0 B5R0.1 C(C#N)C(=O)N CUR-0015106 [0,0,0,0,0,0|2,0,2]=4 1 B5R0.1 C(C#N)C(=O)O CUR-0011506 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 C(CBr)C(=O)O CUR-0102453 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.1 C(CCl)C(=O)Cl CUR-0009101 [0,0,0,0,0,0|2,0,2]=4 4 B5R0.1 C(CCl)C(=O)O CUR-0008480 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.1 C(CN)C(=O)O CUR-0006907 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.1 C(CN)C(=O)[O-] CUR-0101293 [0,0,0,0,0,0|2,0,2]=4 7 B5R0.1 C(CS)C(=O)O CUR-0101651 [0,0,0,0,0,0|2,0,2]=4 8 B5R0.1 CC(=CCBr)C CUR-0059675 [0,0,0,0,0,0|2,0,1]=3 9 B5R0.1 CC(=CCCl)C CUR-0022594 [0,0,0,0,0,0|2,0,1]=3 10 B5R0.1 CC(=O)COC CUR-0101516 [0,0,0,0,0,0|1,0,1]=2 11 B5R0.1 CC(=O)OC=C CUR-0001318 [0,0,0,0,0,0|1,0,1]=2 12 B5R0.1 CC(C)CC=O CUR-0101502 [0,0,0,0,0,0|2,0,2]=4 13 B5R0.1 CC(COC)N CUR-0101532 [0,0,0,0,0,0|2,0,2]=4 14 B5R0.1 CC(CSC)N CUR-0019523 [0,0,0,0,0,0|2,0,2]=4 15 B5R0.1 CCCC(=O)C CUR-0026599 [0,0,0,0,0,0|0,0,2]=2 16 B5R0.1 CCCC(=O)Cl CUR-0020308 [0,0,0,0,0,0|1,0,2]=3 17 B5R0.1 CCCC(=O)O CUR-0020198 [0,0,0,0,0,0|1,0,2]=3 18 B5R0.1 CCCC(C)O CUR-0023615 [0,0,0,0,0,0|0,0,4]=4 19 B5R0.1 CCC[N+](=O)[O-] CUR-0101527 [0,0,0,0,0,0|2,0,2]=4 20 B5R0.1 CCOC(=O)C CUR-0101519 [0,0,0,0,0,0|1,0,1]=2 21 B5R0.1 CCOC(=O)Cl CUR-0026181 [0,0,0,0,0,0|2,0,1]=3 22 B5R0.1 CCOC(=O)N CUR-0100824 [0,0,0,0,0,0|2,0,1]=3 23 B5R0.1 CNCC(=O)O CUR-0018005 [0,0,0,0,0,0|2,0,1]=3 24 B5R0.1 COCC(=O)Cl CUR-0101665 [0,0,0,0,0,0|2,0,1]=3 25 B5R0.1 COCC(=O)O CUR-0014449 [0,0,0,0,0,0|2,0,1]=3 26 B5R0.1 CSCC(=N)N CUR-0100998 [0,0,0,0,0,0|3,0,1]=4 27 B5R0.1 CSCC(=O)O CUR-0025987 [0,0,0,0,0,0|2,0,1]=3 28 B5R0.1 C\C(=C\C#N)\N CUR-0009988 [0,0,0,0,0,0|2,0,1]=3 29 B5R0.1 C\C=C\C(=O)O CUR-0100765 [0,0,0,0,0,0|1,0,0]=1 30 B4R0.1 C#CC(=O)O CUR-0101441 [1,0,0,0,0,0|1,0,2]=4 31 B4R0.1 C(=C(Cl)Cl)Cl CUR-0101983 [1,0,0,0,0,0|3,0,0]=4 32 B4R0.1 C(=O)(N)NN CUR-0003223 [1,0,0,0,0,0|3,0,0]=4 33 B4R0.1 C(=O)(N)NO CUR-0001014 [1,0,0,0,0,0|3,0,0]=4 34 B4R0.1 C(=O)C(=O)O CUR-0021308 [1,0,0,0,0,0|2,0,0]=3 35 B4R0.1 C(C(=O)Br)Br CUR-0006369 [1,0,0,0,0,0|2,0,1]=4 36 B4R0.1 C(C(=O)Cl)Cl CUR-0004550 [1,0,0,0,0,0|2,0,1]=4 37 B4R0.1 C(C(=O)N)Br CUR-0014813 [1,0,0,0,0,0|2,0,1]=4 38 B4R0.1 C(C(=O)N)Cl CUR-0007516 [1,0,0,0,0,0|2,0,1]=4 39 B4R0.1 C(C(=O)N)N CUR-0101687 [1,0,0,0,0,0|2,0,1]=4 40 B4R0.1 C(C(=O)N)O CUR-0113957 [1,0,0,0,0,0|2,0,1]=4 41 B4R0.1 C(C(=O)O)Br CUR-0100788 [1,0,0,0,0,0|2,0,1]=4 42 B4R0.1 C(C(=O)O)Cl CUR-0003311 [1,0,0,0,0,0|2,0,1]=4 43 B4R0.1 C(C(=O)O)I CUR-0003176 [1,0,0,0,0,0|2,0,1]=4 44 B4R0.1 C(C(=O)O)N CUR-0014574 [1,0,0,0,0,0|2,0,1]=4 45 B4R0.1 C(C(=O)O)N CUR-0101231 [1,0,0,0,0,0|2,0,1]=4 46 B4R0.1 C(C(=O)O)O CUR-0014667 [1,0,0,0,0,0|2,0,1]=4 47 B4R0.1 C(C(=O)O)S CUR-0101545 [1,0,0,0,0,0|2,0,1]=4 48 B4R0.1 C=CC(=O)Cl CUR-0101542 [1,0,0,0,0,0|1,0,0]=2 49 B4R0.1 C=CC(=O)N CUR-0007166 [1,0,0,0,0,0|1,0,0]=2 50 B4R0.1 C=CC(=O)O CUR-0028045 [1,0,0,0,0,0|1,0,0]=2 51 B4R0.1 CC(=C)C=O CUR-0101443 [1,0,0,0,0,0|2,0,0]=3 52 B4R0.1 CC(=C)CCl CUR-0011941 [1,0,0,0,0,0|2,0,1]=4 53 B4R0.1 CC(=C)OC CUR-0101450 [1,0,0,0,0,0|2,0,0]=3 54 B4R0.1 CC(=O)C=C CUR-0013098 [1,0,0,0,0,0|0,0,0]=1 55 B4R0.1 CC(=O)C=O CUR-0101448 [1,0,0,0,0,0|1,0,0]=2 56 B4R0.1 CC(=O)CCl CUR-0002239 [1,0,0,0,0,0|1,0,1]=3 57 B4R0.1 CC(=O)CO CUR-0005016 [1,0,0,0,0,0|1,0,1]=3 58 B4R0.1 CC(C)C=O CUR-0017872 [1,0,0,0,0,0|2,0,1]=4 59 B4R0.1 CCC(=O)Cl CUR-0101547 [1,0,0,0,0,0|1,0,1]=3 60 B4R0.1 CCC(=O)N CUR-0101453 [1,0,0,0,0,0|1,0,1]=3 61 B4R0.1 CCC(=O)O CUR-0010221 [1,0,0,0,0,0|1,0,1]=3 62 B4R0.1 CCC(C)Br CUR-0102085 [1,0,0,0,0,0|1,0,2]=4 63 B4R0.1 CCC(C)I CUR-0055396 [1,0,0,0,0,0|1,0,2]=4 64 B4R0.1 CCC(C)N CUR-0001789 [1,0,0,0,0,0|1,0,2]=4 65 B4R0.1 CCN(C)C CUR-0101456 [1,0,0,0,0,0|2,0,1]=4 66 B4R0.1 CC[N+](=O)[O-] CUR-0012449 [1,0,0,0,0,0|2,0,1]=4 67 B4R0.1 CNC(=O)N CUR-0025342 [1,0,0,0,0,0|2,0,0]=3 68 B4R0.1 CNC(=S)N CUR-0004136 [1,0,0,0,0,0|2,1,0]=4 69 B4R0.1 COC(=N)N CUR-0101458 [1,0,0,0,0,0|3,0,0]=4 70 B4R0.1 COC(=O)Cl CUR-0019109 [1,0,0,0,0,0|2,0,0]=3 71 B4R0.1 CSC(=N)N CUR-0104011 [1,0,0,0,0,0|3,0,0]=4 72 B4R0.1 C\C(=N\O)\N CUR-0098903 [1,0,0,0,0,0|3,0,0]=4 73 B4R0.2 CC=CC#N CUR-0028876 [1,0,0,0,0,0|1,0,1]=3 74 B4R0.2 CCCC=O CUR-0100896 [1,0,0,0,0,0|0,0,2]=3 75 B4R0.2 CCN=C=O CUR-0101447 [1,0,0,0,0,0|1,0,2]=4 76 B4R0.2 CCNCC CUR-0022731 [1,0,0,0,0,0|1,0,2]=4 77 B4R0.2 CCNCC CUR-0101285 [1,0,0,0,0,0|1,0,2]=4 78 B4R0.2 CCOC=C CUR-0100764 [1,0,0,0,0,0|1,0,2]=4 79 B4R0.2 CCOC=O CUR-0010493 [1,0,0,0,0,0|1,0,1]=3 80 B4R0.2 COCOC CUR-0101465 [1,0,0,0,0,0|2,0,1]=4 81 B4R0.2 C\C=C\C#N CUR-0101432 [1,0,0,0,0,0|1,0,1]=3 82 B4R0.2 C\C=C\C=O CUR-0001472 [1,0,0,0,0,0|0,0,0]=1 83 B6R0.1 CCC(=O)OCC CUR-0101621 [0,1,0,0,0,0|1,0,1]=3 84 B6R0.1 CCCC(C)C=O CUR-0101597 [0,1,0,0,0,0|0,0,3]=4 85 B6R0.1 CCNC(=O)C#C CUR-0067040 [0,1,0,0,0,0|1,0,2]=4 86 B6R0.1 CCNC(=O)CCl CUR-0099539 [0,1,0,0,0,0|1,0,1]=3 87 B6R0.1 CCOC(=O)C#C CUR-0101411 [0,1,0,0,0,0|1,0,2]=4 88 B6R0.1 CCOC(=O)C#N CUR-0012085 [0,1,0,0,0,0|1,0,2]=4 89 B6R0.1 CCOC(=O)C=C CUR-0027721 [0,1,0,0,0,0|1,0,2]=4 90 B6R0.1 CCOC(=O)C=O CUR-0101612 [0,1,0,0,0,0|1,0,2]=4 91 B6R0.1 CCOC(=O)CBr CUR-0001682 [0,1,0,0,0,0|1,0,1]=3 92 B6R0.1 CCOC(=O)CCl CUR-0015757 [0,1,0,0,0,0|1,0,1]=3 93 B6R0.1 CCOC(=O)CF CUR-0101650 [0,1,0,0,0,0|1,0,1]=3 94 B6R0.1 CCOC(=O)CN CUR-0024509 [0,1,0,0,0,0|1,0,1]=3 95 B6R0.1 CCOC(=O)CO CUR-0101638 [0,1,0,0,0,0|1,0,1]=3 96 B6R0.1 CNC(=O)CC#N CUR-0098025 [0,1,0,0,0,0|1,0,2]=4 97 B6R0.1 CNCC(=O)OC CUR-0102132 [0,1,0,0,0,0|1,0,1]=3 98 B6R0.1 COC(=O)CC#N CUR-0022414 [0,1,0,0,0,0|1,0,2]=4 99 B6R0.1 COC(=O)CCS CUR-0005277 [0,1,0,0,0,0|1,0,2]=4 100 B6R0.1 COCC(=O)OC CUR-0101636 [0,1,0,0,0,0|1,0,1]=3 101 B6R0.1 C\C=C\C(=O)OC CUR-0101585 [0,1,0,0,0,0|0,0,0]=1 102 B6R0.2 C(C(=O)N)C(=O)N CUR-0021261 [0,1,0,0,0,0|2,0,1]=4 103 B6R0.2 C(C(=O)N)C(=S)N CUR-0096493 [0,1,0,0,0,0|2,0,1]=4 104 B6R0.2 C(C(=O)O)C(=O)O CUR-0011839 [0,1,0,0,0,0|2,0,1]=4 105 B6R0.2 CC(=CC(=O)O)C CUR-0101587 [0,1,0,0,0,0|1,0,0]=2 106 B6R0.2 CC(=O)CC(=O)C CUR-0004776 [0,1,0,0,0,0|0,0,1]=2 107 B6R0.2 CC(=O)CC(=O)N CUR-0101600 [0,1,0,0,0,0|1,0,1]=3 108 B6R0.2 CC(=O)NC(=S)N CUR-0002878 [0,1,0,0,0,0|2,0,0]=3 109 B6R0.2 CC(C)CC(=O)C CUR-0017562 [0,1,0,0,0,0|0,0,2]=3 110 B6R0.2 CC(C)CC(=O)Cl CUR-0101806 [0,1,0,0,0,0|1,0,2]=4 111 B6R0.2 CC(C)CC(=O)O CUR-0017645 [0,1,0,0,0,0|1,0,2]=4 112 B6R0.2 CC(C)OC(=O)Cl CUR-0100902 [0,1,0,0,0,0|2,0,1]=4 113 B6R0.2 CC(OC(=O)Cl)Cl CUR-0007306 [0,1,0,0,0,0|2,0,1]=4 114 B6R0.3 CC(=C)C(=O)OC CUR-0012718 [0,1,0,0,0,0|2,0,0]=3 115 B6R0.3 CC(=O)C(=O)OC CUR-0100866 [0,1,0,0,0,0|1,0,0]=2 116 B6R0.3 CC(C(=O)OC)Br CUR-0102802 [0,1,0,0,0,0|2,0,1]=4 117 B6R0.3 CC(C)C(=N)OC CUR-0101310 [0,1,0,0,0,0|2,0,1]=4 118 B6R0.3 CCC(C(=O)N)Br CUR-0027495 [0,1,0,0,0,0|1,0,2]=4 119 B6R0.3 CCC(C(=O)O)Br CUR-0102801 [0,1,0,0,0,0|1,0,2]=4 120 B6R0.3 CCC(C(=O)O)N CUR-0010659 [0,1,0,0,0,0|1,0,2]=4 121 B6R0.3 CCC(C)C(=O)O CUR-0101619 [0,1,0,0,0,0|1,0,2]=4 122 B6R0.3 C\C(=N\O)\C(=O)C CUR-0101601 [0,1,0,0,0,0|2,0,0]=3 123 B6R0.4 C(CC(=O)Cl)CBr CUR-0103177 [0,1,0,0,0,0|1,0,2]=4 124 B6R0.4 C(CC(=O)Cl)CCl CUR-0020663 [0,1,0,0,0,0|1,0,2]=4 125 B6R0.4 C(CC(=O)O)CN CUR-0010241 [0,1,0,0,0,0|1,0,2]=4 126 B6R0.4 C(CNC(=O)N)N CUR-0013187 [0,1,0,0,0,0|2,0,1]=4 127 B6R0.4 C=CCCC(=O)O CUR-0101586 [0,1,0,0,0,0|1,0,2]=4 128 B6R0.4 CC(=O)CCCCl CUR-0004280 [0,1,0,0,0,0|0,0,2]=3 129 B6R0.4 CCCCC(=O)C CUR-0101595 [0,1,0,0,0,0|0,0,2]=3 130 B6R0.4 CCCCC(=O)Cl CUR-0101805 [0,1,0,0,0,0|1,0,2]=4 131 B6R0.4 CCCCC(=O)O CUR-0101620 [0,1,0,0,0,0|1,0,2]=4 132 B6R0.4 CCOCC(=O)O CUR-0101637 [0,1,0,0,0,0|1,0,2]=4 133 B6R0.4 COCCC(=O)O CUR-0012995 [0,1,0,0,0,0|1,0,2]=4 134 B6R1.2 C1CC(=O)C=C1 CUR-0001940 [0,0,0,1,0,0|0,0,0]=1 135 B6R1.2 C1CC(=O)NC1 CUR-0017206 [0,0,0,1,0,0|1,0,1]=3 136 B6R1.2 C1CC(=O)OC1 CUR-0101496 [0,0,0,1,0,0|1,0,1]=3 137 B6R1.2 C1CCC(=O)C1 CUR-0027028 [0,0,0,1,0,0|0,0,2]=3 138 B6R1.2 C1CNC(=O)N1 CUR-0017995 [0,0,0,1,0,0|2,0,1]=4 139 B6R1.2 C1CNC(=O)N1 CUR-0101499 [0,0,0,1,0,0|2,0,1]=4 140 B6R1.2 C1COC(=O)N1 CUR-0101507 [0,0,0,1,0,0|2,0,1]=4 141 B6R1.2 C1CSCC1=O CUR-0101623 [0,0,0,1,0,0|1,0,1]=3 142 B6R1.2 Cc1[nH]ccn1 CUR-0003878 [0,0,0,1,0,0|2,0,1]=4 143 B6R1.2 Cc1cc[nH]n1 CUR-0101477 [0,0,0,1,0,0|2,0,0]=3 144 B6R1.2 Cc1ccco1 CUR-0026171 [0,0,0,1,0,0|0,0,2]=3 145 B6R1.2 Cc1cccs1 CUR-0101571 [0,0,0,1,0,0|0,1,1]=3 146 B6R1.2 Cc1ccno1 CUR-0100786 [0,0,0,1,0,0|1,0,1]=3 147 B6R1.2 Cc1ccsc1 CUR-0006917 [0,0,0,1,0,0|2,0,0]=3 148 B6R1.2 Cc1cscn1 CUR-0101579 [0,0,0,1,0,0|2,0,1]=4 149 B6R1.2 Cn1cccc1 CUR-0101475 [0,0,0,1,0,0|2,0,1]=4 150 B6R1.2 Cn1cccn1 CUR-0023331 [0,0,0,1,0,0|2,0,1]=4 151 B6R1.2 Cn1ccnc1 CUR-0022901 [0,0,0,1,0,0|3,0,0]=4 152 B6R1.2 c1c[nH]nc1N CUR-0101482 [0,0,0,1,0,0|3,0,0]=4 153 B6R1.2 c1cc(sc1)Br CUR-0102679 [0,0,0,1,0,0|1,1,1]=4 154 B6R1.2 c1cc(sc1)Cl CUR-0013952 [0,0,0,1,0,0|1,1,1]=4 155 B6R1.2 c1cc(sc1)I CUR-0103583 [0,0,0,1,0,0|1,1,1]=4 156 B6R1.2 c1cocc1Br CUR-0102292 [0,0,0,1,0,0|2,0,1]=4 157 B6R1.2 c1conc1N CUR-0101483 [0,0,0,1,0,0|3,0,0]=4 158 B6R1.2 c1cscc1Br CUR-0102678 [0,0,0,1,0,0|2,0,1]=4 159 B6R1.2 c1cscc1F CUR-0098914 [0,0,0,1,0,0|2,0,1]=4 160 B6R1.2 c1cscc1N CUR-0103243 [0,0,0,1,0,0|2,0,1]=4 161 B6R1.11 C1CC1C(=O)Cl CUR-0101645 [0,0,0,1,0,0|1,0,2]=4 162 B6R1.11 C1CC1C(=O)O CUR-0027058 [0,0,0,1,0,0|1,0,2]=4 163 B6R1.11 CC(=O)C1CC1 CUR-0020622 [0,0,0,1,0,0|0,0,2]=3 164 B3R0.1 C(=O)C=O CUR-0024623 [2,0,0,0,0,0|1,0,0]=3 165 B3R0.1 C(=O)NN CUR-0101193 [2,0,0,0,0,0|2,0,0]=4 166 B3R0.1 C(C=O)Cl CUR-0018990 [2,0,0,0,0,0|1,0,1]=4 167 B3R0.1 C=CC#N CUR-0023863 [2,0,0,0,0,0|1,0,1]=4 168 B3R0.1 C=CCBr CUR-0014802 [2,0,0,0,0,0|1,0,1]=4 169 B3R0.1 C=CCCl CUR-0002102 [2,0,0,0,0,0|1,0,1]=4 170 B3R0.1 C=CCI CUR-0024817 [2,0,0,0,0,0|1,0,1]=4 171 B3R0.1 C=CCN CUR-0009493 [2,0,0,0,0,0|1,0,1]=4 172 B3R0.1 C=CCO CUR-0101427 [2,0,0,0,0,0|0,0,2]=4 173 B3R0.1 CCC=O CUR-0015273 [2,0,0,0,0,0|0,0,1]=3 174 B3R0.1 CNC=O CUR-0012781 [2,0,0,0,0,0|1,0,0]=3 175 B3R0.1 CNOC CUR-0015640 [2,0,0,0,0,0|2,0,0]=4 176 B3R0.1 CSSC CUR-0101553 [2,0,0,0,0,0|2,0,0]=4 177 B3R0.2 C(=O)(N)N CUR-0004435 [2,0,0,0,0,0|2,0,0]=4 178 B3R0.2 CC(=N)N CUR-0023632 [2,0,0,0,0,0|2,0,0]=4 179 B3R0.2 CC(=O)Br CUR-0004133 [2,0,0,0,0,0|1,0,0]=3 180 B3R0.2 CC(=O)Cl CUR-0019985 [2,0,0,0,0,0|1,0,0]=3 181 B3R0.2 CC(=O)N CUR-0016336 [2,0,0,0,0,0|1,0,0]=3 182 B3R0.2 CC(=O)O CUR-0005925 [2,0,0,0,0,0|1,0,0]=3 183 B3R0.2 CC(=S)N CUR-0008655 [2,0,0,0,0,0|1,1,0]=4 184 B3R0.2 CC(C)Br CUR-0027321 [2,0,0,0,0,0|1,0,1]=4 185 B3R0.2 CC(C)Cl CUR-0022523 [2,0,0,0,0,0|1,0,1]=4 186 B3R0.2 CC(C)I CUR-0026227 [2,0,0,0,0,0|1,0,1]=4 187 B3R0.2 CC(C)N CUR-0024558 [2,0,0,0,0,0|1,0,1]=4 188 B3R0.2 CC(C)S CUR-0012379 [2,0,0,0,0,0|0,1,1]=4 189 B3R0.2 CN(C)C CUR-0004768 [2,0,0,0,0,0|2,0,0]=4 190 B3R0.2 CP(C)C CUR-0006076 [2,0,0,0,0,0|2,0,0]=4 191 B3R0.2 C[N+](=O)[O-] CUR-0016305 [2,0,0,0,0,0|2,0,0]=4 192 B3R0.2 C[S+](C)C CUR-0103505 [2,0,0,0,0,0|2,0,0]=4 193 B5R0.3 C(C(=O)CCl)Cl CUR-0101901 [1,1,0,0,0,0|1,0,1]=4 194 B5R0.3 CCC(=O)CC CUR-0101500 [1,1,0,0,0,0|0,0,1]=3 195 B5R0.3 CNC(=O)C#C CUR-0016542 [1,1,0,0,0,0|0,0,2]=4 196 B5R0.3 CNC(=O)CCl CUR-0099536 [1,1,0,0,0,0|1,0,0]=3 197 B5R0.3 CNC(=O)NC CUR-0101521 [1,1,0,0,0,0|1,0,0]=3 198 B5R0.3 CNC(=S)NC CUR-0101643 [1,1,0,0,0,0|1,1,0]=4 199 B5R0.3 COC(=N)CCl CUR-0101034 [1,1,0,0,0,0|2,0,0]=4 200 B5R0.3 COC(=O)C#C CUR-0008050 [1,1,0,0,0,0|0,0,2]=4 201 B5R0.3 COC(=O)C=C CUR-0018588 [1,1,0,0,0,0|0,0,0]=2 202 B5R0.3 COC(=O)CBr CUR-0102451 [1,1,0,0,0,0|1,0,0]=3 203 B5R0.3 COC(=O)CCl CUR-0019510 [1,1,0,0,0,0|1,0,0]=3 204 B5R0.3 COC(=O)CN CUR-0016914 [1,1,0,0,0,0|1,0,0]=3 205 B5R0.3 COC(=O)CO CUR-0101535 [1,1,0,0,0,0|1,0,0]=3 206 B5R0.3 COC(=O)CS CUR-0014981 [1,1,0,0,0,0|1,0,0]=3 207 B5R0.3 COC(=O)NN CUR-0100906 [1,1,0,0,0,0|2,0,0]=4 208 B5R0.3 COC(=O)OC CUR-0101536 [1,1,0,0,0,0|1,0,0]=3 209 B5R0.3 COP(=O)OC CUR-0016444 [1,1,0,0,0,0|2,0,0]=4 210 B5R0.4 CS(=O)(=O)C=C CUR-0003882 [1,1,0,0,0,0|1,0,0]=3 211 B5R0.5 C(=O)(C(=O)Cl)Cl CUR-0022479 [1,1,0,0,0,0|2,0,0]=4 212 B5R0.5 C(=O)(C(=O)N)N CUR-0013129 [1,1,0,0,0,0|2,0,0]=4 213 B5R0.5 C(=O)(C(=O)O)O CUR-0022161 [1,1,0,0,0,0|2,0,0]=4 214 B5R0.5 C(=O)(C(=O)O)O CUR-0100644 [1,1,0,0,0,0|2,0,0]=4 215 B5R0.5 CC(=O)C(=O)C CUR-0014415 [1,1,0,0,0,0|0,0,0]=2 216 B5R0.5 CC(=O)C(=O)O CUR-0101513 [1,1,0,0,0,0|1,0,0]=3 217 B5R0.5 CC(=O)N(C)C CUR-0015735 [1,1,0,0,0,0|1,0,0]=3 218 B5R0.5 CC(C(=O)Br)Br CUR-0103656 [1,1,0,0,0,0|1,0,1]=4 219 B5R0.5 CC(C(=O)C)Cl CUR-0002968 [1,1,0,0,0,0|0,0,1]=3 220 B5R0.5 CC(C(=O)C)O CUR-0101517 [1,1,0,0,0,0|0,0,1]=3 221 B5R0.5 CC(C(=O)Cl)Cl CUR-0025103 [1,1,0,0,0,0|1,0,1]=4 222 B5R0.5 CC(C(=O)O)Cl CUR-0027467 [1,1,0,0,0,0|1,0,1]=4 223 B5R0.5 CC(C(=O)O)N CUR-0005753 [1,1,0,0,0,0|1,0,1]=4 224 B5R0.5 CC(C(=O)O)O CUR-0100772 [1,1,0,0,0,0|1,0,1]=4 225 B5R0.5 CC(C(=O)O)S CUR-0001712 [1,1,0,0,0,0|1,0,1]=4 226 B5R0.5 CC(C)C(=O)C CUR-0101503 [1,1,0,0,0,0|0,0,1]=3 227 B5R0.5 CC(C)C(=O)Cl CUR-0101654 [1,1,0,0,0,0|1,0,1]=4 228 B5R0.5 CC(C)C(=O)O CUR-0023620 [1,1,0,0,0,0|1,0,1]=4 229 B5R0.5 CN(C)C(=O)Cl CUR-0021018 [1,1,0,0,0,0|2,0,0]=4 230 B5R0.5 C[C@@H](C(=O)N)N CUR-0101872 [1,1,0,0,0,0|1,0,1]=4 231 B5R0.5 C[C@@H](C(=O)O)N CUR-0101526 [1,1,0,0,0,0|1,0,1]=4 232 B5R0.2 C(C=CCO)O CUR-0100969 [1,1,0,0,0,0|0,0,2]=4 233 B5R0.2 C(\C=C/CO)O CUR-0101515 [1,1,0,0,0,0|0,0,2]=4 234 B5R0.2 CCCCC=O CUR-0020580 [1,1,0,0,0,0|0,0,2]=4 235 B5R0.2 CCO\C=C\C CUR-0101289 [1,1,0,0,0,0|0,0,1]=3 236 B5R0.2 CC\C=C/C#N CUR-0101476 [1,1,0,0,0,0|0,0,2]=4 237 B5R0.2 CC\C=C/CO CUR-0101504 [1,1,0,0,0,0|0,0,1]=3 238 B7R0.2 C(C(=O)NC(=O)N)Cl CUR-0099170 [0,2,0,0,0,0|2,0,0]=4 239 B7R0.2 CC(=O)CC(=O)OC CUR-0018522 [0,2,0,0,0,0|0,0,1]=3 240 B7R0.2 CC(C)OC(=O)CCl CUR-0013704 [0,2,0,0,0,0|1,0,1]=4 241 B7R0.3 C(C(=O)\N=C\NO)Cl CUR-0027210 [0,2,0,0,0,0|2,0,0]=4 242 B7R0.3 CCCNC(=O)CCl CUR-0099537 [0,2,0,0,0,0|0,0,2]=4 243 B7R0.3 CCCOC(=O)CCl CUR-0101322 [0,2,0,0,0,0|0,0,2]=4 244 B7R0.3 CNC(=O)OCCO CUR-0053764 [0,2,0,0,0,0|1,0,1]=4 245 B7R0.3 CNC(=O)\C=C\CN CUR-0155233 [0,2,0,0,0,0|0,0,0]=2 246 B7R0.3 COC(=O)CCCN CUR-0008398 [0,2,0,0,0,0|0,0,2]=4 247 B7R0.3 COC(=O)\C=C\CBr CUR-0103039 [0,2,0,0,0,0|0,0,0]=2 248 B7R0.3 COCCC(=O)OC CUR-0101774 [0,2,0,0,0,0|0,0,2]=4 249 B7R0.3 CO\C=C\C(=O)OC CUR-0101064 [0,2,0,0,0,0|0,0,0]=2 250 B7R0.5 CCOC(=O)C(=O)C CUR-0021376 [0,2,0,0,0,0|0,0,1]=3 251 B7R0.5 CCOC(=O)C(=O)Cl CUR-0102081 [0,2,0,0,0,0|1,0,1]=4 252 B7R0.5 CCOC(=O)C(=O)N CUR-0013418 [0,2,0,0,0,0|1,0,1]=4 253 B7R0.5 CCOC(=O)C(C)Br CUR-0103087 [0,2,0,0,0,0|1,0,1]=4 254 B7R0.5 CCOC(=O)C(F)F CUR-0007059 [0,2,0,0,0,0|1,0,1]=4 255 B7R0.7 CCCC(=O)OCC CUR-0005973 [0,2,0,0,0,0|0,0,2]=4 256 B7R0.7 CCOC(=O)C=[N+]=[N-] CUR-0018665 [0,2,0,0,0,0|2,0,0]=4 257 B7R0.7 CCOC(=O)CC#N CUR-0025194 [0,2,0,0,0,0|1,0,1]=4 258 B7R0.7 CCOC(=O)CCBr CUR-0103086 [0,2,0,0,0,0|1,0,1]=4 259 B7R0.7 CCOC(=O)CCCl CUR-0017965 [0,2,0,0,0,0|1,0,1]=4 260 B7R0.7 CCOC(=O)CNN CUR-0022001 [0,2,0,0,0,0|1,0,1]=4 261 B7R0.7 CCOC(=O)C[N+]#[C-] CUR-0023815 [0,2,0,0,0,0|1,0,1]=4 262 B7R0.7 CCOC(=O)OCC CUR-0003960 [0,2,0,0,0,0|1,0,1]=4 263 B7R0.10 COC(=O)C(=O)OC CUR-0027911 [0,2,0,0,0,0|1,0,0]=3 264 B7R0.9 CC(=O)CC(C)(C)O CUR-0020852 [0,2,0,0,0,0|0,0,2]=4 265 B7R0.9 CC(=O)OC(C)(C)C CUR-0001433 [0,2,0,0,0,0|1,0,1]=4 266 B7R0.16 C(=O)(C(=O)O)C(=O)O CUR-0028231 [0,2,0,0,0,0|2,0,0]=4 267 B7R0.16 CC(=O)C(C(=O)C)Cl CUR-0004455 [0,2,0,0,0,0|0,0,1]=3 268 B7R0.16 CC(C(=O)C)C(=O)C CUR-0101719 [0,2,0,0,0,0|0,0,1]=3 269 B7R0.15 CC(=O)C(OC)OC CUR-0009018 [0,2,0,0,0,0|1,0,1]=4 270 B7R0.4 CCCCOC(=O)C CUR-0026180 [0,2,0,0,0,0|0,0,2]=4 271 B7R0.4 C\C=C\C=C/C(=O)O CUR-0101700 [0,2,0,0,0,0|1,0,0]=3 272 B7R0.4 C\C=C\C=C\C(=O)O CUR-0100842 [0,2,0,0,0,0|1,0,0]=3 273 B7R0.6 C(=C/C(=O)O)/C(=O)O CUR-0004106 [0,2,0,0,0,0|1,0,1]=4 274 B7R0.6 C(=C\C(=O)O)/C(=O)O CUR-0100787 [0,2,0,0,0,0|1,0,1]=4 275 B7R0.6 CC(=O)CCC(=O)C CUR-0022649 [0,2,0,0,0,0|0,0,1]=3 276 B7R0.6 CC(=O)CCC(=O)O CUR-0012941 [0,2,0,0,0,0|1,0,1]=4 277 B7R0.6 CC(=O)NCC(=O)O CUR-0024688 [0,2,0,0,0,0|1,0,1]=4 278 B7R0.6 CC(=O)OCC(=O)Cl CUR-0102082 [0,2,0,0,0,0|1,0,1]=4 279 B7R0.8 CS(=O)(=O)\C=C/CN CUR-0166248 [0,2,0,0,0,0|1,0,0]=3 280 B7R0.8 CS(=O)(=O)\C=C\CN CUR-0163361 [0,2,0,0,0,0|1,0,0]=3 281 B7R0.8 CS(=O)(=O)\C=C\CN CUR-0166247 [0,2,0,0,0,0|1,0,0]=3 282 B5R1.2 C1CC(=O)C1 CUR-0005686 [1,0,0,1,0,0|0,0,1]=3 283 B5R1.1 C1C=CCO1 CUR-0017724 [1,0,0,1,0,0|0,0,2]=4 284 B5R1.1 C1COC=C1 CUR-0023942 [1,0,0,1,0,0|1,0,0]=3 285 B5R1.1 c1c[nH]nc1 CUR-0027742 [1,0,0,1,0,0|2,0,0]=4 286 B5R1.1 c1cc[nH]c1 CUR-0101433 [1,0,0,1,0,0|1,0,1]=4 287 B5R1.1 c1ccoc1 CUR-0017577 [1,0,0,1,0,0|0,0,2]=4 288 B5R1.1 c1ccsc1 CUR-0023526 [1,0,0,1,0,0|0,1,1]=4 289 B5R1.1 c1cnoc1 CUR-0101437 [1,0,0,1,0,0|1,0,1]=4 290 B7R1.1 CCc1cccs1 CUR-0101705 [0,1,0,1,0,0|0,1,1]=4 291 B7R1.1 c1cc([nH]c1)C=O CUR-0101556 [0,1,0,1,0,0|1,0,1]=4 292 B7R1.1 c1cc(oc1)C=O CUR-0027369 [0,1,0,1,0,0|1,0,1]=4 293 B7R1.1 c1cc(oc1)CN CUR-0006239 [0,1,0,1,0,0|0,0,2]=4 294 B7R1.1 c1cc(oc1)CO CUR-0018391 [0,1,0,1,0,0|0,0,2]=4 295 B7R1.1 c1cc(oc1)CS CUR-0101724 [0,1,0,1,0,0|0,0,2]=4 296 B7R1.1 c1cc(sc1)C=O CUR-0025426 [0,1,0,1,0,0|1,0,1]=4 297 B7R1.1 c1cc(sc1)CN CUR-0000390 [0,1,0,1,0,0|0,1,1]=4 298 B7R1.1 c1cc(sc1)CO CUR-0023830 [0,1,0,1,0,0|0,1,1]=4 299 B7R1.1 c1cn[nH]c1CN CUR-0011116 [0,1,0,1,0,0|2,0,0]=4 300 B7R1.1 c1cnoc1CN CUR-0084598 [0,1,0,1,0,0|1,0,1]=4 301 B7R1.1 c1cocc1C=O CUR-0101559 [0,1,0,1,0,0|1,0,1]=4 302 B7R1.1 c1conc1CCl CUR-0006498 [0,1,0,1,0,0|2,0,0]=4 303 B7R1.1 c1cscc1C=O CUR-0026809 [0,1,0,1,0,0|1,0,1]=4 304 B7R1.1 c1cscc1CO CUR-0029172 [0,1,0,1,0,0|2,0,0]=4 305 B7R1.2 C1=CC(=O)NC1=O CUR-0011255 [0,1,0,1,0,0|1,0,1]=4 306 B7R1.2 C1=CC(=O)OC1=O CUR-0023802 [0,1,0,1,0,0|1,0,1]=4 307 B7R1.2 C1C(=N)NC(=O)S1 CUR-0096040 [0,1,0,1,0,0|2,0,0]=4 308 B7R1.2 C1C(=O)CNC1=O CUR-0122247 [0,1,0,1,0,0|1,0,1]=4 309 B7R1.2 C1C(=O)COC1=O CUR-0100913 [0,1,0,1,0,0|1,0,1]=4 310 B7R1.2 C1C(=O)NC(=O)N1 CUR-0101582 [0,1,0,1,0,0|2,0,0]=4 311 B7R1.2 C1C(=O)NC(=S)S1 CUR-0102016 [0,1,0,1,0,0|2,0,0]=4 312 B7R1.2 C1C(CNC1=O)N CUR-0087034 [0,1,0,1,0,0|1,0,1]=4 313 B7R1.2 C1CC(=O)CC1=O CUR-0010695 [0,1,0,1,0,0|0,0,1]=3 314 B7R1.2 C1CC(=O)NC1=O CUR-0005450 [0,1,0,1,0,0|1,0,0]=3 315 B7R1.2 C1CC(=O)OC1=O CUR-0017714 [0,1,0,1,0,0|1,0,0]=3 316 B7R1.2 CC1CCC(=O)N1 CUR-0016557 [0,1,0,1,0,0|1,0,1]=4 317 B7R1.2 CC1CCC(=O)O1 CUR-0101591 [0,1,0,1,0,0|1,0,1]=4 318 B7R1.2 CC1COC(=O)O1 CUR-0101613 [0,1,0,1,0,0|1,0,1]=4 319 B7R1.2 Cc1cc(=O)[nH][nH]1 CUR-0101081 [0,1,0,1,0,0|1,0,0]=3 320 B7R1.2 Cc1cc(n[nH]1)C CUR-0012171 [0,1,0,1,0,0|1,0,0]=3 321 B7R1.2 Cc1cc(n[nH]1)N CUR-0013118 [0,1,0,1,0,0|2,0,0]=4 322 B7R1.2 Cc1cc(no1)N CUR-0024529 [0,1,0,1,0,0|1,0,1]=4 323 B7R1.2 Cc1cc(on1)C CUR-0101566 [0,1,0,1,0,0|0,0,1]=3 324 B7R1.2 Cc1cc(on1)N CUR-0022581 [0,1,0,1,0,0|1,0,1]=4 325 B7R1.2 Cc1cc(sn1)N CUR-0102387 [0,1,0,1,0,0|1,1,0]=4 326 B7R1.2 Cc1ccc(o1)C CUR-0101561 [0,1,0,1,0,0|0,0,1]=3 327 B7R1.2 Cc1ccc(s1)C CUR-0012643 [0,1,0,1,0,0|0,1,0]=3 328 B7R1.2 Cc1cnc(s1)N CUR-0101725 [0,1,0,1,0,0|1,1,0]=4 329 B7R1.2 Cc1coc(n1)N CUR-0010957 [0,1,0,1,0,0|2,0,0]=4 330 B7R1.2 Cc1csc(n1)Br CUR-0099044 [0,1,0,1,0,0|2,0,0]=4 331 B7R1.2 Cc1csc(n1)N CUR-0099540 [0,1,0,1,0,0|2,0,0]=4 332 B7R1.2 Cc1csc(n1)S CUR-0101982 [0,1,0,1,0,0|1,1,0]=4 333 B7R1.3 C1CC=CC(=O)C1 CUR-0002304 [0,1,0,1,0,0|0,0,0]=2 334 B7R1.3 C1CCC(=O)CC1 CUR-0013382 [0,1,0,1,0,0|0,0,2]=4 335 B7R1.3 C1CCNC(=O)C1 CUR-0002331 [0,1,0,1,0,0|0,0,2]=4 336 B7R1.3 C1CNC(=O)CN1 CUR-0101593 [0,1,0,1,0,0|1,0,1]=4 337 B7R1.3 C1CNCCC1=O CUR-0009294 [0,1,0,1,0,0|0,0,2]=4 338 B7R1.3 C1CNCCC1=O CUR-0102475 [0,1,0,1,0,0|0,0,2]=4 339 B7R1.3 C1COCC(=O)N1 CUR-0014967 [0,1,0,1,0,0|1,0,1]=4 340 B7R1.3 C1COCCC1=O CUR-0001478 [0,1,0,1,0,0|0,0,2]=4 341 B7R1.3 C1CSCC(=O)N1 CUR-0095816 [0,1,0,1,0,0|1,0,1]=4 342 B7R1.3 C1CSCCC1=O CUR-0005576 [0,1,0,1,0,0|0,0,2]=4 343 B7R1.3 Cc1ccccn1 CUR-0005465 [0,1,0,1,0,0|1,0,1]=4 344 B7R1.3 Cc1cccnc1 CUR-0100815 [0,1,0,1,0,0|1,0,1]=4 345 B7R1.3 Cc1ccncc1 CUR-0027079 [0,1,0,1,0,0|1,0,1]=4 346 B7R1.3 Cc1cnccn1 CUR-0100916 [0,1,0,1,0,0|1,0,1]=4 347 B7R1.3 c1cc(=O)[nH]nc1 CUR-0115206 [0,1,0,1,0,0|1,0,1]=4 348 B7R1.3 c1cc[nH]c(=O)c1 CUR-0101554 [0,1,0,1,0,0|0,0,2]=4 349 B7R1.4 C1CC(=O)C(=O)C1 CUR-0061064 [0,1,0,1,0,0|0,0,1]=3 350 B7R1.4 C1CC(=O)N(C1)N CUR-0099031 [0,1,0,1,0,0|1,0,1]=4 351 B7R1.4 C1CNC(=O)C1Br CUR-0004832 [0,1,0,1,0,0|1,0,1]=4 352 B7R1.4 C1COC(=O)C1Br CUR-0012154 [0,1,0,1,0,0|1,0,1]=4 353 B7R1.4 C1CSC(=O)C1N CUR-0025625 [0,1,0,1,0,0|1,0,1]=4 354 B7R1.4 C1[C@H](C(=O)NO1)N CUR-0101615 [0,1,0,1,0,0|2,0,0]=4 355 B7R1.4 CN1CCCC1=O CUR-0101576 [0,1,0,1,0,0|0,0,2]=4 356 B7R1.4 Cc1c(c[nH]n1)Br CUR-0100170 [0,1,0,1,0,0|2,0,0]=4 357 B7R1.22 C1CC1C(=O)CBr CUR-0027626 [0,1,0,1,0,0|0,0,2]=4 358 B7R1.22 COC(=O)C1CC1 CUR-0101589 [0,1,0,1,0,0|0,0,2]=4 359 B7R1.14 C1C=CCP1(=O)Cl CUR-0018597 [0,1,0,1,0,0|2,0,0]=4 360 B7R1.14 C1C=CCS1(=O)=O CUR-0013292 [0,1,0,1,0,0|2,0,0]=4