0 B4R0.1 C=C(Br)CBr SBB061691 [0,0,0,0,0,0|3,0,0]=3 1 B4R0.1 CC(Br)CBr SBB060202 [0,0,0,0,0,0|3,0,1]=4 2 B4R0.1 CC(Br)CCl SBB061477 [0,0,0,0,0,0|3,0,1]=4 3 B4R0.1 CC(C)CBr SBB059932 [0,0,0,0,0,0|3,0,1]=4 4 B4R0.1 CC(Cl)CCl SBB059979 [0,0,0,0,0,0|3,0,1]=4 5 B4R0.1 CCC(C)Br SBB059931 [0,0,0,0,0,0|2,0,1]=3 6 B4R0.1 CCN(C)N SBB107453 [0,0,0,0,0,0|3,0,0]=3 7 B4R0.1 COC(=N)N SBB067236 [0,0,0,0,0,0|3,0,0]=3 8 B4R0.1 CSC(=N)N SBB080624 [0,0,0,0,0,0|3,0,0]=3 9 B4R0.1 CSC(=N)N SBB095512 [0,0,0,0,0,0|3,0,0]=3 10 B4R0.1 ClC(Br)CBr SBB059976 [0,0,0,0,0,0|3,0,1]=4 11 B4R0.1 N=C(N)CCl SBB056491 [0,0,0,0,0,0|3,0,0]=3 12 B4R0.1 NCC(=O)O SBB071447 [0,0,0,0,0,0|1,0,0]=1 13 B4R0.1 NCC(=O)[O-] SBB116671 [0,0,0,0,0,0|1,0,1]=2 14 B4R0.1 NCC(F)F SBB009831 [0,0,0,0,0,0|3,0,1]=4 15 B4R0.1 NNC(N)=S SBB040860 [0,0,0,0,0,0|3,1,0]=4 16 B4R0.1 O=C(Br)CBr SBB040828 [0,0,0,0,0,0|2,0,0]=2 17 B4R0.1 O=C(Cl)CBr SBB051682 [0,0,0,0,0,0|2,0,0]=2 18 B4R0.1 O=C(Cl)CCl SBB040859 [0,0,0,0,0,0|2,0,0]=2 19 B4R0.1 O=C(O)CBr SBB053569 [0,0,0,0,0,0|1,0,0]=1 20 B4R0.1 OCC(F)F SBB021966 [0,0,0,0,0,0|3,0,1]=4 21 B4R0.1 [NH2+]=C(N)SC SBB060409 [0,0,0,0,0,0|3,0,0]=3 22 B4R0.1 [NH3+]NC(=N)N SBB059784 [0,0,0,0,0,0|4,0,0]=4 23 B4R0.1 [NH3+]NC(N)=O SBB060865 [0,0,0,0,0,0|3,0,0]=3 24 B3R0.1 BrCCBr SBB040806 [1,0,0,0,0,0|2,0,1]=4 25 B3R0.1 C=CCBr SBB059929 [1,0,0,0,0,0|2,0,0]=3 26 B3R0.1 CCCBr SBB040931 [1,0,0,0,0,0|1,0,1]=3 27 B3R0.1 C\C=C\Cl SBB059896 [1,0,0,0,0,0|1,0,1]=3 28 B3R0.1 ClCCCl SBB040805 [1,0,0,0,0,0|2,0,1]=4 29 B3R0.1 N#CCBr SBB066988 [1,0,0,0,0,0|2,0,1]=4 30 B3R0.1 N#CCN SBB065784 [1,0,0,0,0,0|2,0,1]=4 31 B3R0.1 NCCBr SBB005857 [1,0,0,0,0,0|2,0,1]=4 32 B3R0.1 NCCCl SBB005775 [1,0,0,0,0,0|2,0,1]=4 33 B3R0.1 OCCBr SBB058668 [1,0,0,0,0,0|1,0,1]=3 34 B3R0.1 [NH3+]CCBr SBB060242 [1,0,0,0,0,0|2,0,1]=4 35 B3R0.2 CC(C)Br SBB060452 [1,0,0,0,0,0|2,0,1]=4 36 B3R0.2 N=C(N)N SBB065761 [1,0,0,0,0,0|3,0,0]=4 37 B3R0.2 NC(N)=O SBB008449 [1,0,0,0,0,0|2,0,0]=3 38 B5R0.1 C#CCC(=O)O SBB116169 [0,1,0,0,0,0|0,0,1]=2 39 B5R0.1 CC(=O)CC#N SBB014113 [0,1,0,0,0,0|1,0,1]=3 40 B5R0.1 CC(=O)N=S=O SBB059583 [0,1,0,0,0,0|3,0,0]=4 41 B5R0.1 CC(C)=CCBr SBB061690 [0,1,0,0,0,0|2,0,1]=4 42 B5R0.1 CC(C)CCBr SBB061181 [0,1,0,0,0,0|2,0,1]=4 43 B5R0.1 CC(C)CCO SBB060162 [0,1,0,0,0,0|2,0,1]=4 44 B5R0.1 CCCC(=O)Cl SBB040624 [0,1,0,0,0,0|1,0,0]=2 45 B5R0.1 CCOC(=O)Cl SBB040861 [0,1,0,0,0,0|1,0,0]=2 46 B5R0.1 CN(C)CCBr SBB073020 [0,1,0,0,0,0|3,0,0]=4 47 B5R0.1 CN(C)CCN SBB007533 [0,1,0,0,0,0|3,0,0]=4 48 B5R0.1 COCC(=O)O SBB061376 [0,1,0,0,0,0|0,0,0]=1 49 B5R0.1 CS(=O)CCN SBB050811 [0,1,0,0,0,0|2,0,0]=3 50 B5R0.1 CSCC(=O)O SBB053570 [0,1,0,0,0,0|0,0,0]=1 51 B5R0.1 C\C(Cl)=C\CN SBB301293 [0,1,0,0,0,0|2,0,1]=4 52 B5R0.1 N#CCC(N)=O SBB007540 [0,1,0,0,0,0|1,0,1]=3 53 B5R0.1 N#CCC(N)=S SBB015115 [0,1,0,0,0,0|1,1,1]=4 54 B5R0.1 O=C(O)CCBr SBB065770 [0,1,0,0,0,0|0,0,0]=1 55 B5R0.1 O=C(O)CCCl SBB069140 [0,1,0,0,0,0|0,0,0]=1 56 B5R0.1 [NH+](C)(C)CCCl SBB057087 [0,1,0,0,0,0|3,0,0]=4 57 B5R0.3 C#CC(=O)OC SBB049642 [0,1,0,0,0,0|0,0,2]=3 58 B5R0.3 C=C(CCl)CCl SBB061694 [0,1,0,0,0,0|3,0,0]=4 59 B5R0.3 C=CC(O)CBr SBB007652 [0,1,0,0,0,0|2,0,1]=4 60 B5R0.3 CCC(=O)NN SBB021112 [0,1,0,0,0,0|1,0,0]=2 61 B5R0.3 CCC(C)CBr SBB007669 [0,1,0,0,0,0|2,0,1]=4 62 B5R0.3 CCC(Cl)CCl SBB060453 [0,1,0,0,0,0|2,0,1]=4 63 B5R0.3 CCC(N)CC SBB000050 [0,1,0,0,0,0|2,0,1]=4 64 B5R0.3 CCC(N)CC SBB071911 [0,1,0,0,0,0|2,0,1]=4 65 B5R0.3 CC\C(N)=N\O SBB024198 [0,1,0,0,0,0|1,0,0]=2 66 B5R0.3 CNC(=N)NN SBB056467 [0,1,0,0,0,0|3,0,0]=4 67 B5R0.3 CNC(=O)CBr SBB080576 [0,1,0,0,0,0|2,0,0]=3 68 B5R0.3 CNC(=O)CCl SBB049936 [0,1,0,0,0,0|2,0,0]=3 69 B5R0.3 CNC(=S)NC SBB060411 [0,1,0,0,0,0|2,1,0]=4 70 B5R0.3 CNC(=S)NN SBB028184 [0,1,0,0,0,0|2,1,0]=4 71 B5R0.3 COC(=O)CBr SBB056823 [0,1,0,0,0,0|1,0,0]=2 72 B5R0.3 COC(=O)CCl SBB040686 [0,1,0,0,0,0|1,0,0]=2 73 B5R0.3 COC(=O)NN SBB061728 [0,1,0,0,0,0|2,0,0]=3 74 B5R0.3 CS\C(N)=N/N SBB098045 [0,1,0,0,0,0|3,0,0]=4 75 B5R0.3 NNC(=O)CO SBB111858 [0,1,0,0,0,0|2,0,0]=3 76 B5R0.3 OC(CCl)CCl SBB060190 [0,1,0,0,0,0|2,0,1]=4 77 B5R0.3 OCC(O)CCl SBB060480 [0,1,0,0,0,0|1,0,2]=4 78 B5R0.3 P(=O)(OC)OC SBB060964 [0,1,0,0,0,0|2,0,0]=3 79 B5R0.3 [NH2+]=C(NN)SC SBB072632 [0,1,0,0,0,0|3,0,0]=4 80 B5R0.4 CCS(=O)(=O)Cl SBB061401 [0,1,0,0,0,0|1,0,1]=3 81 B5R0.4 COS(C)(=O)=O SBB058203 [0,1,0,0,0,0|2,0,1]=4 82 B5R0.4 O=S(=O)(Cl)CCl SBB066601 [0,1,0,0,0,0|2,0,1]=4 83 B5R0.5 CC(=O)C(C)Cl SBB060958 [0,1,0,0,0,0|1,0,0]=2 84 B5R0.5 CC(=O)C(F)F SBB021370 [0,1,0,0,0,0|2,0,0]=3 85 B5R0.5 CC(=S)N(C)C SBB007924 [0,1,0,0,0,0|2,1,0]=4 86 B5R0.5 CC(Br)C(=O)O SBB060286 [0,1,0,0,0,0|0,0,0]=1 87 B5R0.5 CC(Br)C(Cl)Br SBB059977 [0,1,0,0,0,0|2,0,1]=4 88 B5R0.5 CC(Br)C(Cl)Cl SBB060490 [0,1,0,0,0,0|2,0,1]=4 89 B5R0.5 CC(C)C(=N)N SBB056456 [0,1,0,0,0,0|2,0,0]=3 90 B5R0.5 CC(C)C(=O)Cl SBB060269 [0,1,0,0,0,0|1,0,0]=2 91 B5R0.5 CC(O)C(=O)O SBB065762 [0,1,0,0,0,0|0,0,0]=1 92 B5R0.5 CN(C)C(=O)Cl SBB040876 [0,1,0,0,0,0|2,0,0]=3 93 B5R0.5 CN(C)C(=O)[O-] SBB059132 [0,1,0,0,0,0|1,0,1]=3 94 B5R0.5 CN(C)C(=S)Cl SBB085540 [0,1,0,0,0,0|2,1,0]=4 95 B5R0.5 CN(N)C(N)=S SBB066591 [0,1,0,0,0,0|2,1,0]=4 96 B5R0.5 [NH2+]=C(N)N(C)C SBB059825 [0,1,0,0,0,0|3,0,0]=4 97 B5R1.2 OC1CNC1 SBB056270 [0,0,0,1,0,0|2,0,1]=4 98 B2R0.1 CCBr SBB040912 [2,0,0,0,0,0|1,0,0]=3 99 B2R0.1 ONC SBB005850 [2,0,0,0,0,0|1,0,0]=3 100 B4R0.2 BrCCCBr SBB060203 [1,1,0,0,0,0|1,0,1]=4 101 B4R0.2 CCCCBr SBB059930 [1,1,0,0,0,0|1,0,1]=4 102 B4R0.2 CNCC#N SBB071612 [1,1,0,0,0,0|1,0,1]=4 103 B4R0.2 CNCCI SBB071605 [1,1,0,0,0,0|1,0,1]=4 104 B4R0.2 COCCBr SBB007906 [1,1,0,0,0,0|1,0,1]=4 105 B4R0.2 C\C=C\CC SBB059879 [1,1,0,0,0,0|1,0,0]=3 106 B4R0.2 ClCCCBr SBB058669 [1,1,0,0,0,0|1,0,1]=4 107 B4R0.2 ClCCCCl SBB040918 [1,1,0,0,0,0|1,0,1]=4 108 B4R0.2 Cl\C=C/CCl SBB061393 [1,1,0,0,0,0|1,0,1]=4 109 B4R0.2 OCCCBr SBB054750 [1,1,0,0,0,0|0,0,1]=3 110 B4R0.2 [NH2+](CC)CC SBB059849 [1,1,0,0,0,0|1,0,1]=4 111 B4R0.3 O=S(=O)(O)O SBB066031 [1,1,0,0,0,0|2,0,0]=4 112 B6R0.1 C#CC(=O)OCC SBB060344 [0,2,0,0,0,0|1,0,0]=3 113 B6R0.1 C#CC(O)CCC SBB067434 [0,2,0,0,0,0|1,0,1]=4 114 B6R0.1 C=CC(=O)OCC SBB060348 [0,2,0,0,0,0|1,0,0]=3 115 B6R0.1 CCC(O)COC SBB072708 [0,2,0,0,0,0|0,0,2]=4 116 B6R0.1 CCCC(=O)CC SBB061496 [0,2,0,0,0,0|1,0,0]=3 117 B6R0.1 CCCC(=O)NN SBB028175 [0,2,0,0,0,0|1,0,0]=3 118 B6R0.1 CCCC(=O)OC SBB061104 [0,2,0,0,0,0|0,0,0]=2 119 B6R0.1 CCCC(C)CO SBB061282 [0,2,0,0,0,0|1,0,1]=4 120 B6R0.1 CCCC(O)CC SBB061363 [0,2,0,0,0,0|1,0,1]=4 121 B6R0.1 CCC\C(N)=N/O SBB028173 [0,2,0,0,0,0|1,0,0]=3 122 B6R0.1 CCNC(=O)CBr SBB051008 [0,2,0,0,0,0|1,0,0]=3 123 B6R0.1 CCNC(=O)CCl SBB008200 [0,2,0,0,0,0|1,0,0]=3 124 B6R0.1 CCNC(=S)NN SBB072595 [0,2,0,0,0,0|1,1,0]=4 125 B6R0.1 CCNC(C)CO SBB046531 [0,2,0,0,0,0|1,0,1]=4 126 B6R0.1 CCOC(=O)CBr SBB060995 [0,2,0,0,0,0|1,0,0]=3 127 B6R0.1 CCOC(=O)CC SBB060312 [0,2,0,0,0,0|0,0,0]=2 128 B6R0.1 CCOC(=O)NN SBB028182 [0,2,0,0,0,0|1,0,0]=3 129 B6R0.1 CNCC(C)OC SBB049894 [0,2,0,0,0,0|1,0,1]=4 130 B6R0.1 COC(=O)CC#N SBB059483 [0,2,0,0,0,0|0,0,1]=3 131 B6R0.1 COC(=O)CCBr SBB070709 [0,2,0,0,0,0|0,0,0]=2 132 B6R0.1 COC(=O)CCN SBB071679 [0,2,0,0,0,0|0,0,0]=2 133 B6R0.1 COCC(=O)NN SBB021113 [0,2,0,0,0,0|1,0,0]=3 134 B6R0.1 COCC(O)CN SBB051203 [0,2,0,0,0,0|1,0,1]=4 135 B6R0.1 C\C=C\C(=O)OC SBB061218 [0,2,0,0,0,0|0,0,1]=3 136 B6R0.1 N#CCC(=O)NN SBB028164 [0,2,0,0,0,0|1,0,1]=4 137 B6R0.1 OC(CBr)CCBr SBB007842 [0,2,0,0,0,0|1,0,1]=4 138 B6R0.1 OCNC(=O)CCl SBB004273 [0,2,0,0,0,0|1,0,0]=3 139 B6R0.1 [NH3+]CC(=O)OCC SBB056599 [0,2,0,0,0,0|1,0,0]=3 140 B6R0.2 C=C(C)OC(C)=O SBB056824 [0,2,0,0,0,0|1,0,1]=4 141 B6R0.2 CC(=O)C=C(C)C SBB040870 [0,2,0,0,0,0|1,0,1]=4 142 B6R0.2 CC(=O)CC(C)=O SBB009914 [0,2,0,0,0,0|1,0,0]=3 143 B6R0.2 CC(=O)CC(C)C SBB060384 [0,2,0,0,0,0|1,0,0]=3 144 B6R0.2 CC(=O)CC(N)=O SBB061675 [0,2,0,0,0,0|1,0,0]=3 145 B6R0.2 CC(=O)\C=C(\C)N SBB007945 [0,2,0,0,0,0|1,0,1]=4 146 B6R0.2 CC(=O)\C=C(\C)[O-] SBB080715 [0,2,0,0,0,0|1,0,1]=4 147 B6R0.2 CC(C)=CC(=O)O SBB065769 [0,2,0,0,0,0|0,0,1]=3 148 B6R0.2 CC(C)CB(O)O SBB062832 [0,2,0,0,0,0|1,0,1]=4 149 B6R0.2 CC(C)CC(=O)Cl SBB040623 [0,2,0,0,0,0|1,0,0]=3 150 B6R0.2 CC(C)CC(C)O SBB061337 [0,2,0,0,0,0|1,0,1]=4 151 B6R0.2 CC(C)CC(N)=O SBB028167 [0,2,0,0,0,0|1,0,0]=3 152 B6R0.2 CC(O)CC(=O)O SBB065815 [0,2,0,0,0,0|0,0,0]=2 153 B6R0.2 CC(O)CN(C)C SBB060002 [0,2,0,0,0,0|1,0,1]=4 154 B6R0.2 CN(C)CC(=O)O SBB065779 [0,2,0,0,0,0|0,0,0]=2 155 B6R0.2 NC(=O)CC(=O)O SBB049982 [0,2,0,0,0,0|0,0,1]=3 156 B6R0.2 NC(=O)CC(N)=O SBB044920 [0,2,0,0,0,0|1,0,1]=4 157 B6R0.2 NC(=O)C[N+](=O)[O-] SBB000037 [0,2,0,0,0,0|2,0,0]=4 158 B6R0.2 O=C(Cl)CC(=O)Cl SBB060017 [0,2,0,0,0,0|1,0,1]=4 159 B6R0.2 O=C(O)CC(=O)O SBB040552 [0,2,0,0,0,0|0,0,1]=3 160 B6R0.2 [NH+](C)(C)CC(=O)O SBB061663 [0,2,0,0,0,0|0,0,0]=2 161 B6R0.3 C#CC(O)C(C)C SBB009138 [0,2,0,0,0,0|1,0,1]=4 162 B6R0.3 C=C(C)C(=O)OC SBB060556 [0,2,0,0,0,0|0,0,1]=3 163 B6R0.3 C=CC(=O)N(C)C SBB008330 [0,2,0,0,0,0|2,0,0]=4 164 B6R0.3 CC(=O)\C(C)=N/O SBB061682 [0,2,0,0,0,0|1,0,1]=4 165 B6R0.3 CC(C)C(=O)NN SBB030401 [0,2,0,0,0,0|1,0,0]=3 166 B6R0.3 CC(C)\C(N)=N/O SBB028172 [0,2,0,0,0,0|1,0,0]=3 167 B6R0.3 CC(CN)C(=O)O SBB061656 [0,2,0,0,0,0|0,0,0]=2 168 B6R0.3 CC(CO)[N+](=O)[O-] SBB108844 [0,2,0,0,0,0|1,0,1]=4 169 B6R0.3 CCC(=O)C(C)=O SBB061626 [0,2,0,0,0,0|0,0,1]=3 170 B6R0.3 CCC(Br)C(=O)O SBB040791 [0,2,0,0,0,0|0,0,0]=2 171 B6R0.3 CCC(N)C(N)=O SBB017505 [0,2,0,0,0,0|1,0,0]=3 172 B6R0.3 CCN(C)C(=N)N SBB056493 [0,2,0,0,0,0|2,0,0]=4 173 B6R0.3 CC[C@H](N)C(=O)O SBB053588 [0,2,0,0,0,0|0,0,0]=2 174 B6R0.3 CN(C)C(=O)CCl SBB038711 [0,2,0,0,0,0|2,0,0]=4 175 B6R0.3 CN[C@@H](C)C(=O)O SBB069105 [0,2,0,0,0,0|0,0,0]=2 176 B6R0.3 CN[C@@H](C)C(=O)O SBB069106 [0,2,0,0,0,0|0,0,0]=2 177 B6R0.3 COC(=O)C(C)C SBB061111 [0,2,0,0,0,0|0,0,0]=2 178 B6R0.3 COC(=O)C(C)N SBB007634 [0,2,0,0,0,0|0,0,0]=2 179 B6R0.3 COC(=O)C(F)F SBB021971 [0,2,0,0,0,0|1,0,0]=3 180 B6R0.3 C\C=C(\C)C(=O)O SBB071598 [0,2,0,0,0,0|0,0,1]=3 181 B6R0.3 N#CC(N)C(N)=O SBB001501 [0,2,0,0,0,0|1,0,1]=4 182 B6R0.3 NC(=O)C(N)CO SBB004161 [0,2,0,0,0,0|1,0,0]=3 183 B6R0.3 NC(CO)C(=O)O SBB061655 [0,2,0,0,0,0|0,0,0]=2 184 B6R0.3 NCC(N)C(=O)O SBB060844 [0,2,0,0,0,0|0,0,0]=2 185 B6R0.3 NC[C@H](O)C(=O)O SBB062829 [0,2,0,0,0,0|0,0,0]=2 186 B6R0.3 O=C(O)C(=O)CBr SBB053571 [0,2,0,0,0,0|0,0,1]=3 187 B6R0.3 O=C(O)C(=O)CBr SBB053584 [0,2,0,0,0,0|0,0,1]=3 188 B6R0.3 O=C(O)C(Br)CBr SBB068302 [0,2,0,0,0,0|0,0,0]=2 189 B6R0.3 O=C(O)C(O)CCl SBB072606 [0,2,0,0,0,0|0,0,0]=2 190 B6R0.3 OC(=O)[C@@H](CN)N SBB005812 [0,2,0,0,0,0|0,0,0]=2 191 B6R0.4 C#CCCC(=O)O SBB009121 [0,2,0,0,0,0|0,0,0]=2 192 B6R0.4 C=CCCC(=O)O SBB061214 [0,2,0,0,0,0|0,0,0]=2 193 B6R0.4 C=CCCC(C)=O SBB009089 [0,2,0,0,0,0|1,0,0]=3 194 B6R0.4 CC(=O)NCCCl SBB008165 [0,2,0,0,0,0|1,0,0]=3 195 B6R0.4 CC(=O)NCCN SBB028176 [0,2,0,0,0,0|1,0,0]=3 196 B6R0.4 CC(=O)NCCO SBB007954 [0,2,0,0,0,0|1,0,0]=3 197 B6R0.4 CC(=O)OCCCl SBB058505 [0,2,0,0,0,0|1,0,0]=3 198 B6R0.4 CCC#CC(C)=O SBB009086 [0,2,0,0,0,0|1,0,0]=3 199 B6R0.4 CCC#CC(C)O SBB067141 [0,2,0,0,0,0|1,0,1]=4 200 B6R0.4 CCCCC(=O)O SBB053585 [0,2,0,0,0,0|0,0,0]=2 201 B6R0.4 CCCCC(C)=O SBB061262 [0,2,0,0,0,0|1,0,0]=3 202 B6R0.4 CCCCC(C)O SBB061290 [0,2,0,0,0,0|1,0,1]=4 203 B6R0.4 CCCCC(N)=O SBB028169 [0,2,0,0,0,0|1,0,0]=3 204 B6R0.4 CCCNC(N)=O SBB028174 [0,2,0,0,0,0|1,0,0]=3 205 B6R0.4 CCCOC(C)=O SBB060305 [0,2,0,0,0,0|1,0,0]=3 206 B6R0.4 CCCOC(N)=O SBB000036 [0,2,0,0,0,0|1,0,0]=3 207 B6R0.4 CCOCC(=O)O SBB069120 [0,2,0,0,0,0|0,0,0]=2 208 B6R0.4 CCOCC(C)O SBB061006 [0,2,0,0,0,0|1,0,1]=4 209 B6R0.4 CCSCC(=O)O SBB047288 [0,2,0,0,0,0|0,0,0]=2 210 B6R0.4 CC\C=C\C(=O)O SBB061994 [0,2,0,0,0,0|0,0,0]=2 211 B6R0.4 CNCCC(N)=O SBB080375 [0,2,0,0,0,0|1,0,0]=3 212 B6R0.4 NCCCC(=O)O SBB028179 [0,2,0,0,0,0|0,0,0]=2 213 B6R0.4 NCCNC(=S)S SBB069239 [0,2,0,0,0,0|0,2,0]=4 214 B6R0.4 O=C(Cl)CCCCl SBB060894 [0,2,0,0,0,0|1,0,0]=3 215 B6R0.4 O=C(O)CCCBr SBB065986 [0,2,0,0,0,0|0,0,0]=2 216 B6R0.5 CCCS(=O)(=O)Cl SBB048026 [0,2,0,0,0,0|1,0,1]=4 217 B6R0.5 CCOS(C)(=O)=O SBB058685 [0,2,0,0,0,0|1,0,1]=4 218 B6R0.5 CS(=O)(=O)CCN SBB047603 [0,2,0,0,0,0|1,0,1]=4 219 B6R0.5 NCCS(N)(=O)=O SBB014994 [0,2,0,0,0,0|1,0,1]=4 220 B6R0.5 NCCS(N)(=O)=O SBB070085 [0,2,0,0,0,0|1,0,1]=4 221 B6R0.5 O=S(=O)(Cl)CCCl SBB048025 [0,2,0,0,0,0|1,0,1]=4 222 B6R0.5 [NH3+]CCS(=O)(=O)[O-] SBB061255 [0,2,0,0,0,0|1,0,1]=4 223 B6R0.8 C#CC(C)(O)CC SBB002148 [0,2,0,0,0,0|1,0,1]=4 224 B6R0.8 CCC(C)(O)CC SBB060948 [0,2,0,0,0,0|1,0,1]=4 225 B6R0.9 CC=C(CC)CC SBB059883 [0,2,0,0,0,0|2,0,0]=4 226 B6R0.9 CCC(C=O)CC SBB059875 [0,2,0,0,0,0|1,0,1]=4 227 B6R0.9 CCC(CC)CO SBB059900 [0,2,0,0,0,0|1,0,1]=4 228 B6R0.9 CCC(CN)OC SBB302370 [0,2,0,0,0,0|1,0,1]=4 229 B6R0.9 CCN(C=O)CC SBB056822 [0,2,0,0,0,0|2,0,0]=4 230 B6R0.7 CC(=O)C(C)(C)C SBB060385 [0,2,0,0,0,0|1,0,0]=3 231 B6R0.7 CC(=O)C(C)(C)Cl SBB008903 [0,2,0,0,0,0|1,0,0]=3 232 B6R0.7 CC(=O)C(C)(C)N SBB013635 [0,2,0,0,0,0|1,0,0]=3 233 B6R0.7 CC(C)(Br)C(=O)O SBB065985 [0,2,0,0,0,0|0,0,0]=2 234 B6R0.7 CC(C)(C)C(=N)N SBB072322 [0,2,0,0,0,0|2,0,0]=4 235 B6R0.7 CC(C)(C)C(=O)Cl SBB060922 [0,2,0,0,0,0|1,0,0]=3 236 B6R0.7 CC(C)(C)C(N)=O SBB028170 [0,2,0,0,0,0|1,0,0]=3 237 B6R0.7 CC(C)(C)[S@](N)=O SBB056498 [0,2,0,0,0,0|2,0,0]=4 238 B6R0.7 CC(C)(N)C(=O)O SBB028178 [0,2,0,0,0,0|0,0,0]=2 239 B6R0.7 CC(C)(O)C(=O)O SBB065771 [0,2,0,0,0,0|0,0,0]=2 240 B6R0.7 NC(=O)C(F)(F)Cl SBB017538 [0,2,0,0,0,0|2,0,0]=4 241 B6R0.7 O=C(Br)C(F)(F)Br SBB098866 [0,2,0,0,0,0|2,0,0]=4 242 B6R0.7 O=C(Br)C(F)(F)Cl SBB091626 [0,2,0,0,0,0|2,0,0]=4 243 B6R0.7 O=C(O)C(Br)(Br)Br SBB065991 [0,2,0,0,0,0|1,0,0]=3 244 B6R1.2 CC1=NCCN1 SBB040067 [0,1,0,1,0,0|2,0,0]=4 245 B6R1.2 NC1=NCCN1 SBB300496 [0,1,0,1,0,0|2,0,0]=4 246 B6R1.2 NC1=NCCS1 SBB004361 [0,1,0,1,0,0|1,1,0]=4 247 B6R1.2 O=C1C=CCO1 SBB040281 [0,1,0,1,0,0|0,0,1]=3 248 B6R1.2 O=C1CCCC1 SBB040835 [0,1,0,1,0,0|1,0,0]=3 249 B6R1.2 O=C1CCCN1 SBB060296 [0,1,0,1,0,0|1,0,0]=3 250 B6R1.2 O=C1CCNN1 SBB007977 [0,1,0,1,0,0|1,0,0]=3 251 B6R1.2 O=C1CCSC1 SBB007947 [0,1,0,1,0,0|0,1,0]=3 252 B6R1.2 OC1=NNCC1 SBB047550 [0,1,0,1,0,0|1,0,0]=3 253 B6R1.2 OC1CCNC1 SBB056152 [0,1,0,1,0,0|1,0,1]=4 254 B6R1.2 O[C@H]1CCNC1 SBB004272 [0,1,0,1,0,0|1,0,1]=4 255 B6R1.2 O[C@H]1CCNC1 SBB027336 [0,1,0,1,0,0|1,0,1]=4 256 B6R1.2 O[C@H]1CCOC1 SBB062959 [0,1,0,1,0,0|0,0,2]=4 257 B6R1.2 S=C1NCCN1 SBB004362 [0,1,0,1,0,0|1,1,0]=4 258 B6R1.2 SC1=NCCS1 SBB004290 [0,1,0,1,0,0|0,2,0]=4 259 B6R1.11 CC(=O)C1CC1 SBB040825 [0,1,0,1,0,0|1,0,0]=3 260 B6R1.11 N=C(N)C1CC1 SBB028203 [0,1,0,1,0,0|2,0,0]=4 261 B6R1.11 NC(=O)C1CC1 SBB008326 [0,1,0,1,0,0|1,0,0]=3 262 B6R1.11 NC(=S)C1CC1 SBB024106 [0,1,0,1,0,0|1,1,0]=4 263 B6R1.11 O=C(Cl)C1CC1 SBB061720 [0,1,0,1,0,0|1,0,0]=3 264 B6R1.11 O=C(O)C1CC1 SBB008028 [0,1,0,1,0,0|0,0,0]=2 265 B6R1.7 CC1(CO)CC1 SBB084505 [0,1,0,1,0,0|1,0,1]=4