0 B5R0.3 C(C(=NO)N)Cl CUR-0029129 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.3 C(C(=O)CCl)Cl CUR-0101901 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.3 C(C(CO)O)O CUR-0012902 [0,0,0,0,0,0|0,0,0]=0 3 B5R0.3 CC(CO)CO CUR-0101538 [0,0,0,0,0,0|1,0,0]=1 4 B5R0.3 CCC(=O)CC CUR-0101500 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.3 CCC(C)CO CUR-0101523 [0,0,0,0,0,0|2,0,0]=2 6 B5R0.3 CCC(C)NN CUR-0004060 [0,0,0,0,0,0|4,0,0]=4 7 B5R0.3 CCC(CC)Br CUR-0020873 [0,0,0,0,0,0|3,0,0]=3 8 B5R0.3 CCC(CO)N CUR-0101528 [0,0,0,0,0,0|2,0,0]=2 9 B5R0.3 CC\C(=N/O)\N CUR-0010533 [0,0,0,0,0,0|3,0,1]=4 10 B5R0.3 COC(=O)CO CUR-0101535 [0,0,0,0,0,0|2,0,2]=4 11 B4R0.1 C(C(=O)N)O CUR-0113957 [1,0,0,0,0,0|1,0,2]=4 12 B4R0.1 C(C(=O)O)Br CUR-0100788 [1,0,0,0,0,0|1,0,2]=4 13 B4R0.1 C(C(=O)O)Cl CUR-0003311 [1,0,0,0,0,0|1,0,2]=4 14 B4R0.1 C(C(=O)O)I CUR-0003176 [1,0,0,0,0,0|1,0,2]=4 15 B4R0.1 C(C(=O)O)N CUR-0014574 [1,0,0,0,0,0|1,0,2]=4 16 B4R0.1 C(C(=O)O)N CUR-0101231 [1,0,0,0,0,0|1,0,2]=4 17 B4R0.1 C(C(=O)O)O CUR-0014667 [1,0,0,0,0,0|0,0,2]=3 18 B4R0.1 C(C(=O)O)S CUR-0101545 [1,0,0,0,0,0|0,1,2]=4 19 B4R0.1 C(C(Cl)Cl)Cl CUR-0102022 [1,0,0,0,0,0|3,0,0]=4 20 B4R0.1 C(C(Cl)Cl)N CUR-0101208 [1,0,0,0,0,0|3,0,0]=4 21 B4R0.1 C(O)S(=O)[O-] CUR-0023303 [1,0,0,0,0,0|1,0,2]=4 22 B4R0.1 CC(=C)CCl CUR-0011941 [1,0,0,0,0,0|2,0,1]=4 23 B4R0.1 CC(=O)CCl CUR-0002239 [1,0,0,0,0,0|1,0,2]=4 24 B4R0.1 CC(=O)CO CUR-0005016 [1,0,0,0,0,0|0,0,2]=3 25 B4R0.1 CC(C#C)N CUR-0083146 [1,0,0,0,0,0|2,0,1]=4 26 B4R0.1 CC(C#C)O CUR-0101444 [1,0,0,0,0,0|1,0,1]=3 27 B4R0.1 CC(C#N)Cl CUR-0101233 [1,0,0,0,0,0|2,0,1]=4 28 B4R0.1 CC(C)C#N CUR-0009528 [1,0,0,0,0,0|2,0,1]=4 29 B4R0.1 CC(C)C=O CUR-0017872 [1,0,0,0,0,0|1,0,2]=4 30 B4R0.1 CC(C)CBr CUR-0024115 [1,0,0,0,0,0|2,0,0]=3 31 B4R0.1 CC(C)CI CUR-0028804 [1,0,0,0,0,0|2,0,0]=3 32 B4R0.1 CC(C)CN CUR-0020747 [1,0,0,0,0,0|2,0,0]=3 33 B4R0.1 CC(C)CO CUR-0012302 [1,0,0,0,0,0|1,0,0]=2 34 B4R0.1 CC(C)NN CUR-0014509 [1,0,0,0,0,0|3,0,0]=4 35 B4R0.1 CC(CN)N CUR-0101461 [1,0,0,0,0,0|2,0,0]=3 36 B4R0.1 CC(CN)O CUR-0024952 [1,0,0,0,0,0|1,0,0]=2 37 B4R0.1 CC(CN)S CUR-0003165 [1,0,0,0,0,0|1,1,0]=3 38 B4R0.1 CC(CO)O CUR-0022593 [1,0,0,0,0,0|0,0,0]=1 39 B4R0.1 CC(CS)N CUR-0021165 [1,0,0,0,0,0|1,1,0]=3 40 B4R0.1 CCC(=O)O CUR-0010221 [1,0,0,0,0,0|1,0,2]=4 41 B4R0.1 CCC(C)Br CUR-0102085 [1,0,0,0,0,0|2,0,0]=3 42 B4R0.1 CCC(C)I CUR-0055396 [1,0,0,0,0,0|2,0,0]=3 43 B4R0.1 CCC(C)N CUR-0001789 [1,0,0,0,0,0|2,0,0]=3 44 B4R0.1 CCN(C)C CUR-0101456 [1,0,0,0,0,0|3,0,0]=4 45 B4R0.1 C\C(=N\O)\N CUR-0098903 [1,0,0,0,0,0|2,0,1]=4 46 B4R0.2 C#CCCN CUR-0100609 [1,0,0,0,0,0|2,0,1]=4 47 B4R0.2 C#CCCO CUR-0101442 [1,0,0,0,0,0|1,0,1]=3 48 B4R0.2 C(CBr)CBr CUR-0016721 [1,0,0,0,0,0|2,0,0]=3 49 B4R0.2 C(CCl)C#N CUR-0025838 [1,0,0,0,0,0|2,0,1]=4 50 B4R0.2 C(CCl)CBr CUR-0004377 [1,0,0,0,0,0|2,0,0]=3 51 B4R0.2 C(CN)CBr CUR-0103678 [1,0,0,0,0,0|2,0,0]=3 52 B4R0.2 C(CN)CCl CUR-0101958 [1,0,0,0,0,0|2,0,0]=3 53 B4R0.2 C(CN)CN CUR-0101462 [1,0,0,0,0,0|2,0,0]=3 54 B4R0.2 C(CN)CO CUR-0005687 [1,0,0,0,0,0|1,0,0]=2 55 B4R0.2 C(CO)C#N CUR-0000520 [1,0,0,0,0,0|1,0,1]=3 56 B4R0.2 C(CO)CCl CUR-0004180 [1,0,0,0,0,0|1,0,0]=2 57 B4R0.2 C(CO)CO CUR-0007262 [1,0,0,0,0,0|0,0,0]=1 58 B4R0.2 C(CO)NN CUR-0100819 [1,0,0,0,0,0|2,0,0]=3 59 B4R0.2 C(CS)CS CUR-0006323 [1,0,0,0,0,0|0,2,0]=3 60 B4R0.2 C=CCCBr CUR-0002027 [1,0,0,0,0,0|2,0,1]=4 61 B4R0.2 C=CCCI CUR-0000685 [1,0,0,0,0,0|2,0,1]=4 62 B4R0.2 C=CCCO CUR-0101449 [1,0,0,0,0,0|1,0,1]=3 63 B4R0.2 CCCC#N CUR-0101440 [1,0,0,0,0,0|2,0,1]=4 64 B4R0.2 CCCC=O CUR-0100896 [1,0,0,0,0,0|1,0,2]=4 65 B4R0.2 CCCCBr CUR-0023794 [1,0,0,0,0,0|2,0,0]=3 66 B4R0.2 CCCCCl CUR-0023945 [1,0,0,0,0,0|2,0,0]=3 67 B4R0.2 CCCCI CUR-0001021 [1,0,0,0,0,0|2,0,0]=3 68 B4R0.2 CCCCN CUR-0017800 [1,0,0,0,0,0|2,0,0]=3 69 B4R0.2 CCCCN CUR-0101317 [1,0,0,0,0,0|2,0,0]=3 70 B4R0.2 CCCCO CUR-0016718 [1,0,0,0,0,0|1,0,0]=2 71 B4R0.2 CCCNN CUR-0022831 [1,0,0,0,0,0|3,0,0]=4 72 B4R0.2 CCNCC CUR-0022731 [1,0,0,0,0,0|3,0,0]=4 73 B4R0.2 CCNCC CUR-0101285 [1,0,0,0,0,0|3,0,0]=4 74 B4R0.2 CNCCI CUR-0017490 [1,0,0,0,0,0|3,0,0]=4 75 B4R0.2 CNCCO CUR-0011813 [1,0,0,0,0,0|2,0,0]=3 76 B4R0.2 COCCBr CUR-0009505 [1,0,0,0,0,0|3,0,0]=4 77 B4R0.2 COCCCl CUR-0000941 [1,0,0,0,0,0|3,0,0]=4 78 B4R0.2 COCCN CUR-0012344 [1,0,0,0,0,0|3,0,0]=4 79 B4R0.2 COCCO CUR-0101466 [1,0,0,0,0,0|2,0,0]=3 80 B4R0.2 CSCCN CUR-0101544 [1,0,0,0,0,0|3,0,0]=4 81 B6R0.1 C(CN)C(CN)O CUR-0122282 [0,1,0,0,0,0|2,0,0]=3 82 B6R0.1 CCOC(=O)CO CUR-0101638 [0,1,0,0,0,0|1,0,2]=4 83 B6R0.3 C(C(C(=O)O)Br)Br CUR-0100855 [0,1,0,0,0,0|2,0,1]=4 84 B6R0.3 C(C(C(=O)O)N)O CUR-0101646 [0,1,0,0,0,0|1,0,1]=3 85 B6R0.3 C(C(C(=O)O)N)S CUR-0101261 [0,1,0,0,0,0|1,1,1]=4 86 B6R0.3 C([C@@H](C(=O)O)N)O CUR-0101109 [0,1,0,0,0,0|1,0,1]=3 87 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0004971 [0,1,0,0,0,0|1,1,1]=4 88 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0101810 [0,1,0,0,0,0|1,1,1]=4 89 B6R0.3 CC(C)C(CN)O CUR-0027506 [0,1,0,0,0,0|2,0,0]=3 90 B6R0.3 CCC(C(=O)O)Br CUR-0102801 [0,1,0,0,0,0|2,0,1]=4 91 B6R0.3 CCC(C(=O)O)N CUR-0010659 [0,1,0,0,0,0|2,0,1]=4 92 B6R0.3 CCC(C(C)O)N CUR-0067426 [0,1,0,0,0,0|2,0,0]=3 93 B6R0.3 CCC(C)C(=O)O CUR-0101619 [0,1,0,0,0,0|2,0,1]=4 94 B6R0.8 CC(C)(CO)CO CUR-0101641 [0,1,0,0,0,0|1,0,0]=2 95 B6R0.8 CC(CO)(CO)N CUR-0101648 [0,1,0,0,0,0|1,0,0]=2 96 B6R0.8 CCC(C)(C)CO CUR-0004648 [0,1,0,0,0,0|2,0,0]=3 97 B6R0.9 CCC(CC)C=O CUR-0009845 [0,1,0,0,0,0|2,0,1]=4 98 B6R0.9 COC(CCl)OC CUR-0101871 [0,1,0,0,0,0|3,0,0]=4 99 B6R0.9 COC(CN)OC CUR-0008874 [0,1,0,0,0,0|3,0,0]=4 100 B6R1.2 C1CCC(C1)Br CUR-0025546 [0,0,0,1,0,0|3,0,0]=4 101 B6R1.2 C1CCC(C1)N CUR-0006172 [0,0,0,1,0,0|3,0,0]=4 102 B6R1.2 C1CCC(C1)O CUR-0021370 [0,0,0,1,0,0|2,0,0]=3 103 B6R1.2 C1CNCC1O CUR-0101217 [0,0,0,1,0,0|2,0,0]=3 104 B6R1.2 C1CNC[C@@H]1O CUR-0101508 [0,0,0,1,0,0|2,0,0]=3 105 B6R1.2 C1COCC1O CUR-0101518 [0,0,0,1,0,0|1,0,0]=2 106 B6R1.2 C1[C@H](CON1)O CUR-0120241 [0,0,0,1,0,0|1,0,0]=2 107 B6R1.4 CC1CCC1N CUR-0163343 [0,0,0,1,0,0|3,0,0]=4 108 B6R1.4 CC1CCC1O CUR-0090358 [0,0,0,1,0,0|2,0,0]=3 109 B6R1.6 C1CC(C1)CBr CUR-0003993 [0,0,0,1,0,0|3,0,0]=4 110 B6R1.6 C1CC(C1)CO CUR-0022828 [0,0,0,1,0,0|2,0,0]=3 111 B6R1.8 C=C1CC1CO CUR-0163362 [0,0,0,1,0,0|2,0,1]=4 112 B3R0.1 C#CCO CUR-0007009 [2,0,0,0,0,0|0,0,2]=4 113 B3R0.1 C(CBr)Br CUR-0000806 [2,0,0,0,0,0|2,0,0]=4 114 B3R0.1 C(CBr)Cl CUR-0006161 [2,0,0,0,0,0|2,0,0]=4 115 B3R0.1 C(CBr)N CUR-0103516 [2,0,0,0,0,0|2,0,0]=4 116 B3R0.1 C(CBr)O CUR-0021042 [2,0,0,0,0,0|1,0,0]=3 117 B3R0.1 C(CCl)N CUR-0015629 [2,0,0,0,0,0|2,0,0]=4 118 B3R0.1 C(CCl)O CUR-0101474 [2,0,0,0,0,0|1,0,0]=3 119 B3R0.1 C(CN)N CUR-0009355 [2,0,0,0,0,0|2,0,0]=4 120 B3R0.1 C(CN)N CUR-0101207 [2,0,0,0,0,0|2,0,0]=4 121 B3R0.1 C(CN)N CUR-0101271 [2,0,0,0,0,0|2,0,0]=4 122 B3R0.1 C(CO)N CUR-0010085 [2,0,0,0,0,0|1,0,0]=3 123 B3R0.1 C(CO)O CUR-0026540 [2,0,0,0,0,0|0,0,0]=2 124 B3R0.1 C(CS)N CUR-0000633 [2,0,0,0,0,0|1,1,0]=4 125 B3R0.1 C(CS)N CUR-0101235 [2,0,0,0,0,0|1,1,0]=4 126 B3R0.1 C(CS)O CUR-0013730 [2,0,0,0,0,0|0,1,0]=3 127 B3R0.1 C=CCO CUR-0101427 [2,0,0,0,0,0|0,0,2]=4 128 B3R0.1 CCC#N CUR-0100813 [2,0,0,0,0,0|1,0,1]=4 129 B3R0.1 CCC=O CUR-0015273 [2,0,0,0,0,0|0,0,2]=4 130 B3R0.1 CCCBr CUR-0028377 [2,0,0,0,0,0|1,0,0]=3 131 B3R0.1 CCCI CUR-0010202 [2,0,0,0,0,0|1,0,0]=3 132 B3R0.1 CCCN CUR-0000120 [2,0,0,0,0,0|1,0,0]=3 133 B3R0.1 CCCO CUR-0017382 [2,0,0,0,0,0|0,0,0]=2 134 B3R0.1 CCCS CUR-0009615 [2,0,0,0,0,0|0,1,0]=3 135 B3R0.1 CCNN CUR-0017500 [2,0,0,0,0,0|2,0,0]=4 136 B3R0.1 COCCl CUR-0028317 [2,0,0,0,0,0|2,0,0]=4 137 B3R0.2 CC(=O)O CUR-0005925 [2,0,0,0,0,0|0,0,2]=4 138 B3R0.2 CC(C)Br CUR-0027321 [2,0,0,0,0,0|1,0,0]=3 139 B3R0.2 CC(C)Cl CUR-0022523 [2,0,0,0,0,0|1,0,0]=3 140 B3R0.2 CC(C)I CUR-0026227 [2,0,0,0,0,0|1,0,0]=3 141 B3R0.2 CC(C)N CUR-0024558 [2,0,0,0,0,0|1,0,0]=3 142 B3R0.2 CC(C)S CUR-0012379 [2,0,0,0,0,0|0,1,0]=3 143 B3R0.2 CN(C)C CUR-0004768 [2,0,0,0,0,0|2,0,0]=4 144 B3R0.2 CP(C)C CUR-0006076 [2,0,0,0,0,0|2,0,0]=4 145 B3R0.2 C[S+](C)C CUR-0103505 [2,0,0,0,0,0|2,0,0]=4 146 B5R0.1 CC(=O)COC CUR-0101516 [1,1,0,0,0,0|0,0,2]=4 147 B5R0.1 CC(C)CC#N CUR-0101228 [1,1,0,0,0,0|2,0,0]=4 148 B5R0.1 CC(C)CC=O CUR-0101502 [1,1,0,0,0,0|1,0,1]=4 149 B5R0.1 CC(C)CCBr CUR-0002757 [1,1,0,0,0,0|2,0,0]=4 150 B5R0.1 CC(C)CCN CUR-0101511 [1,1,0,0,0,0|2,0,0]=4 151 B5R0.1 CC(C)CCO CUR-0003416 [1,1,0,0,0,0|1,0,0]=3 152 B5R0.1 CC(C)CNN CUR-0001046 [1,1,0,0,0,0|2,0,0]=4 153 B5R0.1 CC(CCO)O CUR-0003759 [1,1,0,0,0,0|0,0,0]=2 154 B5R0.1 CC(COC)N CUR-0101532 [1,1,0,0,0,0|1,0,0]=3 155 B5R0.1 CC(CSC)N CUR-0019523 [1,1,0,0,0,0|1,1,0]=4 156 B5R0.1 CCCC(C)O CUR-0023615 [1,1,0,0,0,0|1,0,0]=3 157 B5R0.1 CN(C)CCO CUR-0019188 [1,1,0,0,0,0|2,0,0]=4 158 B5R0.1 COCC(=O)O CUR-0014449 [1,1,0,0,0,0|0,0,2]=4 159 B5R0.4 C(C(F)(F)F)O CUR-0023041 [1,1,0,0,0,0|2,0,0]=4 160 B5R0.4 CC(C)(C#C)O CUR-0101018 [1,1,0,0,0,0|1,0,1]=4 161 B5R0.4 CC(C)(C#N)O CUR-0021522 [1,1,0,0,0,0|1,0,1]=4 162 B5R0.4 CC(C)(C)OO CUR-0122293 [1,1,0,0,0,0|2,0,0]=4 163 B5R0.4 CC(C)(CCl)O CUR-0008479 [1,1,0,0,0,0|1,0,0]=3 164 B5R0.4 CC(C)(CO)N CUR-0101533 [1,1,0,0,0,0|1,0,0]=3 165 B5R0.4 CCC(C)(C)N CUR-0017274 [1,1,0,0,0,0|2,0,0]=4 166 B5R0.4 CCC(C)(C)O CUR-0012425 [1,1,0,0,0,0|1,0,0]=3 167 B5R0.5 CC(C(=O)C)O CUR-0101517 [1,1,0,0,0,0|0,0,2]=4 168 B5R0.5 CC(C(=O)O)Cl CUR-0027467 [1,1,0,0,0,0|1,0,1]=4 169 B5R0.5 CC(C(=O)O)N CUR-0005753 [1,1,0,0,0,0|1,0,1]=4 170 B5R0.5 CC(C(=O)O)O CUR-0100772 [1,1,0,0,0,0|0,0,1]=3 171 B5R0.5 CC(C(=O)O)S CUR-0001712 [1,1,0,0,0,0|0,1,1]=4 172 B5R0.5 CC(C(C)Br)Br CUR-0103657 [1,1,0,0,0,0|2,0,0]=4 173 B5R0.5 CC(C)C(=O)O CUR-0023620 [1,1,0,0,0,0|1,0,1]=4 174 B5R0.5 C[C@@H](C(=O)O)N CUR-0101526 [1,1,0,0,0,0|1,0,1]=4 175 B5R0.2 C#CCCCO CUR-0101486 [1,1,0,0,0,0|1,0,0]=3 176 B5R0.2 C(C#CCO)N CUR-0090769 [1,1,0,0,0,0|1,0,1]=4 177 B5R0.2 C(C#CCO)O CUR-0101498 [1,1,0,0,0,0|0,0,1]=3 178 B5R0.2 C(C=CCO)O CUR-0100969 [1,1,0,0,0,0|0,0,1]=3 179 B5R0.2 C(CC#N)CCl CUR-0000109 [1,1,0,0,0,0|2,0,0]=4 180 B5R0.2 C(CC#N)CO CUR-0020823 [1,1,0,0,0,0|1,0,0]=3 181 B5R0.2 C(CCBr)CBr CUR-0026189 [1,1,0,0,0,0|2,0,0]=4 182 B5R0.2 C(CCBr)CCl CUR-0000065 [1,1,0,0,0,0|2,0,0]=4 183 B5R0.2 C(CCCl)CO CUR-0025105 [1,1,0,0,0,0|1,0,0]=3 184 B5R0.2 C(CCN)CN CUR-0016745 [1,1,0,0,0,0|2,0,0]=4 185 B5R0.2 C(CCO)CO CUR-0024794 [1,1,0,0,0,0|0,0,0]=2 186 B5R0.2 C(CCS)CN CUR-0119579 [1,1,0,0,0,0|1,1,0]=4 187 B5R0.2 C(\C=C/CO)O CUR-0101515 [1,1,0,0,0,0|0,0,1]=3 188 B5R0.2 C=CCCCN CUR-0089890 [1,1,0,0,0,0|2,0,0]=4 189 B5R0.2 CCCCC#N CUR-0002776 [1,1,0,0,0,0|2,0,0]=4 190 B5R0.2 CCCCC=O CUR-0020580 [1,1,0,0,0,0|1,0,1]=4 191 B5R0.2 CCCCCBr CUR-0020920 [1,1,0,0,0,0|2,0,0]=4 192 B5R0.2 CCCCCI CUR-0007389 [1,1,0,0,0,0|2,0,0]=4 193 B5R0.2 CCCCCN CUR-0101510 [1,1,0,0,0,0|2,0,0]=4 194 B5R0.2 CCCCCO CUR-0018736 [1,1,0,0,0,0|1,0,0]=3 195 B5R0.2 CCCCNC CUR-0101509 [1,1,0,0,0,0|2,0,0]=4 196 B5R0.2 CCNCCCl CUR-0137711 [1,1,0,0,0,0|2,0,0]=4 197 B5R0.2 CCNCCO CUR-0101534 [1,1,0,0,0,0|1,0,0]=3 198 B5R0.2 CCOCCBr CUR-0026041 [1,1,0,0,0,0|2,0,0]=4 199 B5R0.2 CCOCCO CUR-0010841 [1,1,0,0,0,0|1,0,0]=3 200 B5R0.2 CC\C=C/CO CUR-0101504 [1,1,0,0,0,0|1,0,1]=4 201 B5R0.2 CNCCCN CUR-0101524 [1,1,0,0,0,0|2,0,0]=4 202 B5R0.2 CNCCOC CUR-0101531 [1,1,0,0,0,0|2,0,0]=4 203 B5R0.2 COCCC#N CUR-0101494 [1,1,0,0,0,0|1,0,1]=4 204 B5R0.2 COCCCN CUR-0101530 [1,1,0,0,0,0|1,0,0]=3 205 B5R0.2 COCCNN CUR-0018740 [1,1,0,0,0,0|2,0,0]=4 206 B5R0.2 COCCOC CUR-0026380 [1,1,0,0,0,0|2,0,0]=4 207 B7R0.2 CCC(C)CC(=O)O CUR-0101758 [0,2,0,0,0,0|2,0,0]=4 208 B7R0.2 CN(C)CC(CO)N CUR-0048488 [0,2,0,0,0,0|2,0,0]=4 209 B7R0.2 CN(C)CC(CO)N CUR-0163315 [0,2,0,0,0,0|2,0,0]=4 210 B7R0.3 CCOCC(CN)O CUR-0096148 [0,2,0,0,0,0|1,0,0]=3 211 B7R0.5 C(CO)C(C(=O)O)N CUR-0009208 [0,2,0,0,0,0|1,0,1]=4 212 B7R0.7 COCC(CCO)N CUR-0020087 [0,2,0,0,0,0|1,0,0]=3 213 B7R0.7 CSCC(CCO)N CUR-0018604 [0,2,0,0,0,0|1,1,0]=4 214 B7R0.10 C([C@H]([C@H](CO)O)O)O CUR-0163306 [0,2,0,0,0,0|0,0,0]=2 215 B7R0.10 COC(=O)C(CO)N CUR-0010591 [0,2,0,0,0,0|1,0,1]=4 216 B7R0.11 CC(CN)(COC)O CUR-0010743 [0,2,0,0,0,0|1,0,0]=3 217 B7R0.14 C(C(C(F)(F)F)O)N CUR-0120641 [0,2,0,0,0,0|2,0,0]=4 218 B7R0.15 CCC(CC)C(=O)O CUR-0101754 [0,2,0,0,0,0|2,0,0]=4 219 B7R0.16 CC(C(C(=O)O)N)O CUR-0101788 [0,2,0,0,0,0|1,0,1]=4 220 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O CUR-0023309 [0,2,0,0,0,0|1,0,1]=4 221 B7R0.18 C(C(CO)(CO)N)O CUR-0010350 [0,2,0,0,0,0|0,0,0]=2 222 B7R0.18 CC(CO)(CO)CO CUR-0007983 [0,2,0,0,0,0|0,0,0]=2 223 B5R1.2 C1C(CN1)O CUR-0015234 [1,0,0,1,0,0|1,0,0]=3 224 B5R1.2 C1C(CO1)O CUR-0028981 [1,0,0,1,0,0|0,0,0]=2 225 B5R1.2 C1CC(C1)Br CUR-0102047 [1,0,0,1,0,0|2,0,0]=4 226 B5R1.2 C1CC(C1)O CUR-0029256 [1,0,0,1,0,0|1,0,0]=3 227 B5R1.3 C1C(O1)CCl CUR-0004573 [1,0,0,1,0,0|1,0,0]=3 228 B5R1.3 C1C(O1)CO CUR-0011597 [1,0,0,1,0,0|0,0,0]=2 229 B5R1.3 C1CC1CBr CUR-0015213 [1,0,0,1,0,0|2,0,0]=4 230 B5R1.3 C1CC1CN CUR-0019694 [1,0,0,1,0,0|2,0,0]=4 231 B5R1.3 C1CC1CO CUR-0016442 [1,0,0,1,0,0|1,0,0]=3 232 B5R1.1 C1CCNC1 CUR-0027320 [1,0,0,1,0,0|2,0,0]=4 233 B5R1.1 C1COC=C1 CUR-0023942 [1,0,0,1,0,0|1,0,1]=4 234 B7R1.1 C1CC(OC1)CBr CUR-0102737 [0,1,0,1,0,0|2,0,0]=4 235 B7R1.1 C1CC(OC1)CCl CUR-0000752 [0,1,0,1,0,0|2,0,0]=4 236 B7R1.1 C1CC(OC1)CN CUR-0022405 [0,1,0,1,0,0|2,0,0]=4 237 B7R1.1 C1CC(OC1)CO CUR-0021816 [0,1,0,1,0,0|1,0,0]=3 238 B7R1.1 C1CCC(C1)CO CUR-0114427 [0,1,0,1,0,0|2,0,0]=4 239 B7R1.1 C1COC(O1)CBr CUR-0102803 [0,1,0,1,0,0|2,0,0]=4 240 B7R1.1 C1COCC1C#N CUR-0018666 [0,1,0,1,0,0|2,0,0]=4 241 B7R1.1 C1COCC1C=O CUR-0082585 [0,1,0,1,0,0|1,0,1]=4 242 B7R1.1 C1COCC1CBr CUR-0003563 [0,1,0,1,0,0|2,0,0]=4 243 B7R1.1 C1COCC1CI CUR-0015713 [0,1,0,1,0,0|2,0,0]=4 244 B7R1.1 C1COCC1CN CUR-0021455 [0,1,0,1,0,0|2,0,0]=4 245 B7R1.1 C1COCC1CO CUR-0101139 [0,1,0,1,0,0|1,0,0]=3 246 B7R1.1 CNC1CCOC1 CUR-0020484 [0,1,0,1,0,0|2,0,0]=4 247 B7R1.3 C1CC(CNC1)O CUR-0101604 [0,1,0,1,0,0|2,0,0]=4 248 B7R1.3 C1CC(COC1)N CUR-0090441 [0,1,0,1,0,0|2,0,0]=4 249 B7R1.3 C1CCC(CC1)O CUR-0020069 [0,1,0,1,0,0|2,0,0]=4 250 B7R1.3 C1CNCCC1O CUR-0021573 [0,1,0,1,0,0|2,0,0]=4 251 B7R1.3 C1COCCC1O CUR-0101618 [0,1,0,1,0,0|1,0,0]=3 252 B7R1.4 C1CC(C(C1)F)O CUR-0014122 [0,1,0,1,0,0|2,0,0]=4 253 B7R1.22 C1CC1C(CN)O CUR-0022173 [0,1,0,1,0,0|2,0,0]=4 254 B7R1.25 CC1(COC1)CO CUR-0022359 [0,1,0,1,0,0|1,0,0]=3 255 B7R1.29 C1CC1(CN)CO CUR-0092055 [0,1,0,1,0,0|2,0,0]=4 256 B7R1.29 C1CC1(CO)CO CUR-0101616 [0,1,0,1,0,0|1,0,0]=3 257 B7R2.13 C1C2C(O2)CO1 CUR-0101497 [0,0,0,2,0,0|1,0,0]=3 258 B7R2.13 C1CC2C(C1)O2 CUR-0001673 [0,0,0,2,0,0|2,0,0]=4