0 B4R0.1 C#CC(=O)O CUR-0101441 [0,0,0,0,0,0|3,0,0]=3 1 B4R0.1 C(=C(Cl)Cl)Cl CUR-0101983 [0,0,0,0,0,0|4,0,0]=4 2 B4R0.1 C(=O)(N)NN CUR-0003223 [0,0,0,0,0,0|3,0,0]=3 3 B4R0.1 C(=O)(N)NO CUR-0001014 [0,0,0,0,0,0|2,0,0]=2 4 B4R0.1 C(=O)C(=O)O CUR-0021308 [0,0,0,0,0,0|2,0,1]=3 5 B4R0.1 C(=S)(N)NN CUR-0004669 [0,0,0,0,0,0|3,1,0]=4 6 B4R0.1 C(C(=N)N)Cl CUR-0085287 [0,0,0,0,0,0|4,0,0]=4 7 B4R0.1 C(C(=O)Br)Br CUR-0006369 [0,0,0,0,0,0|3,0,0]=3 8 B4R0.1 C(C(=O)Cl)Cl CUR-0004550 [0,0,0,0,0,0|3,0,0]=3 9 B4R0.1 C(C(=O)N)Br CUR-0014813 [0,0,0,0,0,0|3,0,0]=3 10 B4R0.1 C(C(=O)N)Cl CUR-0007516 [0,0,0,0,0,0|3,0,0]=3 11 B4R0.1 C(C(=O)N)N CUR-0101687 [0,0,0,0,0,0|3,0,0]=3 12 B4R0.1 C(C(=O)N)O CUR-0113957 [0,0,0,0,0,0|2,0,0]=2 13 B4R0.1 C(C(=O)O)Br CUR-0100788 [0,0,0,0,0,0|3,0,0]=3 14 B4R0.1 C(C(=O)O)Cl CUR-0003311 [0,0,0,0,0,0|3,0,0]=3 15 B4R0.1 C(C(=O)O)I CUR-0003176 [0,0,0,0,0,0|3,0,0]=3 16 B4R0.1 C(C(=O)O)N CUR-0014574 [0,0,0,0,0,0|3,0,0]=3 17 B4R0.1 C(C(=O)O)N CUR-0101231 [0,0,0,0,0,0|3,0,0]=3 18 B4R0.1 C(C(=O)O)O CUR-0014667 [0,0,0,0,0,0|2,0,0]=2 19 B4R0.1 C(C(=O)O)S CUR-0101545 [0,0,0,0,0,0|2,1,0]=3 20 B4R0.1 C(O)S(=O)[O-] CUR-0023303 [0,0,0,0,0,0|3,0,0]=3 21 B4R0.1 C=C(C#N)Cl CUR-0000372 [0,0,0,0,0,0|3,0,1]=4 22 B4R0.1 C=CC(=O)Cl CUR-0101542 [0,0,0,0,0,0|3,0,0]=3 23 B4R0.1 C=CC(=O)N CUR-0007166 [0,0,0,0,0,0|3,0,0]=3 24 B4R0.1 C=CC(=O)O CUR-0028045 [0,0,0,0,0,0|3,0,0]=3 25 B4R0.1 CC(=C)C=O CUR-0101443 [0,0,0,0,0,0|2,0,1]=3 26 B4R0.1 CC(=C)CCl CUR-0011941 [0,0,0,0,0,0|3,0,0]=3 27 B4R0.1 CC(=C)OC CUR-0101450 [0,0,0,0,0,0|2,0,0]=2 28 B4R0.1 CC(=O)C=C CUR-0013098 [0,0,0,0,0,0|2,0,0]=2 29 B4R0.1 CC(=O)C=O CUR-0101448 [0,0,0,0,0,0|1,0,1]=2 30 B4R0.1 CC(=O)CCl CUR-0002239 [0,0,0,0,0,0|2,0,0]=2 31 B4R0.1 CC(=O)CO CUR-0005016 [0,0,0,0,0,0|1,0,0]=1 32 B4R0.1 CC(C#C)N CUR-0083146 [0,0,0,0,0,0|3,0,1]=4 33 B4R0.1 CC(C#C)O CUR-0101444 [0,0,0,0,0,0|2,0,2]=4 34 B4R0.1 CC(C#N)Cl CUR-0101233 [0,0,0,0,0,0|3,0,1]=4 35 B4R0.1 CC(C)C#N CUR-0009528 [0,0,0,0,0,0|3,0,1]=4 36 B4R0.1 CC(C)C=O CUR-0017872 [0,0,0,0,0,0|2,0,2]=4 37 B4R0.1 CC(C)CBr CUR-0024115 [0,0,0,0,0,0|3,0,1]=4 38 B4R0.1 CC(C)CI CUR-0028804 [0,0,0,0,0,0|3,0,1]=4 39 B4R0.1 CC(C)CN CUR-0020747 [0,0,0,0,0,0|3,0,1]=4 40 B4R0.1 CC(C)CO CUR-0012302 [0,0,0,0,0,0|2,0,1]=3 41 B4R0.1 CC(C)NN CUR-0014509 [0,0,0,0,0,0|3,0,1]=4 42 B4R0.1 CC(CN)N CUR-0101461 [0,0,0,0,0,0|3,0,1]=4 43 B4R0.1 CC(CN)O CUR-0024952 [0,0,0,0,0,0|2,0,2]=4 44 B4R0.1 CC(CN)S CUR-0003165 [0,0,0,0,0,0|2,1,1]=4 45 B4R0.1 CC(CO)O CUR-0022593 [0,0,0,0,0,0|1,0,2]=3 46 B4R0.1 CC(CS)N CUR-0021165 [0,0,0,0,0,0|2,1,1]=4 47 B4R0.1 CCC(=O)Cl CUR-0101547 [0,0,0,0,0,0|3,0,0]=3 48 B4R0.1 CCC(=O)N CUR-0101453 [0,0,0,0,0,0|3,0,0]=3 49 B4R0.1 CCC(=O)O CUR-0010221 [0,0,0,0,0,0|3,0,0]=3 50 B4R0.1 CCC(C)Br CUR-0102085 [0,0,0,0,0,0|3,0,1]=4 51 B4R0.1 CCC(C)I CUR-0055396 [0,0,0,0,0,0|3,0,1]=4 52 B4R0.1 CCC(C)N CUR-0001789 [0,0,0,0,0,0|3,0,1]=4 53 B4R0.1 CCN(C)C CUR-0101456 [0,0,0,0,0,0|4,0,0]=4 54 B4R0.1 CC[N+](=O)[O-] CUR-0012449 [0,0,0,0,0,0|4,0,0]=4 55 B4R0.1 CN(C)C#N CUR-0101445 [0,0,0,0,0,0|4,0,0]=4 56 B4R0.1 CNC(=O)N CUR-0025342 [0,0,0,0,0,0|3,0,0]=3 57 B4R0.1 CNC(=S)N CUR-0004136 [0,0,0,0,0,0|3,1,0]=4 58 B4R0.1 COC(=N)N CUR-0101458 [0,0,0,0,0,0|3,0,0]=3 59 B4R0.1 COC(=O)Cl CUR-0019109 [0,0,0,0,0,0|2,0,0]=2 60 B4R0.1 COC(Cl)Cl CUR-0101733 [0,0,0,0,0,0|3,0,1]=4 61 B4R0.1 CSC(=N)N CUR-0104011 [0,0,0,0,0,0|3,1,0]=4 62 B4R0.1 C\C(=N\O)\N CUR-0098903 [0,0,0,0,0,0|2,0,0]=2 63 B3R0.1 C#CCO CUR-0007009 [1,0,0,0,0,0|1,0,2]=4 64 B3R0.1 C(=O)C=O CUR-0024623 [1,0,0,0,0,0|1,0,1]=3 65 B3R0.1 C(=O)NN CUR-0101193 [1,0,0,0,0,0|2,0,0]=3 66 B3R0.1 C(C=O)Cl CUR-0018990 [1,0,0,0,0,0|2,0,0]=3 67 B3R0.1 C(CBr)O CUR-0021042 [1,0,0,0,0,0|2,0,1]=4 68 B3R0.1 C(CCl)O CUR-0101474 [1,0,0,0,0,0|2,0,1]=4 69 B3R0.1 C(CO)N CUR-0010085 [1,0,0,0,0,0|2,0,1]=4 70 B3R0.1 C(CO)O CUR-0026540 [1,0,0,0,0,0|1,0,2]=4 71 B3R0.1 C(CS)O CUR-0013730 [1,0,0,0,0,0|1,1,1]=4 72 B3R0.1 C=CC#N CUR-0023863 [1,0,0,0,0,0|2,0,1]=4 73 B3R0.1 C=CCBr CUR-0014802 [1,0,0,0,0,0|2,0,1]=4 74 B3R0.1 C=CCCl CUR-0002102 [1,0,0,0,0,0|2,0,1]=4 75 B3R0.1 C=CCI CUR-0024817 [1,0,0,0,0,0|2,0,1]=4 76 B3R0.1 C=CCN CUR-0009493 [1,0,0,0,0,0|2,0,1]=4 77 B3R0.1 C=CCO CUR-0101427 [1,0,0,0,0,0|1,0,1]=3 78 B3R0.1 CCC#N CUR-0100813 [1,0,0,0,0,0|2,0,1]=4 79 B3R0.1 CCC=O CUR-0015273 [1,0,0,0,0,0|2,0,0]=3 80 B3R0.1 CCCBr CUR-0028377 [1,0,0,0,0,0|2,0,1]=4 81 B3R0.1 CCCI CUR-0010202 [1,0,0,0,0,0|2,0,1]=4 82 B3R0.1 CCCN CUR-0000120 [1,0,0,0,0,0|2,0,1]=4 83 B3R0.1 CCCO CUR-0017382 [1,0,0,0,0,0|1,0,1]=3 84 B3R0.1 CCCS CUR-0009615 [1,0,0,0,0,0|1,1,1]=4 85 B3R0.1 CCNN CUR-0017500 [1,0,0,0,0,0|2,0,1]=4 86 B3R0.1 CN=C=S CUR-0012135 [1,0,0,0,0,0|2,1,0]=4 87 B3R0.1 CNC=O CUR-0012781 [1,0,0,0,0,0|2,0,0]=3 88 B3R0.1 CNOC CUR-0015640 [1,0,0,0,0,0|2,0,0]=3 89 B3R0.1 COCCl CUR-0028317 [1,0,0,0,0,0|2,0,1]=4 90 B3R0.1 CSSC CUR-0101553 [1,0,0,0,0,0|2,1,0]=4 91 B3R0.2 C(=N)(N)N CUR-0011215 [1,0,0,0,0,0|3,0,0]=4 92 B3R0.2 C(=O)(N)N CUR-0004435 [1,0,0,0,0,0|2,0,0]=3 93 B3R0.2 C(=S)(N)N CUR-0027936 [1,0,0,0,0,0|2,1,0]=4 94 B3R0.2 CC(=N)N CUR-0023632 [1,0,0,0,0,0|2,0,0]=3 95 B3R0.2 CC(=O)Br CUR-0004133 [1,0,0,0,0,0|1,0,0]=2 96 B3R0.2 CC(=O)Cl CUR-0019985 [1,0,0,0,0,0|1,0,0]=2 97 B3R0.2 CC(=O)N CUR-0016336 [1,0,0,0,0,0|1,0,0]=2 98 B3R0.2 CC(=O)O CUR-0005925 [1,0,0,0,0,0|0,0,0]=1 99 B3R0.2 CC(=S)N CUR-0008655 [1,0,0,0,0,0|1,1,0]=3 100 B3R0.2 CC(C)Br CUR-0027321 [1,0,0,0,0,0|2,0,1]=4 101 B3R0.2 CC(C)Cl CUR-0022523 [1,0,0,0,0,0|2,0,1]=4 102 B3R0.2 CC(C)I CUR-0026227 [1,0,0,0,0,0|2,0,1]=4 103 B3R0.2 CC(C)N CUR-0024558 [1,0,0,0,0,0|2,0,1]=4 104 B3R0.2 CC(C)S CUR-0012379 [1,0,0,0,0,0|1,1,1]=4 105 B3R0.2 CN(C)C CUR-0004768 [1,0,0,0,0,0|3,0,0]=4 106 B3R0.2 CP(C)C CUR-0006076 [1,0,0,0,0,0|3,0,0]=4 107 B3R0.2 C[N+](=O)[O-] CUR-0016305 [1,0,0,0,0,0|1,0,1]=3 108 B3R0.2 C[S+](C)C CUR-0103505 [1,0,0,0,0,0|3,0,0]=4 109 B5R0.1 C(C#N)C(=O)N CUR-0015106 [0,1,0,0,0,0|3,0,0]=4 110 B5R0.1 C(C#N)C(=O)O CUR-0011506 [0,1,0,0,0,0|3,0,0]=4 111 B5R0.1 C(CBr)C(=O)O CUR-0102453 [0,1,0,0,0,0|3,0,0]=4 112 B5R0.1 C(CCl)C(=O)Cl CUR-0009101 [0,1,0,0,0,0|3,0,0]=4 113 B5R0.1 C(CCl)C(=O)O CUR-0008480 [0,1,0,0,0,0|3,0,0]=4 114 B5R0.1 C(CN)C(=O)O CUR-0006907 [0,1,0,0,0,0|3,0,0]=4 115 B5R0.1 C(CN)C(=O)[O-] CUR-0101293 [0,1,0,0,0,0|3,0,0]=4 116 B5R0.1 C(CS)C(=O)O CUR-0101651 [0,1,0,0,0,0|2,1,0]=4 117 B5R0.1 CC(=CCBr)C CUR-0059675 [0,1,0,0,0,0|3,0,0]=4 118 B5R0.1 CC(=CCCl)C CUR-0022594 [0,1,0,0,0,0|3,0,0]=4 119 B5R0.1 CC(=O)COC CUR-0101516 [0,1,0,0,0,0|1,0,0]=2 120 B5R0.1 CC(=O)OC=C CUR-0001318 [0,1,0,0,0,0|1,0,0]=2 121 B5R0.1 CC(C)CCO CUR-0003416 [0,1,0,0,0,0|2,0,1]=4 122 B5R0.1 CC(CCO)O CUR-0003759 [0,1,0,0,0,0|1,0,2]=4 123 B5R0.1 CC(COC)N CUR-0101532 [0,1,0,0,0,0|2,0,1]=4 124 B5R0.1 CCCC(=O)C CUR-0026599 [0,1,0,0,0,0|2,0,0]=3 125 B5R0.1 CCCC(=O)Cl CUR-0020308 [0,1,0,0,0,0|3,0,0]=4 126 B5R0.1 CCCC(=O)O CUR-0020198 [0,1,0,0,0,0|3,0,0]=4 127 B5R0.1 CCOC(=O)C CUR-0101519 [0,1,0,0,0,0|1,0,0]=2 128 B5R0.1 CCOC(=O)Cl CUR-0026181 [0,1,0,0,0,0|2,0,0]=3 129 B5R0.1 CCOC(=O)N CUR-0100824 [0,1,0,0,0,0|2,0,0]=3 130 B5R0.1 CN(C)CCO CUR-0019188 [0,1,0,0,0,0|3,0,0]=4 131 B5R0.1 CNCC(=O)O CUR-0018005 [0,1,0,0,0,0|3,0,0]=4 132 B5R0.1 COCC(=O)Cl CUR-0101665 [0,1,0,0,0,0|2,0,0]=3 133 B5R0.1 COCC(=O)O CUR-0014449 [0,1,0,0,0,0|2,0,0]=3 134 B5R0.1 CSCC(=O)O CUR-0025987 [0,1,0,0,0,0|2,1,0]=4 135 B5R0.1 C\C(=C\C#N)\N CUR-0009988 [0,1,0,0,0,0|3,0,0]=4 136 B5R0.1 C\C=C\C(=O)O CUR-0100765 [0,1,0,0,0,0|3,0,0]=4 137 B5R0.3 C(C(=NO)N)Cl CUR-0029129 [0,1,0,0,0,0|2,0,0]=3 138 B5R0.3 C(C(=O)CCl)Cl CUR-0101901 [0,1,0,0,0,0|2,0,0]=3 139 B5R0.3 C(C(CO)O)O CUR-0012902 [0,1,0,0,0,0|1,0,2]=4 140 B5R0.3 CC(CO)CO CUR-0101538 [0,1,0,0,0,0|1,0,2]=4 141 B5R0.3 CCC(=O)CC CUR-0101500 [0,1,0,0,0,0|2,0,0]=3 142 B5R0.3 CCC(C)CO CUR-0101523 [0,1,0,0,0,0|2,0,1]=4 143 B5R0.3 CCC(CO)N CUR-0101528 [0,1,0,0,0,0|2,0,1]=4 144 B5R0.3 CC\C(=N/O)\N CUR-0010533 [0,1,0,0,0,0|2,0,0]=3 145 B5R0.3 CNC(=O)C#C CUR-0016542 [0,1,0,0,0,0|2,0,0]=3 146 B5R0.3 CNC(=O)CCl CUR-0099536 [0,1,0,0,0,0|2,0,0]=3 147 B5R0.3 CNC(=O)NC CUR-0101521 [0,1,0,0,0,0|2,0,0]=3 148 B5R0.3 CNC(=S)NC CUR-0101643 [0,1,0,0,0,0|2,1,0]=4 149 B5R0.3 CNC(=S)NN CUR-0026769 [0,1,0,0,0,0|2,1,0]=4 150 B5R0.3 COC(=N)CCl CUR-0101034 [0,1,0,0,0,0|2,0,0]=3 151 B5R0.3 COC(=O)C#C CUR-0008050 [0,1,0,0,0,0|1,0,1]=3 152 B5R0.3 COC(=O)C=C CUR-0018588 [0,1,0,0,0,0|1,0,1]=3 153 B5R0.3 COC(=O)CBr CUR-0102451 [0,1,0,0,0,0|1,0,0]=2 154 B5R0.3 COC(=O)CCl CUR-0019510 [0,1,0,0,0,0|1,0,0]=2 155 B5R0.3 COC(=O)CN CUR-0016914 [0,1,0,0,0,0|1,0,0]=2 156 B5R0.3 COC(=O)CO CUR-0101535 [0,1,0,0,0,0|1,0,0]=2 157 B5R0.3 COC(=O)CS CUR-0014981 [0,1,0,0,0,0|1,0,0]=2 158 B5R0.3 COC(=O)NN CUR-0100906 [0,1,0,0,0,0|2,0,0]=3 159 B5R0.3 COC(=O)OC CUR-0101536 [0,1,0,0,0,0|1,0,0]=2 160 B5R0.3 COP(=O)OC CUR-0016444 [0,1,0,0,0,0|2,0,0]=3 161 B5R0.4 CC(C)(C)OO CUR-0122293 [0,1,0,0,0,0|1,0,1]=3 162 B5R0.4 CC(C)(CO)N CUR-0101533 [0,1,0,0,0,0|2,0,1]=4 163 B5R0.4 CS(=O)(=O)C=C CUR-0003882 [0,1,0,0,0,0|3,0,0]=4 164 B5R0.5 C(=O)(C(=O)Cl)Cl CUR-0022479 [0,1,0,0,0,0|2,0,1]=4 165 B5R0.5 C(=O)(C(=O)N)N CUR-0013129 [0,1,0,0,0,0|2,0,1]=4 166 B5R0.5 C(=O)(C(=O)O)O CUR-0022161 [0,1,0,0,0,0|2,0,0]=3 167 B5R0.5 C(=O)(C(=O)O)O CUR-0100644 [0,1,0,0,0,0|2,0,0]=3 168 B5R0.5 C(C(=O)Cl)(Cl)Cl CUR-0015043 [0,1,0,0,0,0|3,0,0]=4 169 B5R0.5 C(C(=O)O)(Cl)Cl CUR-0017246 [0,1,0,0,0,0|3,0,0]=4 170 B5R0.5 CC(=O)C(=O)C CUR-0014415 [0,1,0,0,0,0|1,0,1]=3 171 B5R0.5 CC(=O)C(=O)O CUR-0101513 [0,1,0,0,0,0|1,0,0]=2 172 B5R0.5 CC(=O)N(C)C CUR-0015735 [0,1,0,0,0,0|2,0,0]=3 173 B5R0.5 CC(C(=O)Br)Br CUR-0103656 [0,1,0,0,0,0|3,0,0]=4 174 B5R0.5 CC(C(=O)C)Cl CUR-0002968 [0,1,0,0,0,0|2,0,0]=3 175 B5R0.5 CC(C(=O)C)O CUR-0101517 [0,1,0,0,0,0|1,0,0]=2 176 B5R0.5 CC(C(=O)Cl)Cl CUR-0025103 [0,1,0,0,0,0|3,0,0]=4 177 B5R0.5 CC(C(=O)O)Cl CUR-0027467 [0,1,0,0,0,0|2,0,1]=4 178 B5R0.5 CC(C(=O)O)N CUR-0005753 [0,1,0,0,0,0|2,0,1]=4 179 B5R0.5 CC(C(=O)O)O CUR-0100772 [0,1,0,0,0,0|2,0,0]=3 180 B5R0.5 CC(C(=O)O)S CUR-0001712 [0,1,0,0,0,0|1,1,1]=4 181 B5R0.5 CC(C)C(=O)C CUR-0101503 [0,1,0,0,0,0|2,0,0]=3 182 B5R0.5 CC(C)C(=O)Cl CUR-0101654 [0,1,0,0,0,0|3,0,0]=4 183 B5R0.5 CC(C)C(=O)O CUR-0023620 [0,1,0,0,0,0|2,0,1]=4 184 B5R0.5 CN(C)C(=O)Cl CUR-0021018 [0,1,0,0,0,0|3,0,0]=4 185 B5R0.5 C[C@@H](C(=O)N)N CUR-0101872 [0,1,0,0,0,0|3,0,0]=4 186 B5R0.5 C[C@@H](C(=O)O)N CUR-0101526 [0,1,0,0,0,0|2,0,1]=4 187 B5R1.2 C1C(CO1)O CUR-0028981 [0,0,0,1,0,0|1,0,2]=4 188 B5R1.2 C1CC(=O)C1 CUR-0005686 [0,0,0,1,0,0|2,0,0]=3 189 B5R1.3 C1C(O1)CO CUR-0011597 [0,0,0,1,0,0|1,0,2]=4 190 B5R1.3 C1CC1CO CUR-0016442 [0,0,0,1,0,0|2,0,1]=4 191 B2R0.1 C(=O)N CUR-0026798 [2,0,0,0,0,0|1,0,0]=3 192 B2R0.1 C(=O)O CUR-0018439 [2,0,0,0,0,0|0,0,0]=2 193 B2R0.1 CC=O CUR-0008743 [2,0,0,0,0,0|0,0,0]=2 194 B2R0.1 CCBr CUR-0012119 [2,0,0,0,0,0|1,0,1]=4 195 B2R0.1 CCI CUR-0000443 [2,0,0,0,0,0|1,0,1]=4 196 B2R0.1 CCN CUR-0101229 [2,0,0,0,0,0|1,0,1]=4 197 B2R0.1 CCS CUR-0022672 [2,0,0,0,0,0|0,1,1]=4 198 B2R0.1 CNC CUR-0026541 [2,0,0,0,0,0|2,0,0]=4 199 B2R0.1 CNC CUR-0101266 [2,0,0,0,0,0|2,0,0]=4 200 B2R0.1 CNN CUR-0101255 [2,0,0,0,0,0|2,0,0]=4 201 B2R0.1 CON CUR-0007384 [2,0,0,0,0,0|1,0,0]=3 202 B4R0.2 C(CN)CO CUR-0005687 [1,1,0,0,0,0|1,0,1]=4 203 B4R0.2 C(CO)CCl CUR-0004180 [1,1,0,0,0,0|1,0,1]=4 204 B4R0.2 C(CO)CO CUR-0007262 [1,1,0,0,0,0|1,0,1]=4 205 B4R0.2 C=CCCO CUR-0101449 [1,1,0,0,0,0|1,0,1]=4 206 B4R0.2 CC=CC#N CUR-0028876 [1,1,0,0,0,0|2,0,0]=4 207 B4R0.2 CCCC=O CUR-0100896 [1,1,0,0,0,0|2,0,0]=4 208 B4R0.2 CCCCO CUR-0016718 [1,1,0,0,0,0|1,0,1]=4 209 B4R0.2 CCOC=C CUR-0100764 [1,1,0,0,0,0|1,0,1]=4 210 B4R0.2 CCOC=O CUR-0010493 [1,1,0,0,0,0|1,0,0]=3 211 B4R0.2 CNCCO CUR-0011813 [1,1,0,0,0,0|1,0,1]=4 212 B4R0.2 COCCBr CUR-0009505 [1,1,0,0,0,0|1,0,1]=4 213 B4R0.2 COCCCl CUR-0000941 [1,1,0,0,0,0|1,0,1]=4 214 B4R0.2 COCCN CUR-0012344 [1,1,0,0,0,0|1,0,1]=4 215 B4R0.2 COCCO CUR-0101466 [1,1,0,0,0,0|1,0,1]=4 216 B4R0.2 COCOC CUR-0101465 [1,1,0,0,0,0|1,0,1]=4 217 B4R0.2 C\C=C\C#N CUR-0101432 [1,1,0,0,0,0|2,0,0]=4 218 B4R0.2 C\C=C\C=O CUR-0001472 [1,1,0,0,0,0|1,0,1]=4 219 B4R0.3 CC(C)(C)O CUR-0002925 [1,1,0,0,0,0|1,0,1]=4 220 B4R0.3 CP(=O)(C)[O-] CUR-0012653 [1,1,0,0,0,0|1,0,1]=4 221 B4R0.3 CS(=O)(=O)Cl CUR-0028112 [1,1,0,0,0,0|1,0,1]=4 222 B4R0.3 CS(=O)(=O)N CUR-0017808 [1,1,0,0,0,0|1,0,1]=4 223 B4R0.3 CS(=O)(=O)O CUR-0017504 [1,1,0,0,0,0|1,0,0]=3 224 B4R0.3 C[S+](=O)(C)C CUR-0021799 [1,1,0,0,0,0|2,0,0]=4 225 B4R0.3 OS(=O)(=O)O CUR-0103589 [1,1,0,0,0,0|2,0,0]=4 226 B6R0.1 C(C#N)C(=O)NN CUR-0005368 [0,2,0,0,0,0|2,0,0]=4 227 B6R0.1 CCC(=O)OCC CUR-0101621 [0,2,0,0,0,0|1,0,0]=3 228 B6R0.1 CCNC(=O)C#C CUR-0067040 [0,2,0,0,0,0|2,0,0]=4 229 B6R0.1 CCNC(=O)CCl CUR-0099539 [0,2,0,0,0,0|2,0,0]=4 230 B6R0.1 CCOC(=O)C#C CUR-0101411 [0,2,0,0,0,0|1,0,1]=4 231 B6R0.1 CCOC(=O)C#N CUR-0012085 [0,2,0,0,0,0|1,0,1]=4 232 B6R0.1 CCOC(=O)C=C CUR-0027721 [0,2,0,0,0,0|1,0,1]=4 233 B6R0.1 CCOC(=O)C=O CUR-0101612 [0,2,0,0,0,0|1,0,1]=4 234 B6R0.1 CCOC(=O)CBr CUR-0001682 [0,2,0,0,0,0|1,0,0]=3 235 B6R0.1 CCOC(=O)CCl CUR-0015757 [0,2,0,0,0,0|1,0,0]=3 236 B6R0.1 CCOC(=O)CF CUR-0101650 [0,2,0,0,0,0|1,0,0]=3 237 B6R0.1 CCOC(=O)CN CUR-0024509 [0,2,0,0,0,0|1,0,0]=3 238 B6R0.1 CCOC(=O)CO CUR-0101638 [0,2,0,0,0,0|1,0,0]=3 239 B6R0.1 CNC(=O)CC#N CUR-0098025 [0,2,0,0,0,0|2,0,0]=4 240 B6R0.1 CNCC(=O)OC CUR-0102132 [0,2,0,0,0,0|1,0,0]=3 241 B6R0.1 COC(=N)CC#N CUR-0101103 [0,2,0,0,0,0|2,0,0]=4 242 B6R0.1 COC(=O)CC#N CUR-0022414 [0,2,0,0,0,0|1,0,0]=3 243 B6R0.1 COC(=O)CCS CUR-0005277 [0,2,0,0,0,0|1,0,0]=3 244 B6R0.1 COCC(=O)OC CUR-0101636 [0,2,0,0,0,0|1,0,0]=3 245 B6R0.1 C\C=C\C(=O)OC CUR-0101585 [0,2,0,0,0,0|1,0,0]=3 246 B6R0.2 C(C(=O)O)C(=O)O CUR-0011839 [0,2,0,0,0,0|2,0,0]=4 247 B6R0.2 CC(=CC(=O)O)C CUR-0101587 [0,2,0,0,0,0|2,0,0]=4 248 B6R0.2 CC(=O)CC(=O)C CUR-0004776 [0,2,0,0,0,0|1,0,1]=4 249 B6R0.2 CC(=O)CC(=O)N CUR-0101600 [0,2,0,0,0,0|1,0,1]=4 250 B6R0.2 CC(=O)NC(=S)N CUR-0002878 [0,2,0,0,0,0|1,1,0]=4 251 B6R0.2 CC(C)CC(=O)C CUR-0017562 [0,2,0,0,0,0|2,0,0]=4 252 B6R0.2 CC(C)OC(=O)Cl CUR-0100902 [0,2,0,0,0,0|2,0,0]=4 253 B6R0.2 CC(OC(=O)Cl)Cl CUR-0007306 [0,2,0,0,0,0|2,0,0]=4 254 B6R0.3 C(C(=O)C(Cl)Cl)Cl CUR-0013381 [0,2,0,0,0,0|2,0,0]=4 255 B6R0.3 C(C(C(=O)O)N)O CUR-0101646 [0,2,0,0,0,0|2,0,0]=4 256 B6R0.3 C([C@@H](C(=O)O)N)O CUR-0101109 [0,2,0,0,0,0|2,0,0]=4 257 B6R0.3 CC(=C)C(=O)OC CUR-0012718 [0,2,0,0,0,0|1,0,0]=3 258 B6R0.3 CC(=O)C(=O)OC CUR-0100866 [0,2,0,0,0,0|1,0,0]=3 259 B6R0.3 CC(C(=O)OC)Br CUR-0102802 [0,2,0,0,0,0|1,0,0]=3 260 B6R0.3 CC(C)C(=N)OC CUR-0101310 [0,2,0,0,0,0|2,0,0]=4 261 B6R0.3 CC(C)C(=NO)N CUR-0027209 [0,2,0,0,0,0|2,0,0]=4 262 B6R0.3 CN(C)C(=O)C#C CUR-0066918 [0,2,0,0,0,0|2,0,0]=4 263 B6R0.3 CN(C)C(=O)NN CUR-0100988 [0,2,0,0,0,0|2,0,0]=4 264 B6R0.3 COC(=O)C(Cl)Cl CUR-0010880 [0,2,0,0,0,0|1,0,0]=3 265 B6R0.3 C\C(=N\O)\C(=O)C CUR-0101601 [0,2,0,0,0,0|1,0,0]=3 266 B6R0.4 CC(=O)CCCCl CUR-0004280 [0,2,0,0,0,0|2,0,0]=4 267 B6R0.4 CCCCC(=O)C CUR-0101595 [0,2,0,0,0,0|2,0,0]=4 268 B6R0.4 CCOCC(=O)O CUR-0101637 [0,2,0,0,0,0|2,0,0]=4 269 B6R0.4 COCCC(=O)O CUR-0012995 [0,2,0,0,0,0|2,0,0]=4 270 B6R0.5 CS(=O)(=O)CCO CUR-0101869 [0,2,0,0,0,0|2,0,0]=4 271 B6R0.8 COP(=O)(C)OC CUR-0009223 [0,2,0,0,0,0|2,0,0]=4 272 B6R0.8 COS(=O)(=O)OC CUR-0007713 [0,2,0,0,0,0|2,0,0]=4 273 B6R0.7 CC(=O)C(C)(C)C CUR-0101594 [0,2,0,0,0,0|2,0,0]=4 274 B4R1.2 CC1CO1 CUR-0006075 [1,0,0,1,0,0|1,0,1]=4 275 B6R1.2 C1CC(=O)C=C1 CUR-0001940 [0,1,0,1,0,0|2,0,0]=4 276 B6R1.2 C1CC(=O)NC1 CUR-0017206 [0,1,0,1,0,0|2,0,0]=4 277 B6R1.2 C1CC(=O)OC1 CUR-0101496 [0,1,0,1,0,0|1,0,0]=3 278 B6R1.2 C1CCC(=O)C1 CUR-0027028 [0,1,0,1,0,0|2,0,0]=4 279 B6R1.2 C1CNC(=O)N1 CUR-0017995 [0,1,0,1,0,0|2,0,0]=4 280 B6R1.2 C1CNC(=O)N1 CUR-0101499 [0,1,0,1,0,0|2,0,0]=4 281 B6R1.2 C1COC(=O)N1 CUR-0101507 [0,1,0,1,0,0|1,0,0]=3 282 B6R1.2 C1CSCC1=O CUR-0101623 [0,1,0,1,0,0|1,1,0]=4 283 B6R1.2 Cc1ccco1 CUR-0026171 [0,1,0,1,0,0|2,0,0]=4 284 B6R1.2 Cc1ccno1 CUR-0100786 [0,1,0,1,0,0|2,0,0]=4 285 B6R1.8 C=C1CC1CO CUR-0163362 [0,1,0,1,0,0|2,0,0]=4 286 B6R1.11 CC(=O)C1CC1 CUR-0020622 [0,1,0,1,0,0|2,0,0]=4