0 B5R0.5 C(=O)(C(=O)Cl)Cl CUR-0022479 [0,0,0,0,0,0|2,1,1]=4 1 B5R0.5 C(=O)(C(=O)N)N CUR-0013129 [0,0,0,0,0,0|2,1,1]=4 2 B5R0.5 C(=O)(C(=O)O)O CUR-0022161 [0,0,0,0,0,0|2,1,1]=4 3 B5R0.5 C(=O)(C(=O)O)O CUR-0100644 [0,0,0,0,0,0|2,1,1]=4 4 B5R0.5 C(C(=O)Cl)(Cl)Cl CUR-0015043 [0,0,0,0,0,0|3,0,0]=3 5 B5R0.5 C(C(=O)O)(Cl)Cl CUR-0017246 [0,0,0,0,0,0|3,0,0]=3 6 B5R0.5 CC(=O)C(=O)C CUR-0014415 [0,0,0,0,0,0|0,1,1]=2 7 B5R0.5 CC(=O)C(=O)O CUR-0101513 [0,0,0,0,0,0|1,1,1]=3 8 B5R0.5 CC(=O)N(C)C CUR-0015735 [0,0,0,0,0,0|2,0,0]=2 9 B5R0.5 CC(C(=N)N)Cl CUR-0013780 [0,0,0,0,0,0|3,0,0]=3 10 B5R0.5 CC(C(=O)Br)Br CUR-0103656 [0,0,0,0,0,0|2,0,0]=2 11 B5R0.5 CC(C(=O)C)Cl CUR-0002968 [0,0,0,0,0,0|1,0,0]=1 12 B5R0.5 CC(C(=O)C)O CUR-0101517 [0,0,0,0,0,0|0,1,0]=1 13 B5R0.5 CC(C(=O)Cl)Cl CUR-0025103 [0,0,0,0,0,0|2,0,0]=2 14 B5R0.5 CC(C(=O)O)Cl CUR-0027467 [0,0,0,0,0,0|2,0,0]=2 15 B5R0.5 CC(C(=O)O)N CUR-0005753 [0,0,0,0,0,0|2,0,0]=2 16 B5R0.5 CC(C(=O)O)O CUR-0100772 [0,0,0,0,0,0|1,1,0]=2 17 B5R0.5 CC(C(=O)O)S CUR-0001712 [0,0,0,0,0,0|1,0,0]=1 18 B5R0.5 CC(C(C)Br)Br CUR-0103657 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.5 CC(C)C(=N)N CUR-0101000 [0,0,0,0,0,0|3,0,0]=3 20 B5R0.5 CC(C)C(=O)C CUR-0101503 [0,0,0,0,0,0|1,0,0]=1 21 B5R0.5 CC(C)C(=O)Cl CUR-0101654 [0,0,0,0,0,0|2,0,0]=2 22 B5R0.5 CC(C)C(=O)O CUR-0023620 [0,0,0,0,0,0|2,0,0]=2 23 B5R0.5 CC(C)[N+](=O)[O-] CUR-0001597 [0,0,0,0,0,0|3,0,0]=3 24 B5R0.5 CN(C)C(=N)N CUR-0100903 [0,0,0,0,0,0|4,0,0]=4 25 B5R0.5 CN(C)C(=O)Cl CUR-0021018 [0,0,0,0,0,0|3,0,0]=3 26 B5R0.5 CN(C)C(=S)Cl CUR-0101854 [0,0,0,0,0,0|3,1,0]=4 27 B5R0.5 CN(C)C(=S)N CUR-0099857 [0,0,0,0,0,0|3,1,0]=4 28 B5R0.5 C[C@@H](C(=O)N)N CUR-0101872 [0,0,0,0,0,0|2,0,0]=2 29 B5R0.5 C[C@@H](C(=O)O)N CUR-0101526 [0,0,0,0,0,0|2,0,0]=2 30 B4R0.1 C#CC(=O)O CUR-0101441 [1,0,0,0,0,0|1,0,2]=4 31 B4R0.1 C(=O)(N)NN CUR-0003223 [1,0,0,0,0,0|3,0,0]=4 32 B4R0.1 C(=O)(N)NO CUR-0001014 [1,0,0,0,0,0|2,1,0]=4 33 B4R0.1 C(=O)C(=O)O CUR-0021308 [1,0,0,0,0,0|1,1,1]=4 34 B4R0.1 C(C(=N)N)Cl CUR-0085287 [1,0,0,0,0,0|3,0,0]=4 35 B4R0.1 C(C(=O)Br)Br CUR-0006369 [1,0,0,0,0,0|2,0,0]=3 36 B4R0.1 C(C(=O)Cl)Cl CUR-0004550 [1,0,0,0,0,0|2,0,0]=3 37 B4R0.1 C(C(=O)N)Br CUR-0014813 [1,0,0,0,0,0|2,0,0]=3 38 B4R0.1 C(C(=O)N)Cl CUR-0007516 [1,0,0,0,0,0|2,0,0]=3 39 B4R0.1 C(C(=O)N)N CUR-0101687 [1,0,0,0,0,0|2,0,0]=3 40 B4R0.1 C(C(=O)N)O CUR-0113957 [1,0,0,0,0,0|1,1,0]=3 41 B4R0.1 C(C(=O)O)Br CUR-0100788 [1,0,0,0,0,0|2,0,0]=3 42 B4R0.1 C(C(=O)O)Cl CUR-0003311 [1,0,0,0,0,0|2,0,0]=3 43 B4R0.1 C(C(=O)O)I CUR-0003176 [1,0,0,0,0,0|2,0,0]=3 44 B4R0.1 C(C(=O)O)N CUR-0014574 [1,0,0,0,0,0|2,0,0]=3 45 B4R0.1 C(C(=O)O)N CUR-0101231 [1,0,0,0,0,0|2,0,0]=3 46 B4R0.1 C(C(=O)O)O CUR-0014667 [1,0,0,0,0,0|1,1,0]=3 47 B4R0.1 C(C(=O)O)S CUR-0101545 [1,0,0,0,0,0|1,0,0]=2 48 B4R0.1 C(O)S(=O)[O-] CUR-0023303 [1,0,0,0,0,0|2,1,0]=4 49 B4R0.1 C=CC(=O)Cl CUR-0101542 [1,0,0,0,0,0|1,0,2]=4 50 B4R0.1 C=CC(=O)N CUR-0007166 [1,0,0,0,0,0|1,0,2]=4 51 B4R0.1 C=CC(=O)O CUR-0028045 [1,0,0,0,0,0|1,0,2]=4 52 B4R0.1 CC(=C)C=O CUR-0101443 [1,0,0,0,0,0|1,0,1]=3 53 B4R0.1 CC(=C)CCl CUR-0011941 [1,0,0,0,0,0|2,0,0]=3 54 B4R0.1 CC(=C)OC CUR-0101450 [1,0,0,0,0,0|2,0,0]=3 55 B4R0.1 CC(=O)C=C CUR-0013098 [1,0,0,0,0,0|0,0,2]=3 56 B4R0.1 CC(=O)C=O CUR-0101448 [1,0,0,0,0,0|0,1,1]=3 57 B4R0.1 CC(=O)CCl CUR-0002239 [1,0,0,0,0,0|1,0,0]=2 58 B4R0.1 CC(=O)CO CUR-0005016 [1,0,0,0,0,0|0,1,0]=2 59 B4R0.1 CC(C#C)N CUR-0083146 [1,0,0,0,0,0|1,0,2]=4 60 B4R0.1 CC(C#C)O CUR-0101444 [1,0,0,0,0,0|0,1,2]=4 61 B4R0.1 CC(C#N)Cl CUR-0101233 [1,0,0,0,0,0|2,0,1]=4 62 B4R0.1 CC(C)C#N CUR-0009528 [1,0,0,0,0,0|2,0,1]=4 63 B4R0.1 CC(C)C=O CUR-0017872 [1,0,0,0,0,0|1,0,0]=2 64 B4R0.1 CC(C)CBr CUR-0024115 [1,0,0,0,0,0|2,0,1]=4 65 B4R0.1 CC(C)CI CUR-0028804 [1,0,0,0,0,0|2,0,1]=4 66 B4R0.1 CC(C)CN CUR-0020747 [1,0,0,0,0,0|2,0,1]=4 67 B4R0.1 CC(C)CO CUR-0012302 [1,0,0,0,0,0|1,0,2]=4 68 B4R0.1 CC(C)NN CUR-0014509 [1,0,0,0,0,0|3,0,0]=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|1,0,1]=3 72 B4R0.1 CC(CO)O CUR-0022593 [1,0,0,0,0,0|0,1,2]=4 73 B4R0.1 CC(CS)N CUR-0021165 [1,0,0,0,0,0|1,0,1]=3 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|3,0,0]=4 85 B4R0.1 COC(=O)Cl CUR-0019109 [1,0,0,0,0,0|2,0,0]=3 86 B4R0.1 COC(Cl)Cl CUR-0101733 [1,0,0,0,0,0|3,0,0]=4 87 B4R0.1 CSC(=N)N CUR-0104011 [1,0,0,0,0,0|3,0,0]=4 88 B4R0.1 C\C(=N\O)\N CUR-0098903 [1,0,0,0,0,0|2,1,0]=4 89 B6R0.3 C(C(=O)C(Cl)Cl)Cl CUR-0013381 [0,1,0,0,0,0|2,0,0]=3 90 B6R0.3 C(C(C(=O)O)Br)Br CUR-0100855 [0,1,0,0,0,0|2,0,0]=3 91 B6R0.3 C(C(C(=O)O)N)O CUR-0101646 [0,1,0,0,0,0|2,0,0]=3 92 B6R0.3 C(C(C(=O)O)N)S CUR-0101261 [0,1,0,0,0,0|2,0,0]=3 93 B6R0.3 C([C@@H](C(=O)O)N)O CUR-0101109 [0,1,0,0,0,0|2,0,0]=3 94 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0004971 [0,1,0,0,0,0|2,0,0]=3 95 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0101810 [0,1,0,0,0,0|2,0,0]=3 96 B6R0.3 CC(=C)C(=O)OC CUR-0012718 [0,1,0,0,0,0|1,0,1]=3 97 B6R0.3 CC(=O)C(=O)OC CUR-0100866 [0,1,0,0,0,0|0,1,1]=3 98 B6R0.3 CC(C(=O)OC)Br CUR-0102802 [0,1,0,0,0,0|1,0,0]=2 99 B6R0.3 CC(C)C(=N)OC CUR-0101310 [0,1,0,0,0,0|2,0,0]=3 100 B6R0.3 CC(C)C(=NO)N CUR-0027209 [0,1,0,0,0,0|2,0,1]=4 101 B6R0.3 CC(C)C(CN)O CUR-0027506 [0,1,0,0,0,0|1,0,2]=4 102 B6R0.3 CCC(C(=O)N)Br CUR-0027495 [0,1,0,0,0,0|2,0,0]=3 103 B6R0.3 CCC(C(=O)O)Br CUR-0102801 [0,1,0,0,0,0|2,0,0]=3 104 B6R0.3 CCC(C(=O)O)N CUR-0010659 [0,1,0,0,0,0|2,0,0]=3 105 B6R0.3 CCC(C(C)O)N CUR-0067426 [0,1,0,0,0,0|1,0,2]=4 106 B6R0.3 CCC(C)C(=O)O CUR-0101619 [0,1,0,0,0,0|2,0,0]=3 107 B6R0.3 CN(C)C(=O)C#C CUR-0066918 [0,1,0,0,0,0|2,0,1]=4 108 B6R0.3 CN(C)C(=O)NN CUR-0100988 [0,1,0,0,0,0|3,0,0]=4 109 B6R0.3 COC(=O)C(Cl)Cl CUR-0010880 [0,1,0,0,0,0|2,0,0]=3 110 B6R0.3 C\C(=N\O)\C(=O)C CUR-0101601 [0,1,0,0,0,0|0,1,1]=3 111 B6R0.7 C(=O)(C(Cl)(Cl)Cl)Cl CUR-0020206 [0,1,0,0,0,0|3,0,0]=4 112 B6R0.7 C(=O)(C(Cl)(Cl)Cl)N CUR-0018446 [0,1,0,0,0,0|3,0,0]=4 113 B6R0.7 C(=O)(C(Cl)(Cl)Cl)O CUR-0102700 [0,1,0,0,0,0|3,0,0]=4 114 B6R0.7 C(=O)(C(F)(F)Cl)O CUR-0100968 [0,1,0,0,0,0|3,0,0]=4 115 B6R0.7 C(=O)(C(F)(F)Cl)[O-] CUR-0102445 [0,1,0,0,0,0|3,0,0]=4 116 B6R0.7 C(=O)(C(F)(F)F)N CUR-0100757 [0,1,0,0,0,0|3,0,0]=4 117 B6R0.7 C(=O)(C(F)(F)F)O CUR-0012954 [0,1,0,0,0,0|3,0,0]=4 118 B6R0.7 CC(=O)C(C)(C)C CUR-0101594 [0,1,0,0,0,0|1,0,0]=2 119 B6R0.7 CC(C)(C(=O)O)N CUR-0019881 [0,1,0,0,0,0|2,0,0]=3 120 B6R0.7 CC(C)(C)C(=N)N CUR-0100926 [0,1,0,0,0,0|3,0,0]=4 121 B6R0.7 CC(C)(C)C(=O)Cl CUR-0008199 [0,1,0,0,0,0|2,0,0]=3 122 B6R0.7 CC(C)(C)C(=O)O CUR-0000758 [0,1,0,0,0,0|2,0,0]=3 123 B6R0.7 CC(C)(C)S(=O)N CUR-0101820 [0,1,0,0,0,0|3,0,0]=4 124 B6R0.7 CC(C)S(=O)(=O)Cl CUR-0102209 [0,1,0,0,0,0|3,0,0]=4 125 B6R1.4 CC1CCC1N CUR-0163343 [0,0,0,1,0,0|2,0,1]=4 126 B6R1.4 CC1CCC1O CUR-0090358 [0,0,0,1,0,0|1,0,2]=4 127 B6R1.9 CC1(CC1N)C CUR-0090235 [0,0,0,1,0,0|2,0,1]=4 128 B6R1.11 C1CC1C(=O)Cl CUR-0101645 [0,0,0,1,0,0|2,0,0]=3 129 B6R1.11 C1CC1C(=O)O CUR-0027058 [0,0,0,1,0,0|2,0,0]=3 130 B6R1.11 CC(=O)C1CC1 CUR-0020622 [0,0,0,1,0,0|1,0,0]=2 131 B6R0.2 CC(=CC(=O)O)C CUR-0101587 [0,0,0,0,0,1|2,0,1]=4 132 B6R0.2 CC(=O)CC(=O)C CUR-0004776 [0,0,0,0,0,1|0,1,1]=3 133 B6R0.2 CC(=O)CC(=O)N CUR-0101600 [0,0,0,0,0,1|1,1,1]=4 134 B6R0.2 CC(=O)NC(=S)N CUR-0002878 [0,0,0,0,0,1|1,0,2]=4 135 B6R0.2 CC(C)CC(=O)C CUR-0017562 [0,0,0,0,0,1|1,0,0]=2 136 B6R0.2 CC(C)CC(=O)Cl CUR-0101806 [0,0,0,0,0,1|2,0,0]=3 137 B6R0.2 CC(C)CC(=O)O CUR-0017645 [0,0,0,0,0,1|2,0,0]=3 138 B6R0.2 CC(C)NC(C)C CUR-0028446 [0,0,0,0,0,1|2,0,1]=4 139 B6R0.2 CC(C)OC(=O)Cl CUR-0100902 [0,0,0,0,0,1|2,0,0]=3 140 B6R0.2 CC(OC(=O)Cl)Cl CUR-0007306 [0,0,0,0,0,1|2,0,0]=3 141 B3R0.1 C(=O)C=O CUR-0024623 [2,0,0,0,0,0|0,1,1]=4 142 B3R0.1 C(=O)NN CUR-0101193 [2,0,0,0,0,0|2,0,0]=4 143 B3R0.1 C(C=O)Cl CUR-0018990 [2,0,0,0,0,0|1,0,0]=3 144 B3R0.1 C(CS)N CUR-0000633 [2,0,0,0,0,0|1,0,1]=4 145 B3R0.1 C(CS)N CUR-0101235 [2,0,0,0,0,0|1,0,1]=4 146 B3R0.1 C(CS)O CUR-0013730 [2,0,0,0,0,0|0,0,2]=4 147 B3R0.1 C=CCBr CUR-0014802 [2,0,0,0,0,0|1,0,1]=4 148 B3R0.1 C=CCCl CUR-0002102 [2,0,0,0,0,0|1,0,1]=4 149 B3R0.1 C=CCI CUR-0024817 [2,0,0,0,0,0|1,0,1]=4 150 B3R0.1 C=CCN CUR-0009493 [2,0,0,0,0,0|1,0,1]=4 151 B3R0.1 C=CCO CUR-0101427 [2,0,0,0,0,0|0,1,1]=4 152 B3R0.1 CCC#N CUR-0100813 [2,0,0,0,0,0|1,0,1]=4 153 B3R0.1 CCC=O CUR-0015273 [2,0,0,0,0,0|0,0,0]=2 154 B3R0.1 CCCBr CUR-0028377 [2,0,0,0,0,0|1,0,1]=4 155 B3R0.1 CCCI CUR-0010202 [2,0,0,0,0,0|1,0,1]=4 156 B3R0.1 CCCN CUR-0000120 [2,0,0,0,0,0|1,0,1]=4 157 B3R0.1 CCCO CUR-0017382 [2,0,0,0,0,0|0,0,2]=4 158 B3R0.1 CCCS CUR-0009615 [2,0,0,0,0,0|0,0,1]=3 159 B3R0.1 CCNN CUR-0017500 [2,0,0,0,0,0|2,0,0]=4 160 B3R0.1 CNC=O CUR-0012781 [2,0,0,0,0,0|1,0,0]=3 161 B3R0.1 CNOC CUR-0015640 [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 B3R0.1 CSSC CUR-0101553 [2,0,0,0,0,0|2,0,0]=4 164 B3R0.2 C(=O)(N)N CUR-0004435 [2,0,0,0,0,0|2,0,0]=4 165 B3R0.2 CC(=N)N CUR-0023632 [2,0,0,0,0,0|2,0,0]=4 166 B3R0.2 CC(=O)Br CUR-0004133 [2,0,0,0,0,0|1,0,0]=3 167 B3R0.2 CC(=O)Cl CUR-0019985 [2,0,0,0,0,0|1,0,0]=3 168 B3R0.2 CC(=O)N CUR-0016336 [2,0,0,0,0,0|1,0,0]=3 169 B3R0.2 CC(=O)O CUR-0005925 [2,0,0,0,0,0|0,1,0]=3 170 B3R0.2 CC(=S)N CUR-0008655 [2,0,0,0,0,0|1,0,1]=4 171 B3R0.2 CC(C)Br CUR-0027321 [2,0,0,0,0,0|1,0,0]=3 172 B3R0.2 CC(C)Cl CUR-0022523 [2,0,0,0,0,0|1,0,0]=3 173 B3R0.2 CC(C)I CUR-0026227 [2,0,0,0,0,0|1,0,0]=3 174 B3R0.2 CC(C)N CUR-0024558 [2,0,0,0,0,0|1,0,0]=3 175 B3R0.2 CC(C)S CUR-0012379 [2,0,0,0,0,0|0,0,0]=2 176 B3R0.2 CN(C)C CUR-0004768 [2,0,0,0,0,0|2,0,0]=4 177 B3R0.2 CP(C)C CUR-0006076 [2,0,0,0,0,0|2,0,0]=4 178 B3R0.2 C[N+](=O)[O-] CUR-0016305 [2,0,0,0,0,0|1,1,0]=4 179 B3R0.2 C[S+](C)C CUR-0103505 [2,0,0,0,0,0|2,0,0]=4 180 B5R0.1 C(C#N)C(=O)N CUR-0015106 [1,1,0,0,0,0|1,0,1]=4 181 B5R0.1 C(C#N)C(=O)O CUR-0011506 [1,1,0,0,0,0|1,0,1]=4 182 B5R0.1 C(CBr)C(=O)O CUR-0102453 [1,1,0,0,0,0|1,0,0]=3 183 B5R0.1 C(CCl)C(=O)Cl CUR-0009101 [1,1,0,0,0,0|1,0,0]=3 184 B5R0.1 C(CCl)C(=O)O CUR-0008480 [1,1,0,0,0,0|1,0,0]=3 185 B5R0.1 C(CN)C(=O)O CUR-0006907 [1,1,0,0,0,0|1,0,0]=3 186 B5R0.1 C(CN)C(=O)[O-] CUR-0101293 [1,1,0,0,0,0|1,0,0]=3 187 B5R0.1 C(CS)C(=O)O CUR-0101651 [1,1,0,0,0,0|1,0,0]=3 188 B5R0.1 CC(=CCBr)C CUR-0059675 [1,1,0,0,0,0|1,0,1]=4 189 B5R0.1 CC(=CCCl)C CUR-0022594 [1,1,0,0,0,0|1,0,1]=4 190 B5R0.1 CC(=O)COC CUR-0101516 [1,1,0,0,0,0|0,0,0]=2 191 B5R0.1 CC(=O)OC=C CUR-0001318 [1,1,0,0,0,0|0,0,2]=4 192 B5R0.1 CC(C)CC=O CUR-0101502 [1,1,0,0,0,0|1,0,0]=3 193 B5R0.1 CC(C)CCBr CUR-0002757 [1,1,0,0,0,0|1,0,1]=4 194 B5R0.1 CC(C)CCN CUR-0101511 [1,1,0,0,0,0|1,0,1]=4 195 B5R0.1 CC(C)CCO CUR-0003416 [1,1,0,0,0,0|1,0,1]=4 196 B5R0.1 CC(C)N=C=O CUR-0101492 [1,1,0,0,0,0|1,0,1]=4 197 B5R0.1 CC(CCO)O CUR-0003759 [1,1,0,0,0,0|0,0,2]=4 198 B5R0.1 CC(COC)N CUR-0101532 [1,1,0,0,0,0|1,0,1]=4 199 B5R0.1 CC(CSC)N CUR-0019523 [1,1,0,0,0,0|1,0,1]=4 200 B5R0.1 CCCC(=O)C CUR-0026599 [1,1,0,0,0,0|0,0,0]=2 201 B5R0.1 CCCC(=O)Cl CUR-0020308 [1,1,0,0,0,0|1,0,0]=3 202 B5R0.1 CCCC(=O)O CUR-0020198 [1,1,0,0,0,0|1,0,0]=3 203 B5R0.1 CCCC(C)O CUR-0023615 [1,1,0,0,0,0|0,0,2]=4 204 B5R0.1 CCC[N+](=O)[O-] CUR-0101527 [1,1,0,0,0,0|2,0,0]=4 205 B5R0.1 CCOC(=O)C CUR-0101519 [1,1,0,0,0,0|0,0,0]=2 206 B5R0.1 CCOC(=O)Cl CUR-0026181 [1,1,0,0,0,0|1,0,0]=3 207 B5R0.1 CCOC(=O)N CUR-0100824 [1,1,0,0,0,0|1,0,0]=3 208 B5R0.1 CN(C)CCCl CUR-0017041 [1,1,0,0,0,0|2,0,0]=4 209 B5R0.1 CN(C)CCN CUR-0101525 [1,1,0,0,0,0|2,0,0]=4 210 B5R0.1 CN(C)CCO CUR-0019188 [1,1,0,0,0,0|2,0,0]=4 211 B5R0.1 CNCC(=O)O CUR-0018005 [1,1,0,0,0,0|1,0,0]=3 212 B5R0.1 COCC(=O)Cl CUR-0101665 [1,1,0,0,0,0|1,0,0]=3 213 B5R0.1 COCC(=O)O CUR-0014449 [1,1,0,0,0,0|1,0,0]=3 214 B5R0.1 CSCC(=N)N CUR-0100998 [1,1,0,0,0,0|2,0,0]=4 215 B5R0.1 CSCC(=O)O CUR-0025987 [1,1,0,0,0,0|1,0,0]=3 216 B5R0.1 C\C=C\C(=O)O CUR-0100765 [1,1,0,0,0,0|1,0,1]=4 217 B5R0.3 C(C(=O)CCl)Cl CUR-0101901 [1,1,0,0,0,0|1,0,0]=3 218 B5R0.3 CCC(=O)CC CUR-0101500 [1,1,0,0,0,0|0,0,0]=2 219 B5R0.3 CCC(C)CO CUR-0101523 [1,1,0,0,0,0|0,0,2]=4 220 B5R0.3 CCC(C)NN CUR-0004060 [1,1,0,0,0,0|1,0,1]=4 221 B5R0.3 CCC(CC)Br CUR-0020873 [1,1,0,0,0,0|1,0,1]=4 222 B5R0.3 CCC(CO)N CUR-0101528 [1,1,0,0,0,0|1,0,1]=4 223 B5R0.3 CC\C(=N/O)\N CUR-0010533 [1,1,0,0,0,0|1,0,1]=4 224 B5R0.3 CNC(=O)C#C CUR-0016542 [1,1,0,0,0,0|0,0,2]=4 225 B5R0.3 CNC(=O)CCl CUR-0099536 [1,1,0,0,0,0|1,0,0]=3 226 B5R0.3 CNC(=O)NC CUR-0101521 [1,1,0,0,0,0|1,0,0]=3 227 B5R0.3 CNC(=S)NC CUR-0101643 [1,1,0,0,0,0|1,1,0]=4 228 B5R0.3 COC(=N)CCl CUR-0101034 [1,1,0,0,0,0|2,0,0]=4 229 B5R0.3 COC(=O)C#C CUR-0008050 [1,1,0,0,0,0|0,0,2]=4 230 B5R0.3 COC(=O)C=C CUR-0018588 [1,1,0,0,0,0|0,0,2]=4 231 B5R0.3 COC(=O)CBr CUR-0102451 [1,1,0,0,0,0|1,0,0]=3 232 B5R0.3 COC(=O)CCl CUR-0019510 [1,1,0,0,0,0|1,0,0]=3 233 B5R0.3 COC(=O)CN CUR-0016914 [1,1,0,0,0,0|1,0,0]=3 234 B5R0.3 COC(=O)CO CUR-0101535 [1,1,0,0,0,0|0,1,0]=3 235 B5R0.3 COC(=O)CS CUR-0014981 [1,1,0,0,0,0|0,0,0]=2 236 B5R0.3 COC(=O)NN CUR-0100906 [1,1,0,0,0,0|2,0,0]=4 237 B5R0.3 COC(=O)OC CUR-0101536 [1,1,0,0,0,0|1,0,0]=3 238 B5R0.3 COP(=O)OC CUR-0016444 [1,1,0,0,0,0|2,0,0]=4 239 B5R0.4 C(=O)C(F)(F)F CUR-0101751 [1,1,0,0,0,0|2,0,0]=4 240 B5R0.4 CC(C)(C)C=O CUR-0101501 [1,1,0,0,0,0|1,0,0]=3 241 B5R0.4 CCC(C)(C)N CUR-0017274 [1,1,0,0,0,0|1,0,1]=4 242 B5R0.4 CCC(C)(C)O CUR-0012425 [1,1,0,0,0,0|0,0,2]=4 243 B5R0.4 CCS(=O)(=O)Cl CUR-0019376 [1,1,0,0,0,0|2,0,0]=4 244 B7R0.2 CC(=O)CC(=O)OC CUR-0018522 [0,1,0,0,0,1|0,1,1]=4 245 B7R0.2 CC(C)CC(=O)C=C CUR-0050915 [0,1,0,0,0,1|1,0,1]=4 246 B7R0.2 CC(C)OC(=O)CCl CUR-0013704 [0,1,0,0,0,1|1,0,0]=3 247 B7R0.2 CCC(C)CC(=O)O CUR-0101758 [0,1,0,0,0,1|2,0,0]=4 248 B7R0.9 CC(=O)CC(C)(C)O CUR-0020852 [0,1,0,0,0,1|0,1,0]=3 249 B7R0.9 CC(=O)OC(C)(C)C CUR-0001433 [0,1,0,0,0,1|1,0,0]=3 250 B7R0.9 CC(C)(C)CC(=O)Cl CUR-0102044 [0,1,0,0,0,1|2,0,0]=4 251 B7R0.9 CC(C)(C)CC(=O)O CUR-0101757 [0,1,0,0,0,1|2,0,0]=4 252 B7R0.9 CC(C)(C)OC(=O)N CUR-0100962 [0,1,0,0,0,1|2,0,0]=4 253 B7R0.16 CC(=O)C(C(=O)C)Cl CUR-0004455 [0,1,0,0,0,1|0,1,1]=4 254 B7R0.16 CC(C(=O)C)C(=O)C CUR-0101719 [0,1,0,0,0,1|0,1,1]=4 255 B7R0.16 CC(C(C(=O)O)N)O CUR-0101788 [0,1,0,0,0,1|1,1,0]=4 256 B7R0.16 CC(C)[C@@H](C(=O)O)N CUR-0016393 [0,1,0,0,0,1|2,0,0]=4 257 B7R0.16 CC(C)[C@H](C(=O)O)N CUR-0101079 [0,1,0,0,0,1|2,0,0]=4 258 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O CUR-0023309 [0,1,0,0,0,1|1,1,0]=4 259 B7R0.5 C(CO)C(C(=O)O)N CUR-0009208 [0,2,0,0,0,0|2,0,0]=4 260 B7R0.5 CCCC(C(=O)O)Br CUR-0020650 [0,2,0,0,0,0|2,0,0]=4 261 B7R0.5 CCOC(=O)C(=O)C CUR-0021376 [0,2,0,0,0,0|0,1,1]=4 262 B7R0.5 CCOC(=O)C(C)Br CUR-0103087 [0,2,0,0,0,0|1,0,0]=3 263 B7R0.5 CCOC(=O)C(F)F CUR-0007059 [0,2,0,0,0,0|2,0,0]=4 264 B7R0.10 COC(=O)C(=O)OC CUR-0027911 [0,2,0,0,0,0|0,1,1]=4 265 B7R0.10 COC(=O)C(CO)N CUR-0010591 [0,2,0,0,0,0|1,0,0]=3 266 B7R0.13 CC(C)(CCl)C(=O)Cl CUR-0102514 [0,2,0,0,0,0|2,0,0]=4 267 B7R0.14 C(C(=O)C(F)(F)F)Br CUR-0005112 [0,2,0,0,0,0|2,0,0]=4 268 B7R0.14 CC(C)(C)C(=O)CCl CUR-0102046 [0,2,0,0,0,0|1,0,0]=3 269 B7R0.14 COC(=O)C(Cl)(Cl)Cl CUR-0101027 [0,2,0,0,0,0|2,0,0]=4 270 B7R0.15 CC(=O)C(OC)OC CUR-0009018 [0,2,0,0,0,0|0,1,0]=3 271 B7R0.15 CCC(CC)C(=O)O CUR-0101754 [0,2,0,0,0,0|2,0,0]=4 272 B5R1.2 C1CC(=O)C1 CUR-0005686 [1,0,0,1,0,0|0,0,0]=2 273 B5R1.2 C1CC(C1)Br CUR-0102047 [1,0,0,1,0,0|1,0,1]=4 274 B5R1.2 C1CC(C1)O CUR-0029256 [1,0,0,1,0,0|0,0,2]=4 275 B5R1.3 C1CC1C=O CUR-0016286 [1,0,0,1,0,0|1,0,0]=3 276 B7R1.2 C1C(=O)NC(=S)S1 CUR-0102016 [0,0,0,1,0,1|1,0,1]=4 277 B7R1.2 C1C(CNC1=O)N CUR-0087034 [0,0,0,1,0,1|2,0,0]=4 278 B7R1.2 C1CC(=O)CC1=O CUR-0010695 [0,0,0,1,0,1|0,1,1]=4 279 B7R1.2 C1CC(=O)NC1=O CUR-0005450 [0,0,0,1,0,1|0,1,1]=4 280 B7R1.2 C1CC(=O)OC1=O CUR-0017714 [0,0,0,1,0,1|0,1,1]=4 281 B7R1.2 CC1CCC(=O)N1 CUR-0016557 [0,0,0,1,0,1|1,0,0]=3 282 B7R1.2 CC1CCC(=O)O1 CUR-0101591 [0,0,0,1,0,1|1,0,0]=3 283 B7R1.2 CC1COC(=O)O1 CUR-0101613 [0,0,0,1,0,1|2,0,0]=4 284 B7R1.12 CC1CC1C(=O)O CUR-0100917 [0,0,0,1,0,1|2,0,0]=4 285 B7R1.20 C1CC1CC(=O)O CUR-0101588 [0,0,0,1,0,1|2,0,0]=4 286 B7R1.4 C1CC(=O)C(=O)C1 CUR-0061064 [0,1,0,1,0,0|0,1,1]=4 287 B7R1.4 C1CC(=O)N(C1)N CUR-0099031 [0,1,0,1,0,0|2,0,0]=4 288 B7R1.4 C1CNC(=O)C1Br CUR-0004832 [0,1,0,1,0,0|1,0,0]=3 289 B7R1.4 C1COC(=O)C1Br CUR-0012154 [0,1,0,1,0,0|1,0,0]=3 290 B7R1.4 C1CSC(=O)C1N CUR-0025625 [0,1,0,1,0,0|1,0,0]=3 291 B7R1.4 C1[C@H](C(=O)NO1)N CUR-0101615 [0,1,0,1,0,0|2,0,0]=4 292 B7R1.4 CN1CCCC1=O CUR-0101576 [0,1,0,1,0,0|2,0,0]=4 293 B7R1.18 C1C(CN1)C(=O)O CUR-0009104 [0,1,0,1,0,0|2,0,0]=4 294 B7R1.18 C1CC(C1)C(=O)Cl CUR-0016394 [0,1,0,1,0,0|2,0,0]=4 295 B7R1.18 C1CC(C1)C(=O)O CUR-0009068 [0,1,0,1,0,0|2,0,0]=4 296 B7R1.18 C1CNC1C(=O)O CUR-0081896 [0,1,0,1,0,0|2,0,0]=4 297 B7R1.19 C1CC1(C(=O)O)N CUR-0010902 [0,1,0,1,0,0|2,0,0]=4 298 B7R1.22 C1CC1C(=O)CBr CUR-0027626 [0,1,0,1,0,0|1,0,0]=3 299 B7R1.22 COC(=O)C1CC1 CUR-0101589 [0,1,0,1,0,0|1,0,0]=3 300 B7R0.6 CC(=O)CCC(=O)C CUR-0022649 [0,0,0,0,0,2|0,1,1]=4 301 B7R0.6 CC(C)COC(=O)Cl CUR-0020162 [0,0,0,0,0,2|2,0,0]=4