0 B6R0.1 C#CCC(=O)OC BB32-1580 [1,0,0,0,0,0|0,0,2]=3 1 B6R0.1 CCCC(=O)CCl BB31-4027 [1,0,0,0,0,0|2,0,0]=3 2 B6R0.1 NNC(=O)CCO BB31-4269 [1,0,0,0,0,0|3,0,0]=4 3 B6R0.4 CC(=O)CCCBr BB31-6000 [1,0,0,0,0,0|1,0,0]=2 4 B6R0.4 CCCCC(=N)N BB31-8730 [1,0,0,0,0,0|2,0,0]=3 5 B6R0.4 COCCC(=N)N BB31-7023 [1,0,0,0,0,0|3,0,0]=4 6 B6R0.4 COCOC(C)=O BB32-2824 [1,0,0,0,0,0|2,0,0]=3 7 B6R0.4 NCCNC(N)=O BB32-3910 [1,0,0,0,0,0|3,0,0]=4 8 B6R0.4 O=[N+]([O-])CCCO BB31-4344 [1,0,0,0,0,0|2,0,1]=4 9 B6R0.6 CNCCCCCl BB31-7841 [1,0,0,0,0,0|2,0,1]=4 10 B8R0.1 C#CCCC(=O)CCO BB31-2828 [0,1,0,0,0,0|1,0,2]=4 11 B8R0.6 CCCCOC(=O)CN BB31-9514 [0,1,0,0,0,0|2,0,0]=3 12 B8R0.6 CCNCCC(=O)OC BB31-6215 [0,1,0,0,0,0|0,0,0]=1 13 B8R0.8 CCCCC(=O)C(=O)O BB31-4311 [0,1,0,0,0,0|2,0,0]=3 14 B8R0.8 CCCCC(=O)[C@H](C)N BB31-2998 [0,1,0,0,0,0|1,0,0]=2 15 B8R0.9 CCC(=O)NCC(C)C BB32-3399 [0,1,0,0,0,0|2,0,0]=3 16 B8R0.9 COC(=O)CNC(C)=O BB31-6237 [0,1,0,0,0,0|1,0,1]=3 17 B8R0.19 CC[C@H](O)CC(=O)OC BB31-5331 [0,1,0,0,0,0|0,0,0]=1 18 B8R0.19 COC(=O)N[C@@H](C)CN BB31-0922 [0,1,0,0,0,0|2,0,0]=3 19 B8R1.1 COC1=CC(=O)CC1 BB31-5801 [0,0,0,1,0,0|2,0,1]=4 20 B8R1.1 N#CC1CCC(=O)C1 BB32-2063 [0,0,0,1,0,0|2,0,1]=4 21 B8R1.1 N#CC1CNC(=O)C1 BB31-6774 [0,0,0,1,0,0|2,0,1]=4 22 B8R1.1 NCC1CCC(=O)N1 BB31-5970 [0,0,0,1,0,0|3,0,0]=4 23 B8R1.1 NCC1CNC(=O)O1 BB31-3233 [0,0,0,1,0,0|3,0,0]=4 24 B8R1.1 O=C1N[C@@H](CI)CO1 BB31-2803 [0,0,0,1,0,0|2,0,0]=3 25 B8R1.1 O=C1N[C@H](CO)CO1 BB31-1953 [0,0,0,1,0,0|2,0,0]=3 26 B8R1.2 CO[C@H]1CCCNC1 BB31-5248 [0,0,0,1,0,0|2,0,1]=4 27 B8R1.3 CC1CNC(=O)CO1 BB31-1811 [0,0,0,1,0,0|2,0,0]=3 28 B8R1.3 C[C@@H]1CO[C@H](C)CN1 BB31-3235 [0,0,0,1,0,0|2,0,1]=4 29 B8R1.3 C[C@H]1CC[C@@H](N)CC1 BB31-5132 [0,0,0,1,0,0|2,0,1]=4 30 B8R1.3 C[C@H]1CN[C@H](C)CO1 BB31-3234 [0,0,0,1,0,0|2,0,1]=4 31 B8R1.3 NC1CCC(=O)NC1 BB31-0976 [0,0,0,1,0,0|2,0,0]=3 32 B8R1.3 N[C@@H]1CCC(=O)NC1 BB31-0068 [0,0,0,1,0,0|2,0,0]=3 33 B8R1.3 O=C1CC[C@@H](O)CN1 BB31-0348 [0,0,0,1,0,0|2,0,0]=3 34 B8R1.5 CC1COCCC1=O BB31-0779 [0,0,0,1,0,0|2,0,0]=3 35 B8R1.5 CN1CCOCC1=O BB31-4094 [0,0,0,1,0,0|2,0,0]=3 36 B8R1.5 NC1CCCCC1=O BB31-7416 [0,0,0,1,0,0|2,0,0]=3 37 B8R1.5 NC1CCCNC1=O BB52-8540 [0,0,0,1,0,0|3,0,0]=4 38 B8R1.5 O=C1CCOCC1Br BB31-5776 [0,0,0,1,0,0|3,0,0]=4 39 B8R1.5 O=C1CCOCC1F BB32-3113 [0,0,0,1,0,0|3,0,0]=4 40 B8R1.5 O=C1NCCCC1Br BB32-1567 [0,0,0,1,0,0|3,0,0]=4 41 B8R1.22 CC1CCCCCN1 BB32-1446 [0,0,0,1,0,0|2,0,1]=4 42 B8R1.22 NC1=NCCCCC1 BB52-7687 [0,0,0,1,0,0|2,0,0]=3 43 B8R1.22 O=C1CCCCNC1 BB32-3316 [0,0,0,1,0,0|2,0,0]=3 44 B8R1.22 O=C1CCCOCC1 BB32-3102 [0,0,0,1,0,0|2,0,0]=3 45 B8R1.22 O=C1CNCCCN1 BB31-5486 [0,0,0,1,0,0|2,0,0]=3 46 B8R1.22 O=C1CNCCCN1 BB31-6324 [0,0,0,1,0,0|2,0,0]=3 47 B8R1.38 COC(=O)C1COC1 BB31-3226 [0,0,0,1,0,0|1,0,0]=2 48 B8R1.38 O=C(CBr)C1CCC1 BB31-1832 [0,0,0,1,0,0|2,0,0]=3 49 B8R1.38 O=C(CBr)N1CCC1 BB31-6413 [0,0,0,1,0,0|3,0,0]=4 50 B8R1.40 COC(=O)CC1CC1 BB32-1998 [0,0,0,1,0,0|0,0,0]=1 51 B8R1.50 CN1CCC(=O)C1=O BB32-2163 [0,0,0,1,0,0|3,0,0]=4 52 B5R0.1 CC(=O)CCBr BB31-4479 [2,0,0,0,0,0|1,0,0]=3 53 B5R0.1 COCC(N)=O BB31-3207 [2,0,0,0,0,0|2,0,0]=4 54 B5R0.1 O=C(O)CCF BB32-2513 [2,0,0,0,0,0|1,0,0]=3 55 B5R0.2 C=CCCCI BB31-6966 [2,0,0,0,0,0|1,0,1]=4 56 B5R0.2 C=CCCCN BB31-4446 [2,0,0,0,0,0|1,0,1]=4 57 B5R0.2 OCCCCI BB32-2029 [2,0,0,0,0,0|1,0,1]=4 58 B5R0.3 CCC(=O)CN BB31-8248 [2,0,0,0,0,0|2,0,0]=4 59 B7R0.10 COC(=O)C(C)CN BB31-6417 [1,1,0,0,0,0|1,0,0]=3 60 B7R0.10 COC(=O)[C@@H](C)CBr BB31-6195 [1,1,0,0,0,0|1,0,0]=3 61 B7R0.10 C\C=C(/Br)C(=O)OC BB31-3618 [1,1,0,0,0,0|0,0,2]=4 62 B7R0.4 N#CCCCC(=O)O BB31-7795 [1,1,0,0,0,0|0,0,1]=3 63 B7R0.4 NC(=O)CCCCO BB31-4574 [1,1,0,0,0,0|1,0,0]=3 64 B7R0.4 O=C([O-])COCCO BB31-2744 [1,1,0,0,0,0|1,0,1]=4 65 B7R0.4 OB(O)CCCCBr BB31-5383 [1,1,0,0,0,0|1,0,1]=4 66 B7R0.6 CC(=O)NCC(C)O BB31-7690 [1,1,0,0,0,0|1,0,0]=3 67 B7R0.6 CC(=O)NNC(C)C BB32-2318 [1,1,0,0,0,0|2,0,0]=4 68 B7R0.6 CC(C)CC[N+](=O)[O-] BB32-3570 [1,1,0,0,0,0|1,0,1]=4 69 B7R0.6 CC(N)CCC(=O)O BB31-2419 [1,1,0,0,0,0|0,0,0]=2 70 B7R0.6 CC(O)CCC(=O)[O-] BB31-5329 [1,1,0,0,0,0|0,0,1]=3 71 B7R0.8 CS(=O)(=O)CCCCl BB32-2712 [1,1,0,0,0,0|2,0,0]=4 72 B7R0.8 CS(=O)(=O)CCCN BB31-3020 [1,1,0,0,0,0|2,0,0]=4 73 B7R0.1 CCCNCCOC BB31-6246 [1,1,0,0,0,0|0,0,1]=3 74 B9R0.48 CC(C)CNC(=O)CCN BB32-0238 [0,2,0,0,0,0|2,0,0]=4 75 B9R0.48 CCOC(=O)OCC(C)C BB31-5205 [0,2,0,0,0,0|1,0,0]=3 76 B9R0.23 COC(=O)C(=O)CC(C)C BB31-6224 [0,2,0,0,0,0|0,0,1]=3 77 B9R0.23 COC(=O)C(O)CC(C)C BB32-2157 [0,2,0,0,0,0|0,0,0]=2 78 B9R0.23 COC(=O)[C@H](N)CC(N)=O BB32-0096 [0,2,0,0,0,0|1,0,1]=4 79 B9R0.27 CCC(=O)C(C)C(=O)OC BB31-3423 [0,2,0,0,0,0|0,0,1]=3 80 B9R0.27 CCC(C)C(N)C(=O)OC BB32-1071 [0,2,0,0,0,0|0,0,0]=2 81 B9R0.27 CCC(C)C(O)C(=O)OC BB31-7708 [0,2,0,0,0,0|0,0,0]=2 82 B9R0.1 C=C(C)CCCC(=O)OC BB32-1876 [0,2,0,0,0,0|0,0,0]=2 83 B9R0.24 CCC(=O)CCC(=O)CC BB31-4562 [0,2,0,0,0,0|1,0,0]=3 84 B9R0.47 CCCCCC(=O)N(C)C BB31-6255 [0,2,0,0,0,0|1,0,0]=3 85 B9R0.13 CCCC[C@H](NC)C(=O)O BB31-3398 [0,2,0,0,0,0|1,0,1]=4 86 B9R0.42 COC(=O)CC(=O)C(C)Br BB31-4983 [0,2,0,0,0,0|0,0,1]=3 87 B9R0.42 COC(=O)C[C@@H](C)C(=O)O BB31-5539 [0,2,0,0,0,0|1,0,1]=4 88 B9R0.42 COC(=O)C[C@H](C)C(=O)O BB31-9056 [0,2,0,0,0,0|1,0,1]=4 89 B9R0.21 CCC(=O)CNC(C)(C)C BB54-2744 [0,2,0,0,0,0|2,0,0]=4 90 B7R1.2 C[C@@H]1CCC(=O)N1 BB31-7724 [1,0,0,1,0,0|2,0,0]=4 91 B7R1.2 C[C@H]1CCC(=O)N1 BB31-2966 [1,0,0,1,0,0|2,0,0]=4 92 B7R1.2 N[C@H]1CNC(=O)C1 BB31-3703 [1,0,0,1,0,0|2,0,0]=4 93 B7R1.2 O=C1CC(O)CO1 BB31-5337 [1,0,0,1,0,0|1,0,0]=3 94 B7R1.2 O=C1CCC(O)C1 BB31-4994 [1,0,0,1,0,0|2,0,0]=4 95 B7R1.3 O=C1CNCCO1 BB32-2655 [1,0,0,1,0,0|1,0,0]=3 96 B7R1.3 S=C1CCCCN1 BB31-1665 [1,0,0,1,0,0|1,1,0]=4 97 B7R1.12 C[C@@H]1C[C@H]1C(=O)O BB32-3490 [1,0,0,1,0,0|0,0,0]=2 98 B7R1.12 C[C@H]1C[C@@H]1C(=O)O BB32-0696 [1,0,0,1,0,0|0,0,0]=2 99 B7R1.12 O=C(O)[C@@H]1C[C@H]1F BB31-3334 [1,0,0,1,0,0|1,0,0]=3 100 B7R1.18 CC(=O)N1CCC1 BB32-2755 [1,0,0,1,0,0|1,0,0]=3 101 B7R1.18 CC(N)C1CCC1 BB31-5264 [1,0,0,1,0,0|1,0,1]=4 102 B7R1.18 N=C(N)C1CCC1 BB31-6957 [1,0,0,1,0,0|2,0,0]=4 103 B7R1.18 NC(=O)C1CNC1 BB31-1092 [1,0,0,1,0,0|2,0,0]=4 104 B7R1.18 NC(=S)C1CCC1 BB31-2990 [1,0,0,1,0,0|1,1,0]=4 105 B7R1.18 O=C(O)C1=CCC1 BB32-1171 [1,0,0,1,0,0|0,0,2]=4 106 B7R1.18 O=C(O)C1COC1 BB31-0382 [1,0,0,1,0,0|1,0,0]=3 107 B9R1.2 CCC1CCCC(=O)C1 BB31-8126 [0,1,0,1,0,0|1,0,0]=3 108 B9R1.2 COC1=CC(=O)CCC1 BB31-3355 [0,1,0,1,0,0|1,0,1]=4 109 B9R1.2 CO[C@@H]1CCN[C@@H](C)C1 BB32-0123 [0,1,0,1,0,0|1,0,1]=4 110 B9R1.2 NCC1CCNC(=O)C1 BB32-0239 [0,1,0,1,0,0|2,0,0]=4 111 B9R1.2 O=C1CC(CO)CCN1 BB32-2912 [0,1,0,1,0,0|2,0,0]=4 112 B9R1.2 O=C1COCC(CO)N1 BB31-9072 [0,1,0,1,0,0|2,0,0]=4 113 B9R1.7 CCCC1=NNC(=O)C1 BB52-7288 [0,1,0,1,0,0|2,0,0]=4 114 B9R1.7 CCCC1COC(=O)O1 BB31-8496 [0,1,0,1,0,0|0,0,0]=2 115 B9R1.15 CCN1CCNCC1=O BB52-8136 [0,1,0,1,0,0|2,0,0]=4 116 B9R1.15 COC1=CCCCC1=O BB32-1133 [0,1,0,1,0,0|0,0,1]=3 117 B9R1.15 COC1CCCCC1N BB32-2888 [0,1,0,1,0,0|1,0,1]=4 118 B9R1.15 O=CC1=C(Br)CCCC1 BB32-2004 [0,1,0,1,0,0|2,0,0]=4 119 B9R1.15 O=CC1=C(Cl)CCCC1 BB31-8272 [0,1,0,1,0,0|2,0,0]=4 120 B9R1.48 O=C1CCCNC(=O)C1 BB31-4559 [0,1,0,1,0,0|1,0,1]=4 121 B9R1.69 CN1CCC(=O)CC1=O BB31-0803 [0,1,0,1,0,0|1,0,1]=4 122 B9R1.69 CN1CCC(N)CC1=O BB31-2065 [0,1,0,1,0,0|1,0,0]=3 123 B9R1.75 CCOC(=O)C=C1CC1 BB31-6895 [0,1,0,1,0,0|0,0,2]=4 124 B9R1.3 C[C@@H]1NCCN(C)C1=O BB31-9836 [0,1,0,1,0,0|2,0,0]=4 125 B9R1.3 C[C@H]1NCCN(C)C1=O BB31-9831 [0,1,0,1,0,0|2,0,0]=4 126 B9R1.11 O=C(CBr)N1CCCC1 BB53-1057 [0,1,0,1,0,0|2,0,0]=4 127 B9R1.82 COC(=O)C1CC(Cl)C1 BB31-3084 [0,1,0,1,0,0|0,0,0]=2 128 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 BB32-3300 [0,1,0,1,0,0|0,0,0]=2 129 B9R1.101 COC(=O)[C@@H](N)C1CC1 BB31-2388 [0,1,0,1,0,0|0,0,0]=2 130 B9R1.132 CN1C(=O)CCC1CO BB31-5269 [0,1,0,1,0,0|1,0,0]=3 131 B9R1.186 COC(=O)C1(C)CCC1 BB31-6996 [0,1,0,1,0,0|0,0,0]=2 132 B9R1.1 CON1CCC(=O)CC1 BB31-8752 [0,1,0,1,0,0|2,0,0]=4 133 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 BB32-3392 [0,1,0,1,0,0|1,0,1]=4 134 B9R1.1 CO[C@H]1CC[C@H](O)CC1 BB32-1070 [0,1,0,1,0,0|1,0,1]=4 135 B9R1.1 NCC1CCC(=O)NC1 BB32-1698 [0,1,0,1,0,0|1,0,0]=3 136 B9R1.1 O=C1CCC(CBr)CC1 BB31-3860 [0,1,0,1,0,0|1,0,0]=3 137 B9R1.1 O=C1CO[C@H](CO)CN1 BB31-8603 [0,1,0,1,0,0|2,0,0]=4 138 B9R1.1 O=CC1CCC(=O)CC1 BB31-5251 [0,1,0,1,0,0|1,0,1]=4 139 B9R1.79 COC(=O)CC1COC1 BB31-2235 [0,1,0,1,0,0|0,0,0]=2 140 B9R1.89 COC1CCCNCC1 BB31-2531 [0,1,0,1,0,0|1,0,1]=4 141 B9R1.118 COC1(C)CCNCC1 BB32-1706 [0,1,0,1,0,0|1,0,1]=4 142 B9R1.35 CC(C)[C@@H]1CCC(=O)N1 BB31-2463 [0,1,0,1,0,0|2,0,0]=4 143 B9R1.40 CC1(C)CCCNC1=O BB32-1436 [0,1,0,1,0,0|2,0,0]=4 144 B9R1.40 CC1(C)CNCCC1=O BB31-5743 [0,1,0,1,0,0|2,0,0]=4 145 B9R1.110 O=C(O)C(=O)C1CCC1 BB31-7654 [0,1,0,1,0,0|2,0,0]=4 146 B9R2.39 O=C1NC2CCC1C2 BB31-4286 [0,0,0,2,0,0|2,0,0]=4