0 B5R0.1 C(C#N)C(=O)N CUR-0015106 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.1 C(C#N)C(=O)O CUR-0011506 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.1 C(CBr)C(=O)O CUR-0102453 [0,0,0,0,0,0|3,0,0]=3 3 B5R0.1 C(CCl)C(=O)Cl CUR-0009101 [0,0,0,0,0,0|3,0,0]=3 4 B5R0.1 C(CCl)C(=O)O CUR-0008480 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.1 C(CN)C(=O)O CUR-0006907 [0,0,0,0,0,0|3,0,0]=3 6 B5R0.1 C(CN)C(=O)[O-] CUR-0101293 [0,0,0,0,0,0|3,0,0]=3 7 B5R0.1 C(CS)C(=O)O CUR-0101651 [0,0,0,0,0,0|3,0,0]=3 8 B5R0.1 CC(=CCBr)C CUR-0059675 [0,0,0,0,0,0|3,0,0]=3 9 B5R0.1 CC(=CCCl)C CUR-0022594 [0,0,0,0,0,0|3,0,0]=3 10 B5R0.1 CC(=O)COC CUR-0101516 [0,0,0,0,0,0|2,0,0]=2 11 B5R0.1 CC(=O)OC=C CUR-0001318 [0,0,0,0,0,0|0,1,2]=3 12 B5R0.1 CC(C)CCBr CUR-0002757 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.1 CC(C)CCN CUR-0101511 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.1 CC(C)CCO CUR-0003416 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.1 CC(CCO)O CUR-0003759 [0,0,0,0,0,0|2,0,2]=4 16 B5R0.1 CC(COC)N CUR-0101532 [0,0,0,0,0,0|3,0,1]=4 17 B5R0.1 CC(CSC)N CUR-0019523 [0,0,0,0,0,0|3,0,1]=4 18 B5R0.1 CCCC(=O)C CUR-0026599 [0,0,0,0,0,0|1,0,0]=1 19 B5R0.1 CCCC(=O)Cl CUR-0020308 [0,0,0,0,0,0|2,0,0]=2 20 B5R0.1 CCCC(=O)O CUR-0020198 [0,0,0,0,0,0|2,0,0]=2 21 B5R0.1 CCCC(C)O CUR-0023615 [0,0,0,0,0,0|1,0,2]=3 22 B5R0.1 CCC[N+](=O)[O-] CUR-0101527 [0,0,0,0,0,0|3,0,0]=3 23 B5R0.1 CCOC(=O)C CUR-0101519 [0,0,0,0,0,0|0,1,0]=1 24 B5R0.1 CCOC(=O)Cl CUR-0026181 [0,0,0,0,0,0|1,1,0]=2 25 B5R0.1 CCOC(=O)N CUR-0100824 [0,0,0,0,0,0|1,1,0]=2 26 B5R0.1 CN(C)CCCl CUR-0017041 [0,0,0,0,0,0|4,0,0]=4 27 B5R0.1 CN(C)CCN CUR-0101525 [0,0,0,0,0,0|4,0,0]=4 28 B5R0.1 CN(C)CCO CUR-0019188 [0,0,0,0,0,0|4,0,0]=4 29 B5R0.1 CNCC(=O)O CUR-0018005 [0,0,0,0,0,0|3,0,0]=3 30 B5R0.1 COCC(=O)Cl CUR-0101665 [0,0,0,0,0,0|3,0,0]=3 31 B5R0.1 COCC(=O)O CUR-0014449 [0,0,0,0,0,0|3,0,0]=3 32 B5R0.1 CSCC(=N)N CUR-0100998 [0,0,0,0,0,0|4,0,0]=4 33 B5R0.1 CSCC(=O)O CUR-0025987 [0,0,0,0,0,0|3,0,0]=3 34 B5R0.1 C\C(=C\C#N)\N CUR-0009988 [0,0,0,0,0,0|3,0,1]=4 35 B5R0.1 C\C=C\C(=O)O CUR-0100765 [0,0,0,0,0,0|2,0,1]=3 36 B4R0.1 C#CC(=O)O CUR-0101441 [1,0,0,0,0,0|1,0,2]=4 37 B4R0.1 C(=O)(N)NN CUR-0003223 [1,0,0,0,0,0|3,0,0]=4 38 B4R0.1 C(=O)(N)NO CUR-0001014 [1,0,0,0,0,0|3,0,0]=4 39 B4R0.1 C(=O)C(=O)O CUR-0021308 [1,0,0,0,0,0|2,0,1]=4 40 B4R0.1 C(C(=N)N)Cl CUR-0085287 [1,0,0,0,0,0|3,0,0]=4 41 B4R0.1 C(C(=O)Br)Br CUR-0006369 [1,0,0,0,0,0|2,0,0]=3 42 B4R0.1 C(C(=O)Cl)Cl CUR-0004550 [1,0,0,0,0,0|2,0,0]=3 43 B4R0.1 C(C(=O)N)Br CUR-0014813 [1,0,0,0,0,0|2,0,0]=3 44 B4R0.1 C(C(=O)N)Cl CUR-0007516 [1,0,0,0,0,0|2,0,0]=3 45 B4R0.1 C(C(=O)N)N CUR-0101687 [1,0,0,0,0,0|2,0,0]=3 46 B4R0.1 C(C(=O)N)O CUR-0113957 [1,0,0,0,0,0|2,0,0]=3 47 B4R0.1 C(C(=O)O)Br CUR-0100788 [1,0,0,0,0,0|2,0,0]=3 48 B4R0.1 C(C(=O)O)Cl CUR-0003311 [1,0,0,0,0,0|2,0,0]=3 49 B4R0.1 C(C(=O)O)I CUR-0003176 [1,0,0,0,0,0|2,0,0]=3 50 B4R0.1 C(C(=O)O)N CUR-0014574 [1,0,0,0,0,0|2,0,0]=3 51 B4R0.1 C(C(=O)O)N CUR-0101231 [1,0,0,0,0,0|2,0,0]=3 52 B4R0.1 C(C(=O)O)O CUR-0014667 [1,0,0,0,0,0|2,0,0]=3 53 B4R0.1 C(C(=O)O)S CUR-0101545 [1,0,0,0,0,0|2,0,0]=3 54 B4R0.1 C(O)S(=O)[O-] CUR-0023303 [1,0,0,0,0,0|3,0,0]=4 55 B4R0.1 C=CC(=O)Cl CUR-0101542 [1,0,0,0,0,0|1,0,2]=4 56 B4R0.1 C=CC(=O)N CUR-0007166 [1,0,0,0,0,0|1,0,2]=4 57 B4R0.1 C=CC(=O)O CUR-0028045 [1,0,0,0,0,0|1,0,2]=4 58 B4R0.1 CC(=C)C=O CUR-0101443 [1,0,0,0,0,0|2,0,1]=4 59 B4R0.1 CC(=C)CCl CUR-0011941 [1,0,0,0,0,0|2,0,0]=3 60 B4R0.1 CC(=C)OC CUR-0101450 [1,0,0,0,0,0|1,1,0]=3 61 B4R0.1 CC(=O)C=C CUR-0013098 [1,0,0,0,0,0|0,0,2]=3 62 B4R0.1 CC(=O)C=O CUR-0101448 [1,0,0,0,0,0|1,0,1]=3 63 B4R0.1 CC(=O)CCl CUR-0002239 [1,0,0,0,0,0|1,0,0]=2 64 B4R0.1 CC(=O)CO CUR-0005016 [1,0,0,0,0,0|1,0,0]=2 65 B4R0.1 CC(C)CBr CUR-0024115 [1,0,0,0,0,0|2,0,1]=4 66 B4R0.1 CC(C)CI CUR-0028804 [1,0,0,0,0,0|2,0,1]=4 67 B4R0.1 CC(C)CN CUR-0020747 [1,0,0,0,0,0|2,0,1]=4 68 B4R0.1 CC(C)CO CUR-0012302 [1,0,0,0,0,0|2,0,1]=4 69 B4R0.1 CC(CN)N CUR-0101461 [1,0,0,0,0,0|2,0,1]=4 70 B4R0.1 CC(CN)O CUR-0024952 [1,0,0,0,0,0|1,0,2]=4 71 B4R0.1 CC(CN)S CUR-0003165 [1,0,0,0,0,0|1,1,1]=4 72 B4R0.1 CC(CO)O CUR-0022593 [1,0,0,0,0,0|1,0,2]=4 73 B4R0.1 CC(CS)N CUR-0021165 [1,0,0,0,0,0|2,0,1]=4 74 B4R0.1 CCC(=O)Cl CUR-0101547 [1,0,0,0,0,0|1,0,0]=2 75 B4R0.1 CCC(=O)N CUR-0101453 [1,0,0,0,0,0|1,0,0]=2 76 B4R0.1 CCC(=O)O CUR-0010221 [1,0,0,0,0,0|1,0,0]=2 77 B4R0.1 CCC(C)Br CUR-0102085 [1,0,0,0,0,0|1,0,1]=3 78 B4R0.1 CCC(C)I CUR-0055396 [1,0,0,0,0,0|1,0,1]=3 79 B4R0.1 CCC(C)N CUR-0001789 [1,0,0,0,0,0|1,0,1]=3 80 B4R0.1 CCN(C)C CUR-0101456 [1,0,0,0,0,0|2,0,0]=3 81 B4R0.1 CC[N+](=O)[O-] CUR-0012449 [1,0,0,0,0,0|2,0,0]=3 82 B4R0.1 CNC(=O)N CUR-0025342 [1,0,0,0,0,0|2,0,0]=3 83 B4R0.1 CNC(=S)N CUR-0004136 [1,0,0,0,0,0|2,1,0]=4 84 B4R0.1 COC(=N)N CUR-0101458 [1,0,0,0,0,0|2,1,0]=4 85 B4R0.1 COC(=O)Cl CUR-0019109 [1,0,0,0,0,0|1,1,0]=3 86 B4R0.1 CSC(=N)N CUR-0104011 [1,0,0,0,0,0|2,0,0]=3 87 B4R0.1 C\C(=N\O)\N CUR-0098903 [1,0,0,0,0,0|3,0,0]=4 88 B4R0.2 C=CCCBr CUR-0002027 [1,0,0,0,0,0|2,0,1]=4 89 B4R0.2 C=CCCI CUR-0000685 [1,0,0,0,0,0|2,0,1]=4 90 B4R0.2 C=CCCO CUR-0101449 [1,0,0,0,0,0|2,0,1]=4 91 B4R0.2 CC#CCBr CUR-0102000 [1,0,0,0,0,0|2,0,1]=4 92 B4R0.2 CC=CC#N CUR-0028876 [1,0,0,0,0,0|2,0,1]=4 93 B4R0.2 CCCC#N CUR-0101440 [1,0,0,0,0,0|2,0,1]=4 94 B4R0.2 CCCC=O CUR-0100896 [1,0,0,0,0,0|1,0,0]=2 95 B4R0.2 CCCCBr CUR-0023794 [1,0,0,0,0,0|2,0,1]=4 96 B4R0.2 CCCCCl CUR-0023945 [1,0,0,0,0,0|2,0,1]=4 97 B4R0.2 CCCCI CUR-0001021 [1,0,0,0,0,0|2,0,1]=4 98 B4R0.2 CCCCN CUR-0017800 [1,0,0,0,0,0|2,0,1]=4 99 B4R0.2 CCCCN CUR-0101317 [1,0,0,0,0,0|2,0,1]=4 100 B4R0.2 CCCCO CUR-0016718 [1,0,0,0,0,0|1,0,2]=4 101 B4R0.2 CCCNN CUR-0022831 [1,0,0,0,0,0|3,0,0]=4 102 B4R0.2 CCN=C=O CUR-0101447 [1,0,0,0,0,0|1,0,1]=3 103 B4R0.2 CCN=C=S CUR-0006416 [1,0,0,0,0,0|1,1,1]=4 104 B4R0.2 CCNCC CUR-0022731 [1,0,0,0,0,0|1,0,1]=3 105 B4R0.2 CCNCC CUR-0101285 [1,0,0,0,0,0|1,0,1]=3 106 B4R0.2 CCOC=C CUR-0100764 [1,0,0,0,0,0|0,1,1]=3 107 B4R0.2 CCOC=O CUR-0010493 [1,0,0,0,0,0|0,1,0]=2 108 B4R0.2 CNCCI CUR-0017490 [1,0,0,0,0,0|3,0,0]=4 109 B4R0.2 CNCCO CUR-0011813 [1,0,0,0,0,0|3,0,0]=4 110 B4R0.2 COCCBr CUR-0009505 [1,0,0,0,0,0|3,0,0]=4 111 B4R0.2 COCCCl CUR-0000941 [1,0,0,0,0,0|3,0,0]=4 112 B4R0.2 COCCN CUR-0012344 [1,0,0,0,0,0|3,0,0]=4 113 B4R0.2 COCCO CUR-0101466 [1,0,0,0,0,0|3,0,0]=4 114 B4R0.2 COCOC CUR-0101465 [1,0,0,0,0,0|3,0,0]=4 115 B4R0.2 CSCCN CUR-0101544 [1,0,0,0,0,0|3,0,0]=4 116 B4R0.2 C\C=C\C#N CUR-0101432 [1,0,0,0,0,0|2,0,1]=4 117 B4R0.2 C\C=C\C=O CUR-0001472 [1,0,0,0,0,0|1,0,1]=3 118 B6R0.1 CCC(=O)OCC CUR-0101621 [0,1,0,0,0,0|0,1,0]=2 119 B6R0.1 CCCC(C)C=O CUR-0101597 [0,1,0,0,0,0|1,0,1]=3 120 B6R0.1 CCNC(=O)C#C CUR-0067040 [0,1,0,0,0,0|1,0,1]=3 121 B6R0.1 CCNC(=O)CCl CUR-0099539 [0,1,0,0,0,0|1,0,0]=2 122 B6R0.1 CCOC(=O)C#C CUR-0101411 [0,1,0,0,0,0|0,1,1]=3 123 B6R0.1 CCOC(=O)C#N CUR-0012085 [0,1,0,0,0,0|0,1,1]=3 124 B6R0.1 CCOC(=O)C=C CUR-0027721 [0,1,0,0,0,0|0,1,1]=3 125 B6R0.1 CCOC(=O)C=O CUR-0101612 [0,1,0,0,0,0|0,1,1]=3 126 B6R0.1 CCOC(=O)CBr CUR-0001682 [0,1,0,0,0,0|0,1,0]=2 127 B6R0.1 CCOC(=O)CCl CUR-0015757 [0,1,0,0,0,0|0,1,0]=2 128 B6R0.1 CCOC(=O)CF CUR-0101650 [0,1,0,0,0,0|0,1,0]=2 129 B6R0.1 CCOC(=O)CN CUR-0024509 [0,1,0,0,0,0|0,1,0]=2 130 B6R0.1 CCOC(=O)CO CUR-0101638 [0,1,0,0,0,0|0,1,0]=2 131 B6R0.1 CNC(=O)CC#N CUR-0098025 [0,1,0,0,0,0|2,0,1]=4 132 B6R0.1 CNCC(=O)OC CUR-0102132 [0,1,0,0,0,0|2,0,0]=3 133 B6R0.1 COC(=O)CC#N CUR-0022414 [0,1,0,0,0,0|2,0,1]=4 134 B6R0.1 COC(=O)CCS CUR-0005277 [0,1,0,0,0,0|2,0,0]=3 135 B6R0.1 COCC(=O)OC CUR-0101636 [0,1,0,0,0,0|2,0,0]=3 136 B6R0.1 C\C=C\C(=O)OC CUR-0101585 [0,1,0,0,0,0|1,0,1]=3 137 B6R0.2 CC(=CC(=O)O)C CUR-0101587 [0,1,0,0,0,0|2,0,1]=4 138 B6R0.2 CC(=O)CC(=O)C CUR-0004776 [0,1,0,0,0,0|1,0,1]=3 139 B6R0.2 CC(=O)CC(=O)N CUR-0101600 [0,1,0,0,0,0|2,0,1]=4 140 B6R0.2 CC(=O)NC(=S)N CUR-0002878 [0,1,0,0,0,0|2,0,1]=4 141 B6R0.2 CC(C)CC(=O)C CUR-0017562 [0,1,0,0,0,0|1,0,0]=2 142 B6R0.2 CC(C)CC(=O)Cl CUR-0101806 [0,1,0,0,0,0|2,0,0]=3 143 B6R0.2 CC(C)CC(=O)O CUR-0017645 [0,1,0,0,0,0|2,0,0]=3 144 B6R0.2 CC(C)NC(C)C CUR-0028446 [0,1,0,0,0,0|2,0,1]=4 145 B6R0.2 CC(C)OC(=O)Cl CUR-0100902 [0,1,0,0,0,0|1,1,0]=3 146 B6R0.2 CC(OC(=O)Cl)Cl CUR-0007306 [0,1,0,0,0,0|1,1,0]=3 147 B6R0.3 C(C(C(=O)O)Br)Br CUR-0100855 [0,1,0,0,0,0|3,0,0]=4 148 B6R0.3 C(C(C(=O)O)N)O CUR-0101646 [0,1,0,0,0,0|3,0,0]=4 149 B6R0.3 C(C(C(=O)O)N)S CUR-0101261 [0,1,0,0,0,0|3,0,0]=4 150 B6R0.3 C([C@@H](C(=O)O)N)O CUR-0101109 [0,1,0,0,0,0|3,0,0]=4 151 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0004971 [0,1,0,0,0,0|3,0,0]=4 152 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0101810 [0,1,0,0,0,0|3,0,0]=4 153 B6R0.3 CC(=C)C(=O)OC CUR-0012718 [0,1,0,0,0,0|3,0,0]=4 154 B6R0.3 CC(=O)C(=O)OC CUR-0100866 [0,1,0,0,0,0|2,0,0]=3 155 B6R0.3 CCC(C(=O)N)Br CUR-0027495 [0,1,0,0,0,0|2,0,0]=3 156 B6R0.3 CCC(C(=O)O)Br CUR-0102801 [0,1,0,0,0,0|2,0,0]=3 157 B6R0.3 CCC(C(=O)O)N CUR-0010659 [0,1,0,0,0,0|2,0,0]=3 158 B6R0.3 CCC(C(C)O)N CUR-0067426 [0,1,0,0,0,0|1,0,2]=4 159 B6R0.3 CCC(C)C(=O)O CUR-0101619 [0,1,0,0,0,0|2,0,0]=3 160 B6R0.3 C\C(=N\O)\C(=O)C CUR-0101601 [0,1,0,0,0,0|3,0,0]=4 161 B6R0.4 C(CC(=O)Cl)CBr CUR-0103177 [0,1,0,0,0,0|2,0,0]=3 162 B6R0.4 C(CC(=O)Cl)CCl CUR-0020663 [0,1,0,0,0,0|2,0,0]=3 163 B6R0.4 C(CC(=O)O)CN CUR-0010241 [0,1,0,0,0,0|2,0,0]=3 164 B6R0.4 C(CNC(=O)N)N CUR-0013187 [0,1,0,0,0,0|2,0,0]=3 165 B6R0.4 C=CCCC(=O)O CUR-0101586 [0,1,0,0,0,0|2,0,1]=4 166 B6R0.4 CC(=O)CCCCl CUR-0004280 [0,1,0,0,0,0|1,0,0]=2 167 B6R0.4 CC(C)NCCO CUR-0101633 [0,1,0,0,0,0|2,0,1]=4 168 B6R0.4 CCCCC(=O)C CUR-0101595 [0,1,0,0,0,0|1,0,0]=2 169 B6R0.4 CCCCC(=O)Cl CUR-0101805 [0,1,0,0,0,0|2,0,0]=3 170 B6R0.4 CCCCC(=O)O CUR-0101620 [0,1,0,0,0,0|2,0,0]=3 171 B6R0.4 CCOCC(=O)O CUR-0101637 [0,1,0,0,0,0|1,1,0]=3 172 B6R0.4 CN(C)CCCN CUR-0101628 [0,1,0,0,0,0|3,0,0]=4 173 B6R0.4 CN(C)CCCO CUR-0020324 [0,1,0,0,0,0|3,0,0]=4 174 B6R0.4 COCCC(=O)O CUR-0012995 [0,1,0,0,0,0|2,0,0]=3 175 B6R0.5 CCCS(=O)(=O)Cl CUR-0006923 [0,1,0,0,0,0|3,0,0]=4 176 B6R0.5 CS(=O)(=O)CCO CUR-0101869 [0,1,0,0,0,0|3,0,0]=4 177 B6R1.2 C1CC(=O)C=C1 CUR-0001940 [0,0,0,1,0,0|1,0,1]=3 178 B6R1.2 C1CC(=O)NC1 CUR-0017206 [0,0,0,1,0,0|1,0,0]=2 179 B6R1.2 C1CC(=O)OC1 CUR-0101496 [0,0,0,1,0,0|0,1,0]=2 180 B6R1.2 C1CCC(=O)C1 CUR-0027028 [0,0,0,1,0,0|1,0,0]=2 181 B6R1.2 C1CCC(C1)Br CUR-0025546 [0,0,0,1,0,0|2,0,1]=4 182 B6R1.2 C1CCC(C1)N CUR-0006172 [0,0,0,1,0,0|2,0,1]=4 183 B6R1.2 C1CCC(C1)O CUR-0021370 [0,0,0,1,0,0|1,0,2]=4 184 B6R1.2 C1CNC(=O)N1 CUR-0017995 [0,0,0,1,0,0|2,0,0]=3 185 B6R1.2 C1CNC(=O)N1 CUR-0101499 [0,0,0,1,0,0|2,0,0]=3 186 B6R1.2 C1CNC(=S)N1 CUR-0101624 [0,0,0,1,0,0|2,1,0]=4 187 B6R1.2 C1COC(=O)N1 CUR-0101507 [0,0,0,1,0,0|1,1,0]=3 188 B6R1.2 C1CSC(=N)N1 CUR-0101395 [0,0,0,1,0,0|2,0,0]=3 189 B6R1.2 C1CSC(=N1)N CUR-0013303 [0,0,0,1,0,0|2,0,0]=3 190 B6R1.2 C1CSC(=N1)N CUR-0101202 [0,0,0,1,0,0|2,0,0]=3 191 B6R1.2 C1CSC(=N1)S CUR-0101794 [0,0,0,1,0,0|1,1,0]=3 192 B6R1.2 C1CSCC1=O CUR-0101623 [0,0,0,1,0,0|2,0,0]=3 193 B6R1.2 CN1CCCC1 CUR-0101495 [0,0,0,1,0,0|3,0,0]=4 194 B6R1.2 Cc1cccs1 CUR-0101571 [0,0,0,1,0,0|1,0,2]=4 195 B6R1.8 C=C1CC1CO CUR-0163362 [0,0,0,1,0,0|3,0,0]=4 196 B6R1.11 C1CC1C(=O)Cl CUR-0101645 [0,0,0,1,0,0|2,0,0]=3 197 B6R1.11 C1CC1C(=O)O CUR-0027058 [0,0,0,1,0,0|2,0,0]=3 198 B6R1.11 CC(=O)C1CC1 CUR-0020622 [0,0,0,1,0,0|1,0,0]=2 199 B3R0.1 C(=O)C=O CUR-0024623 [2,0,0,0,0,0|1,0,1]=4 200 B3R0.1 C(=O)NN CUR-0101193 [2,0,0,0,0,0|2,0,0]=4 201 B3R0.1 C(C=O)Cl CUR-0018990 [2,0,0,0,0,0|1,0,0]=3 202 B3R0.1 C=CCBr CUR-0014802 [2,0,0,0,0,0|1,0,1]=4 203 B3R0.1 C=CCCl CUR-0002102 [2,0,0,0,0,0|1,0,1]=4 204 B3R0.1 C=CCI CUR-0024817 [2,0,0,0,0,0|1,0,1]=4 205 B3R0.1 C=CCN CUR-0009493 [2,0,0,0,0,0|1,0,1]=4 206 B3R0.1 C=CCO CUR-0101427 [2,0,0,0,0,0|1,0,1]=4 207 B3R0.1 CCC#N CUR-0100813 [2,0,0,0,0,0|1,0,1]=4 208 B3R0.1 CCC=O CUR-0015273 [2,0,0,0,0,0|0,0,0]=2 209 B3R0.1 CCCBr CUR-0028377 [2,0,0,0,0,0|1,0,1]=4 210 B3R0.1 CCCI CUR-0010202 [2,0,0,0,0,0|1,0,1]=4 211 B3R0.1 CCCN CUR-0000120 [2,0,0,0,0,0|1,0,1]=4 212 B3R0.1 CCCO CUR-0017382 [2,0,0,0,0,0|0,0,2]=4 213 B3R0.1 CCCS CUR-0009615 [2,0,0,0,0,0|0,1,1]=4 214 B3R0.1 CCNN CUR-0017500 [2,0,0,0,0,0|2,0,0]=4 215 B3R0.1 CNC=O CUR-0012781 [2,0,0,0,0,0|1,0,0]=3 216 B3R0.1 CNOC CUR-0015640 [2,0,0,0,0,0|1,1,0]=4 217 B3R0.1 COCCl CUR-0028317 [2,0,0,0,0,0|1,1,0]=4 218 B3R0.1 CSSC CUR-0101553 [2,0,0,0,0,0|1,0,0]=3 219 B3R0.2 C(=O)(N)N CUR-0004435 [2,0,0,0,0,0|2,0,0]=4 220 B3R0.2 CC(=N)N CUR-0023632 [2,0,0,0,0,0|2,0,0]=4 221 B3R0.2 CC(=O)Br CUR-0004133 [2,0,0,0,0,0|1,0,0]=3 222 B3R0.2 CC(=O)Cl CUR-0019985 [2,0,0,0,0,0|1,0,0]=3 223 B3R0.2 CC(=O)N CUR-0016336 [2,0,0,0,0,0|1,0,0]=3 224 B3R0.2 CC(=O)O CUR-0005925 [2,0,0,0,0,0|0,1,0]=3 225 B3R0.2 CC(=S)N CUR-0008655 [2,0,0,0,0,0|1,0,1]=4 226 B3R0.2 CC(C)Br CUR-0027321 [2,0,0,0,0,0|1,0,1]=4 227 B3R0.2 CC(C)Cl CUR-0022523 [2,0,0,0,0,0|1,0,1]=4 228 B3R0.2 CC(C)I CUR-0026227 [2,0,0,0,0,0|1,0,1]=4 229 B3R0.2 CC(C)N CUR-0024558 [2,0,0,0,0,0|1,0,1]=4 230 B3R0.2 CC(C)S CUR-0012379 [2,0,0,0,0,0|0,1,1]=4 231 B3R0.2 CN(C)C CUR-0004768 [2,0,0,0,0,0|2,0,0]=4 232 B3R0.2 CP(C)C CUR-0006076 [2,0,0,0,0,0|2,0,0]=4 233 B3R0.2 C[N+](=O)[O-] CUR-0016305 [2,0,0,0,0,0|1,1,0]=4 234 B3R0.2 C[S+](C)C CUR-0103505 [2,0,0,0,0,0|2,0,0]=4 235 B5R0.3 C(C(=O)CCl)Cl CUR-0101901 [1,1,0,0,0,0|1,0,0]=3 236 B5R0.3 CCC(=O)CC CUR-0101500 [1,1,0,0,0,0|0,0,0]=2 237 B5R0.3 CCC(C)CO CUR-0101523 [1,1,0,0,0,0|0,0,2]=4 238 B5R0.3 CCC(C)NN CUR-0004060 [1,1,0,0,0,0|1,0,1]=4 239 B5R0.3 CCC(CC)Br CUR-0020873 [1,1,0,0,0,0|1,0,1]=4 240 B5R0.3 CCC(CO)N CUR-0101528 [1,1,0,0,0,0|1,0,1]=4 241 B5R0.3 CC\C(=N/O)\N CUR-0010533 [1,1,0,0,0,0|1,0,1]=4 242 B5R0.3 CNC(=O)C#C CUR-0016542 [1,1,0,0,0,0|0,0,2]=4 243 B5R0.3 CNC(=O)CCl CUR-0099536 [1,1,0,0,0,0|1,0,0]=3 244 B5R0.3 CNC(=O)NC CUR-0101521 [1,1,0,0,0,0|1,0,0]=3 245 B5R0.3 CNC(=S)NC CUR-0101643 [1,1,0,0,0,0|1,1,0]=4 246 B5R0.3 COC(=N)CCl CUR-0101034 [1,1,0,0,0,0|1,1,0]=4 247 B5R0.3 COC(=O)C#C CUR-0008050 [1,1,0,0,0,0|0,0,2]=4 248 B5R0.3 COC(=O)C=C CUR-0018588 [1,1,0,0,0,0|0,0,2]=4 249 B5R0.3 COC(=O)CBr CUR-0102451 [1,1,0,0,0,0|0,1,0]=3 250 B5R0.3 COC(=O)CCl CUR-0019510 [1,1,0,0,0,0|0,1,0]=3 251 B5R0.3 COC(=O)CN CUR-0016914 [1,1,0,0,0,0|0,1,0]=3 252 B5R0.3 COC(=O)CO CUR-0101535 [1,1,0,0,0,0|0,1,0]=3 253 B5R0.3 COC(=O)CS CUR-0014981 [1,1,0,0,0,0|0,1,0]=3 254 B5R0.3 COC(=O)NN CUR-0100906 [1,1,0,0,0,0|1,1,0]=4 255 B5R0.3 COC(=O)OC CUR-0101536 [1,1,0,0,0,0|0,1,0]=3 256 B5R0.3 COP(=O)OC CUR-0016444 [1,1,0,0,0,0|1,1,0]=4 257 B5R0.4 CCC(C)(C)N CUR-0017274 [1,1,0,0,0,0|1,0,1]=4 258 B5R0.4 CCC(C)(C)O CUR-0012425 [1,1,0,0,0,0|0,0,2]=4 259 B5R0.4 CCS(=O)(=O)Cl CUR-0019376 [1,1,0,0,0,0|2,0,0]=4 260 B5R0.5 C(C(=O)Cl)(Cl)Cl CUR-0015043 [1,1,0,0,0,0|2,0,0]=4 261 B5R0.5 C(C(=O)O)(Cl)Cl CUR-0017246 [1,1,0,0,0,0|2,0,0]=4 262 B5R0.5 CC(=O)C(=O)C CUR-0014415 [1,1,0,0,0,0|0,0,1]=3 263 B5R0.5 CC(=O)C(=O)O CUR-0101513 [1,1,0,0,0,0|1,0,1]=4 264 B5R0.5 CC(=O)N(C)C CUR-0015735 [1,1,0,0,0,0|1,0,0]=3 265 B5R0.5 CC(C(=N)N)Cl CUR-0013780 [1,1,0,0,0,0|2,0,0]=4 266 B5R0.5 CC(C(=O)Br)Br CUR-0103656 [1,1,0,0,0,0|1,0,0]=3 267 B5R0.5 CC(C(=O)C)Cl CUR-0002968 [1,1,0,0,0,0|0,0,0]=2 268 B5R0.5 CC(C(=O)C)O CUR-0101517 [1,1,0,0,0,0|0,0,0]=2 269 B5R0.5 CC(C(=O)Cl)Cl CUR-0025103 [1,1,0,0,0,0|1,0,0]=3 270 B5R0.5 CC(C(=O)O)Cl CUR-0027467 [1,1,0,0,0,0|1,0,0]=3 271 B5R0.5 CC(C(=O)O)N CUR-0005753 [1,1,0,0,0,0|1,0,0]=3 272 B5R0.5 CC(C(=O)O)O CUR-0100772 [1,1,0,0,0,0|1,0,0]=3 273 B5R0.5 CC(C(=O)O)S CUR-0001712 [1,1,0,0,0,0|1,0,0]=3 274 B5R0.5 CC(C(C)Br)Br CUR-0103657 [1,1,0,0,0,0|1,0,1]=4 275 B5R0.5 CC(C)C(=N)N CUR-0101000 [1,1,0,0,0,0|2,0,0]=4 276 B5R0.5 CC(C)C(=O)C CUR-0101503 [1,1,0,0,0,0|0,0,0]=2 277 B5R0.5 CC(C)C(=O)Cl CUR-0101654 [1,1,0,0,0,0|1,0,0]=3 278 B5R0.5 CC(C)C(=O)O CUR-0023620 [1,1,0,0,0,0|1,0,0]=3 279 B5R0.5 CC(C)[N+](=O)[O-] CUR-0001597 [1,1,0,0,0,0|2,0,0]=4 280 B5R0.5 CN(C)C(=O)Cl CUR-0021018 [1,1,0,0,0,0|2,0,0]=4 281 B5R0.5 C[C@@H](C(=O)N)N CUR-0101872 [1,1,0,0,0,0|1,0,0]=3 282 B5R0.5 C[C@@H](C(=O)O)N CUR-0101526 [1,1,0,0,0,0|1,0,0]=3 283 B5R0.2 C(C=CCO)O CUR-0100969 [1,1,0,0,0,0|2,0,0]=4 284 B5R0.2 C(CCl)N=C=O CUR-0029062 [1,1,0,0,0,0|1,0,1]=4 285 B5R0.2 C(\C=C/CO)O CUR-0101515 [1,1,0,0,0,0|2,0,0]=4 286 B5R0.2 C=CCCCN CUR-0089890 [1,1,0,0,0,0|1,0,1]=4 287 B5R0.2 CC#CCCN CUR-0091824 [1,1,0,0,0,0|1,0,1]=4 288 B5R0.2 CCCCC=O CUR-0020580 [1,1,0,0,0,0|1,0,0]=3 289 B5R0.2 CCCCCBr CUR-0020920 [1,1,0,0,0,0|1,0,1]=4 290 B5R0.2 CCCCCI CUR-0007389 [1,1,0,0,0,0|1,0,1]=4 291 B5R0.2 CCCCCN CUR-0101510 [1,1,0,0,0,0|1,0,1]=4 292 B5R0.2 CCCCCO CUR-0018736 [1,1,0,0,0,0|1,0,1]=4 293 B5R0.2 CCCCNC CUR-0101509 [1,1,0,0,0,0|1,0,1]=4 294 B5R0.2 CCCN=C=O CUR-0101493 [1,1,0,0,0,0|1,0,1]=4 295 B5R0.2 CCNCCCl CUR-0137711 [1,1,0,0,0,0|1,0,1]=4 296 B5R0.2 CCNCCO CUR-0101534 [1,1,0,0,0,0|1,0,1]=4 297 B5R0.2 CCOCCBr CUR-0026041 [1,1,0,0,0,0|0,1,1]=4 298 B5R0.2 CCOCCO CUR-0010841 [1,1,0,0,0,0|0,1,1]=4 299 B5R0.2 CCO\C=C\C CUR-0101289 [1,1,0,0,0,0|0,1,0]=3 300 B5R0.2 CC\C=C/C#N CUR-0101476 [1,1,0,0,0,0|1,0,1]=4 301 B5R0.2 CC\C=C/CO CUR-0101504 [1,1,0,0,0,0|1,0,0]=3 302 B5R0.2 CNCCCN CUR-0101524 [1,1,0,0,0,0|2,0,0]=4 303 B5R0.2 CNCCNC CUR-0001888 [1,1,0,0,0,0|2,0,0]=4 304 B5R0.2 CNCCOC CUR-0101531 [1,1,0,0,0,0|2,0,0]=4 305 B5R0.2 COCCCN CUR-0101530 [1,1,0,0,0,0|2,0,0]=4 306 B5R0.2 COCCOC CUR-0026380 [1,1,0,0,0,0|2,0,0]=4 307 B7R0.2 CC(=O)CC(=O)OC CUR-0018522 [0,2,0,0,0,0|1,0,1]=4 308 B7R0.2 CC(C)CC(=O)C=C CUR-0050915 [0,2,0,0,0,0|1,0,1]=4 309 B7R0.2 CC(C)OC(=O)CCl CUR-0013704 [0,2,0,0,0,0|0,1,0]=3 310 B7R0.2 CCC(C)CC(=O)O CUR-0101758 [0,2,0,0,0,0|2,0,0]=4 311 B7R0.3 C(C#N)NC(=O)CCl CUR-0024918 [0,2,0,0,0,0|1,0,1]=4 312 B7R0.3 CCCNC(=O)CCl CUR-0099537 [0,2,0,0,0,0|1,0,0]=3 313 B7R0.3 CCCOC(=O)CCl CUR-0101322 [0,2,0,0,0,0|0,1,0]=3 314 B7R0.3 CNC(=O)OCCO CUR-0053764 [0,2,0,0,0,0|0,1,0]=3 315 B7R0.3 CNC(=O)\C=C\CN CUR-0155233 [0,2,0,0,0,0|1,0,1]=4 316 B7R0.3 COC(=O)CCCN CUR-0008398 [0,2,0,0,0,0|1,0,0]=3 317 B7R0.3 COC(=O)\C=C\CBr CUR-0103039 [0,2,0,0,0,0|1,0,1]=4 318 B7R0.3 COCCC(=O)OC CUR-0101774 [0,2,0,0,0,0|1,0,0]=3 319 B7R0.3 CO\C=C\C(=O)OC CUR-0101064 [0,2,0,0,0,0|1,0,1]=4 320 B7R0.5 C(CO)C(C(=O)O)N CUR-0009208 [0,2,0,0,0,0|2,0,0]=4 321 B7R0.5 CCCC(C(=O)O)Br CUR-0020650 [0,2,0,0,0,0|2,0,0]=4 322 B7R0.5 CCOC(=O)C(=O)C CUR-0021376 [0,2,0,0,0,0|0,1,0]=3 323 B7R0.5 CCOC(=O)C(=O)Cl CUR-0102081 [0,2,0,0,0,0|0,1,1]=4 324 B7R0.5 CCOC(=O)C(=O)N CUR-0013418 [0,2,0,0,0,0|0,1,1]=4 325 B7R0.5 CCOC(=O)C(=S)N CUR-0029192 [0,2,0,0,0,0|0,1,1]=4 326 B7R0.5 CCOC(=O)C(C)Br CUR-0103087 [0,2,0,0,0,0|0,1,0]=3 327 B7R0.5 CCOC(=O)C(F)F CUR-0007059 [0,2,0,0,0,0|0,1,0]=3 328 B7R0.7 CCCC(=O)OCC CUR-0005973 [0,2,0,0,0,0|0,1,0]=3 329 B7R0.7 CCNC(=S)NCC CUR-0101996 [0,2,0,0,0,0|1,1,0]=4 330 B7R0.7 CCOC(=O)C=[N+]=[N-] CUR-0018665 [0,2,0,0,0,0|0,1,1]=4 331 B7R0.7 CCOC(=O)CC#N CUR-0025194 [0,2,0,0,0,0|0,1,0]=3 332 B7R0.7 CCOC(=O)CCBr CUR-0103086 [0,2,0,0,0,0|0,1,0]=3 333 B7R0.7 CCOC(=O)CCCl CUR-0017965 [0,2,0,0,0,0|0,1,0]=3 334 B7R0.7 CCOC(=O)CNN CUR-0022001 [0,2,0,0,0,0|0,1,0]=3 335 B7R0.7 CCOC(=O)C[N+]#[C-] CUR-0023815 [0,2,0,0,0,0|0,1,0]=3 336 B7R0.7 CCOC(=O)OCC CUR-0003960 [0,2,0,0,0,0|0,1,0]=3 337 B7R0.7 CCOP(=O)OCC CUR-0027645 [0,2,0,0,0,0|1,1,0]=4 338 B7R0.10 COC(=O)C(=O)OC CUR-0027911 [0,2,0,0,0,0|2,0,0]=4 339 B7R0.10 COC(=O)C(CO)N CUR-0010591 [0,2,0,0,0,0|2,0,0]=4 340 B7R0.9 CC(=O)CC(C)(C)O CUR-0020852 [0,2,0,0,0,0|1,0,0]=3 341 B7R0.9 CC(=O)OC(C)(C)C CUR-0001433 [0,2,0,0,0,0|0,1,0]=3 342 B7R0.9 CC(C)(C)CC(=O)Cl CUR-0102044 [0,2,0,0,0,0|2,0,0]=4 343 B7R0.9 CC(C)(C)CC(=O)O CUR-0101757 [0,2,0,0,0,0|2,0,0]=4 344 B7R0.9 CC(C)(C)OC(=O)N CUR-0100962 [0,2,0,0,0,0|1,1,0]=4 345 B7R0.16 CC(=O)C(C(=O)C)Cl CUR-0004455 [0,2,0,0,0,0|1,0,1]=4 346 B7R0.16 CC(C(=O)C)C(=O)C CUR-0101719 [0,2,0,0,0,0|1,0,1]=4 347 B7R0.16 CC(C(C(=O)O)N)O CUR-0101788 [0,2,0,0,0,0|2,0,0]=4 348 B7R0.16 CC(C)[C@@H](C(=O)O)N CUR-0016393 [0,2,0,0,0,0|2,0,0]=4 349 B7R0.16 CC(C)[C@H](C(=O)O)N CUR-0101079 [0,2,0,0,0,0|2,0,0]=4 350 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O CUR-0023309 [0,2,0,0,0,0|2,0,0]=4 351 B7R0.15 CC(=O)C(OC)OC CUR-0009018 [0,2,0,0,0,0|2,0,0]=4 352 B7R0.15 CCC(CC)C(=O)O CUR-0101754 [0,2,0,0,0,0|2,0,0]=4 353 B7R0.4 C(CCBr)CC(=O)O CUR-0103088 [0,2,0,0,0,0|2,0,0]=4 354 B7R0.4 C(CCN)CC(=O)O CUR-0018281 [0,2,0,0,0,0|2,0,0]=4 355 B7R0.4 CCCCNC(=O)N CUR-0101762 [0,2,0,0,0,0|2,0,0]=4 356 B7R0.4 CCCCOC(=O)C CUR-0026180 [0,2,0,0,0,0|0,1,0]=3 357 B7R0.6 CC(=O)CCC(=O)C CUR-0022649 [0,2,0,0,0,0|1,0,0]=3 358 B7R0.6 CC(=O)CCC(=O)O CUR-0012941 [0,2,0,0,0,0|1,0,1]=4 359 B7R0.6 CC(=O)NCC(=O)O CUR-0024688 [0,2,0,0,0,0|1,0,1]=4 360 B7R0.6 CC(=O)OCC(=O)Cl CUR-0102082 [0,2,0,0,0,0|0,1,1]=4 361 B7R0.6 CC(C)COC(=O)Cl CUR-0020162 [0,2,0,0,0,0|1,1,0]=4 362 B7R0.8 CS(=O)(=O)CCCBr CUR-0028536 [0,2,0,0,0,0|2,0,0]=4 363 B7R0.8 CS(=O)(=O)NCCCl CUR-0004085 [0,2,0,0,0,0|2,0,0]=4 364 B5R1.2 C1CC(=O)C1 CUR-0005686 [1,0,0,1,0,0|0,0,0]=2 365 B5R1.2 C1CC(C1)Br CUR-0102047 [1,0,0,1,0,0|1,0,1]=4 366 B5R1.2 C1CC(C1)O CUR-0029256 [1,0,0,1,0,0|0,0,2]=4 367 B5R1.1 C1C=CCO1 CUR-0017724 [1,0,0,1,0,0|2,0,0]=4 368 B5R1.1 C1CCNC1 CUR-0027320 [1,0,0,1,0,0|1,0,1]=4 369 B5R1.1 C1COC=C1 CUR-0023942 [1,0,0,1,0,0|0,1,1]=4 370 B7R1.1 C1CCN(C1)C=O CUR-0050422 [0,1,0,1,0,0|2,0,0]=4 371 B7R1.1 CCC1=NCCO1 CUR-0101578 [0,1,0,1,0,0|1,0,1]=4 372 B7R1.1 COC1=NCCC1 CUR-0119549 [0,1,0,1,0,0|1,0,1]=4 373 B7R1.1 CSC1=NCCN1 CUR-0098382 [0,1,0,1,0,0|2,0,0]=4 374 B7R1.2 C1C(=N)NC(=O)S1 CUR-0096040 [0,1,0,1,0,0|1,0,1]=4 375 B7R1.2 C1C(=O)CNC1=O CUR-0122247 [0,1,0,1,0,0|1,0,1]=4 376 B7R1.2 C1C(=O)COC1=O CUR-0100913 [0,1,0,1,0,0|0,1,1]=4 377 B7R1.2 C1C(CNC1=O)N CUR-0087034 [0,1,0,1,0,0|1,0,0]=3 378 B7R1.2 C1CC(=O)CC1=O CUR-0010695 [0,1,0,1,0,0|1,0,1]=4 379 B7R1.2 C1CC(=O)NC1=O CUR-0005450 [0,1,0,1,0,0|1,0,1]=4 380 B7R1.2 C1CC(=O)OC1=O CUR-0017714 [0,1,0,1,0,0|0,1,1]=4 381 B7R1.2 CC1CCC(=O)N1 CUR-0016557 [0,1,0,1,0,0|1,0,0]=3 382 B7R1.2 CC1CCC(=O)O1 CUR-0101591 [0,1,0,1,0,0|0,1,0]=3 383 B7R1.2 CC1COC(=O)O1 CUR-0101613 [0,1,0,1,0,0|0,1,0]=3 384 B7R1.2 Cc1ccc(s1)C CUR-0012643 [0,1,0,1,0,0|1,0,1]=4 385 B7R1.3 C1CC=CC(=O)C1 CUR-0002304 [0,1,0,1,0,0|1,0,0]=3 386 B7R1.3 C1CCC(=O)CC1 CUR-0013382 [0,1,0,1,0,0|1,0,0]=3 387 B7R1.3 C1CCNC(=O)C1 CUR-0002331 [0,1,0,1,0,0|1,0,0]=3 388 B7R1.3 C1CNC(=N)NC1 CUR-0096512 [0,1,0,1,0,0|2,0,0]=4 389 B7R1.3 C1CNC(=N)OC1 CUR-0096514 [0,1,0,1,0,0|1,1,0]=4 390 B7R1.3 C1CNC(=O)CN1 CUR-0101593 [0,1,0,1,0,0|1,0,0]=3 391 B7R1.3 C1CNC(=S)NC1 CUR-0101763 [0,1,0,1,0,0|1,1,0]=4 392 B7R1.3 C1CNCCC1=O CUR-0009294 [0,1,0,1,0,0|1,0,0]=3 393 B7R1.3 C1CNCCC1=O CUR-0102475 [0,1,0,1,0,0|1,0,0]=3 394 B7R1.3 C1COCC(=O)N1 CUR-0014967 [0,1,0,1,0,0|1,0,0]=3 395 B7R1.3 C1COCCC1=O CUR-0001478 [0,1,0,1,0,0|1,0,0]=3 396 B7R1.3 C1CSCC(=O)N1 CUR-0095816 [0,1,0,1,0,0|1,0,0]=3 397 B7R1.3 C1CSCCC1=O CUR-0005576 [0,1,0,1,0,0|1,0,0]=3 398 B7R1.4 C1CC(=O)C(=O)C1 CUR-0061064 [0,1,0,1,0,0|1,0,0]=3 399 B7R1.4 C1CC(=O)N(C1)N CUR-0099031 [0,1,0,1,0,0|1,0,0]=3 400 B7R1.4 C1CNC(=O)C1Br CUR-0004832 [0,1,0,1,0,0|1,0,0]=3 401 B7R1.4 C1COC(=O)C1Br CUR-0012154 [0,1,0,1,0,0|0,1,0]=3 402 B7R1.4 C1CSC(=O)C1N CUR-0025625 [0,1,0,1,0,0|0,0,0]=2 403 B7R1.4 C1[C@H](C(=O)NO1)N CUR-0101615 [0,1,0,1,0,0|2,0,0]=4 404 B7R1.4 CN1CCCC1=O CUR-0101576 [0,1,0,1,0,0|1,0,0]=3 405 B7R1.22 C1CC1C(=O)CBr CUR-0027626 [0,1,0,1,0,0|1,0,0]=3 406 B7R1.22 COC(=O)C1CC1 CUR-0101589 [0,1,0,1,0,0|1,0,0]=3 407 B7R1.12 CC1CC1C(=O)O CUR-0100917 [0,1,0,1,0,0|2,0,0]=4 408 B7R1.20 C1CC1CC(=O)O CUR-0101588 [0,1,0,1,0,0|2,0,0]=4 409 B7R1.18 C1C(CN1)C(=O)O CUR-0009104 [0,1,0,1,0,0|2,0,0]=4 410 B7R1.18 C1CC(C1)C(=O)Cl CUR-0016394 [0,1,0,1,0,0|2,0,0]=4 411 B7R1.18 C1CC(C1)C(=O)O CUR-0009068 [0,1,0,1,0,0|2,0,0]=4 412 B7R1.18 C1CNC1C(=O)O CUR-0081896 [0,1,0,1,0,0|2,0,0]=4 413 B7R1.19 C1CC1(C(=O)O)N CUR-0010902 [0,1,0,1,0,0|2,0,0]=4 414 B7R1.14 C1CCS(=O)(=O)C1 CUR-0001027 [0,1,0,1,0,0|2,0,0]=4 415 B7R1.14 C1COS(=O)(=O)C1 CUR-0101825 [0,1,0,1,0,0|1,1,0]=4