0 B11R1.40 CC(CN)CN1CCOCC1 1056998 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.40 COC(=O)CC1CCNCC1 1287803 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.40 COC(=O)CC1CCOCC1 6923372 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.40 COC(=O)CC1CCSCC1 6902365 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.17 CCOCC1CCCNC1 1147300 [1,0,0,0,0,0|3,0,0]=4 5 B10R1.17 CNCCC1CCCCO1 2125461 [1,0,0,0,0,0|1,0,0]=2 6 B10R1.17 CNCCC1CCOCC1 2317425 [1,0,0,0,0,0|1,0,0]=2 7 B10R1.17 N#CCCC1CCOCC1 2818441 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.17 NCCCC1CCOCC1 2313008 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.17 NCCNC1CCCCC1 1206152 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.18 NC(=O)CC1CCOCC1 6921839 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.18 NC(=O)CN1CCCCC1 1375221 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.18 NC(=O)OC1CCCCC1 10051874 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.18 NC(=S)CN1CCCCC1 1327523 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.18 O=C(O)CC1CCCCC1 1287819 [1,0,0,0,0,0|2,0,1]=4 15 B12R1.32 CCOC(=O)CC1CCCCC1 2843939 [0,1,0,0,0,0|2,0,1]=4 16 B12R1.32 NCCC(O)CN1CCCCC1 3516372 [0,1,0,0,0,0|3,0,0]=4 17 B12R1.3524 COC(=O)CC1(N)CCCCC1 5973187 [0,1,0,0,0,0|2,0,1]=4 18 B10R0.74 CCCCCCCC(=O)NN 7119846920 [0,0,1,0,0,0|2,0,1]=4 19 B10R1.15 CC(CN)N1CCCCC1 7020210397 [0,0,0,0,1,0|3,0,0]=4 20 B10R1.15 CNC(=O)C1CCNCC1 1778985 [0,0,0,0,1,0|2,0,1]=4 21 B10R1.15 NNC(=O)C1CCCCC1 1778976 [0,0,0,0,1,0|2,0,1]=4 22 B9R0.2 CCCNCCCN(C)C 1366733 [1,0,1,0,0,0|2,0,0]=4 23 B9R0.45 CCCCCCCCCCl 2832692 [1,0,1,0,0,0|2,0,0]=4 24 B9R0.45 CCCCCNCCCC 1366728 [1,0,1,0,0,0|2,0,0]=4 25 B9R1.8 ClCCN1CCCCC1 1902086 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.8 NCCC1=CCCCC1 2826290 [2,0,0,0,0,0|0,0,2]=4 27 B9R1.8 NCCC1CCOCC1 1366593 [2,0,0,0,0,0|1,0,0]=3 28 B9R1.8 NCCC1OCCCO1 1655109 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.8 NCCN1CCNCC1 1180860 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.8 NCCN1CCOCC1 2124294 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.8 OCCC1CCCCN1 2826600 [2,0,0,0,0,0|2,0,0]=4 32 B9R1.8 OCCC1CCOCC1 4060201 [2,0,0,0,0,0|2,0,0]=4 33 B11R1.28 NCCCCN1CCCCC1 7020210330 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.91 CN(C)CCC1CCCCN1 7119900002 [1,1,0,0,0,0|1,0,0]=3 35 B11R1.91 O=C(O)CCC1CCCCC1 1902275 [1,1,0,0,0,0|2,0,0]=4 36 B11R1.36 C[C@H](N)C(=O)N1CCCCC1 7020691707 [1,1,0,0,0,0|1,0,1]=4 37 B11R1.509 CC(C)(C)CN1CCNCC1 1048740 [1,1,0,0,0,0|2,0,0]=4 38 B11R2.20 C1CN2CCSCC2CN1 3508092 [1,0,0,1,0,0|2,0,0]=4 39 B13R2.10 NC1CCN(C2CCCCC2)C1 1362165 [0,0,0,1,0,1|2,0,0]=4 40 B13R2.6450 OCC1CC2CC(O)CC(C1)C2 0111370081 [0,1,0,1,0,0|2,0,0]=4 41 B13R3.3861 O=C1C2CC3CC(C2)CC1C3 0110864325 [0,0,0,2,0,0|2,0,0]=4 42 B13R3.6479 OCC12CC3CC(CC1C3)C2 7216430031 [0,0,0,2,0,0|2,0,0]=4 43 B9R1.12 CNCCN1CCCC1 1192664 [1,0,0,0,1,0|1,0,0]=3 44 B9R1.12 CNCCN1CCCC1 3851320 [1,0,0,0,1,0|1,0,0]=3 45 B9R1.6 CN(C)C1CCNCC1 22430359 [1,0,0,0,1,0|2,0,0]=4 46 B9R1.6 NC(=O)C1CCCCC1 1375196 [1,0,0,0,1,0|1,0,1]=4 47 B9R1.6 NC(=S)C1CCCCC1 2125373 [1,0,0,0,1,0|1,0,1]=4