0 B7R0.3 C=C(CCl)OCOC BB31-5584 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.1 C#CCC(=O)OC BB32-1580 [1,0,0,0,0,0|1,0,2]=4 2 B6R0.1 CCCC(=O)CCl BB31-4027 [1,0,0,0,0,0|1,0,0]=2 3 B6R0.1 NNC(=O)CCO BB31-4269 [1,0,0,0,0,0|3,0,0]=4 4 B6R0.4 CC(=O)CCCBr BB31-6000 [1,0,0,0,0,0|1,0,0]=2 5 B6R0.4 CCCCC(=N)N BB31-8730 [1,0,0,0,0,0|2,0,0]=3 6 B6R0.4 COCCC(=N)N BB31-7023 [1,0,0,0,0,0|3,0,0]=4 7 B6R0.4 COCOC(C)=O BB32-2824 [1,0,0,0,0,0|2,0,0]=3 8 B6R0.4 NCCNC(N)=O BB32-3910 [1,0,0,0,0,0|3,0,0]=4 9 B6R0.4 O=[N+]([O-])CCCO BB31-4344 [1,0,0,0,0,0|3,0,0]=4 10 B6R0.6 CNCCCCCl BB31-7841 [1,0,0,0,0,0|2,0,1]=4 11 B8R0.1 C#CCCC(=O)CCO BB31-2828 [0,1,0,0,0,0|0,0,2]=3 12 B8R0.1 COCCN(C)CCO BB32-1044 [0,1,0,0,0,0|3,0,0]=4 13 B8R0.6 CCCCOC(=O)CN BB31-9514 [0,1,0,0,0,0|1,0,0]=2 14 B8R0.6 CCNCCC(=O)OC BB31-6215 [0,1,0,0,0,0|1,0,0]=2 15 B8R0.8 CCCCC(=O)C(=O)O BB31-4311 [0,1,0,0,0,0|1,0,1]=3 16 B8R0.8 CCCCC(=O)[C@H](C)N BB31-2998 [0,1,0,0,0,0|0,0,0]=1 17 B8R0.9 CCC(=O)NCC(C)C BB32-3399 [0,1,0,0,0,0|1,0,0]=2 18 B8R0.9 CCC(C)CCC(C)=O BB31-3584 [0,1,0,0,0,0|1,0,2]=4 19 B8R0.9 COC(=O)CNC(C)=O BB31-6237 [0,1,0,0,0,0|2,0,1]=4 20 B8R0.19 CC[C@H](O)CC(=O)OC BB31-5331 [0,1,0,0,0,0|1,0,0]=2 21 B8R0.19 COC(=O)N[C@@H](C)CN BB31-0922 [0,1,0,0,0,0|3,0,0]=4 22 B8R1.1 C=CC1CCC(=O)N1 BB31-7031 [0,0,0,1,0,0|1,0,2]=4 23 B8R1.1 COC1=CC(=O)CC1 BB31-5801 [0,0,0,1,0,0|1,0,2]=4 24 B8R1.1 N#CC1CCC(=O)C1 BB32-2063 [0,0,0,1,0,0|1,0,1]=3 25 B8R1.1 N#CC1CNC(=O)C1 BB31-6774 [0,0,0,1,0,0|2,0,1]=4 26 B8R1.1 NCC1CCC(=O)N1 BB31-5970 [0,0,0,1,0,0|2,0,0]=3 27 B8R1.1 NCC1CNC(=O)O1 BB31-3233 [0,0,0,1,0,0|3,0,0]=4 28 B8R1.1 O=C1N[C@@H](CI)CO1 BB31-2803 [0,0,0,1,0,0|3,0,0]=4 29 B8R1.1 O=C1N[C@H](CO)CO1 BB31-1953 [0,0,0,1,0,0|3,0,0]=4 30 B8R1.1 OCC1CCN(C)C1 BB52-8882 [0,0,0,1,0,0|3,0,0]=4 31 B8R1.2 CCC1CCCNC1 BB31-8098 [0,0,0,1,0,0|2,0,1]=4 32 B8R1.2 CC[C@@H]1COCCN1 BB31-8706 [0,0,0,1,0,0|2,0,1]=4 33 B8R1.2 CC[C@@H]1COCCN1 BB32-1053 [0,0,0,1,0,0|2,0,1]=4 34 B8R1.2 ICC1CCCCO1 BB32-2266 [0,0,0,1,0,0|1,0,2]=4 35 B8R1.3 CC1CNC(=O)CO1 BB31-1811 [0,0,0,1,0,0|2,0,0]=3 36 B8R1.3 C[C@H]1CC[C@@H](N)CC1 BB31-5132 [0,0,0,1,0,0|1,0,1]=3 37 B8R1.3 NC1CCC(=O)NC1 BB31-0976 [0,0,0,1,0,0|2,0,0]=3 38 B8R1.3 N[C@@H]1CCC(=O)NC1 BB31-0068 [0,0,0,1,0,0|2,0,0]=3 39 B8R1.3 O=C1CC[C@@H](O)CN1 BB31-0348 [0,0,0,1,0,0|2,0,0]=3 40 B8R1.3 O[C@H]1CC[C@@H](O)CC1 BB31-4868 [0,0,0,1,0,0|1,0,2]=4 41 B8R1.5 CC1COCCC1=O BB31-0779 [0,0,0,1,0,0|1,0,0]=2 42 B8R1.5 CN1CCOCC1=O BB31-4094 [0,0,0,1,0,0|2,0,0]=3 43 B8R1.5 C[C@@H]1CNCCN1C BB31-0645 [0,0,0,1,0,0|3,0,0]=4 44 B8R1.5 C[C@@H]1CNCCN1C BB32-3303 [0,0,0,1,0,0|3,0,0]=4 45 B8R1.5 C[C@H]1CNCCN1C BB32-2670 [0,0,0,1,0,0|3,0,0]=4 46 B8R1.5 NC1CCCCC1=O BB31-7416 [0,0,0,1,0,0|1,0,0]=2 47 B8R1.5 NC1CCCNC1=O BB52-8540 [0,0,0,1,0,0|2,0,0]=3 48 B8R1.5 O=C1CCOCC1Br BB31-5776 [0,0,0,1,0,0|2,0,0]=3 49 B8R1.5 O=C1CCOCC1F BB32-3113 [0,0,0,1,0,0|2,0,0]=3 50 B8R1.5 O=C1NCCCC1Br BB32-1567 [0,0,0,1,0,0|2,0,0]=3 51 B8R1.22 CC1CCCCCN1 BB32-1446 [0,0,0,1,0,0|2,0,1]=4 52 B8R1.22 NC1=NCCCCC1 BB52-7687 [0,0,0,1,0,0|2,0,0]=3 53 B8R1.22 N[C@@H]1CCCCNC1 BB31-1104 [0,0,0,1,0,0|2,0,1]=4 54 B8R1.22 O=C1CCCCNC1 BB32-3316 [0,0,0,1,0,0|1,0,0]=2 55 B8R1.22 O=C1CCCOCC1 BB32-3102 [0,0,0,1,0,0|1,0,0]=2 56 B8R1.22 O=C1CNCCCN1 BB31-5486 [0,0,0,1,0,0|2,0,0]=3 57 B8R1.22 O=C1CNCCCN1 BB31-6324 [0,0,0,1,0,0|2,0,0]=3 58 B8R1.22 OC1CCCNCC1 BB31-0709 [0,0,0,1,0,0|1,0,2]=4 59 B8R1.38 COC(=O)C1COC1 BB31-3226 [0,0,0,1,0,0|2,0,0]=3 60 B8R1.38 O=C(CBr)C1CCC1 BB31-1832 [0,0,0,1,0,0|1,0,0]=2 61 B8R1.38 O=C(CBr)N1CCC1 BB31-6413 [0,0,0,1,0,0|2,0,0]=3 62 B8R1.40 COC(=O)CC1CC1 BB32-1998 [0,0,0,1,0,0|1,0,0]=2 63 B8R1.50 CC1=NNC(=O)C1C BB52-7289 [0,0,0,1,0,0|2,0,1]=4 64 B8R1.50 CN1CCC(=O)C1=O BB32-2163 [0,0,0,1,0,0|2,0,1]=4 65 B5R0.1 CC(=O)CCBr BB31-4479 [2,0,0,0,0,0|1,0,0]=3 66 B5R0.1 COCC(N)=O BB31-3207 [2,0,0,0,0,0|2,0,0]=4 67 B5R0.1 O=C(O)CCF BB32-2513 [2,0,0,0,0,0|2,0,0]=4 68 B5R0.2 C=CCCCI BB31-6966 [2,0,0,0,0,0|1,0,1]=4 69 B5R0.2 C=CCCCN BB31-4446 [2,0,0,0,0,0|1,0,1]=4 70 B5R0.2 CCSCCN BB31-5588 [2,0,0,0,0,0|2,0,0]=4 71 B5R0.2 OCCCCI BB32-2029 [2,0,0,0,0,0|2,0,0]=4 72 B5R0.3 CCC(=O)CN BB31-8248 [2,0,0,0,0,0|1,0,0]=3 73 B7R0.10 COC(=O)C(C)CN BB31-6417 [1,1,0,0,0,0|2,0,0]=4 74 B7R0.10 COC(=O)[C@@H](C)CBr BB31-6195 [1,1,0,0,0,0|2,0,0]=4 75 B7R0.4 N#CCCCC(=O)O BB31-7795 [1,1,0,0,0,0|1,0,1]=4 76 B7R0.4 NC(=O)CCCCO BB31-4574 [1,1,0,0,0,0|1,0,0]=3 77 B7R0.4 O=C([O-])COCCO BB31-2744 [1,1,0,0,0,0|2,0,0]=4 78 B7R0.6 CC(=O)NCC(C)O BB31-7690 [1,1,0,0,0,0|1,0,0]=3 79 B7R0.6 CC(=O)NNC(C)C BB32-2318 [1,1,0,0,0,0|2,0,0]=4 80 B7R0.6 CC(C)CC[N+](=O)[O-] BB32-3570 [1,1,0,0,0,0|2,0,0]=4 81 B7R0.6 CC(N)CCC(=O)O BB31-2419 [1,1,0,0,0,0|1,0,0]=3 82 B7R0.6 CC(O)CCC(=O)[O-] BB31-5329 [1,1,0,0,0,0|1,0,0]=3 83 B7R0.8 CS(=O)(=O)CCCCl BB32-2712 [1,1,0,0,0,0|2,0,0]=4 84 B7R0.8 CS(=O)(=O)CCCN BB31-3020 [1,1,0,0,0,0|2,0,0]=4 85 B7R0.1 CCCNCCOC BB31-6246 [1,1,0,0,0,0|1,0,1]=4 86 B9R0.18 CCCCC(N)CCCC BB31-5984 [0,2,0,0,0,0|1,0,1]=4 87 B9R0.48 CC(C)CNC(=O)CCN BB32-0238 [0,2,0,0,0,0|1,0,0]=3 88 B9R0.48 CCOC(=O)OCC(C)C BB31-5205 [0,2,0,0,0,0|1,0,0]=3 89 B9R0.23 COC(=O)C(=O)CC(C)C BB31-6224 [0,2,0,0,0,0|1,0,1]=4 90 B9R0.23 COC(=O)C(O)CC(C)C BB32-2157 [0,2,0,0,0,0|1,0,0]=3 91 B9R0.27 CCC(=O)C(C)C(=O)OC BB31-3423 [0,2,0,0,0,0|1,0,1]=4 92 B9R0.27 CCC(C)C(N)C(=O)OC BB32-1071 [0,2,0,0,0,0|1,0,0]=3 93 B9R0.27 CCC(C)C(O)C(=O)OC BB31-7708 [0,2,0,0,0,0|1,0,0]=3 94 B9R0.1 C=C(C)CCCC(=O)OC BB32-1876 [0,2,0,0,0,0|1,0,0]=3 95 B9R0.24 CCC(=O)CCC(=O)CC BB31-4562 [0,2,0,0,0,0|0,0,0]=2 96 B9R0.47 CCCCCC(=O)N(C)C BB31-6255 [0,2,0,0,0,0|1,0,0]=3 97 B9R0.3 CC(C)(Br)C(=O)OCCO BB31-4077 [0,2,0,0,0,0|2,0,0]=4 98 B9R0.3 CC(C)(C)C(=O)NCCO BB31-7840 [0,2,0,0,0,0|2,0,0]=4 99 B9R0.3 CC(C)(C)C(=O)SCCO BB31-8023 [0,2,0,0,0,0|2,0,0]=4 100 B9R0.13 CCCC[C@H](NC)C(=O)O BB31-3398 [0,2,0,0,0,0|1,0,1]=4 101 B9R0.42 COC(=O)CC(=O)C(C)Br BB31-4983 [0,2,0,0,0,0|1,0,1]=4 102 B9R0.21 CCC(=O)CNC(C)(C)C BB54-2744 [0,2,0,0,0,0|1,0,0]=3 103 B7R1.1 BrCC1=CCCC1 BB32-3867 [1,0,0,1,0,0|2,0,0]=4 104 B7R1.1 CC[C@@H]1CCCN1 BB32-2574 [1,0,0,1,0,0|1,0,1]=4 105 B7R1.2 C[C@@H]1CCC(=O)N1 BB31-7724 [1,0,0,1,0,0|1,0,0]=3 106 B7R1.2 C[C@H]1CCC(=O)N1 BB31-2966 [1,0,0,1,0,0|1,0,0]=3 107 B7R1.2 N[C@H]1CNC(=O)C1 BB31-3703 [1,0,0,1,0,0|2,0,0]=4 108 B7R1.2 O=C1CC(O)CO1 BB31-5337 [1,0,0,1,0,0|2,0,0]=4 109 B7R1.2 O=C1CCC(O)C1 BB31-4994 [1,0,0,1,0,0|1,0,0]=3 110 B7R1.3 O=C1CNCCO1 BB32-2655 [1,0,0,1,0,0|2,0,0]=4 111 B7R1.3 O=S1CCNCC1 BB32-3985 [1,0,0,1,0,0|2,0,0]=4 112 B7R1.3 S=C1CCCCN1 BB31-1665 [1,0,0,1,0,0|1,1,0]=4 113 B7R1.4 NC1CCNC1=O BB31-0754 [1,0,0,1,0,0|2,0,0]=4 114 B7R1.4 NC1CCOC1=O BB52-6516 [1,0,0,1,0,0|2,0,0]=4 115 B7R1.22 CCC(N)C1CC1 BB31-5288 [1,0,0,1,0,0|1,0,1]=4 116 B7R1.22 CCC(O)C1CC1 BB32-0693 [1,0,0,1,0,0|0,0,2]=4 117 B7R1.12 C[C@@H]1C[C@H]1C(=O)O BB32-3490 [1,0,0,1,0,0|1,0,0]=3 118 B7R1.12 C[C@H]1C[C@@H]1C(=O)O BB32-0696 [1,0,0,1,0,0|1,0,0]=3 119 B7R1.12 O=C(O)[C@@H]1C[C@H]1F BB31-3334 [1,0,0,1,0,0|2,0,0]=4 120 B7R1.18 CC(=O)N1CCC1 BB32-2755 [1,0,0,1,0,0|1,0,0]=3 121 B7R1.18 CC(N)C1CCC1 BB31-5264 [1,0,0,1,0,0|1,0,1]=4 122 B7R1.18 N=C(N)C1CCC1 BB31-6957 [1,0,0,1,0,0|2,0,0]=4 123 B7R1.18 NC(=O)C1CNC1 BB31-1092 [1,0,0,1,0,0|2,0,0]=4 124 B7R1.18 NC(=S)C1CCC1 BB31-2990 [1,0,0,1,0,0|1,1,0]=4 125 B7R1.18 O=C(O)C1COC1 BB31-0382 [1,0,0,1,0,0|2,0,0]=4 126 B9R1.2 CCC1CCCC(=O)C1 BB31-8126 [0,1,0,1,0,0|0,0,0]=2 127 B9R1.2 CCN1CCN[C@H](C)C1 BB32-0558 [0,1,0,1,0,0|2,0,0]=4 128 B9R1.2 NCC1CCNC(=O)C1 BB32-0239 [0,1,0,1,0,0|1,0,0]=3 129 B9R1.2 O=C1CC(CO)CCN1 BB32-2912 [0,1,0,1,0,0|1,0,0]=3 130 B9R1.2 O=C1CCC[C@@H](CO)N1 BB31-1849 [0,1,0,1,0,0|2,0,0]=4 131 B9R1.2 O=C1COCC(CO)N1 BB31-9072 [0,1,0,1,0,0|2,0,0]=4 132 B9R1.7 CCCC1=NNC(=O)C1 BB52-7288 [0,1,0,1,0,0|2,0,0]=4 133 B9R1.7 CCCC1COC(=O)O1 BB31-8496 [0,1,0,1,0,0|1,0,0]=3 134 B9R1.7 CN1CCC(CCO)C1 BB32-2050 [0,1,0,1,0,0|2,0,0]=4 135 B9R1.8 BrCCN1CCCCC1 BB31-5212 [0,1,0,1,0,0|2,0,0]=4 136 B9R1.8 NCCC1CCCCC1 BB31-6120 [0,1,0,1,0,0|1,0,1]=4 137 B9R1.15 CCN1CCNCC1=O BB52-8136 [0,1,0,1,0,0|1,0,0]=3 138 B9R1.15 CN[C@@H]1CCCC[C@H]1O BB31-4371 [0,1,0,1,0,0|0,0,2]=4 139 B9R1.15 COC1=CCCCC1=O BB32-1133 [0,1,0,1,0,0|0,0,2]=4 140 B9R1.15 COC1CCCCC1N BB32-2888 [0,1,0,1,0,0|1,0,1]=4 141 B9R1.15 O=CC1=C(Br)CCCC1 BB32-2004 [0,1,0,1,0,0|1,0,1]=4 142 B9R1.15 O=CC1=C(Cl)CCCC1 BB31-8272 [0,1,0,1,0,0|1,0,1]=4 143 B9R1.33 NCCN1CCCC1=O BB52-8355 [0,1,0,1,0,0|2,0,0]=4 144 B9R1.33 O=C1NCCN1CCCl BB31-8092 [0,1,0,1,0,0|2,0,0]=4 145 B9R1.48 O=C1CCCNC(=O)C1 BB31-4559 [0,1,0,1,0,0|1,0,1]=4 146 B9R1.69 CN1CCC(=O)CC1=O BB31-0803 [0,1,0,1,0,0|1,0,1]=4 147 B9R1.69 CN1CCC(N)CC1=O BB31-2065 [0,1,0,1,0,0|1,0,0]=3 148 B9R1.75 CCOC(=O)C=C1CC1 BB31-6895 [0,1,0,1,0,0|0,0,2]=4 149 B9R1.3 C[C@@H]1NCCN(C)C1=O BB31-9836 [0,1,0,1,0,0|2,0,0]=4 150 B9R1.3 C[C@H]1NCCN(C)C1=O BB31-9831 [0,1,0,1,0,0|2,0,0]=4 151 B9R1.11 O=C(CBr)N1CCCC1 BB53-1057 [0,1,0,1,0,0|1,0,0]=3 152 B9R1.82 COC(=O)C1CC(Cl)C1 BB31-3084 [0,1,0,1,0,0|1,0,0]=3 153 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 BB32-3300 [0,1,0,1,0,0|1,0,0]=3 154 B9R1.101 COC(=O)[C@@H](N)C1CC1 BB31-2388 [0,1,0,1,0,0|1,0,0]=3 155 B9R1.132 CN1C(=O)CCC1CO BB31-5269 [0,1,0,1,0,0|1,0,0]=3 156 B9R1.186 COC(=O)C1(C)CCC1 BB31-6996 [0,1,0,1,0,0|1,0,0]=3 157 B9R1.1 CCN1CCC(N)CC1 BB32-1966 [0,1,0,1,0,0|1,0,1]=4 158 B9R1.1 CN1CCC(CN)CC1 BB31-9028 [0,1,0,1,0,0|2,0,0]=4 159 B9R1.1 CNC1CCC(N)CC1 BB32-2136 [0,1,0,1,0,0|1,0,1]=4 160 B9R1.1 CON1CCC(=O)CC1 BB31-8752 [0,1,0,1,0,0|1,0,0]=3 161 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 BB32-3392 [0,1,0,1,0,0|1,0,1]=4 162 B9R1.1 CO[C@H]1CC[C@H](O)CC1 BB32-1070 [0,1,0,1,0,0|0,0,2]=4 163 B9R1.1 NCC1CCC(=O)NC1 BB32-1698 [0,1,0,1,0,0|1,0,0]=3 164 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 BB31-0982 [0,1,0,1,0,0|0,0,2]=4 165 B9R1.1 NC[C@H]1CC[C@H](O)CC1 BB31-0289 [0,1,0,1,0,0|0,0,2]=4 166 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 BB32-3486 [0,1,0,1,0,0|1,0,1]=4 167 B9R1.1 O=C1CCC(CBr)CC1 BB31-3860 [0,1,0,1,0,0|0,0,0]=2 168 B9R1.1 O=C1CO[C@H](CO)CN1 BB31-8603 [0,1,0,1,0,0|2,0,0]=4 169 B9R1.1 O=CC1CCC(=O)CC1 BB31-5251 [0,1,0,1,0,0|0,0,1]=3 170 B9R1.21 OCC1CCN(CC)C1 BB52-8839 [0,1,0,1,0,0|2,0,0]=4 171 B9R1.79 COC(=O)CC1COC1 BB31-2235 [0,1,0,1,0,0|1,0,0]=3 172 B9R1.35 CC(=O)N1CCC(=O)C1 BB32-2049 [0,1,0,1,0,0|1,0,1]=4 173 B9R1.35 CC(C)[C@@H]1CCC(=O)N1 BB31-2463 [0,1,0,1,0,0|1,0,0]=3 174 B9R1.40 CC1(C)CCCNC1=O BB32-1436 [0,1,0,1,0,0|1,0,0]=3 175 B9R1.40 CC1(C)CNCCC1=O BB31-5743 [0,1,0,1,0,0|1,0,0]=3 176 B9R1.106 CC1(C)C(=O)CCC1=O BB32-1969 [0,1,0,1,0,0|1,0,1]=4 177 B9R1.110 O=C(O)C(=O)C1CCC1 BB31-7654 [0,1,0,1,0,0|1,0,1]=4 178 B9R1.10 CC1(C)CCC(N)CC1 BB31-3849 [0,1,0,1,0,0|1,0,1]=4 179 B9R1.10 CC1(C)CCC(N)CC1 BB32-1029 [0,1,0,1,0,0|1,0,1]=4 180 B9R1.10 C[C@]1(O)CC[C@@H](N)CC1 BB31-3648 [0,1,0,1,0,0|1,0,1]=4 181 B9R1.10 C[C@]1(O)CC[C@@H](O)CC1 BB31-1102 [0,1,0,1,0,0|0,0,2]=4 182 B9R1.10 C[C@]1(O)CC[C@H](N)CC1 BB31-3647 [0,1,0,1,0,0|1,0,1]=4 183 B9R1.133 CNC1CCS(=O)(=O)C1 BB32-2260 [0,1,0,1,0,0|2,0,0]=4 184 B9R2.39 O=C1NC2CCC1C2 BB31-4286 [0,0,0,2,0,0|1,0,0]=3 185 B9R2.68 C1CC2CCC(C1)N2 BB31-4852 [0,0,0,2,0,0|1,0,1]=4 186 B9R2.49 C1CC2CCC1CN2 BB32-3450 [0,0,0,2,0,0|1,0,1]=4