0 B5R0.3 C=C[C@H](N)CO BB32-0951 [0,0,0,0,0,0|2,0,2]=4 1 B5R0.3 CC(CO)CBr BB31-7772 [0,0,0,0,0,0|2,0,0]=2 2 B5R0.3 CCC(=O)CN BB31-8248 [0,0,0,0,0,0|1,0,1]=2 3 B5R0.3 CO[C@@H](C)CO BB31-0453 [0,0,0,0,0,0|2,0,0]=2 4 B5R0.3 NCC(Br)CBr BB31-7157 [0,0,0,0,0,0|2,0,0]=2 5 B5R0.3 NCC(O)CCl BB31-4889 [0,0,0,0,0,0|2,0,0]=2 6 B5R0.3 O=C[C@H](O)CO BB31-6122 [0,0,0,0,0,0|3,0,1]=4 7 B4R0.1 C#C[C@H](C)N BB31-2680 [1,0,0,0,0,0|0,0,2]=3 8 B4R0.1 CC(N)C#N BB31-5240 [1,0,0,0,0,0|1,0,1]=3 9 B4R0.1 OCC(Cl)Cl BB31-5600 [1,0,0,0,0,0|3,0,0]=4 10 B4R0.2 C=CCCI BB31-6880 [1,0,0,0,0,0|1,0,2]=4 11 B4R0.2 NCCON BB32-1546 [1,0,0,0,0,0|2,0,0]=3 12 B6R0.1 CCC(O)CC#N BB31-2014 [0,1,0,0,0,0|1,0,1]=3 13 B6R0.1 CCCC(=O)CCl BB31-4027 [0,1,0,0,0,0|2,0,1]=4 14 B6R0.1 CN(C=O)CCO BB31-3078 [0,1,0,0,0,0|2,0,1]=4 15 B6R0.1 C[C@@H](CO)CCN BB31-5417 [0,1,0,0,0,0|1,0,0]=2 16 B6R0.1 NNC(=O)CCO BB31-4269 [0,1,0,0,0,0|2,0,1]=4 17 B6R0.1 OCC[C@H](O)CCl BB31-2429 [0,1,0,0,0,0|2,0,0]=3 18 B6R0.3 CC[C@@H](C)C(=O)O BB31-4656 [0,1,0,0,0,0|1,0,1]=3 19 B6R0.3 CC[C@@H](O)C(=O)O BB31-3920 [0,1,0,0,0,0|2,0,1]=4 20 B6R0.3 NC[C@@H](N)C(=O)O BB31-4003 [0,1,0,0,0,0|2,0,1]=4 21 B6R0.8 CC(C)(CBr)CBr BB32-2264 [0,1,0,0,0,0|2,0,0]=3 22 B6R0.9 CCC(C#N)CC BB32-3543 [0,1,0,0,0,0|0,0,2]=3 23 B6R0.9 CCC(CC)NC BB31-6271 [0,1,0,0,0,0|1,0,0]=2 24 B6R0.9 CCC(CC)NN BB31-5111 [0,1,0,0,0,0|1,0,0]=2 25 B6R1.2 BrC1CCSC1 BB52-7755 [0,0,0,1,0,0|2,0,0]=3 26 B6R1.2 C[C@@H]1CCNC1 BB31-4239 [0,0,0,1,0,0|0,0,0]=1 27 B6R1.2 C[C@H]1CCNC1 BB31-5082 [0,0,0,1,0,0|0,0,0]=1 28 B6R1.2 Cl[C@H]1CCNC1 BB31-9471 [0,0,0,1,0,0|1,0,0]=2 29 B6R1.2 NC1CCSC1 BB52-7752 [0,0,0,1,0,0|2,0,0]=3 30 B6R1.2 OC1CCSC1 BB52-7751 [0,0,0,1,0,0|2,0,0]=3 31 B6R1.2 O[C@@H]1CNOC1 BB31-5422 [0,0,0,1,0,0|2,0,0]=3 32 B6R1.6 BrCC1COC1 BB31-2069 [0,0,0,1,0,0|2,0,0]=3 33 B6R1.6 CNC1CCC1 BB31-5108 [0,0,0,1,0,0|2,0,0]=3 34 B6R1.6 COC1CNC1 BB51-2847 [0,0,0,1,0,0|1,0,0]=2 35 B6R1.6 CSC1CNC1 BB31-2729 [0,0,0,1,0,0|1,0,0]=2 36 B6R1.6 N#CC1COC1 BB31-5311 [0,0,0,1,0,0|1,0,2]=4 37 B6R1.6 NNC1CCC1 BB31-0660 [0,0,0,1,0,0|1,0,0]=2 38 B6R1.6 O=CC1COC1 BB31-1651 [0,0,0,1,0,0|2,0,1]=4 39 B6R1.6 OC[C@@H]1CCN1 BB31-7982 [0,0,0,1,0,0|2,0,0]=3 40 B6R1.6 OC[C@H]1CCN1 BB31-4144 [0,0,0,1,0,0|2,0,0]=3 41 B6R1.7 C#CC1(N)CC1 BB31-1600 [0,0,0,1,0,0|2,0,1]=4 42 B6R1.7 CC1(CN)CC1 BB31-1478 [0,0,0,1,0,0|0,0,0]=1 43 B6R1.7 CCC1(N)CC1 BB31-3439 [0,0,0,1,0,0|2,0,0]=3 44 B6R1.7 NC1(CF)CC1 BB31-5308 [0,0,0,1,0,0|2,0,0]=3 45 B6R1.7 OCC1(Br)CC1 BB32-2844 [0,0,0,1,0,0|2,0,0]=3 46 B6R1.7 OCC1(F)CC1 BB32-0673 [0,0,0,1,0,0|2,0,0]=3 47 B5R0.1 CC(=O)CCBr BB31-4479 [1,1,0,0,0,0|1,0,1]=4 48 B5R0.1 CC(O)CCBr BB32-3029 [1,1,0,0,0,0|1,0,0]=3 49 B5R0.1 CNCC(F)F BB31-9778 [1,1,0,0,0,0|2,0,0]=4 50 B5R0.1 COCC(C)Br BB31-8127 [1,1,0,0,0,0|1,0,0]=3 51 B5R0.1 COCC(N)=O BB31-3207 [1,1,0,0,0,0|1,0,1]=4 52 B5R0.1 C[C@H](N)CC#N BB31-5263 [1,1,0,0,0,0|0,0,1]=3 53 B5R0.4 CC(C)(F)CN BB31-5316 [1,1,0,0,0,0|0,0,0]=2 54 B5R0.2 C#CCCCBr BB31-4992 [1,1,0,0,0,0|1,0,1]=4 55 B5R0.2 C=CCCCI BB31-6966 [1,1,0,0,0,0|1,0,1]=4 56 B5R0.2 C=CCCCN BB31-4446 [1,1,0,0,0,0|0,0,1]=3 57 B5R0.2 CCSCCN BB31-5588 [1,1,0,0,0,0|0,0,0]=2 58 B5R0.2 N#CCCCN BB32-0548 [1,1,0,0,0,0|0,0,1]=3 59 B5R0.2 OCCCCI BB32-2029 [1,1,0,0,0,0|1,0,0]=3 60 B7R0.2 CCC(N)CC(=O)O BB31-5235 [0,2,0,0,0,0|2,0,0]=4 61 B7R0.2 CC[C@H](N)CC(=O)O BB31-2771 [0,2,0,0,0,0|2,0,0]=4 62 B7R0.5 CC(C)C(C)CCO BB31-7531 [0,2,0,0,0,0|1,0,0]=3 63 B7R0.5 CC(C)C(N)CCO BB31-5763 [0,2,0,0,0,0|2,0,0]=4 64 B7R0.5 CC(C)N(C)CCO BB31-4522 [0,2,0,0,0,0|2,0,0]=4 65 B7R0.5 CC(CCO)C(N)=O BB31-7816 [0,2,0,0,0,0|0,0,1]=3 66 B7R0.5 CCOC(O)C(F)F BB31-2858 [0,2,0,0,0,0|2,0,0]=4 67 B7R0.10 COC(=O)C(C)CN BB31-6417 [0,2,0,0,0,0|0,0,1]=3 68 B7R0.10 COC(=O)[C@@H](C)CBr BB31-6195 [0,2,0,0,0,0|1,0,1]=4 69 B7R0.10 O[C@H](CCl)[C@@H](O)CCl BB31-6193 [0,2,0,0,0,0|2,0,0]=4 70 B7R0.11 CC(C)(CO)CCO BB31-8012 [0,2,0,0,0,0|1,0,0]=3 71 B7R0.13 CC(=O)C(C)(C)CO BB32-0806 [0,2,0,0,0,0|1,0,1]=4 72 B7R0.13 CC(C)(CN)C(=O)O BB31-3976 [0,2,0,0,0,0|1,0,1]=4 73 B7R0.13 CC(C)(CN)C(=O)O BB31-5761 [0,2,0,0,0,0|1,0,1]=4 74 B7R0.14 CC(C)(O)[C@H](F)CN BB32-0764 [0,2,0,0,0,0|1,0,0]=3 75 B7R0.14 CC(CO)C(F)(F)F BB31-4963 [0,2,0,0,0,0|2,0,0]=4 76 B7R0.15 NC[C@H](CO)C(=O)O BB31-2226 [0,2,0,0,0,0|1,0,1]=4 77 B7R0.16 CC(C)C(C)C(=O)O BB31-8342 [0,2,0,0,0,0|1,0,1]=4 78 B7R0.16 CC(C)C(N)C(C)C BB32-2069 [0,2,0,0,0,0|2,0,0]=4 79 B5R1.2 BrC1CNC1 BB31-5774 [1,0,0,1,0,0|1,0,0]=3 80 B5R1.2 CC1CCN1 BB31-0642 [1,0,0,1,0,0|0,0,0]=2 81 B5R1.2 ClC1CNC1 BB31-7993 [1,0,0,1,0,0|1,0,0]=3 82 B5R1.2 NC1CSC1 BB31-1853 [1,0,0,1,0,0|1,0,0]=3 83 B5R1.2 SC1CNC1 BB31-3722 [1,0,0,1,0,0|1,0,0]=3 84 B5R1.4 N[C@@H]1C[C@@H]1F BB31-2658 [1,0,0,1,0,0|1,0,0]=3 85 B5R1.4 N[C@@H]1C[C@H]1N BB32-1814 [1,0,0,1,0,0|1,0,0]=3 86 B5R1.4 N[C@H]1C[C@H]1N BB32-3586 [1,0,0,1,0,0|1,0,0]=3 87 B5R1.1 C1CNNC1 BB31-6290 [1,0,0,1,0,0|1,0,0]=3 88 B5R1.1 C1CNOC1 BB31-7828 [1,0,0,1,0,0|1,0,0]=3 89 B7R1.1 BrCC1=CCCC1 BB32-3867 [0,1,0,1,0,0|1,0,1]=4 90 B7R1.1 C#CC1CCCN1 BB31-1749 [0,1,0,1,0,0|1,0,1]=4 91 B7R1.1 CC[C@@H]1CCCN1 BB32-2574 [0,1,0,1,0,0|1,0,0]=3 92 B7R1.1 CN[C@@H]1CCOC1 BB31-1876 [0,1,0,1,0,0|1,0,0]=3 93 B7R1.1 CN[C@H]1CCOC1 BB31-1877 [0,1,0,1,0,0|1,0,0]=3 94 B7R1.1 CO[C@@H]1CCNC1 BB31-1407 [0,1,0,1,0,0|0,0,0]=2 95 B7R1.1 CO[C@H]1CCNC1 BB31-1406 [0,1,0,1,0,0|0,0,0]=2 96 B7R1.1 FC[C@@H]1CCCN1 BB31-6796 [0,1,0,1,0,0|1,0,0]=3 97 B7R1.1 FC[C@@H]1CCNC1 BB31-2793 [0,1,0,1,0,0|0,0,0]=2 98 B7R1.1 N#C[C@@H]1CCCN1 BB31-4661 [0,1,0,1,0,0|0,0,2]=4 99 B7R1.1 N#C[C@H]1CCCN1 BB31-7033 [0,1,0,1,0,0|0,0,2]=4 100 B7R1.1 N#C[C@H]1CCNC1 BB31-0628 [0,1,0,1,0,0|0,0,1]=3 101 B7R1.1 NC[C@@H]1CCOC1 BB31-8725 [0,1,0,1,0,0|0,0,0]=2 102 B7R1.1 OCC1CCNC1 BB52-8382 [0,1,0,1,0,0|0,0,0]=2 103 B7R1.1 OC[C@@H]1CCOC1 BB31-1047 [0,1,0,1,0,0|1,0,0]=3 104 B7R1.2 CN1CC[C@@H](N)C1 BB31-5227 [0,1,0,1,0,0|1,0,0]=3 105 B7R1.2 C[C@@H]1CCC(=O)N1 BB31-7724 [0,1,0,1,0,0|1,0,1]=4 106 B7R1.2 C[C@H]1CCC(=O)N1 BB31-2966 [0,1,0,1,0,0|1,0,1]=4 107 B7R1.2 NC1CCC(O)C1 BB31-2061 [0,1,0,1,0,0|1,0,0]=3 108 B7R1.2 N[C@@H]1CC[C@@H](N)C1 BB32-0743 [0,1,0,1,0,0|1,0,0]=3 109 B7R1.2 N[C@@H]1CC[C@@H](O)C1 BB31-1056 [0,1,0,1,0,0|1,0,0]=3 110 B7R1.2 N[C@H]1CC[C@H](O)C1 BB31-4650 [0,1,0,1,0,0|1,0,0]=3 111 B7R1.2 N[C@H]1CC[C@H](O)C1 BB31-5100 [0,1,0,1,0,0|1,0,0]=3 112 B7R1.2 N[C@H]1CNC(=O)C1 BB31-3703 [0,1,0,1,0,0|1,0,1]=4 113 B7R1.2 O=C1CCC(O)C1 BB31-4994 [0,1,0,1,0,0|2,0,0]=4 114 B7R1.3 CC1=CCNCC1 BB31-4858 [0,1,0,1,0,0|0,0,1]=3 115 B7R1.3 CN1CC=CCC1 BB31-7198 [0,1,0,1,0,0|2,0,0]=4 116 B7R1.3 C[C@H]1CCCNC1 BB32-0441 [0,1,0,1,0,0|0,0,0]=2 117 B7R1.3 C[C@H]1CNCCO1 BB31-0582 [0,1,0,1,0,0|0,0,0]=2 118 B7R1.3 IC1CCNCC1 BB32-0018 [0,1,0,1,0,0|1,0,0]=3 119 B7R1.3 N[C@@H]1CCCOC1 BB31-1896 [0,1,0,1,0,0|2,0,0]=4 120 B7R1.3 N[C@H]1CCCOC1 BB31-1067 [0,1,0,1,0,0|2,0,0]=4 121 B7R1.3 O=C1CNCCO1 BB32-2655 [0,1,0,1,0,0|1,0,1]=4 122 B7R1.3 O=S1CCNCC1 BB32-3985 [0,1,0,1,0,0|2,0,0]=4 123 B7R1.3 OC1CC=CCC1 BB31-4823 [0,1,0,1,0,0|2,0,0]=4 124 B7R1.3 O[C@@H]1CCCOC1 BB31-0149 [0,1,0,1,0,0|2,0,0]=4 125 B7R1.3 SC1CCCNC1 BB31-1279 [0,1,0,1,0,0|1,0,0]=3 126 B7R1.4 Br[C@@H]1CCC[C@H]1Br BB31-0304 [0,1,0,1,0,0|2,0,0]=4 127 B7R1.4 NC1CCNC1=O BB31-0754 [0,1,0,1,0,0|1,0,1]=4 128 B7R1.4 NC1CCOC1=O BB52-6516 [0,1,0,1,0,0|1,0,1]=4 129 B7R1.4 N[C@@H]1CNC[C@H]1F BB31-1134 [0,1,0,1,0,0|1,0,0]=3 130 B7R1.4 N[C@@H]1COC[C@@H]1O BB32-0460 [0,1,0,1,0,0|1,0,0]=3 131 B7R1.4 N[C@@H]1COC[C@H]1O BB31-5283 [0,1,0,1,0,0|1,0,0]=3 132 B7R1.4 N[C@@H]1COC[C@H]1O BB32-1570 [0,1,0,1,0,0|1,0,0]=3 133 B7R1.4 N[C@H]1CCC[C@H]1N BB31-4642 [0,1,0,1,0,0|1,0,0]=3 134 B7R1.4 N[C@H]1COC[C@@H]1N BB32-2872 [0,1,0,1,0,0|1,0,0]=3 135 B7R1.4 N[C@H]1COC[C@@H]1O BB31-3986 [0,1,0,1,0,0|1,0,0]=3 136 B7R1.4 N[C@H]1COC[C@@H]1O BB32-1041 [0,1,0,1,0,0|1,0,0]=3 137 B7R1.4 O[C@H]1CNC[C@@H]1F BB31-3989 [0,1,0,1,0,0|1,0,0]=3 138 B7R1.6 C=CCC1CNC1 BB31-3197 [0,1,0,1,0,0|0,0,1]=3 139 B7R1.6 CCNC1COC1 BB32-0308 [0,1,0,1,0,0|1,0,0]=3 140 B7R1.6 CCOC1CNC1 BB32-2240 [0,1,0,1,0,0|0,0,0]=2 141 B7R1.6 CNCC1COC1 BB31-2533 [0,1,0,1,0,0|1,0,0]=3 142 B7R1.6 COCC1CNC1 BB31-0895 [0,1,0,1,0,0|0,0,0]=2 143 B7R1.6 OCCC1COC1 BB31-4347 [0,1,0,1,0,0|1,0,0]=3 144 B7R1.6 OCCN1CCC1 BB31-7265 [0,1,0,1,0,0|2,0,0]=4 145 B7R1.9 OC[C@H]1C[C@H]1CO BB31-4235 [0,1,0,1,0,0|1,0,0]=3 146 B7R1.10 CCN1CC(O)C1 BB31-5522 [0,1,0,1,0,0|2,0,0]=4 147 B7R1.10 CN1CC(CN)C1 BB32-0572 [0,1,0,1,0,0|0,0,0]=2 148 B7R1.10 CN1CC(CO)C1 BB31-2891 [0,1,0,1,0,0|1,0,0]=3 149 B7R1.10 CNC1CC(O)C1 BB32-0317 [0,1,0,1,0,0|2,0,0]=4 150 B7R1.10 CN[C@H]1C[C@@H](O)C1 BB31-2520 [0,1,0,1,0,0|2,0,0]=4 151 B7R1.10 CN[C@H]1C[C@H](O)C1 BB31-2532 [0,1,0,1,0,0|2,0,0]=4 152 B7R1.10 COC1CC(=O)C1 BB31-4629 [0,1,0,1,0,0|2,0,0]=4 153 B7R1.10 CO[C@H]1C[C@H](N)C1 BB31-2519 [0,1,0,1,0,0|1,0,0]=3 154 B7R1.10 N#C[C@H]1C[C@@H](N)C1 BB31-3230 [0,1,0,1,0,0|0,0,2]=4 155 B7R1.10 N#C[C@H]1C[C@@H](O)C1 BB31-8519 [0,1,0,1,0,0|0,0,2]=4 156 B7R1.10 N#C[C@H]1C[C@H](O)C1 BB31-6405 [0,1,0,1,0,0|0,0,2]=4 157 B7R1.10 NCC1CC(=O)C1 BB31-2692 [0,1,0,1,0,0|0,0,1]=3 158 B7R1.10 NCC1CC(O)C1 BB58-2198 [0,1,0,1,0,0|0,0,0]=2 159 B7R1.10 NC[C@H]1C[C@@H](O)C1 BB31-2482 [0,1,0,1,0,0|0,0,0]=2 160 B7R1.10 N[C@H]1C[C@@H](CO)C1 BB31-9750 [0,1,0,1,0,0|1,0,0]=3 161 B7R1.10 O=C1CC(CBr)C1 BB32-2845 [0,1,0,1,0,0|1,0,1]=4 162 B7R1.10 O=C1CC(CCl)C1 BB31-3444 [0,1,0,1,0,0|1,0,1]=4 163 B7R1.21 CC1(CCO)N=N1 BB31-4324 [0,1,0,1,0,0|1,0,1]=4 164 B7R1.22 CCC(N)C1CC1 BB31-5288 [0,1,0,1,0,0|2,0,0]=4 165 B7R1.22 CCC(O)C1CC1 BB32-0693 [0,1,0,1,0,0|2,0,0]=4 166 B7R1.25 C#CC1(O)CCC1 BB31-7560 [0,1,0,1,0,0|1,0,1]=4 167 B7R1.25 CC1(C#N)COC1 BB32-0857 [0,1,0,1,0,0|0,0,2]=4 168 B7R1.25 CC1(CO)CCO1 BB31-4926 [0,1,0,1,0,0|1,0,0]=3 169 B7R1.25 CC1(CO)CNC1 BB31-2564 [0,1,0,1,0,0|1,0,0]=3 170 B7R1.25 CCC1(N)COC1 BB31-2107 [0,1,0,1,0,0|1,0,0]=3 171 B7R1.25 NC1(CO)CCC1 BB31-3490 [0,1,0,1,0,0|1,0,0]=3 172 B7R1.25 NC1(CO)COC1 BB31-1654 [0,1,0,1,0,0|2,0,0]=4 173 B7R1.25 NCC1(O)CCC1 BB31-3491 [0,1,0,1,0,0|0,0,0]=2 174 B7R1.25 NCC1(O)COC1 BB31-1653 [0,1,0,1,0,0|1,0,0]=3 175 B7R1.12 C[C@@H]1C[C@H]1C(=O)O BB32-3490 [0,1,0,1,0,0|1,0,1]=4 176 B7R1.12 C[C@H]1C[C@@H]1C(=O)O BB32-0696 [0,1,0,1,0,0|1,0,1]=4 177 B7R1.18 CC(N)C1CCC1 BB31-5264 [0,1,0,1,0,0|0,0,0]=2 178 B7R1.18 CC(O)C1CNC1 BB31-4088 [0,1,0,1,0,0|0,0,0]=2 179 B7R1.18 FC(F)C1CNC1 BB32-0232 [0,1,0,1,0,0|1,0,0]=3 180 B7R1.18 N=C(N)C1CCC1 BB31-6957 [0,1,0,1,0,0|0,0,1]=3 181 B7R1.18 NC(=O)C1CNC1 BB31-1092 [0,1,0,1,0,0|1,0,1]=4 182 B7R1.18 NC(=S)C1CCC1 BB31-2990 [0,1,0,1,0,0|0,0,1]=3 183 B7R1.19 CC1(C(N)=O)CC1 BB31-3052 [0,1,0,1,0,0|0,0,1]=3 184 B7R1.14 CC1(C)CCCN1 BB52-8585 [0,1,0,1,0,0|2,0,0]=4 185 B7R1.14 CC1(C)CCNC1 BB31-5023 [0,1,0,1,0,0|0,0,0]=2 186 B7R1.14 CC1(C)COCN1 BB31-4898 [0,1,0,1,0,0|2,0,0]=4 187 B7R1.14 FC1(F)CCNC1 BB31-8014 [0,1,0,1,0,0|1,0,0]=3 188 B7R1.29 N#CC1(CN)CC1 BB31-9192 [0,1,0,1,0,0|0,0,1]=3 189 B7R2.11 C1NC2CC1C2 BB31-5093 [0,0,0,2,0,0|0,0,0]=2