0 B6R0.1 C(C#N)C(=O)NN CUR-0005368 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.1 CC(CCN)OC CUR-0122797 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.1 CC(CSC)NC CUR-0022342 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.1 CCC(=O)OCC CUR-0101621 [0,0,0,0,0,0|2,0,0]=2 4 B6R0.1 CCCC(C)C=O CUR-0101597 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.1 CCNC(=O)C#C CUR-0067040 [0,0,0,0,0,0|2,0,1]=3 6 B6R0.1 CCNC(=O)CCl CUR-0099539 [0,0,0,0,0,0|3,0,0]=3 7 B6R0.1 CCOC(=O)C#C CUR-0101411 [0,0,0,0,0,0|2,0,1]=3 8 B6R0.1 CCOC(=O)C#N CUR-0012085 [0,0,0,0,0,0|3,0,0]=3 9 B6R0.1 CCOC(=O)C=C CUR-0027721 [0,0,0,0,0,0|2,0,1]=3 10 B6R0.1 CCOC(=O)C=O CUR-0101612 [0,0,0,0,0,0|3,0,0]=3 11 B6R0.1 CCOC(=O)CBr CUR-0001682 [0,0,0,0,0,0|3,0,0]=3 12 B6R0.1 CCOC(=O)CCl CUR-0015757 [0,0,0,0,0,0|3,0,0]=3 13 B6R0.1 CCOC(=O)CF CUR-0101650 [0,0,0,0,0,0|3,0,0]=3 14 B6R0.1 CCOC(=O)CN CUR-0024509 [0,0,0,0,0,0|3,0,0]=3 15 B6R0.1 CCOC(=O)CO CUR-0101638 [0,0,0,0,0,0|3,0,0]=3 16 B6R0.1 CNC(=O)CC#N CUR-0098025 [0,0,0,0,0,0|2,0,1]=3 17 B6R0.1 CNCC(=O)OC CUR-0102132 [0,0,0,0,0,0|1,0,0]=1 18 B6R0.1 COC(=N)CC#N CUR-0101103 [0,0,0,0,0,0|2,0,1]=3 19 B6R0.1 COC(=O)CC#N CUR-0022414 [0,0,0,0,0,0|1,0,1]=2 20 B6R0.1 COC(=O)CCS CUR-0005277 [0,0,0,0,0,0|1,0,0]=1 21 B6R0.1 COCC(=O)OC CUR-0101636 [0,0,0,0,0,0|1,0,0]=1 22 B6R0.1 C\C=C\C(=O)OC CUR-0101585 [0,0,0,0,0,0|0,0,2]=2 23 B5R0.1 C(C#N)C(=O)N CUR-0015106 [1,0,0,0,0,0|2,0,1]=4 24 B5R0.1 C(C#N)C(=O)O CUR-0011506 [1,0,0,0,0,0|1,0,1]=3 25 B5R0.1 C(CBr)C(=O)O CUR-0102453 [1,0,0,0,0,0|1,0,0]=2 26 B5R0.1 C(CCl)C(=O)Cl CUR-0009101 [1,0,0,0,0,0|2,0,0]=3 27 B5R0.1 C(CCl)C(=O)O CUR-0008480 [1,0,0,0,0,0|1,0,0]=2 28 B5R0.1 C(CN)C(=O)O CUR-0006907 [1,0,0,0,0,0|1,0,0]=2 29 B5R0.1 C(CN)C(=O)[O-] CUR-0101293 [1,0,0,0,0,0|1,0,1]=3 30 B5R0.1 C(CS)C(=O)O CUR-0101651 [1,0,0,0,0,0|1,0,0]=2 31 B5R0.1 CC(=CCBr)C CUR-0059675 [1,0,0,0,0,0|2,0,1]=4 32 B5R0.1 CC(=CCCl)C CUR-0022594 [1,0,0,0,0,0|2,0,1]=4 33 B5R0.1 CC(=O)COC CUR-0101516 [1,0,0,0,0,0|1,0,0]=2 34 B5R0.1 CC(=O)OC=C CUR-0001318 [1,0,0,0,0,0|1,0,2]=4 35 B5R0.1 CC(C)CCBr CUR-0002757 [1,0,0,0,0,0|2,0,1]=4 36 B5R0.1 CC(C)CCN CUR-0101511 [1,0,0,0,0,0|2,0,1]=4 37 B5R0.1 CC(C)CCO CUR-0003416 [1,0,0,0,0,0|2,0,1]=4 38 B5R0.1 CC(CCO)O CUR-0003759 [1,0,0,0,0,0|1,0,2]=4 39 B5R0.1 CC(COC)N CUR-0101532 [1,0,0,0,0,0|2,0,1]=4 40 B5R0.1 CC(CSC)N CUR-0019523 [1,0,0,0,0,0|2,0,1]=4 41 B5R0.1 CCCC(=O)C CUR-0026599 [1,0,0,0,0,0|0,0,0]=1 42 B5R0.1 CCCC(=O)Cl CUR-0020308 [1,0,0,0,0,0|1,0,0]=2 43 B5R0.1 CCCC(=O)O CUR-0020198 [1,0,0,0,0,0|0,0,0]=1 44 B5R0.1 CCCC(C)O CUR-0023615 [1,0,0,0,0,0|0,0,2]=3 45 B5R0.1 CCC[N+](=O)[O-] CUR-0101527 [1,0,0,0,0,0|1,0,1]=3 46 B5R0.1 CCOC(=O)C CUR-0101519 [1,0,0,0,0,0|1,0,0]=2 47 B5R0.1 CCOC(=O)Cl CUR-0026181 [1,0,0,0,0,0|2,0,0]=3 48 B5R0.1 CCOC(=O)N CUR-0100824 [1,0,0,0,0,0|2,0,0]=3 49 B5R0.1 CN(C)CCCl CUR-0017041 [1,0,0,0,0,0|3,0,0]=4 50 B5R0.1 CN(C)CCN CUR-0101525 [1,0,0,0,0,0|3,0,0]=4 51 B5R0.1 CN(C)CCO CUR-0019188 [1,0,0,0,0,0|3,0,0]=4 52 B5R0.1 CNCC(=O)O CUR-0018005 [1,0,0,0,0,0|1,0,0]=2 53 B5R0.1 COCC(=O)Cl CUR-0101665 [1,0,0,0,0,0|2,0,0]=3 54 B5R0.1 COCC(=O)O CUR-0014449 [1,0,0,0,0,0|1,0,0]=2 55 B5R0.1 CSCC(=N)N CUR-0100998 [1,0,0,0,0,0|3,0,0]=4 56 B5R0.1 CSCC(=O)O CUR-0025987 [1,0,0,0,0,0|1,0,0]=2 57 B5R0.1 C\C=C\C(=O)O CUR-0100765 [1,0,0,0,0,0|0,0,2]=3 58 B5R0.2 CC#CCCN CUR-0091824 [1,0,0,0,0,0|2,0,1]=4 59 B5R0.2 CCCCC#N CUR-0002776 [1,0,0,0,0,0|2,0,1]=4 60 B5R0.2 CCCCC=O CUR-0020580 [1,0,0,0,0,0|2,0,1]=4 61 B5R0.2 CCCCCBr CUR-0020920 [1,0,0,0,0,0|2,0,1]=4 62 B5R0.2 CCCCCI CUR-0007389 [1,0,0,0,0,0|2,0,1]=4 63 B5R0.2 CCCCCN CUR-0101510 [1,0,0,0,0,0|2,0,1]=4 64 B5R0.2 CCCCCO CUR-0018736 [1,0,0,0,0,0|2,0,1]=4 65 B5R0.2 CCCCNC CUR-0101509 [1,0,0,0,0,0|1,0,1]=3 66 B5R0.2 CCCN=C=O CUR-0101493 [1,0,0,0,0,0|3,0,0]=4 67 B5R0.2 CCNCCCl CUR-0137711 [1,0,0,0,0,0|3,0,0]=4 68 B5R0.2 CCNCCO CUR-0101534 [1,0,0,0,0,0|3,0,0]=4 69 B5R0.2 CCOCCBr CUR-0026041 [1,0,0,0,0,0|3,0,0]=4 70 B5R0.2 CCOCCO CUR-0010841 [1,0,0,0,0,0|3,0,0]=4 71 B5R0.2 CCO\C=C\C CUR-0101289 [1,0,0,0,0,0|2,0,0]=3 72 B5R0.2 CC\C=C/C#N CUR-0101476 [1,0,0,0,0,0|2,0,1]=4 73 B5R0.2 CC\C=C/CO CUR-0101504 [1,0,0,0,0,0|2,0,1]=4 74 B5R0.2 CNCCCN CUR-0101524 [1,0,0,0,0,0|2,0,1]=4 75 B5R0.2 CNCCNC CUR-0001888 [1,0,0,0,0,0|2,0,1]=4 76 B5R0.2 CNCCOC CUR-0101531 [1,0,0,0,0,0|1,0,1]=3 77 B5R0.2 COCCC#N CUR-0101494 [1,0,0,0,0,0|1,0,2]=4 78 B5R0.2 COCCCN CUR-0101530 [1,0,0,0,0,0|1,0,1]=3 79 B5R0.2 COCCNN CUR-0018740 [1,0,0,0,0,0|2,0,1]=4 80 B5R0.2 COCCOC CUR-0026380 [1,0,0,0,0,0|1,0,1]=3 81 B5R0.3 C(C(=O)CCl)Cl CUR-0101901 [1,0,0,0,0,0|3,0,0]=4 82 B5R0.3 CCC(=O)CC CUR-0101500 [1,0,0,0,0,0|1,0,0]=2 83 B5R0.3 CCC(CC)Br CUR-0020873 [1,0,0,0,0,0|2,0,1]=4 84 B5R0.3 CC\C(=N/O)\N CUR-0010533 [1,0,0,0,0,0|3,0,0]=4 85 B5R0.3 CNC(=O)C#C CUR-0016542 [1,0,0,0,0,0|1,0,2]=4 86 B5R0.3 CNC(=O)CCl CUR-0099536 [1,0,0,0,0,0|2,0,0]=3 87 B5R0.3 CNC(=O)NC CUR-0101521 [1,0,0,0,0,0|2,0,0]=3 88 B5R0.3 CNC(=S)NC CUR-0101643 [1,0,0,0,0,0|2,1,0]=4 89 B5R0.3 COC(=N)CCl CUR-0101034 [1,0,0,0,0,0|2,0,0]=3 90 B5R0.3 COC(=O)C#C CUR-0008050 [1,0,0,0,0,0|0,0,2]=3 91 B5R0.3 COC(=O)C=C CUR-0018588 [1,0,0,0,0,0|0,0,2]=3 92 B5R0.3 COC(=O)CBr CUR-0102451 [1,0,0,0,0,0|1,0,0]=2 93 B5R0.3 COC(=O)CCl CUR-0019510 [1,0,0,0,0,0|1,0,0]=2 94 B5R0.3 COC(=O)CN CUR-0016914 [1,0,0,0,0,0|1,0,0]=2 95 B5R0.3 COC(=O)CO CUR-0101535 [1,0,0,0,0,0|1,0,0]=2 96 B5R0.3 COC(=O)CS CUR-0014981 [1,0,0,0,0,0|1,0,0]=2 97 B5R0.3 COC(=O)NN CUR-0100906 [1,0,0,0,0,0|2,0,0]=3 98 B5R0.3 COC(=O)OC CUR-0101536 [1,0,0,0,0,0|1,0,0]=2 99 B5R0.3 COP(=O)OC CUR-0016444 [1,0,0,0,0,0|2,0,0]=3 100 B7R0.2 CC(=O)CC(=O)OC CUR-0018522 [0,1,0,0,0,0|0,0,1]=2 101 B7R0.2 CC(C)CC(=O)C=C CUR-0050915 [0,1,0,0,0,0|1,0,1]=3 102 B7R0.2 CC(C)OC(=O)CCl CUR-0013704 [0,1,0,0,0,0|3,0,0]=4 103 B7R0.3 CCCNC(=O)CCl CUR-0099537 [0,1,0,0,0,0|2,0,0]=3 104 B7R0.3 CCCOC(=O)CCl CUR-0101322 [0,1,0,0,0,0|2,0,0]=3 105 B7R0.3 CNC(=O)OCCO CUR-0053764 [0,1,0,0,0,0|2,0,0]=3 106 B7R0.3 CNC(=O)\C=C\CN CUR-0155233 [0,1,0,0,0,0|1,0,2]=4 107 B7R0.3 COC(=O)CCCN CUR-0008398 [0,1,0,0,0,0|0,0,0]=1 108 B7R0.3 COC(=O)\C=C\CBr CUR-0103039 [0,1,0,0,0,0|0,0,2]=3 109 B7R0.3 COCCC(=O)OC CUR-0101774 [0,1,0,0,0,0|0,0,0]=1 110 B7R0.3 CO\C=C\C(=O)OC CUR-0101064 [0,1,0,0,0,0|0,0,2]=3 111 B7R0.5 CCCC(C)C(C)N CUR-0034233 [0,1,0,0,0,0|2,0,1]=4 112 B7R0.5 CCOC(=O)C(=O)C CUR-0021376 [0,1,0,0,0,0|2,0,0]=3 113 B7R0.5 CCOC(=O)C(=O)Cl CUR-0102081 [0,1,0,0,0,0|3,0,0]=4 114 B7R0.5 CCOC(=O)C(=O)N CUR-0013418 [0,1,0,0,0,0|3,0,0]=4 115 B7R0.5 CCOC(=O)C(=S)N CUR-0029192 [0,1,0,0,0,0|3,0,0]=4 116 B7R0.5 CCOC(=O)C(C)Br CUR-0103087 [0,1,0,0,0,0|2,0,0]=3 117 B7R0.5 CCOC(=O)C(F)F CUR-0007059 [0,1,0,0,0,0|3,0,0]=4 118 B7R0.7 CCCC(=O)OCC CUR-0005973 [0,1,0,0,0,0|0,0,0]=1 119 B7R0.7 CCNC(=S)NCC CUR-0101996 [0,1,0,0,0,0|2,1,0]=4 120 B7R0.7 CCOC(=O)C=[N+]=[N-] CUR-0018665 [0,1,0,0,0,0|2,0,1]=4 121 B7R0.7 CCOC(=O)CC#N CUR-0025194 [0,1,0,0,0,0|1,0,1]=3 122 B7R0.7 CCOC(=O)CCBr CUR-0103086 [0,1,0,0,0,0|1,0,0]=2 123 B7R0.7 CCOC(=O)CCCl CUR-0017965 [0,1,0,0,0,0|1,0,0]=2 124 B7R0.7 CCOC(=O)CNN CUR-0022001 [0,1,0,0,0,0|2,0,0]=3 125 B7R0.7 CCOC(=O)C[N+]#[C-] CUR-0023815 [0,1,0,0,0,0|1,0,1]=3 126 B7R0.7 CCOC(=O)OCC CUR-0003960 [0,1,0,0,0,0|1,0,0]=2 127 B7R0.7 CCOC(C)OCC CUR-0008227 [0,1,0,0,0,0|2,0,1]=4 128 B7R0.7 CCOP(=O)OCC CUR-0027645 [0,1,0,0,0,0|2,0,0]=3 129 B7R0.7 COCC(CCO)N CUR-0020087 [0,1,0,0,0,0|2,0,1]=4 130 B7R0.10 COC(=O)C(=O)OC CUR-0027911 [0,1,0,0,0,0|1,0,1]=3 131 B7R0.10 COC(=O)C(CO)N CUR-0010591 [0,1,0,0,0,0|1,0,0]=2 132 B7R0.11 CCS(=O)(=O)CCN CUR-0098565 [0,1,0,0,0,0|3,0,0]=4 133 B7R1.1 CCC1=NCCO1 CUR-0101578 [0,0,0,1,0,0|2,0,1]=4 134 B7R1.1 CNC1CCCC1 CUR-0011121 [0,0,0,1,0,0|2,0,1]=4 135 B7R1.1 COC1=NCCC1 CUR-0119549 [0,0,0,1,0,0|1,0,0]=2 136 B7R1.1 CSC1=NCCN1 CUR-0098382 [0,0,0,1,0,0|2,1,0]=4 137 B7R1.2 C1C(=O)CNC1=O CUR-0122247 [0,0,0,1,0,0|2,0,1]=4 138 B7R1.2 C1C(=O)COC1=O CUR-0100913 [0,0,0,1,0,0|1,0,1]=3 139 B7R1.2 C1C(CNC1=O)N CUR-0087034 [0,0,0,1,0,0|2,0,0]=3 140 B7R1.2 C1CC(=O)CC1=O CUR-0010695 [0,0,0,1,0,0|2,0,1]=4 141 B7R1.2 CC1CCC(=O)N1 CUR-0016557 [0,0,0,1,0,0|2,0,0]=3 142 B7R1.2 CC1CCC(=O)O1 CUR-0101591 [0,0,0,1,0,0|2,0,0]=3 143 B7R1.2 CC1COC(=O)O1 CUR-0101613 [0,0,0,1,0,0|1,0,0]=2 144 B7R1.3 C1CC=CC(=O)C1 CUR-0002304 [0,0,0,1,0,0|1,0,1]=3 145 B7R1.3 C1CCC(=O)CC1 CUR-0013382 [0,0,0,1,0,0|1,0,0]=2 146 B7R1.3 C1CCC(CC1)Br CUR-0027491 [0,0,0,1,0,0|2,0,1]=4 147 B7R1.3 C1CCC(CC1)N CUR-0004167 [0,0,0,1,0,0|2,0,1]=4 148 B7R1.3 C1CCC(CC1)O CUR-0020069 [0,0,0,1,0,0|1,0,2]=4 149 B7R1.3 C1CCNC(=O)C1 CUR-0002331 [0,0,0,1,0,0|1,0,0]=2 150 B7R1.3 C1CNC(=N)NC1 CUR-0096512 [0,0,0,1,0,0|3,0,0]=4 151 B7R1.3 C1CNC(=N)OC1 CUR-0096514 [0,0,0,1,0,0|2,0,0]=3 152 B7R1.3 C1CNC(=O)CN1 CUR-0101593 [0,0,0,1,0,0|2,0,0]=3 153 B7R1.3 C1CNC(=S)NC1 CUR-0101763 [0,0,0,1,0,0|2,1,0]=4 154 B7R1.3 C1CNCCC1=O CUR-0009294 [0,0,0,1,0,0|2,0,0]=3 155 B7R1.3 C1CNCCC1=O CUR-0102475 [0,0,0,1,0,0|2,0,0]=3 156 B7R1.3 C1COCC(=O)N1 CUR-0014967 [0,0,0,1,0,0|2,0,0]=3 157 B7R1.3 C1COCCC1=O CUR-0001478 [0,0,0,1,0,0|2,0,0]=3 158 B7R1.3 C1CSCC(=O)N1 CUR-0095816 [0,0,0,1,0,0|2,0,0]=3 159 B7R1.3 C1CSCCC1=O CUR-0005576 [0,0,0,1,0,0|2,0,0]=3 160 B7R1.3 CC1CCCCN1 CUR-0101581 [0,0,0,1,0,0|2,0,1]=4 161 B7R1.4 C1CC(=O)C(=O)C1 CUR-0061064 [0,0,0,1,0,0|2,0,0]=3 162 B7R1.4 C1CC(=O)N(C1)N CUR-0099031 [0,0,0,1,0,0|2,0,0]=3 163 B7R1.4 C1CNC(=O)C1Br CUR-0004832 [0,0,0,1,0,0|3,0,0]=4 164 B7R1.4 C1COC(=O)C1Br CUR-0012154 [0,0,0,1,0,0|3,0,0]=4 165 B7R1.4 C1CSC(=O)C1N CUR-0025625 [0,0,0,1,0,0|3,0,0]=4 166 B7R1.4 CN1CCCC1=O CUR-0101576 [0,0,0,1,0,0|1,0,0]=2 167 B7R1.22 C1CC1C(=O)CBr CUR-0027626 [0,0,0,1,0,0|2,0,0]=3 168 B7R1.22 C1CC1\C(=N\O)\N CUR-0100689 [0,0,0,1,0,0|3,0,0]=4 169 B7R1.22 COC(=O)C1CC1 CUR-0101589 [0,0,0,1,0,0|0,0,0]=1 170 B4R0.1 C#CC(=O)O CUR-0101441 [2,0,0,0,0,0|0,0,2]=4 171 B4R0.1 C(=O)C(=O)O CUR-0021308 [2,0,0,0,0,0|1,0,1]=4 172 B4R0.1 C(C(=O)Br)Br CUR-0006369 [2,0,0,0,0,0|2,0,0]=4 173 B4R0.1 C(C(=O)Cl)Cl CUR-0004550 [2,0,0,0,0,0|2,0,0]=4 174 B4R0.1 C(C(=O)N)Br CUR-0014813 [2,0,0,0,0,0|2,0,0]=4 175 B4R0.1 C(C(=O)N)Cl CUR-0007516 [2,0,0,0,0,0|2,0,0]=4 176 B4R0.1 C(C(=O)N)N CUR-0101687 [2,0,0,0,0,0|2,0,0]=4 177 B4R0.1 C(C(=O)N)O CUR-0113957 [2,0,0,0,0,0|2,0,0]=4 178 B4R0.1 C(C(=O)O)Br CUR-0100788 [2,0,0,0,0,0|1,0,0]=3 179 B4R0.1 C(C(=O)O)Cl CUR-0003311 [2,0,0,0,0,0|1,0,0]=3 180 B4R0.1 C(C(=O)O)I CUR-0003176 [2,0,0,0,0,0|1,0,0]=3 181 B4R0.1 C(C(=O)O)N CUR-0014574 [2,0,0,0,0,0|1,0,0]=3 182 B4R0.1 C(C(=O)O)N CUR-0101231 [2,0,0,0,0,0|1,0,0]=3 183 B4R0.1 C(C(=O)O)O CUR-0014667 [2,0,0,0,0,0|1,0,0]=3 184 B4R0.1 C(C(=O)O)S CUR-0101545 [2,0,0,0,0,0|1,0,0]=3 185 B4R0.1 C=CC(=O)O CUR-0028045 [2,0,0,0,0,0|0,0,2]=4 186 B4R0.1 CC(=C)CCl CUR-0011941 [2,0,0,0,0,0|2,0,0]=4 187 B4R0.1 CC(=C)OC CUR-0101450 [2,0,0,0,0,0|1,0,0]=3 188 B4R0.1 CC(=O)C=C CUR-0013098 [2,0,0,0,0,0|0,0,2]=4 189 B4R0.1 CC(=O)C=O CUR-0101448 [2,0,0,0,0,0|1,0,1]=4 190 B4R0.1 CC(=O)CCl CUR-0002239 [2,0,0,0,0,0|1,0,0]=3 191 B4R0.1 CC(=O)CO CUR-0005016 [2,0,0,0,0,0|1,0,0]=3 192 B4R0.1 CCC(=O)Cl CUR-0101547 [2,0,0,0,0,0|1,0,0]=3 193 B4R0.1 CCC(=O)N CUR-0101453 [2,0,0,0,0,0|1,0,0]=3 194 B4R0.1 CCC(=O)O CUR-0010221 [2,0,0,0,0,0|0,0,0]=2 195 B4R0.1 CCC(C)Br CUR-0102085 [2,0,0,0,0,0|1,0,1]=4 196 B4R0.1 CCC(C)I CUR-0055396 [2,0,0,0,0,0|1,0,1]=4 197 B4R0.1 CCC(C)N CUR-0001789 [2,0,0,0,0,0|1,0,1]=4 198 B4R0.1 CCN(C)C CUR-0101456 [2,0,0,0,0,0|2,0,0]=4 199 B4R0.1 CC[N+](=O)[O-] CUR-0012449 [2,0,0,0,0,0|1,0,1]=4 200 B4R0.1 CNC(=O)N CUR-0025342 [2,0,0,0,0,0|2,0,0]=4 201 B4R0.1 COC(=N)N CUR-0101458 [2,0,0,0,0,0|2,0,0]=4 202 B4R0.1 COC(=O)Cl CUR-0019109 [2,0,0,0,0,0|1,0,0]=3 203 B4R0.2 C(CN)CO CUR-0005687 [2,0,0,0,0,0|1,0,1]=4 204 B4R0.2 C(CO)CCl CUR-0004180 [2,0,0,0,0,0|1,0,1]=4 205 B4R0.2 C(CO)CO CUR-0007262 [2,0,0,0,0,0|1,0,1]=4 206 B4R0.2 C=CCCBr CUR-0002027 [2,0,0,0,0,0|1,0,1]=4 207 B4R0.2 C=CCCI CUR-0000685 [2,0,0,0,0,0|1,0,1]=4 208 B4R0.2 C=CCCO CUR-0101449 [2,0,0,0,0,0|1,0,1]=4 209 B4R0.2 CCCC#N CUR-0101440 [2,0,0,0,0,0|1,0,1]=4 210 B4R0.2 CCCC=O CUR-0100896 [2,0,0,0,0,0|0,0,0]=2 211 B4R0.2 CCCCBr CUR-0023794 [2,0,0,0,0,0|1,0,1]=4 212 B4R0.2 CCCCCl CUR-0023945 [2,0,0,0,0,0|1,0,1]=4 213 B4R0.2 CCCCI CUR-0001021 [2,0,0,0,0,0|1,0,1]=4 214 B4R0.2 CCCCN CUR-0017800 [2,0,0,0,0,0|1,0,1]=4 215 B4R0.2 CCCCN CUR-0101317 [2,0,0,0,0,0|1,0,1]=4 216 B4R0.2 CCCCO CUR-0016718 [2,0,0,0,0,0|0,0,1]=3 217 B4R0.2 CCCNN CUR-0022831 [2,0,0,0,0,0|2,0,0]=4 218 B4R0.2 CCN=C=O CUR-0101447 [2,0,0,0,0,0|1,0,1]=4 219 B4R0.2 CCNCC CUR-0022731 [2,0,0,0,0,0|1,0,1]=4 220 B4R0.2 CCNCC CUR-0101285 [2,0,0,0,0,0|1,0,1]=4 221 B4R0.2 CCOC=C CUR-0100764 [2,0,0,0,0,0|1,0,1]=4 222 B4R0.2 CCOC=O CUR-0010493 [2,0,0,0,0,0|1,0,0]=3 223 B4R0.2 CNCCI CUR-0017490 [2,0,0,0,0,0|2,0,0]=4 224 B4R0.2 CNCCO CUR-0011813 [2,0,0,0,0,0|1,0,1]=4 225 B4R0.2 COCC#N CUR-0101446 [2,0,0,0,0,0|1,0,1]=4 226 B4R0.2 COCCBr CUR-0009505 [2,0,0,0,0,0|1,0,0]=3 227 B4R0.2 COCCCl CUR-0000941 [2,0,0,0,0,0|1,0,0]=3 228 B4R0.2 COCCN CUR-0012344 [2,0,0,0,0,0|1,0,0]=3 229 B4R0.2 COCCO CUR-0101466 [2,0,0,0,0,0|1,0,0]=3 230 B4R0.2 COCOC CUR-0101465 [2,0,0,0,0,0|1,0,0]=3 231 B4R0.2 CSCCN CUR-0101544 [2,0,0,0,0,0|1,1,0]=4 232 B4R0.2 C\C=C\C=O CUR-0001472 [2,0,0,0,0,0|0,0,2]=4 233 B6R0.2 C(C(=O)O)C(=O)O CUR-0011839 [1,1,0,0,0,0|1,0,1]=4 234 B6R0.2 CC(=CC(=O)O)C CUR-0101587 [1,1,0,0,0,0|0,0,2]=4 235 B6R0.2 CC(=O)CC(=O)C CUR-0004776 [1,1,0,0,0,0|0,0,1]=3 236 B6R0.2 CC(=O)CC(=O)N CUR-0101600 [1,1,0,0,0,0|1,0,1]=4 237 B6R0.2 CC(C)CC(=O)C CUR-0017562 [1,1,0,0,0,0|0,0,0]=2 238 B6R0.2 CC(C)CC(=O)Cl CUR-0101806 [1,1,0,0,0,0|1,0,0]=3 239 B6R0.2 CC(C)CC(=O)O CUR-0017645 [1,1,0,0,0,0|0,0,0]=2 240 B6R0.2 CC(C)OC(=O)Cl CUR-0100902 [1,1,0,0,0,0|2,0,0]=4 241 B6R0.2 CC(OC(=O)Cl)Cl CUR-0007306 [1,1,0,0,0,0|2,0,0]=4 242 B6R0.3 C(C(C(=O)O)Br)Br CUR-0100855 [1,1,0,0,0,0|1,0,0]=3 243 B6R0.3 C(C(C(=O)O)N)O CUR-0101646 [1,1,0,0,0,0|1,0,0]=3 244 B6R0.3 C(C(C(=O)O)N)S CUR-0101261 [1,1,0,0,0,0|1,0,0]=3 245 B6R0.3 C([C@@H](C(=O)O)N)O CUR-0101109 [1,1,0,0,0,0|1,0,0]=3 246 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0004971 [1,1,0,0,0,0|1,0,0]=3 247 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0101810 [1,1,0,0,0,0|1,0,0]=3 248 B6R0.3 CC(=O)C(=O)OC CUR-0100866 [1,1,0,0,0,0|1,0,1]=4 249 B6R0.3 CCC(C(=O)N)Br CUR-0027495 [1,1,0,0,0,0|1,0,0]=3 250 B6R0.3 CCC(C(=O)O)Br CUR-0102801 [1,1,0,0,0,0|0,0,0]=2 251 B6R0.3 CCC(C(=O)O)N CUR-0010659 [1,1,0,0,0,0|0,0,0]=2 252 B6R0.3 CCC(C(C)O)N CUR-0067426 [1,1,0,0,0,0|0,0,2]=4 253 B6R0.3 CCC(C)C(=O)O CUR-0101619 [1,1,0,0,0,0|0,0,0]=2 254 B6R0.4 C(CC(=O)Cl)CBr CUR-0103177 [1,1,0,0,0,0|1,0,0]=3 255 B6R0.4 C(CC(=O)Cl)CCl CUR-0020663 [1,1,0,0,0,0|1,0,0]=3 256 B6R0.4 C(CC(=O)O)CN CUR-0010241 [1,1,0,0,0,0|0,0,0]=2 257 B6R0.4 C(CNC(=O)N)N CUR-0013187 [1,1,0,0,0,0|2,0,0]=4 258 B6R0.4 C=CCCC(=O)O CUR-0101586 [1,1,0,0,0,0|0,0,1]=3 259 B6R0.4 CC(=O)CCCCl CUR-0004280 [1,1,0,0,0,0|0,0,0]=2 260 B6R0.4 CCCCC(=O)C CUR-0101595 [1,1,0,0,0,0|0,0,0]=2 261 B6R0.4 CCCCC(=O)Cl CUR-0101805 [1,1,0,0,0,0|1,0,0]=3 262 B6R0.4 CCCCC(=O)O CUR-0101620 [1,1,0,0,0,0|0,0,0]=2 263 B6R0.4 CCOCC(=O)O CUR-0101637 [1,1,0,0,0,0|0,0,0]=2 264 B6R0.4 CN(C)CCCN CUR-0101628 [1,1,0,0,0,0|2,0,0]=4 265 B6R0.4 CN(C)CCCO CUR-0020324 [1,1,0,0,0,0|2,0,0]=4 266 B6R0.4 COCCC(=O)O CUR-0012995 [1,1,0,0,0,0|0,0,0]=2 267 B6R0.5 C(CS(=O)(=O)O)N CUR-0006763 [1,1,0,0,0,0|2,0,0]=4 268 B6R0.5 CCCS(=O)(=O)Cl CUR-0006923 [1,1,0,0,0,0|1,0,1]=4 269 B6R0.5 CS(=O)(=O)CCO CUR-0101869 [1,1,0,0,0,0|2,0,0]=4 270 B6R0.6 CCCCCCBr CUR-0023541 [1,1,0,0,0,0|1,0,1]=4 271 B6R0.6 CCCCCCC CUR-0101599 [1,1,0,0,0,0|1,0,1]=4 272 B6R0.6 CCCCCCI CUR-0008970 [1,1,0,0,0,0|1,0,1]=4 273 B6R0.6 CCCCCCN CUR-0100774 [1,1,0,0,0,0|1,0,1]=4 274 B6R0.6 CCCCCCO CUR-0025713 [1,1,0,0,0,0|1,0,1]=4 275 B6R0.6 CCCCNCC CUR-0101609 [1,1,0,0,0,0|1,0,1]=4 276 B6R0.6 CCCCOC=C CUR-0002040 [1,1,0,0,0,0|0,0,2]=4 277 B6R0.6 CCCNCCC CUR-0008343 [1,1,0,0,0,0|1,0,1]=4 278 B6R0.6 CCOCCCN CUR-0101632 [1,1,0,0,0,0|1,0,1]=4 279 B6R0.6 CC\C=C\CCO CUR-0007913 [1,1,0,0,0,0|1,0,1]=4 280 B6R0.6 CNCCCCN CUR-0156103 [1,1,0,0,0,0|1,0,1]=4 281 B6R0.8 COP(=O)(C)OC CUR-0009223 [1,1,0,0,0,0|2,0,0]=4 282 B6R0.8 COS(=O)(=O)OC CUR-0007713 [1,1,0,0,0,0|2,0,0]=4 283 B6R0.9 CCC(CC)C=O CUR-0009845 [1,1,0,0,0,0|1,0,1]=4 284 B8R0.5 CCOC(=O)C=C(C)C CUR-0057497 [0,2,0,0,0,0|0,0,2]=4 285 B8R0.5 CCOC(=O)CC(=O)C CUR-0003002 [0,2,0,0,0,0|0,0,1]=3 286 B8R0.5 CCOC(=O)CC(=O)O CUR-0100749 [0,2,0,0,0,0|1,0,1]=4 287 B8R0.5 CCOC(=O)CC(=O)[O-] CUR-0102852 [0,2,0,0,0,0|1,0,1]=4 288 B8R0.5 CCOC(=O)CC(C)C CUR-0101017 [0,2,0,0,0,0|0,0,0]=2 289 B8R0.5 CCOC(=O)CC(C)N CUR-0017477 [0,2,0,0,0,0|0,0,0]=2 290 B8R0.5 CCOC(=O)C[N+](=O)[O-] CUR-0102001 [0,2,0,0,0,0|2,0,0]=4 291 B8R0.5 CCOC(=O)C[S+](C)C CUR-0022340 [0,2,0,0,0,0|1,0,0]=3 292 B8R0.5 CCOC(=O)\C=C(/C)\N CUR-0101944 [0,2,0,0,0,0|0,0,2]=4 293 B8R0.5 CCOC(=O)\C=C(\C)/[O-] CUR-0102419 [0,2,0,0,0,0|0,0,2]=4 294 B8R0.19 CCC(=O)CC(=O)OC CUR-0009634 [0,2,0,0,0,0|0,0,0]=2 295 B8R0.19 CCC(=O)OC(=O)CC CUR-0101961 [0,2,0,0,0,0|1,0,1]=4 296 B8R0.19 COC(=N)CC(=N)OC CUR-0101035 [0,2,0,0,0,0|1,0,1]=4 297 B8R0.19 COC(=O)CC(=O)CCl CUR-0006240 [0,2,0,0,0,0|0,0,1]=3 298 B8R0.19 COC(=O)CC(=O)OC CUR-0100775 [0,2,0,0,0,0|0,0,1]=3 299 B8R0.23 CC(=O)CC(=O)N(C)C CUR-0006335 [0,2,0,0,0,0|1,0,1]=4 300 B8R0.24 COC(=O)CS(=O)(=O)Cl CUR-0100513 [0,2,0,0,0,0|2,0,0]=4 301 B8R0.1 CCCCC(=O)OCC CUR-0101964 [0,2,0,0,0,0|0,0,0]=2 302 B8R0.1 CCOC(=O)CCCBr CUR-0018304 [0,2,0,0,0,0|0,0,0]=2 303 B8R0.1 CCOC(=O)CCCCl CUR-0009890 [0,2,0,0,0,0|0,0,0]=2 304 B8R0.1 CCOC(=O)\C=C\CBr CUR-0103318 [0,2,0,0,0,0|0,0,2]=4 305 B8R0.1 CCOC(=O)\C=C\CN CUR-0163363 [0,2,0,0,0,0|0,0,2]=4 306 B8R0.3 CCC(C(=O)OCC)Br CUR-0103357 [0,2,0,0,0,0|0,0,0]=2 307 B8R0.3 CCOC(=O)C(=O)CBr CUR-0010421 [0,2,0,0,0,0|1,0,1]=4 308 B8R0.3 CCOC(=O)C(=O)NC CUR-0033950 [0,2,0,0,0,0|1,0,1]=4 309 B8R0.3 CCOC(=O)C(CBr)Br CUR-0103955 [0,2,0,0,0,0|1,0,0]=3 310 B8R0.6 COCCNC(=O)CCl CUR-0099538 [0,2,0,0,0,0|2,0,0]=4 311 B8R0.6 COCCNC(=O)CN CUR-0026714 [0,2,0,0,0,0|2,0,0]=4 312 B8R0.9 COC(=O)CCC(=O)Cl CUR-0001082 [0,2,0,0,0,0|0,0,1]=3 313 B8R0.9 COC(=O)CCC(=O)O CUR-0027389 [0,2,0,0,0,0|0,0,1]=3 314 B8R0.11 COC(CCCN)OC CUR-0102018 [0,2,0,0,0,0|0,0,2]=4 315 B8R0.14 CCNC(=O)C(C)(C)O CUR-0072546 [0,2,0,0,0,0|2,0,0]=4 316 B8R0.14 CCOC(=O)C(C)(C)Br CUR-0103356 [0,2,0,0,0,0|2,0,0]=4 317 B8R0.30 CCOS(=O)(=O)OCC CUR-0007146 [0,2,0,0,0,0|2,0,0]=4 318 B8R0.13 CCC(C)(C)C(=O)OC CUR-0163339 [0,2,0,0,0,0|0,0,0]=2 319 B8R0.20 COC(C(=O)OC)OC CUR-0102026 [0,2,0,0,0,0|1,0,0]=3 320 B6R1.2 C1CC(=O)C=C1 CUR-0001940 [1,0,0,1,0,0|0,0,2]=4 321 B6R1.2 C1CC(=O)NC1 CUR-0017206 [1,0,0,1,0,0|1,0,0]=3 322 B6R1.2 C1CC(=O)OC1 CUR-0101496 [1,0,0,1,0,0|0,0,0]=2 323 B6R1.2 C1CCC(=O)C1 CUR-0027028 [1,0,0,1,0,0|0,0,0]=2 324 B6R1.2 C1CCC(C1)Br CUR-0025546 [1,0,0,1,0,0|1,0,1]=4 325 B6R1.2 C1CCC(C1)N CUR-0006172 [1,0,0,1,0,0|1,0,1]=4 326 B6R1.2 C1CCC(C1)O CUR-0021370 [1,0,0,1,0,0|0,0,2]=4 327 B6R1.2 C1CNC(=O)N1 CUR-0017995 [1,0,0,1,0,0|2,0,0]=4 328 B6R1.2 C1CNC(=O)N1 CUR-0101499 [1,0,0,1,0,0|2,0,0]=4 329 B6R1.2 C1COC(=O)N1 CUR-0101507 [1,0,0,1,0,0|1,0,0]=3 330 B6R1.2 C1CSCC1=O CUR-0101623 [1,0,0,1,0,0|1,0,0]=3 331 B6R1.2 CN1CCCC1 CUR-0101495 [1,0,0,1,0,0|2,0,0]=4 332 B6R1.8 C=C1CC1CO CUR-0163362 [1,0,0,1,0,0|2,0,0]=4 333 B6R1.11 C1CC1C(=O)Cl CUR-0101645 [1,0,0,1,0,0|1,0,0]=3 334 B6R1.11 C1CC1C(=O)O CUR-0027058 [1,0,0,1,0,0|0,0,0]=2 335 B6R1.11 CC(=O)C1CC1 CUR-0020622 [1,0,0,1,0,0|0,0,0]=2 336 B6R1.1 C1CC=COC1 CUR-0027513 [1,0,0,1,0,0|0,0,1]=3 337 B6R1.1 C1CCC=CC1 CUR-0022869 [1,0,0,1,0,0|1,0,0]=3 338 B6R1.1 C1COCCN1 CUR-0027011 [1,0,0,1,0,0|1,0,1]=4 339 B6R1.6 CNC1CCC1 CUR-0010771 [1,0,0,1,0,0|1,0,1]=4 340 B8R1.1 C1C(CNC1=O)CBr CUR-0022348 [0,1,0,1,0,0|1,0,0]=3 341 B8R1.1 C1C(CNC1=O)CN CUR-0046714 [0,1,0,1,0,0|1,0,0]=3 342 B8R1.1 C1C(CNC1=O)CO CUR-0098527 [0,1,0,1,0,0|1,0,0]=3 343 B8R1.1 C1CC(=O)NC1CN CUR-0094491 [0,1,0,1,0,0|2,0,0]=4 344 B8R1.1 C1CC(=O)NC1CO CUR-0028114 [0,1,0,1,0,0|2,0,0]=4 345 B8R1.1 CNC1CC(=O)NC1 CUR-0011593 [0,1,0,1,0,0|1,0,0]=3 346 B8R1.4 C1CC(=O)CC(=O)C1 CUR-0019886 [0,1,0,1,0,0|1,0,1]=4 347 B8R1.4 C1CC(=O)OC(=O)C1 CUR-0009916 [0,1,0,1,0,0|0,0,1]=3 348 B8R1.4 CC1CCCC(=O)C1 CUR-0101702 [0,1,0,1,0,0|1,0,0]=3 349 B8R1.18 CC1CC(C(=O)O1)Br CUR-0020365 [0,1,0,1,0,0|2,0,0]=4 350 B8R1.18 CN1CC(=O)CC1=O CUR-0055835 [0,1,0,1,0,0|1,0,1]=4 351 B8R1.18 CN1CC(CC1=O)N CUR-0086561 [0,1,0,1,0,0|1,0,0]=3 352 B8R1.40 C1CC1NC(=O)CCl CUR-0019155 [0,1,0,1,0,0|2,0,0]=4 353 B8R1.2 C1CC(=COC1)C=O CUR-0100474 [0,1,0,1,0,0|2,0,0]=4 354 B8R1.2 C1CCC(=NO)CC1 CUR-0008698 [0,1,0,1,0,0|1,0,1]=4 355 B8R1.2 C1CCC(CC1)C=O CUR-0101704 [0,1,0,1,0,0|1,0,1]=4 356 B8R1.2 C1CCN(CC1)C=O CUR-0012773 [0,1,0,1,0,0|2,0,0]=4 357 B8R1.2 C1CCOC(C1)CO CUR-0101759 [0,1,0,1,0,0|0,0,2]=4 358 B8R1.2 COC1CCNCC1 CUR-0098884 [0,1,0,1,0,0|1,0,1]=4 359 B8R1.2 COC1CCNCC1 CUR-0102416 [0,1,0,1,0,0|1,0,1]=4 360 B8R1.3 C1CC(=O)NCC1N CUR-0023298 [0,1,0,1,0,0|1,0,0]=3 361 B8R1.3 C1CC(=O)NCC1N CUR-0094615 [0,1,0,1,0,0|1,0,0]=3 362 B8R1.3 C=C1CCC(CC1)N CUR-0123168 [0,1,0,1,0,0|2,0,0]=4 363 B8R1.3 CC1CCC(=O)CC1 CUR-0016613 [0,1,0,1,0,0|1,0,0]=3 364 B8R1.3 CN1CCC(=O)CC1 CUR-0101707 [0,1,0,1,0,0|1,0,0]=3 365 B8R1.5 C1CC(C(=O)NC1)Br CUR-0014307 [0,1,0,1,0,0|1,0,0]=3 366 B8R1.5 C1CC(C(=O)OC1)Br CUR-0008409 [0,1,0,1,0,0|0,0,0]=2 367 B8R1.5 C1CCC(=O)C(C1)Cl CUR-0101998 [0,1,0,1,0,0|1,0,0]=3 368 B8R1.5 CC1C(=O)NCCN1 CUR-0001671 [0,1,0,1,0,0|2,0,0]=4 369 B8R1.5 CC1CCCCC1=O CUR-0101703 [0,1,0,1,0,0|1,0,0]=3 370 B8R1.5 CN1CCNCC1=O CUR-0091495 [0,1,0,1,0,0|1,0,0]=3 371 B8R1.22 C1CC(=O)CCNC1 CUR-0099157 [0,1,0,1,0,0|1,0,0]=3 372 B8R1.22 C1CCC(=O)NCC1 CUR-0022015 [0,1,0,1,0,0|1,0,0]=3 373 B8R1.22 C1CCC(=O)OCC1 CUR-0101418 [0,1,0,1,0,0|0,0,0]=2 374 B8R1.22 C1CCCC(=O)CC1 CUR-0004176 [0,1,0,1,0,0|1,0,0]=3 375 B8R1.22 C1CNCCNC1=O CUR-0003886 [0,1,0,1,0,0|1,0,0]=3 376 B8R1.38 C1CC(C1)C(=O)CN CUR-0153392 [0,1,0,1,0,0|2,0,0]=4 377 B8R1.50 CN1CCC(C1=O)Br CUR-0011211 [0,1,0,1,0,0|1,0,0]=3 378 B8R1.50 CN1CCC(C1=O)N CUR-0012125 [0,1,0,1,0,0|1,0,0]=3 379 B8R1.50 CN1CCC(C1=O)O CUR-0013744 [0,1,0,1,0,0|1,0,0]=3 380 B8R1.50 CN1CCN(C1=O)C CUR-0101721 [0,1,0,1,0,0|2,0,0]=4 381 B8R1.19 CC1(CCCC1=O)C CUR-0099926 [0,1,0,1,0,0|1,0,0]=3 382 B8R1.11 C1CC(=O)N(C1)CCl CUR-0095842 [0,1,0,1,0,0|1,0,0]=3 383 B8R1.11 C=CN1CCCC1=O CUR-0026598 [0,1,0,1,0,0|1,0,1]=4 384 B8R1.11 CNC1CCNC1=O CUR-0087614 [0,1,0,1,0,0|2,0,0]=4