0 B9R0.45 C#CCOCCOCCO BB58-3902 [0,0,0,0,0,0|2,0,2]=4 1 B9R0.45 CCCCCC#CCCO BB12-2262 [0,0,0,0,0,0|0,0,2]=2 2 B10R0.71 CCCCCCCSCCO BB54-4511 [0,1,0,0,0,0|0,0,0]=1 3 B10R0.74 CCCCCCCC(=O)NN BB12-3109 [0,1,0,0,0,0|2,0,1]=4 4 B10R1.4 CC1CCCCN1CC#N BB57-0103 [0,0,0,1,0,0|2,0,1]=4 5 B10R1.4 CN1CCCCC1CCCl BB01-6122 [0,0,0,1,0,0|2,0,0]=3 6 B10R1.4 CN1CCCCC1CCO BB55-3532 [0,0,0,1,0,0|1,0,0]=2 7 B10R1.4 CNCC1CCCCN1C BB55-4566 [0,0,0,1,0,0|3,0,0]=4 8 B10R1.17 BrCCCN1CCOCC1 BB31-1160 [0,0,0,1,0,0|3,0,0]=4 9 B10R1.17 CCCCC1CCCCN1 BB56-0666 [0,0,0,1,0,0|1,0,0]=2 10 B10R1.17 CCCCN1CCNCC1 BB55-1685 [0,0,0,1,0,0|3,0,0]=4 11 B10R1.17 CCCNC1CCOCC1 BB53-1520 [0,0,0,1,0,0|3,0,0]=4 12 B10R1.17 CCCOC1CCNCC1 BB01-3707 [0,0,0,1,0,0|3,0,0]=4 13 B10R1.17 CCNCC1CCOCC1 BB55-3592 [0,0,0,1,0,0|3,0,0]=4 14 B10R1.17 CCOCC1CCCNC1 BB53-1687 [0,0,0,1,0,0|3,0,0]=4 15 B10R1.17 CCOCC1CCNCC1 BB53-1667 [0,0,0,1,0,0|3,0,0]=4 16 B10R1.17 CCOCC1CCNCC1 BB56-2582 [0,0,0,1,0,0|3,0,0]=4 17 B10R1.17 CNCCC1CCCOC1 BB58-0311 [0,0,0,1,0,0|3,0,0]=4 18 B10R1.17 COCCC1CCNCC1 BB57-1732 [0,0,0,1,0,0|3,0,0]=4 19 B10R1.17 ClCCCN1CCCCC1 BB01-5068 [0,0,0,1,0,0|2,0,0]=3 20 B10R1.17 N#CCCN1CCCCC1 BB57-0098 [0,0,0,1,0,0|2,0,1]=4 21 B10R1.17 NCCCC1CCCCC1 BB20-3102 [0,0,0,1,0,0|1,0,0]=2 22 B10R1.17 NCCSC1CCCCC1 BB58-0596 [0,0,0,1,0,0|2,0,0]=3 23 B10R1.17 OCCCC1CCNCC1 BB55-3547 [0,0,0,1,0,0|1,0,0]=2 24 B10R1.17 OCCNC1CCCCC1 BB57-6993 [0,0,0,1,0,0|1,0,0]=2 25 B10R1.19 O=C1CCCCCN1CO BB54-0228 [0,0,0,1,0,0|2,0,1]=4 26 B10R1.20 CCN1CCCCC1CN BB12-1769 [0,0,0,1,0,0|2,0,0]=3 27 B10R1.21 NCCCOC1CCCC1 BB58-0621 [0,0,0,1,0,0|2,0,0]=3 28 B10R1.85 CCCC1CCCCCN1 BB56-1743 [0,0,0,1,0,0|1,0,0]=2 29 B10R1.85 NCCC1CCCCCC1 BB32-2304 [0,0,0,1,0,0|1,0,0]=2 30 B10R1.85 NCCN1CCCCCC1 BB12-1387 [0,0,0,1,0,0|2,0,0]=3 31 B7R0.1 CCCCOCCN BB53-1642 [2,0,0,0,0,0|2,0,0]=4 32 B7R0.1 CCCCSCCN BB57-6671 [2,0,0,0,0,0|2,0,0]=4 33 B7R0.1 CCCCSCCO BB54-1800 [2,0,0,0,0,0|1,0,0]=3 34 B7R0.1 CCNCCNCC BB57-6994 [2,0,0,0,0,0|2,0,0]=4 35 B7R0.1 [C-]#[N+]CCCCCC BB56-1203 [2,0,0,0,0,0|1,0,1]=4 36 B9R0.2 CCCCCCC[13C](=O)O BB54-5277 [1,1,0,0,0,0|0,0,1]=3 37 B9R0.2 CCCCSCCC(=O)O BB54-0237 [1,1,0,0,0,0|1,0,1]=4 38 B9R0.18 CCCCN(C)CCCN BB01-5257 [1,1,0,0,0,0|2,0,0]=4 39 B11R0.40 C=CS(=O)CCCCCCCC BB54-1798 [0,2,0,0,0,0|1,0,1]=4 40 B11R0.148 CCCCSCCCCC(=O)O BB54-4514 [0,2,0,0,0,0|0,0,1]=3 41 B11R0.3 CCCCCCCCOCCN BB57-4806 [0,2,0,0,0,0|1,0,0]=3 42 B11R0.3 CCCCCCCCSCCO BB54-1797 [0,2,0,0,0,0|0,0,0]=2 43 B9R1.8 BrCCC1CCCCN1 BB54-3946 [1,0,0,1,0,0|2,0,0]=4 44 B9R1.8 CCCN1CCNCC1 BB01-4863 [1,0,0,1,0,0|2,0,0]=4 45 B9R1.8 CNCC1CCCCO1 BB12-3612 [1,0,0,1,0,0|1,0,0]=3 46 B9R1.8 CNCC1CCCNC1 BB53-1684 [1,0,0,1,0,0|2,0,0]=4 47 B9R1.8 CNCC1CCNCC1 BB53-1681 [1,0,0,1,0,0|2,0,0]=4 48 B9R1.8 CNCC1COCCO1 BB01-4575 [1,0,0,1,0,0|2,0,0]=4 49 B9R1.8 COCC1CCCCN1 BB56-0722 [1,0,0,1,0,0|2,0,0]=4 50 B9R1.8 COCC1CCCNC1 BB31-7247 [1,0,0,1,0,0|2,0,0]=4 51 B9R1.8 COCC1CCCNC1 BB53-1686 [1,0,0,1,0,0|2,0,0]=4 52 B9R1.8 CSCC1CCCCN1 BB56-1708 [1,0,0,1,0,0|2,0,0]=4 53 B9R1.8 CSCC1CCCNC1 BB12-1129 [1,0,0,1,0,0|2,0,0]=4 54 B9R1.8 CSCC1CCNCC1 BB12-1119 [1,0,0,1,0,0|2,0,0]=4 55 B9R1.8 N#CCC1CCCCO1 BB57-4940 [1,0,0,1,0,0|1,0,1]=4 56 B9R1.8 NCCC1CCCCC1 BB55-8639 [1,0,0,1,0,0|1,0,0]=3 57 B9R1.8 NCCC1CCCCO1 BB57-6510 [1,0,0,1,0,0|1,0,0]=3 58 B9R1.8 NCCC1CCCNC1 BB12-2059 [1,0,0,1,0,0|2,0,0]=4 59 B9R1.8 NCCC1CCCOC1 BB54-4864 [1,0,0,1,0,0|2,0,0]=4 60 B9R1.8 NCCN1CCCCO1 BB58-3658 [1,0,0,1,0,0|2,0,0]=4 61 B9R1.8 OCCC1CCCCO1 BB58-1902 [1,0,0,1,0,0|1,0,0]=3 62 B9R1.8 OCCC1CCCOC1 BB58-0315 [1,0,0,1,0,0|1,0,0]=3 63 B9R1.8 OCCC1CNCCO1 BB58-1901 [1,0,0,1,0,0|2,0,0]=4 64 B9R1.12 CCCCC1CCCN1 BB56-0702 [1,0,0,1,0,0|1,0,0]=3 65 B9R1.12 CCCCC1CCNC1 BB56-1976 [1,0,0,1,0,0|1,0,0]=3 66 B9R1.12 NCCCC1CCCC1 BB32-3179 [1,0,0,1,0,0|1,0,0]=3 67 B9R1.12 NCCCC1CCOC1 BB54-1028 [1,0,0,1,0,0|2,0,0]=4 68 B9R1.12 NCCSC1CCCC1 BB58-0597 [1,0,0,1,0,0|2,0,0]=4 69 B9R1.14 CCN1CCCC1CBr BB12-2883 [1,0,0,1,0,0|2,0,0]=4 70 B9R1.14 CCN1CCCC1CCl BB58-2153 [1,0,0,1,0,0|2,0,0]=4 71 B9R1.14 CCN1CCCC1CO BB12-1536 [1,0,0,1,0,0|1,0,0]=3 72 B9R1.15 CC1CCCC\C1=N\O BB12-1622 [1,0,0,1,0,0|1,0,1]=4 73 B9R1.15 CN1CCCCC1CBr BB12-3106 [1,0,0,1,0,0|2,0,0]=4 74 B9R1.15 CN1CCCCC1CCl BB55-5164 [1,0,0,1,0,0|2,0,0]=4 75 B9R1.15 CN1CCCCC1CN BB53-1653 [1,0,0,1,0,0|2,0,0]=4 76 B9R1.15 CN[C@@H]1CCCC[C@H]1O BB58-0623 [1,0,0,1,0,0|1,0,0]=3 77 B9R1.50 O=C1CCCCCCC1 BB12-2910 [1,0,0,1,0,0|0,0,2]=4 78 B9R1.89 CCC1CCCNCC1 BB12-1654 [1,0,0,1,0,0|1,0,0]=3 79 B9R1.89 CCN1CCCNCC1 BB58-1918 [1,0,0,1,0,0|2,0,0]=4 80 B9R1.89 [C-]#[N+]C1CCCCCC1 BB56-1665 [1,0,0,1,0,0|1,0,1]=4 81 B11R1.4 CCCCCCC1CCCN1 BB56-1637 [0,1,0,1,0,0|1,0,0]=3 82 B11R1.24 NCCCN1CCCC(O)C1 BB57-0152 [0,1,0,1,0,0|2,0,0]=4 83 B11R1.91 O=C(O)CCC1CCCCN1 BB54-4041 [0,1,0,1,0,0|1,0,1]=4 84 B11R1.91 O=C(O)CCC1CCCNC1 BB54-3377 [0,1,0,1,0,0|1,0,1]=4 85 B11R1.91 O=C(O)CCC1CCNCC1 BB55-8640 [0,1,0,1,0,0|1,0,1]=4 86 B11R1.172 O=C(O)CCCN1CCCC1 BB31-6636 [0,1,0,1,0,0|1,0,1]=4 87 B11R1.193 CCCN1CCCC1C(=O)O BB58-0838 [0,1,0,1,0,0|1,0,1]=4 88 B11R1.742 CC(C)CC1CCCCCN1 BB56-1612 [0,1,0,1,0,0|1,0,0]=3 89 B11R1.742 CN(C)CC1CCCCCN1 BB56-1719 [0,1,0,1,0,0|2,0,0]=4 90 B11R1.17 CC1CCCCN1CCC#N BB57-0104 [0,1,0,1,0,0|1,0,1]=4 91 B11R1.18 NCCCN1CCCC1CO BB55-3544 [0,1,0,1,0,0|1,0,0]=3 92 B11R1.28 CCCCCN1CCNCC1 BB55-1678 [0,1,0,1,0,0|2,0,0]=4 93 B11R1.28 CCNCCC1CCCOC1 BB58-0312 [0,1,0,1,0,0|1,0,0]=3 94 B11R1.28 NCCCCN1CCCCC1 BB57-6362 [0,1,0,1,0,0|1,0,0]=3 95 B11R1.51 CCC1CNCCCN1CO BB57-1042 [0,1,0,1,0,0|1,0,0]=3 96 B11R1.203 N#CCCN1CCCCCC1 BB57-6719 [0,1,0,1,0,0|1,0,1]=4 97 B11R1.214 CCCCN1CCC(CN)C1 BB57-4022 [0,1,0,1,0,0|2,0,0]=4 98 B11R1.222 CCC(C)C1CCCCC1=O BB01-7985 [0,1,0,1,0,0|0,0,2]=4 99 B11R2.20 C1CCC2OCCNC2C1 BB54-2969 [0,0,0,2,0,0|1,0,0]=3 100 B11R2.20 [C@H]12CCCC[C@H]1CNCC2 BB57-3740 [0,0,0,2,0,0|1,0,0]=3 101 B11R2.1098 NCC12CCCN1CCC2 BB54-5072 [0,0,0,2,0,0|2,0,0]=4 102 B11R2.164 OCC1CN2CCC1CC2 BB54-2967 [0,0,0,2,0,0|1,0,0]=3 103 B11R2.238 C1CCC(NC2CC2)CC1 BB12-1356 [0,0,0,2,0,0|2,0,0]=4 104 B11R2.239 C1CCC(C2CCC2)NC1 BB56-1880 [0,0,0,2,0,0|1,0,0]=3 105 B11R2.1037 C1CCC2CCCC(C1)N2 BB55-6361 [0,0,0,2,0,0|1,0,0]=3 106 B11R2.1261 C1CC2(CCN1)OCCO2 BB12-2912 [0,0,0,2,0,0|2,0,0]=4 107 B11R2.1261 C1CCC2(C1)CCCNC2 BB58-3634 [0,0,0,2,0,0|2,0,0]=4 108 B11R2.1261 C1CCC2(CC1)CCNC2 BB55-7020 [0,0,0,2,0,0|2,0,0]=4 109 B11R2.2 C1CCC(C2CCCN2)C1 BB56-0714 [0,0,0,2,0,0|1,0,0]=3