,0,0]=4 47 B10R1.138 CNCC(=O)NCC1CC1 70891 [1,0,0,1,0,0|2,0,0]=4 48 B10R1.377 CCC[N+]1(C)CCCCC1 T73061 [1,0,0,1,0,0|2,0,0]=4 49 B10R1.15 NCC(=O)C1CCCCC1 P14033 [1,0,0,1,0,0|2,0,0]=4 50 B12R1.51 CCOC(=O)CO[C@H]1CCNC1 F14056 [0,1,0,1,0,0|2,0,0]=4 51 B12R1.308 CCOC(=O)C1CCNCC1C P16206 [0,1,0,1,0,0|2,0,0]=4 52 B12R1.308 CCOC(=O)[C@H]1CCCN[C@H]1C F12981 [0,1,0,1,0,0|2,0,0]=4 53 B12R1.308 CCOC(=O)[C@H]1CCCN[C@H]1C F15959 [0,1,0,1,0,0|2,0,0]=4 54 B12R1.308 CCOC(=O)[C@H]1CCCN[C@H]1C P16051 [0,1,0,1,0,0|2,0,0]=4 55 B12R1.310 CCOC(=O)CCNCC1CC1 C77564 [0,1,0,1,0,0|2,0,0]=4 56 B12R1.316 CCOC(=O)[C@@H]1CCCN1CC T72396 [0,1,0,1,0,0|2,0,0]=4 57 B12R1.316 CCOC(=O)[C@@H]1CCCN1CC T73086 [0,1,0,1,0,0|2,0,0]=4 58 B12R1.316 CCOC(=O)[C@H]1CNC[C@@H]1CC P18718 [0,1,0,1,0,0|2,0,0]=4 59 B12R1.17 CCOC(=O)C1CCCC(N)C1 33661 [0,1,0,1,0,0|2,0,0]=4 60 B12R1.17 CCOC(=O)[C@@H]1CCC[C@H](N)C1 91235 [0,1,0,1,0,0|2,0,0]=4 61 B12R1.30 CCCOC(=O)N1CCNCC1 AT22988 [0,1,0,1,0,0|2,0,0]=4 62 B12R1.30 NCCNC(=O)C1CCCCC1 F21137 [0,1,0,1,0,0|2,0,0]=4 63 B12R1.267 CCCC\C=C1/CCCCC1=O A11776 [0,1,0,1,0,0|1,0,1]=4 64 B12R1.55 CCOC(=O)C(=O)C1CCCC1 W17353 [0,1,0,1,0,0|2,0,0]=4 65 B12R1.555 CCOC(=O)[C@@H](N)CC1CCC1 F52713 [0,1,0,1,0,0|2,0,0]=4 66 B12R1.16 CCOC(=O)C1CCC(N)CC1 AB9197 [0,1,0,1,0,0|2,0,0]=4 67 B12R2.1488 CCOC(=O)C1CC2CC2C1 P15486 [0,0,0,2,0,0|2,0,0]=4 68 B12R2.24 O=C1CN2CCNC[C@H]2CO1 D78736 [0,0,0,2,0,0|2,0,0]=4 69 B12R2.24 O=C1CNC2CCCCC2N1 F14272 [0,0,0,2,0,0|2,0,0]=4 70 B12R2.24 O=C1N[C@H]2CNCC[C@@H]2CO1 C77532 [0,0,0,2,0,0|2,0,0]=4