0 B9R0.45 CCCCCC#CCCO BB12-2262 [0,0,0,0,0,0|0,0,4]=4 1 B8R0.4 C=CCCNCCOC BB58-0794 [1,0,0,0,0,0|2,0,1]=4 2 B10R0.4 CCCCSCCSC(=N)N BB54-1801 [0,1,0,0,0,0|3,0,0]=4 3 B10R0.71 CCCCCCCSCCO BB54-4511 [0,1,0,0,0,0|0,0,2]=3 4 B10R0.74 CCCCCCCC(=O)NN BB12-3109 [0,1,0,0,0,0|2,0,1]=4 5 B10R1.4 CC1CCCCN1CC#N BB57-0103 [0,0,0,1,0,0|2,0,1]=4 6 B10R1.4 CCCN1CCNCC1=O BB57-3769 [0,0,0,1,0,0|2,0,0]=3 7 B10R1.4 CN1CCCCC1CCCl BB01-6122 [0,0,0,1,0,0|2,0,1]=4 8 B10R1.4 CN1CCCCC1CCO BB55-3532 [0,0,0,1,0,0|1,0,2]=4 9 B10R1.4 CNCC1CCCCN1C BB55-4566 [0,0,0,1,0,0|3,0,0]=4 10 B10R1.17 CCCCC1CCCCN1 BB56-0666 [0,0,0,1,0,0|1,0,1]=3 11 B10R1.17 CCOCC1CCCNC1 BB53-1687 [0,0,0,1,0,0|3,0,0]=4 12 B10R1.17 CNCCC1CCCOC1 BB58-0311 [0,0,0,1,0,0|3,0,0]=4 13 B10R1.17 COCCC1CCNCC1 BB57-1732 [0,0,0,1,0,0|3,0,0]=4 14 B10R1.17 ClCCCN1CCCCC1 BB01-5068 [0,0,0,1,0,0|2,0,1]=4 15 B10R1.17 N#CCCN1CCCCC1 BB57-0098 [0,0,0,1,0,0|2,0,1]=4 16 B10R1.17 NCCCC1CCCCC1 BB20-3102 [0,0,0,1,0,0|1,0,1]=3 17 B10R1.17 NCCSC1CCCCC1 BB58-0596 [0,0,0,1,0,0|2,0,1]=4 18 B10R1.17 OCCCC1CCNCC1 BB55-3547 [0,0,0,1,0,0|1,0,2]=4 19 B10R1.17 OCCNC1CCCCC1 BB57-6993 [0,0,0,1,0,0|1,0,2]=4 20 B10R1.19 O=C1CCCCCN1CO BB54-0228 [0,0,0,1,0,0|2,0,0]=3 21 B10R1.20 CCN1CCCCC1CN BB12-1769 [0,0,0,1,0,0|2,0,1]=4 22 B10R1.20 COC1COCCN1C=O BB12-2256 [0,0,0,1,0,0|3,0,0]=4 23 B10R1.21 NCCCOC1CCCC1 BB58-0621 [0,0,0,1,0,0|2,0,1]=4 24 B10R1.85 CCCC1CCCCCN1 BB56-1743 [0,0,0,1,0,0|1,0,1]=3 25 B10R1.85 NCCC1CCCCCC1 BB32-2304 [0,0,0,1,0,0|1,0,1]=3 26 B10R1.85 NCCN1CCCCCC1 BB12-1387 [0,0,0,1,0,0|2,0,1]=4 27 B7R0.1 CCCCOCCN BB53-1642 [2,0,0,0,0,0|2,0,0]=4 28 B7R0.1 CCCCSCCN BB57-6671 [2,0,0,0,0,0|2,0,0]=4 29 B7R0.1 CCCCSCCO BB54-1800 [2,0,0,0,0,0|1,0,1]=4 30 B7R0.1 CCNCCNCC BB57-6994 [2,0,0,0,0,0|2,0,0]=4 31 B7R0.1 [C-]#[N+]CCCCCC BB56-1203 [2,0,0,0,0,0|1,0,1]=4 32 B9R0.2 CCCCCCC[13C](=O)O BB54-5277 [1,1,0,0,0,0|0,0,0]=2 33 B9R0.2 CCCCSCCC(=O)O BB54-0237 [1,1,0,0,0,0|1,0,0]=3 34 B9R0.2 CCOCCCNC(N)=O BB01-7613 [1,1,0,0,0,0|2,0,0]=4 35 B9R0.18 CCCCN(C)CCCN BB01-5257 [1,1,0,0,0,0|2,0,0]=4 36 B11R0.40 C=CS(=O)CCCCCCCC BB54-1798 [0,2,0,0,0,0|1,0,0]=3 37 B11R0.148 CCCCSCCCCC(=O)O BB54-4514 [0,2,0,0,0,0|0,0,0]=2 38 B11R0.148 O=C(O)CCOCCOCCO BB31-9991 [0,2,0,0,0,0|2,0,0]=4 39 B11R0.3 CCCCCCCCOCCN BB57-4806 [0,2,0,0,0,0|1,0,1]=4 40 B11R0.3 CCCCCCCCSCCO BB54-1797 [0,2,0,0,0,0|0,0,2]=4 41 B9R1.8 BrCCC1CCCCN1 BB54-3946 [1,0,0,1,0,0|2,0,0]=4 42 B9R1.8 CNCC1CCCCO1 BB12-3612 [1,0,0,1,0,0|1,0,1]=4 43 B9R1.8 COCC1CCCCN1 BB56-0722 [1,0,0,1,0,0|2,0,0]=4 44 B9R1.8 CSCC1CCCCN1 BB56-1708 [1,0,0,1,0,0|2,0,0]=4 45 B9R1.8 NCCC1CCCCC1 BB55-8639 [1,0,0,1,0,0|1,0,0]=3 46 B9R1.8 NCCC1CCCCO1 BB57-6510 [1,0,0,1,0,0|1,0,1]=4 47 B9R1.8 NCCC1CCCNC1 BB12-2059 [1,0,0,1,0,0|2,0,0]=4 48 B9R1.8 NCCC1CCCOC1 BB54-4864 [1,0,0,1,0,0|2,0,0]=4 49 B9R1.8 O=CCC1CCCOC1 BB58-0314 [1,0,0,1,0,0|1,0,0]=3 50 B9R1.8 OCCC1CCCCO1 BB58-1902 [1,0,0,1,0,0|1,0,1]=4 51 B9R1.8 OCCC1CCCOC1 BB58-0315 [1,0,0,1,0,0|1,0,1]=4 52 B9R1.12 CCCCC1CCCN1 BB56-0702 [1,0,0,1,0,0|1,0,0]=3 53 B9R1.12 CCCCC1CCNC1 BB56-1976 [1,0,0,1,0,0|1,0,1]=4 54 B9R1.12 NCCCC1CCCC1 BB32-3179 [1,0,0,1,0,0|1,0,0]=3 55 B9R1.12 NCCCC1CCOC1 BB54-1028 [1,0,0,1,0,0|2,0,0]=4 56 B9R1.12 NCCSC1CCCC1 BB58-0597 [1,0,0,1,0,0|2,0,0]=4 57 B9R1.14 CCN1CCCC1CBr BB12-2883 [1,0,0,1,0,0|2,0,0]=4 58 B9R1.14 CCN1CCCC1CCl BB58-2153 [1,0,0,1,0,0|2,0,0]=4 59 B9R1.14 CCN1CCCC1CO BB12-1536 [1,0,0,1,0,0|1,0,1]=4 60 B9R1.15 CCC1SCCNC1=O BB57-3971 [1,0,0,1,0,0|2,0,0]=4 61 B9R1.15 CN1CCCCC1CBr BB12-3106 [1,0,0,1,0,0|2,0,0]=4 62 B9R1.15 CN1CCCCC1CCl BB55-5164 [1,0,0,1,0,0|2,0,0]=4 63 B9R1.15 CN1CCCCC1CN BB53-1653 [1,0,0,1,0,0|2,0,0]=4 64 B9R1.15 CN[C@@H]1CCCC[C@H]1O BB58-0623 [1,0,0,1,0,0|1,0,1]=4 65 B9R1.15 O=CC1CCCCC1=O BB12-3722 [1,0,0,1,0,0|1,0,1]=4 66 B9R1.33 O=C1CCCN1CCBr BB55-6495 [1,0,0,1,0,0|2,0,0]=4 67 B9R1.33 O=C1CCCN1CCCl BB55-7854 [1,0,0,1,0,0|2,0,0]=4 68 B9R1.50 O=C1CCCCCCC1 BB12-2910 [1,0,0,1,0,0|0,0,0]=2 69 B9R1.89 CCC1CCCNCC1 BB12-1654 [1,0,0,1,0,0|1,0,1]=4 70 B9R1.89 [C-]#[N+]C1CCCCCC1 BB56-1665 [1,0,0,1,0,0|1,0,1]=4 71 B11R1.4 CCCCCCC1CCCN1 BB56-1637 [0,1,0,1,0,0|1,0,1]=4 72 B11R1.199 CCOC(=O)C1CCCC1=O BB01-7563 [0,1,0,1,0,0|1,0,1]=4 73 B11R1.91 NC(=O)CCN1CCNCC1 BB54-3383 [0,1,0,1,0,0|2,0,0]=4 74 B11R1.91 O=C(O)CCC1CCCCN1 BB54-4041 [0,1,0,1,0,0|1,0,0]=3 75 B11R1.91 O=C(O)CCC1CCCNC1 BB54-3377 [0,1,0,1,0,0|1,0,0]=3 76 B11R1.91 O=C(O)CCC1CCNCC1 BB55-8640 [0,1,0,1,0,0|1,0,0]=3 77 B11R1.91 O=C(O)CCN1CCOCC1 BB01-4157 [0,1,0,1,0,0|2,0,0]=4 78 B11R1.91 O=C(O)COC1CCNCC1 BB57-1740 [0,1,0,1,0,0|2,0,0]=4 79 B11R1.172 O=C(O)CCCN1CCCC1 BB31-6636 [0,1,0,1,0,0|1,0,0]=3 80 B11R1.172 O=C(O)COCC1CCCO1 BB54-1031 [0,1,0,1,0,0|2,0,0]=4 81 B11R1.193 CCCN1CCCC1C(=O)O BB58-0838 [0,1,0,1,0,0|1,0,0]=3 82 B11R1.742 CC(C)CC1CCCCCN1 BB56-1612 [0,1,0,1,0,0|1,0,1]=4 83 B11R1.17 CC1CCCCN1CCC#N BB57-0104 [0,1,0,1,0,0|1,0,1]=4 84 B11R1.28 CCNCCC1CCCOC1 BB58-0312 [0,1,0,1,0,0|2,0,0]=4 85 B11R1.28 NCCCCN1CCCCC1 BB57-6362 [0,1,0,1,0,0|1,0,1]=4 86 B11R1.203 N#CCCN1CCCCCC1 BB57-6719 [0,1,0,1,0,0|1,0,1]=4 87 B11R1.222 CCC(C)C1CCCCC1=O BB01-7985 [0,1,0,1,0,0|0,0,0]=2 88 B11R2.10 O=C1OC2CCCCC2O1 BB54-0661 [0,0,0,2,0,0|2,0,0]=4 89 B11R2.20 [C@H]12CCCC[C@H]1CNCC2 BB57-3740 [0,0,0,2,0,0|1,0,1]=4 90 B11R2.106 O=C1CCNC2CCCC12 BB54-5685 [0,0,0,2,0,0|1,0,0]=3 91 B11R2.1 O=C1CCC2CNCCN12 BB31-8967 [0,0,0,2,0,0|2,0,0]=4 92 B11R2.239 C1CCC(C2CCC2)NC1 BB56-1880 [0,0,0,2,0,0|1,0,1]=4 93 B11R2.1037 C1CCC2CCCC(C1)N2 BB55-6361 [0,0,0,2,0,0|1,0,1]=4 94 B11R2.1261 C1CCC2(C1)CCCNC2 BB58-3634 [0,0,0,2,0,0|2,0,0]=4 95 B11R2.1261 C1CCC2(CC1)CCNC2 BB55-7020 [0,0,0,2,0,0|2,0,0]=4 96 B11R2.2 C1CCC(C2CCCN2)C1 BB56-0714 [0,0,0,2,0,0|1,0,1]=4