0 B5R0.3 C(C(=NO)N)Cl CUR-0029129 [0,0,0,0,0,0|3,0,0]=3 1 B5R0.3 C(C(=O)CCl)Cl CUR-0101901 [0,0,0,0,0,0|2,0,0]=2 2 B5R0.3 C(C(CO)O)O CUR-0012902 [0,0,0,0,0,0|0,0,2]=2 3 B5R0.3 CC(CO)CO CUR-0101538 [0,0,0,0,0,0|1,0,1]=2 4 B5R0.3 CCC(=O)CC CUR-0101500 [0,0,0,0,0,0|2,0,0]=2 5 B5R0.3 CCC(C)CO CUR-0101523 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.3 CCC(CC)Br CUR-0020873 [0,0,0,0,0,0|3,0,1]=4 7 B5R0.3 CCC(CO)N CUR-0101528 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.3 CC\C(=N/O)\N CUR-0010533 [0,0,0,0,0,0|3,0,0]=3 9 B5R0.3 CNC(=O)C#C CUR-0016542 [0,0,0,0,0,0|3,0,1]=4 10 B5R0.3 CNC(=O)CCl CUR-0099536 [0,0,0,0,0,0|3,0,0]=3 11 B5R0.3 CNC(=O)NC CUR-0101521 [0,0,0,0,0,0|4,0,0]=4 12 B5R0.3 COC(=N)CCl CUR-0101034 [0,0,0,0,0,0|4,0,0]=4 13 B5R0.3 COC(=O)C#C CUR-0008050 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.3 COC(=O)C=C CUR-0018588 [0,0,0,0,0,0|3,0,1]=4 15 B5R0.3 COC(=O)CBr CUR-0102451 [0,0,0,0,0,0|3,0,0]=3 16 B5R0.3 COC(=O)CCl CUR-0019510 [0,0,0,0,0,0|3,0,0]=3 17 B5R0.3 COC(=O)CN CUR-0016914 [0,0,0,0,0,0|3,0,0]=3 18 B5R0.3 COC(=O)CO CUR-0101535 [0,0,0,0,0,0|2,0,0]=2 19 B5R0.3 COC(=O)CS CUR-0014981 [0,0,0,0,0,0|2,1,0]=3 20 B5R0.3 COC(=O)NN CUR-0100906 [0,0,0,0,0,0|4,0,0]=4 21 B5R0.3 COC(=O)OC CUR-0101536 [0,0,0,0,0,0|4,0,0]=4 22 B4R0.1 C#CC(=O)O CUR-0101441 [1,0,0,0,0,0|1,0,1]=3 23 B4R0.1 C(=O)(N)NN CUR-0003223 [1,0,0,0,0,0|3,0,0]=4 24 B4R0.1 C(=O)(N)NO CUR-0001014 [1,0,0,0,0,0|2,0,0]=3 25 B4R0.1 C(=O)C(=O)O CUR-0021308 [1,0,0,0,0,0|0,0,2]=3 26 B4R0.1 C(C(=N)N)Cl CUR-0085287 [1,0,0,0,0,0|3,0,0]=4 27 B4R0.1 C(C(=O)Br)Br CUR-0006369 [1,0,0,0,0,0|2,0,0]=3 28 B4R0.1 C(C(=O)Cl)Cl CUR-0004550 [1,0,0,0,0,0|2,0,0]=3 29 B4R0.1 C(C(=O)N)Br CUR-0014813 [1,0,0,0,0,0|2,0,0]=3 30 B4R0.1 C(C(=O)N)Cl CUR-0007516 [1,0,0,0,0,0|2,0,0]=3 31 B4R0.1 C(C(=O)N)N CUR-0101687 [1,0,0,0,0,0|2,0,0]=3 32 B4R0.1 C(C(=O)N)O CUR-0113957 [1,0,0,0,0,0|1,0,0]=2 33 B4R0.1 C(C(=O)O)Br CUR-0100788 [1,0,0,0,0,0|1,0,0]=2 34 B4R0.1 C(C(=O)O)Cl CUR-0003311 [1,0,0,0,0,0|1,0,0]=2 35 B4R0.1 C(C(=O)O)I CUR-0003176 [1,0,0,0,0,0|1,0,0]=2 36 B4R0.1 C(C(=O)O)N CUR-0014574 [1,0,0,0,0,0|1,0,0]=2 37 B4R0.1 C(C(=O)O)N CUR-0101231 [1,0,0,0,0,0|1,0,0]=2 38 B4R0.1 C(C(=O)O)O CUR-0014667 [1,0,0,0,0,0|0,0,0]=1 39 B4R0.1 C(C(=O)O)S CUR-0101545 [1,0,0,0,0,0|0,1,0]=2 40 B4R0.1 C(O)S(=O)[O-] CUR-0023303 [1,0,0,0,0,0|1,0,1]=3 41 B4R0.1 C=CC(=O)Cl CUR-0101542 [1,0,0,0,0,0|2,0,1]=4 42 B4R0.1 C=CC(=O)N CUR-0007166 [1,0,0,0,0,0|2,0,1]=4 43 B4R0.1 C=CC(=O)O CUR-0028045 [1,0,0,0,0,0|1,0,1]=3 44 B4R0.1 CC(=C)C=O CUR-0101443 [1,0,0,0,0,0|1,0,2]=4 45 B4R0.1 CC(=C)CCl CUR-0011941 [1,0,0,0,0,0|2,0,0]=3 46 B4R0.1 CC(=C)OC CUR-0101450 [1,0,0,0,0,0|3,0,0]=4 47 B4R0.1 CC(=O)C=C CUR-0013098 [1,0,0,0,0,0|1,0,1]=3 48 B4R0.1 CC(=O)C=O CUR-0101448 [1,0,0,0,0,0|0,0,2]=3 49 B4R0.1 CC(=O)CCl CUR-0002239 [1,0,0,0,0,0|1,0,0]=2 50 B4R0.1 CC(=O)CO CUR-0005016 [1,0,0,0,0,0|0,0,0]=1 51 B4R0.1 CC(C)CBr CUR-0024115 [1,0,0,0,0,0|2,0,1]=4 52 B4R0.1 CC(C)CI CUR-0028804 [1,0,0,0,0,0|2,0,1]=4 53 B4R0.1 CC(C)CN CUR-0020747 [1,0,0,0,0,0|2,0,1]=4 54 B4R0.1 CC(C)CO CUR-0012302 [1,0,0,0,0,0|1,0,1]=3 55 B4R0.1 CC(CN)N CUR-0101461 [1,0,0,0,0,0|2,0,1]=4 56 B4R0.1 CC(CN)O CUR-0024952 [1,0,0,0,0,0|1,0,2]=4 57 B4R0.1 CC(CN)S CUR-0003165 [1,0,0,0,0,0|1,1,1]=4 58 B4R0.1 CC(CO)O CUR-0022593 [1,0,0,0,0,0|0,0,2]=3 59 B4R0.1 CC(CS)N CUR-0021165 [1,0,0,0,0,0|1,1,1]=4 60 B4R0.1 CCC(=O)Cl CUR-0101547 [1,0,0,0,0,0|2,0,0]=3 61 B4R0.1 CCC(=O)N CUR-0101453 [1,0,0,0,0,0|2,0,0]=3 62 B4R0.1 CCC(=O)O CUR-0010221 [1,0,0,0,0,0|1,0,0]=2 63 B4R0.1 CCC(C)Br CUR-0102085 [1,0,0,0,0,0|2,0,1]=4 64 B4R0.1 CCC(C)I CUR-0055396 [1,0,0,0,0,0|2,0,1]=4 65 B4R0.1 CCC(C)N CUR-0001789 [1,0,0,0,0,0|2,0,1]=4 66 B4R0.1 CCN(C)C CUR-0101456 [1,0,0,0,0,0|3,0,0]=4 67 B4R0.1 CC[N+](=O)[O-] CUR-0012449 [1,0,0,0,0,0|2,0,1]=4 68 B4R0.1 CNC(=O)N CUR-0025342 [1,0,0,0,0,0|3,0,0]=4 69 B4R0.1 COC(=O)Cl CUR-0019109 [1,0,0,0,0,0|3,0,0]=4 70 B4R0.1 C\C(=N\O)\N CUR-0098903 [1,0,0,0,0,0|2,0,0]=3 71 B4R0.2 C#CCCO CUR-0101442 [1,0,0,0,0,0|1,0,2]=4 72 B4R0.2 C(CBr)CBr CUR-0016721 [1,0,0,0,0,0|2,0,1]=4 73 B4R0.2 C(CCl)CBr CUR-0004377 [1,0,0,0,0,0|2,0,1]=4 74 B4R0.2 C(CN)CBr CUR-0103678 [1,0,0,0,0,0|2,0,1]=4 75 B4R0.2 C(CN)CCl CUR-0101958 [1,0,0,0,0,0|2,0,1]=4 76 B4R0.2 C(CN)CN CUR-0101462 [1,0,0,0,0,0|2,0,1]=4 77 B4R0.2 C(CN)CO CUR-0005687 [1,0,0,0,0,0|1,0,1]=3 78 B4R0.2 C(CO)C#N CUR-0000520 [1,0,0,0,0,0|1,0,2]=4 79 B4R0.2 C(CO)CCl CUR-0004180 [1,0,0,0,0,0|1,0,1]=3 80 B4R0.2 C(CO)CO CUR-0007262 [1,0,0,0,0,0|0,0,1]=2 81 B4R0.2 C(CO)NN CUR-0100819 [1,0,0,0,0,0|2,0,1]=4 82 B4R0.2 C(CS)CS CUR-0006323 [1,0,0,0,0,0|0,2,1]=4 83 B4R0.2 C=CCCO CUR-0101449 [1,0,0,0,0,0|1,0,2]=4 84 B4R0.2 CCCCBr CUR-0023794 [1,0,0,0,0,0|2,0,1]=4 85 B4R0.2 CCCCCl CUR-0023945 [1,0,0,0,0,0|2,0,1]=4 86 B4R0.2 CCCCI CUR-0001021 [1,0,0,0,0,0|2,0,1]=4 87 B4R0.2 CCCCN CUR-0017800 [1,0,0,0,0,0|2,0,1]=4 88 B4R0.2 CCCCN CUR-0101317 [1,0,0,0,0,0|2,0,1]=4 89 B4R0.2 CCCCO CUR-0016718 [1,0,0,0,0,0|1,0,1]=3 90 B4R0.2 CCNCC CUR-0022731 [1,0,0,0,0,0|3,0,0]=4 91 B4R0.2 CCNCC CUR-0101285 [1,0,0,0,0,0|3,0,0]=4 92 B4R0.2 CNCCO CUR-0011813 [1,0,0,0,0,0|2,0,1]=4 93 B4R0.2 COCCO CUR-0101466 [1,0,0,0,0,0|2,0,1]=4 94 B6R0.1 C(C#N)C(=O)NN CUR-0005368 [0,1,0,0,0,0|3,0,0]=4 95 B6R0.1 CCC(=O)OCC CUR-0101621 [0,1,0,0,0,0|2,0,0]=3 96 B6R0.1 CCNC(=O)C#C CUR-0067040 [0,1,0,0,0,0|2,0,1]=4 97 B6R0.1 CCNC(=O)CCl CUR-0099539 [0,1,0,0,0,0|2,0,0]=3 98 B6R0.1 CCOC(=O)C#C CUR-0101411 [0,1,0,0,0,0|2,0,1]=4 99 B6R0.1 CCOC(=O)C#N CUR-0012085 [0,1,0,0,0,0|2,0,1]=4 100 B6R0.1 CCOC(=O)C=C CUR-0027721 [0,1,0,0,0,0|2,0,1]=4 101 B6R0.1 CCOC(=O)C=O CUR-0101612 [0,1,0,0,0,0|1,0,2]=4 102 B6R0.1 CCOC(=O)CBr CUR-0001682 [0,1,0,0,0,0|2,0,0]=3 103 B6R0.1 CCOC(=O)CCl CUR-0015757 [0,1,0,0,0,0|2,0,0]=3 104 B6R0.1 CCOC(=O)CF CUR-0101650 [0,1,0,0,0,0|2,0,0]=3 105 B6R0.1 CCOC(=O)CN CUR-0024509 [0,1,0,0,0,0|2,0,0]=3 106 B6R0.1 CCOC(=O)CO CUR-0101638 [0,1,0,0,0,0|1,0,0]=2 107 B6R0.1 CNC(=O)CC#N CUR-0098025 [0,1,0,0,0,0|3,0,0]=4 108 B6R0.1 CNCC(=O)OC CUR-0102132 [0,1,0,0,0,0|3,0,0]=4 109 B6R0.1 COC(=O)CC#N CUR-0022414 [0,1,0,0,0,0|3,0,0]=4 110 B6R0.1 COC(=O)CCS CUR-0005277 [0,1,0,0,0,0|2,1,0]=4 111 B6R0.1 COCC(=O)OC CUR-0101636 [0,1,0,0,0,0|2,0,0]=3 112 B6R0.3 C(C(=O)C(Cl)Cl)Cl CUR-0013381 [0,1,0,0,0,0|2,0,0]=3 113 B6R0.3 C(C(C(=O)O)N)O CUR-0101646 [0,1,0,0,0,0|1,0,2]=4 114 B6R0.3 C([C@@H](C(=O)O)N)O CUR-0101109 [0,1,0,0,0,0|1,0,2]=4 115 B6R0.3 CC(C(=O)OC)Br CUR-0102802 [0,1,0,0,0,0|3,0,0]=4 116 B6R0.3 CC(C)C(=NO)N CUR-0027209 [0,1,0,0,0,0|3,0,0]=4 117 B6R0.3 CCC(C(C)O)N CUR-0067426 [0,1,0,0,0,0|2,0,1]=4 118 B6R0.3 COC(=O)C(Cl)Cl CUR-0010880 [0,1,0,0,0,0|3,0,0]=4 119 B6R0.8 CC(C)(CO)CO CUR-0101641 [0,1,0,0,0,0|1,0,1]=3 120 B6R0.8 CC(CO)(CO)N CUR-0101648 [0,1,0,0,0,0|1,0,1]=3 121 B6R0.8 CCC(C)(C)CO CUR-0004648 [0,1,0,0,0,0|2,0,1]=4 122 B6R0.9 CCC(CC)C=O CUR-0009845 [0,1,0,0,0,0|2,0,1]=4 123 B6R1.2 C1CC(=O)C=C1 CUR-0001940 [0,0,0,1,0,0|2,0,1]=4 124 B6R1.2 C1CC(=O)NC1 CUR-0017206 [0,0,0,1,0,0|3,0,0]=4 125 B6R1.2 C1CC(=O)OC1 CUR-0101496 [0,0,0,1,0,0|3,0,0]=4 126 B6R1.2 C1CCC(=O)C1 CUR-0027028 [0,0,0,1,0,0|2,0,0]=3 127 B6R1.2 C1COCC1O CUR-0101518 [0,0,0,1,0,0|1,0,2]=4 128 B6R1.2 C1CSCC1=O CUR-0101623 [0,0,0,1,0,0|1,1,0]=3 129 B6R1.2 C1[C@H](CON1)O CUR-0120241 [0,0,0,1,0,0|1,0,2]=4 130 B6R1.4 CC1CCC1O CUR-0090358 [0,0,0,1,0,0|2,0,1]=4 131 B6R1.6 C1CC(C1)CO CUR-0022828 [0,0,0,1,0,0|2,0,1]=4 132 B3R0.1 C#CCO CUR-0007009 [2,0,0,0,0,0|0,0,2]=4 133 B3R0.1 C(=O)C=O CUR-0024623 [2,0,0,0,0,0|0,0,2]=4 134 B3R0.1 C(=O)NN CUR-0101193 [2,0,0,0,0,0|2,0,0]=4 135 B3R0.1 C(C=O)Cl CUR-0018990 [2,0,0,0,0,0|1,0,0]=3 136 B3R0.1 C(CBr)Br CUR-0000806 [2,0,0,0,0,0|2,0,0]=4 137 B3R0.1 C(CBr)Cl CUR-0006161 [2,0,0,0,0,0|2,0,0]=4 138 B3R0.1 C(CBr)N CUR-0103516 [2,0,0,0,0,0|2,0,0]=4 139 B3R0.1 C(CBr)O CUR-0021042 [2,0,0,0,0,0|1,0,0]=3 140 B3R0.1 C(CCl)N CUR-0015629 [2,0,0,0,0,0|2,0,0]=4 141 B3R0.1 C(CCl)O CUR-0101474 [2,0,0,0,0,0|1,0,0]=3 142 B3R0.1 C(CN)N CUR-0009355 [2,0,0,0,0,0|2,0,0]=4 143 B3R0.1 C(CN)N CUR-0101207 [2,0,0,0,0,0|2,0,0]=4 144 B3R0.1 C(CN)N CUR-0101271 [2,0,0,0,0,0|2,0,0]=4 145 B3R0.1 C(CO)N CUR-0010085 [2,0,0,0,0,0|1,0,0]=3 146 B3R0.1 C(CO)O CUR-0026540 [2,0,0,0,0,0|0,0,0]=2 147 B3R0.1 C(CS)N CUR-0000633 [2,0,0,0,0,0|1,1,0]=4 148 B3R0.1 C(CS)N CUR-0101235 [2,0,0,0,0,0|1,1,0]=4 149 B3R0.1 C(CS)O CUR-0013730 [2,0,0,0,0,0|0,1,0]=3 150 B3R0.1 C=CCBr CUR-0014802 [2,0,0,0,0,0|1,0,1]=4 151 B3R0.1 C=CCCl CUR-0002102 [2,0,0,0,0,0|1,0,1]=4 152 B3R0.1 C=CCI CUR-0024817 [2,0,0,0,0,0|1,0,1]=4 153 B3R0.1 C=CCN CUR-0009493 [2,0,0,0,0,0|1,0,1]=4 154 B3R0.1 C=CCO CUR-0101427 [2,0,0,0,0,0|0,0,1]=3 155 B3R0.1 CCC=O CUR-0015273 [2,0,0,0,0,0|1,0,0]=3 156 B3R0.1 CCCBr CUR-0028377 [2,0,0,0,0,0|1,0,1]=4 157 B3R0.1 CCCI CUR-0010202 [2,0,0,0,0,0|1,0,1]=4 158 B3R0.1 CCCN CUR-0000120 [2,0,0,0,0,0|1,0,1]=4 159 B3R0.1 CCCO CUR-0017382 [2,0,0,0,0,0|0,0,1]=3 160 B3R0.1 CCCS CUR-0009615 [2,0,0,0,0,0|0,1,1]=4 161 B3R0.1 CNC=O CUR-0012781 [2,0,0,0,0,0|2,0,0]=4 162 B3R0.1 COCCl CUR-0028317 [2,0,0,0,0,0|2,0,0]=4 163 B3R0.2 C(=O)(N)N CUR-0004435 [2,0,0,0,0,0|2,0,0]=4 164 B3R0.2 CC(=N)N CUR-0023632 [2,0,0,0,0,0|2,0,0]=4 165 B3R0.2 CC(=O)Br CUR-0004133 [2,0,0,0,0,0|1,0,0]=3 166 B3R0.2 CC(=O)Cl CUR-0019985 [2,0,0,0,0,0|1,0,0]=3 167 B3R0.2 CC(=O)N CUR-0016336 [2,0,0,0,0,0|1,0,0]=3 168 B3R0.2 CC(=O)O CUR-0005925 [2,0,0,0,0,0|0,0,0]=2 169 B3R0.2 CC(=S)N CUR-0008655 [2,0,0,0,0,0|1,1,0]=4 170 B3R0.2 CC(C)Br CUR-0027321 [2,0,0,0,0,0|1,0,1]=4 171 B3R0.2 CC(C)Cl CUR-0022523 [2,0,0,0,0,0|1,0,1]=4 172 B3R0.2 CC(C)I CUR-0026227 [2,0,0,0,0,0|1,0,1]=4 173 B3R0.2 CC(C)N CUR-0024558 [2,0,0,0,0,0|1,0,1]=4 174 B3R0.2 CC(C)S CUR-0012379 [2,0,0,0,0,0|0,1,1]=4 175 B3R0.2 CN(C)C CUR-0004768 [2,0,0,0,0,0|2,0,0]=4 176 B3R0.2 CP(C)C CUR-0006076 [2,0,0,0,0,0|2,0,0]=4 177 B3R0.2 C[N+](=O)[O-] CUR-0016305 [2,0,0,0,0,0|1,0,1]=4 178 B3R0.2 C[S+](C)C CUR-0103505 [2,0,0,0,0,0|2,0,0]=4 179 B5R0.1 C(C#N)C(=O)N CUR-0015106 [1,1,0,0,0,0|2,0,0]=4 180 B5R0.1 C(C#N)C(=O)O CUR-0011506 [1,1,0,0,0,0|1,0,0]=3 181 B5R0.1 C(CBr)C(=O)O CUR-0102453 [1,1,0,0,0,0|1,0,0]=3 182 B5R0.1 C(CCl)C(=O)Cl CUR-0009101 [1,1,0,0,0,0|2,0,0]=4 183 B5R0.1 C(CCl)C(=O)O CUR-0008480 [1,1,0,0,0,0|1,0,0]=3 184 B5R0.1 C(CN)C(=O)O CUR-0006907 [1,1,0,0,0,0|1,0,0]=3 185 B5R0.1 C(CN)C(=O)[O-] CUR-0101293 [1,1,0,0,0,0|1,0,1]=4 186 B5R0.1 C(CS)C(=O)O CUR-0101651 [1,1,0,0,0,0|0,1,0]=3 187 B5R0.1 CC(=CCBr)C CUR-0059675 [1,1,0,0,0,0|2,0,0]=4 188 B5R0.1 CC(=CCCl)C CUR-0022594 [1,1,0,0,0,0|2,0,0]=4 189 B5R0.1 CC(=O)COC CUR-0101516 [1,1,0,0,0,0|0,0,0]=2 190 B5R0.1 CC(=O)OC=C CUR-0001318 [1,1,0,0,0,0|1,0,1]=4 191 B5R0.1 CC(C)CCO CUR-0003416 [1,1,0,0,0,0|1,0,1]=4 192 B5R0.1 CC(CCO)O CUR-0003759 [1,1,0,0,0,0|0,0,2]=4 193 B5R0.1 CC(COC)N CUR-0101532 [1,1,0,0,0,0|1,0,1]=4 194 B5R0.1 CCCC(=O)C CUR-0026599 [1,1,0,0,0,0|1,0,0]=3 195 B5R0.1 CCCC(=O)Cl CUR-0020308 [1,1,0,0,0,0|2,0,0]=4 196 B5R0.1 CCCC(=O)O CUR-0020198 [1,1,0,0,0,0|1,0,0]=3 197 B5R0.1 CCOC(=O)C CUR-0101519 [1,1,0,0,0,0|1,0,0]=3 198 B5R0.1 CCOC(=O)Cl CUR-0026181 [1,1,0,0,0,0|2,0,0]=4 199 B5R0.1 CCOC(=O)N CUR-0100824 [1,1,0,0,0,0|2,0,0]=4 200 B5R0.1 CN(C)CCO CUR-0019188 [1,1,0,0,0,0|2,0,0]=4 201 B5R0.1 CNCC(=O)O CUR-0018005 [1,1,0,0,0,0|1,0,0]=3 202 B5R0.1 COCC(=O)Cl CUR-0101665 [1,1,0,0,0,0|1,0,0]=3 203 B5R0.1 COCC(=O)O CUR-0014449 [1,1,0,0,0,0|0,0,0]=2 204 B5R0.1 CSCC(=O)O CUR-0025987 [1,1,0,0,0,0|0,1,0]=3 205 B5R0.1 C\C=C\C(=O)O CUR-0100765 [1,1,0,0,0,0|1,0,1]=4 206 B5R0.4 CC(C)(CO)N CUR-0101533 [1,1,0,0,0,0|1,0,1]=4 207 B5R0.5 C(=O)(C(=O)O)O CUR-0022161 [1,1,0,0,0,0|0,0,1]=3 208 B5R0.5 C(=O)(C(=O)O)O CUR-0100644 [1,1,0,0,0,0|0,0,1]=3 209 B5R0.5 C(C(=O)Cl)(Cl)Cl CUR-0015043 [1,1,0,0,0,0|2,0,0]=4 210 B5R0.5 C(C(=O)O)(Cl)Cl CUR-0017246 [1,1,0,0,0,0|1,0,0]=3 211 B5R0.5 CC(=O)C(=O)C CUR-0014415 [1,1,0,0,0,0|0,0,2]=4 212 B5R0.5 CC(=O)C(=O)O CUR-0101513 [1,1,0,0,0,0|0,0,1]=3 213 B5R0.5 CC(=O)N(C)C CUR-0015735 [1,1,0,0,0,0|2,0,0]=4 214 B5R0.5 CC(C(=O)Br)Br CUR-0103656 [1,1,0,0,0,0|2,0,0]=4 215 B5R0.5 CC(C(=O)C)Cl CUR-0002968 [1,1,0,0,0,0|1,0,0]=3 216 B5R0.5 CC(C(=O)C)O CUR-0101517 [1,1,0,0,0,0|0,0,0]=2 217 B5R0.5 CC(C(=O)Cl)Cl CUR-0025103 [1,1,0,0,0,0|2,0,0]=4 218 B5R0.5 CC(C(=O)O)Cl CUR-0027467 [1,1,0,0,0,0|1,0,0]=3 219 B5R0.5 CC(C(=O)O)N CUR-0005753 [1,1,0,0,0,0|1,0,0]=3 220 B5R0.5 CC(C(=O)O)O CUR-0100772 [1,1,0,0,0,0|0,0,0]=2 221 B5R0.5 CC(C(=O)O)S CUR-0001712 [1,1,0,0,0,0|0,1,0]=3 222 B5R0.5 CC(C)C(=O)C CUR-0101503 [1,1,0,0,0,0|1,0,0]=3 223 B5R0.5 CC(C)C(=O)Cl CUR-0101654 [1,1,0,0,0,0|2,0,0]=4 224 B5R0.5 CC(C)C(=O)O CUR-0023620 [1,1,0,0,0,0|1,0,0]=3 225 B5R0.5 C[C@@H](C(=O)N)N CUR-0101872 [1,1,0,0,0,0|2,0,0]=4 226 B5R0.5 C[C@@H](C(=O)O)N CUR-0101526 [1,1,0,0,0,0|1,0,0]=3 227 B5R0.2 C#CCCCO CUR-0101486 [1,1,0,0,0,0|1,0,1]=4 228 B5R0.2 C(C#CCO)N CUR-0090769 [1,1,0,0,0,0|1,0,1]=4 229 B5R0.2 C(C#CCO)O CUR-0101498 [1,1,0,0,0,0|0,0,1]=3 230 B5R0.2 C(C=CCO)O CUR-0100969 [1,1,0,0,0,0|0,0,0]=2 231 B5R0.2 C(CC#N)CO CUR-0020823 [1,1,0,0,0,0|1,0,1]=4 232 B5R0.2 C(CCCl)CO CUR-0025105 [1,1,0,0,0,0|1,0,1]=4 233 B5R0.2 C(CCO)CO CUR-0024794 [1,1,0,0,0,0|0,0,1]=3 234 B5R0.2 C(\C=C/CO)O CUR-0101515 [1,1,0,0,0,0|0,0,0]=2 235 B5R0.2 CCCCCO CUR-0018736 [1,1,0,0,0,0|1,0,1]=4 236 B5R0.2 CCNCCO CUR-0101534 [1,1,0,0,0,0|1,0,1]=4 237 B5R0.2 CCOCCO CUR-0010841 [1,1,0,0,0,0|1,0,1]=4 238 B5R0.2 CC\C=C/CO CUR-0101504 [1,1,0,0,0,0|1,0,0]=3 239 B5R0.2 COCCCN CUR-0101530 [1,1,0,0,0,0|1,0,1]=4 240 B7R0.2 CC(C)OC(=O)CCl CUR-0013704 [0,2,0,0,0,0|2,0,0]=4 241 B7R0.3 C(C#N)NC(=O)CCl CUR-0024918 [0,2,0,0,0,0|2,0,0]=4 242 B7R0.3 C(C(=O)\N=C\NO)Cl CUR-0027210 [0,2,0,0,0,0|1,0,1]=4 243 B7R0.3 CCCNC(=O)CCl CUR-0099537 [0,2,0,0,0,0|2,0,0]=4 244 B7R0.3 CCCOC(=O)CCl CUR-0101322 [0,2,0,0,0,0|2,0,0]=4 245 B7R0.3 CNC(=O)OCCO CUR-0053764 [0,2,0,0,0,0|2,0,0]=4 246 B7R0.3 COCCC(=O)OC CUR-0101774 [0,2,0,0,0,0|2,0,0]=4 247 B7R0.5 CCOC(=O)C(C)Br CUR-0103087 [0,2,0,0,0,0|2,0,0]=4 248 B7R0.5 CCOC(=O)C(F)F CUR-0007059 [0,2,0,0,0,0|2,0,0]=4 249 B7R0.7 CCCC(=O)OCC CUR-0005973 [0,2,0,0,0,0|2,0,0]=4 250 B7R0.7 CCOC(=O)CC#N CUR-0025194 [0,2,0,0,0,0|2,0,0]=4 251 B7R0.7 CCOC(=O)CCBr CUR-0103086 [0,2,0,0,0,0|2,0,0]=4 252 B7R0.7 CCOC(=O)CCCl CUR-0017965 [0,2,0,0,0,0|2,0,0]=4 253 B7R0.7 CCOC(=O)CNN CUR-0022001 [0,2,0,0,0,0|2,0,0]=4 254 B7R0.7 CCOC(=O)C[N+]#[C-] CUR-0023815 [0,2,0,0,0,0|2,0,0]=4 255 B7R0.7 CCOC(=O)OCC CUR-0003960 [0,2,0,0,0,0|2,0,0]=4 256 B7R0.7 COCC(CCO)N CUR-0020087 [0,2,0,0,0,0|1,0,1]=4 257 B7R0.10 C([C@H]([C@H](CO)O)O)O CUR-0163306 [0,2,0,0,0,0|0,0,2]=4 258 B7R0.10 COC(=O)C(CO)N CUR-0010591 [0,2,0,0,0,0|2,0,0]=4 259 B7R0.14 C(C(=O)C(F)(F)F)Br CUR-0005112 [0,2,0,0,0,0|2,0,0]=4 260 B7R0.14 CC(C)(C)C(=O)CCl CUR-0102046 [0,2,0,0,0,0|2,0,0]=4 261 B7R0.16 C(=O)(C(=O)O)C(=O)O CUR-0028231 [0,2,0,0,0,0|0,0,2]=4 262 B7R0.18 C(C(CO)(CO)N)O CUR-0010350 [0,2,0,0,0,0|0,0,2]=4 263 B7R0.18 CC(CO)(CO)CO CUR-0007983 [0,2,0,0,0,0|0,0,2]=4 264 B5R1.2 C1C(CO1)O CUR-0028981 [1,0,0,1,0,0|0,0,2]=4 265 B5R1.2 C1CC(=O)C1 CUR-0005686 [1,0,0,1,0,0|1,0,0]=3 266 B5R1.3 C1C(O1)CO CUR-0011597 [1,0,0,1,0,0|0,0,2]=4 267 B5R1.3 C1CC1CO CUR-0016442 [1,0,0,1,0,0|1,0,1]=4 268 B5R1.1 C1C=CCO1 CUR-0017724 [1,0,0,1,0,0|1,0,1]=4 269 B5R1.1 C1COC=C1 CUR-0023942 [1,0,0,1,0,0|1,0,1]=4 270 B7R1.1 C1COCC1C=O CUR-0082585 [0,1,0,1,0,0|1,0,1]=4 271 B7R1.1 C1COCC1CO CUR-0101139 [0,1,0,1,0,0|1,0,1]=4 272 B7R1.2 C1C(=O)CNC1=O CUR-0122247 [0,1,0,1,0,0|1,0,1]=4 273 B7R1.2 C1C(=O)COC1=O CUR-0100913 [0,1,0,1,0,0|0,0,1]=3 274 B7R1.2 C1CC(=O)CC1=O CUR-0010695 [0,1,0,1,0,0|1,0,1]=4 275 B7R1.2 CC1CCC(=O)N1 CUR-0016557 [0,1,0,1,0,0|2,0,0]=4 276 B7R1.2 CC1CCC(=O)O1 CUR-0101591 [0,1,0,1,0,0|2,0,0]=4 277 B7R1.3 C1CCC(=O)CC1 CUR-0013382 [0,1,0,1,0,0|2,0,0]=4 278 B7R1.3 C1CCNC(=O)C1 CUR-0002331 [0,1,0,1,0,0|2,0,0]=4 279 B7R1.3 C1CNC(=O)CN1 CUR-0101593 [0,1,0,1,0,0|2,0,0]=4 280 B7R1.3 C1CNCCC1=O CUR-0009294 [0,1,0,1,0,0|2,0,0]=4 281 B7R1.3 C1CNCCC1=O CUR-0102475 [0,1,0,1,0,0|2,0,0]=4 282 B7R1.3 C1COCC(=O)N1 CUR-0014967 [0,1,0,1,0,0|1,0,0]=3 283 B7R1.3 C1COCCC1=O CUR-0001478 [0,1,0,1,0,0|1,0,0]=3 284 B7R1.3 C1CSCC(=O)N1 CUR-0095816 [0,1,0,1,0,0|1,1,0]=4 285 B7R1.3 C1CSCCC1=O CUR-0005576 [0,1,0,1,0,0|1,1,0]=4 286 B7R1.4 C1CNC(=O)C1Br CUR-0004832 [0,1,0,1,0,0|2,0,0]=4 287 B7R1.4 C1COC(=O)C1Br CUR-0012154 [0,1,0,1,0,0|2,0,0]=4 288 B7R1.4 C1CSC(=O)C1N CUR-0025625 [0,1,0,1,0,0|2,0,0]=4 289 B7R1.4 C1[C@H](C(=O)NO1)N CUR-0101615 [0,1,0,1,0,0|2,0,0]=4 290 B7R1.22 C1CC1C(=O)CBr CUR-0027626 [0,1,0,1,0,0|2,0,0]=4 291 B7R1.25 CC1(COC1)CO CUR-0022359 [0,1,0,1,0,0|1,0,1]=4 292 B7R1.29 C1CC1(CO)CO CUR-0101616 [0,1,0,1,0,0|1,0,1]=4