0 B8R0.1 CCCCC(=O)OCC CUR-0101964 [0,0,0,0,0,0|0,0,0]=0 1 B8R0.1 CCOC(=O)CCCBr CUR-0018304 [0,0,0,0,0,0|1,0,0]=1 2 B8R0.1 CCOC(=O)CCCCl CUR-0009890 [0,0,0,0,0,0|1,0,0]=1 3 B8R0.1 CCOC(=O)\C=C\CBr CUR-0103318 [0,0,0,0,0,0|1,0,2]=3 4 B8R0.1 CCOC(=O)\C=C\CN CUR-0163363 [0,0,0,0,0,0|1,0,2]=3 5 B7R0.1 CCCCCCCBr CUR-0012025 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.1 CCCCCCCC CUR-0101732 [1,0,0,0,0,0|1,0,1]=3 7 B7R0.1 CCCCCCCI CUR-0002481 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.1 CCCCCCCO CUR-0012442 [1,0,0,0,0,0|2,0,1]=4 9 B7R0.1 CCNCCNCC CUR-0019308 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.3 CCCNC(=O)CCl CUR-0099537 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.3 CCCOC(=O)CCl CUR-0101322 [1,0,0,0,0,0|2,0,0]=3 12 B7R0.3 CNC(=O)OCCO CUR-0053764 [1,0,0,0,0,0|3,0,0]=4 13 B7R0.3 COC(=O)CCCN CUR-0008398 [1,0,0,0,0,0|1,0,0]=2 14 B7R0.3 COC(=O)\C=C\CBr CUR-0103039 [1,0,0,0,0,0|1,0,2]=4 15 B7R0.3 COCCC(=O)OC CUR-0101774 [1,0,0,0,0,0|1,0,0]=2 16 B7R0.3 CO\C=C\C(=O)OC CUR-0101064 [1,0,0,0,0,0|1,0,2]=4 17 B7R0.7 CCCC(=O)OCC CUR-0005973 [1,0,0,0,0,0|0,0,0]=1 18 B7R0.7 CCNC(=S)NCC CUR-0101996 [1,0,0,0,0,0|2,1,0]=4 19 B7R0.7 CCOC(=O)C=[N+]=[N-] CUR-0018665 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.7 CCOC(=O)CC#N CUR-0025194 [1,0,0,0,0,0|1,0,1]=3 21 B7R0.7 CCOC(=O)CCBr CUR-0103086 [1,0,0,0,0,0|1,0,0]=2 22 B7R0.7 CCOC(=O)CCCl CUR-0017965 [1,0,0,0,0,0|1,0,0]=2 23 B7R0.7 CCOC(=O)CNN CUR-0022001 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.7 CCOC(=O)C[N+]#[C-] CUR-0023815 [1,0,0,0,0,0|1,0,1]=3 25 B7R0.7 CCOC(=O)OCC CUR-0003960 [1,0,0,0,0,0|1,0,0]=2 26 B7R0.7 CCOC(C)OCC CUR-0008227 [1,0,0,0,0,0|2,0,1]=4 27 B7R0.7 CCOP(=O)OCC CUR-0027645 [1,0,0,0,0,0|2,0,0]=3 28 B9R0.5 CCCCOC(=O)CCS CUR-0102668 [0,1,0,0,0,0|2,0,0]=3 29 B9R0.5 CCO\C=C\C(=O)OCC CUR-0102229 [0,1,0,0,0,0|0,0,2]=3 30 B9R0.18 C(CC(=O)CCCCl)CCl CUR-0009578 [0,1,0,0,0,0|2,0,0]=3 31 B9R0.18 CCCC[Sn](=O)CCCC CUR-0103916 [0,1,0,0,0,0|2,0,0]=3 32 B9R0.34 CCC(=O)CC(=O)OCC CUR-0101401 [0,1,0,0,0,0|0,0,1]=2 33 B9R0.34 CCCC(=O)CC(=O)OC CUR-0101393 [0,1,0,0,0,0|2,0,1]=4 34 B9R0.34 CCOC(=O)CC(=O)CCl CUR-0025786 [0,1,0,0,0,0|1,0,1]=3 35 B9R0.35 CCOC(=O)C(=O)OCC CUR-0007606 [0,1,0,0,0,0|1,0,1]=3 36 B9R0.48 CCOC(=O)CCC(=O)C CUR-0102227 [0,1,0,0,0,0|0,0,1]=2 37 B9R0.48 CCOC(=O)CCC(=O)Cl CUR-0015518 [0,1,0,0,0,0|1,0,1]=3 38 B9R1.8 C1CCC(=CC1)CCN CUR-0007512 [0,0,0,1,0,0|3,0,0]=4 39 B9R1.8 CCNC1CCCCC1 CUR-0101907 [0,0,0,1,0,0|2,0,1]=4 40 B9R1.15 COC1C(=O)CCCO1 CUR-0028339 [0,0,0,1,0,0|3,0,0]=4 41 B9R1.33 C1CC(=O)N(C1)CCBr CUR-0013499 [0,0,0,1,0,0|3,0,0]=4 42 B9R1.50 C1CCCC(=O)CCC1 CUR-0101896 [0,0,0,1,0,0|1,0,0]=2 43 B9R1.50 C1CCCC(CCC1)N CUR-0014335 [0,0,0,1,0,0|2,0,1]=4 44 B9R1.100 C1CC1C(=O)NCCN CUR-0007911 [0,0,0,1,0,0|3,0,0]=4 45 B9R1.100 C1CC1C(=O)NCCN CUR-0100619 [0,0,0,1,0,0|3,0,0]=4 46 B6R0.6 CCCCCCBr CUR-0023541 [2,0,0,0,0,0|1,0,1]=4 47 B6R0.6 CCCCCCC CUR-0101599 [2,0,0,0,0,0|0,0,1]=3 48 B6R0.6 CCCCCCI CUR-0008970 [2,0,0,0,0,0|1,0,1]=4 49 B6R0.6 CCCCCCN CUR-0100774 [2,0,0,0,0,0|1,0,1]=4 50 B6R0.6 CCCCCCO CUR-0025713 [2,0,0,0,0,0|1,0,1]=4 51 B6R0.6 CCCCNCC CUR-0101609 [2,0,0,0,0,0|1,0,0]=3 52 B6R0.6 CCCCOC=C CUR-0002040 [2,0,0,0,0,0|0,0,2]=4 53 B6R0.6 CCCNCCC CUR-0008343 [2,0,0,0,0,0|1,0,1]=4 54 B6R0.6 CCOCCCN CUR-0101632 [2,0,0,0,0,0|1,0,0]=3 55 B6R0.6 CC\C=C\CCO CUR-0007913 [2,0,0,0,0,0|1,0,1]=4 56 B6R0.1 CCC(=O)OCC CUR-0101621 [2,0,0,0,0,0|0,0,0]=2 57 B6R0.1 CCNC(=O)CCl CUR-0099539 [2,0,0,0,0,0|2,0,0]=4 58 B6R0.1 CCOC(=O)C#C CUR-0101411 [2,0,0,0,0,0|0,0,2]=4 59 B6R0.1 CCOC(=O)C#N CUR-0012085 [2,0,0,0,0,0|1,0,1]=4 60 B6R0.1 CCOC(=O)C=C CUR-0027721 [2,0,0,0,0,0|0,0,2]=4 61 B6R0.1 CCOC(=O)C=O CUR-0101612 [2,0,0,0,0,0|1,0,1]=4 62 B6R0.1 CCOC(=O)CBr CUR-0001682 [2,0,0,0,0,0|1,0,0]=3 63 B6R0.1 CCOC(=O)CCl CUR-0015757 [2,0,0,0,0,0|1,0,0]=3 64 B6R0.1 CCOC(=O)CF CUR-0101650 [2,0,0,0,0,0|1,0,0]=3 65 B6R0.1 CCOC(=O)CN CUR-0024509 [2,0,0,0,0,0|1,0,0]=3 66 B6R0.1 CCOC(=O)CO CUR-0101638 [2,0,0,0,0,0|1,0,0]=3 67 B6R0.1 CNCC(=O)OC CUR-0102132 [2,0,0,0,0,0|1,0,0]=3 68 B6R0.1 COC(=O)CC#N CUR-0022414 [2,0,0,0,0,0|1,0,1]=4 69 B6R0.1 COC(=O)CCS CUR-0005277 [2,0,0,0,0,0|1,0,0]=3 70 B6R0.1 COCC(=O)OC CUR-0101636 [2,0,0,0,0,0|1,0,0]=3 71 B6R0.1 C\C=C\C(=O)OC CUR-0101585 [2,0,0,0,0,0|0,0,2]=4 72 B6R0.4 C(CC(=O)Cl)CBr CUR-0103177 [2,0,0,0,0,0|2,0,0]=4 73 B6R0.4 C(CC(=O)Cl)CCl CUR-0020663 [2,0,0,0,0,0|2,0,0]=4 74 B6R0.4 C(CC(=O)O)CN CUR-0010241 [2,0,0,0,0,0|1,0,0]=3 75 B6R0.4 C=CCCC(=O)O CUR-0101586 [2,0,0,0,0,0|0,0,2]=4 76 B6R0.4 CC(=O)CCCCl CUR-0004280 [2,0,0,0,0,0|1,0,0]=3 77 B6R0.4 CCCCC(=O)C CUR-0101595 [2,0,0,0,0,0|0,0,0]=2 78 B6R0.4 CCCCC(=O)Cl CUR-0101805 [2,0,0,0,0,0|1,0,0]=3 79 B6R0.4 CCCCC(=O)O CUR-0101620 [2,0,0,0,0,0|0,0,0]=2 80 B6R0.4 CCOCC(=O)O CUR-0101637 [2,0,0,0,0,0|1,0,0]=3 81 B6R0.4 COCCC(=O)O CUR-0012995 [2,0,0,0,0,0|1,0,0]=3 82 B8R0.4 CCCCCCCCCl CUR-0017829 [1,1,0,0,0,0|1,0,1]=4 83 B8R0.4 CCCCCCCCN CUR-0016440 [1,1,0,0,0,0|1,0,1]=4 84 B8R0.4 CCCCCCCCO CUR-0019304 [1,1,0,0,0,0|1,0,1]=4 85 B8R0.4 CCCCNCCCC CUR-0010735 [1,1,0,0,0,0|1,0,1]=4 86 B8R0.9 COC(=O)CCC(=O)Cl CUR-0001082 [1,1,0,0,0,0|1,0,1]=4 87 B8R0.9 COC(=O)CCC(=O)O CUR-0027389 [1,1,0,0,0,0|1,0,1]=4 88 B8R0.11 CCCCC(CC)CN CUR-0101954 [1,1,0,0,0,0|1,0,1]=4 89 B8R0.19 CCC(=O)CC(=O)OC CUR-0009634 [1,1,0,0,0,0|0,0,1]=3 90 B8R0.19 CCC(=O)OC(=O)CC CUR-0101961 [1,1,0,0,0,0|1,0,1]=4 91 B8R0.19 COC(=O)CC(=O)CCl CUR-0006240 [1,1,0,0,0,0|1,0,1]=4 92 B8R0.19 COC(=O)CC(=O)OC CUR-0100775 [1,1,0,0,0,0|1,0,1]=4 93 B8R0.5 CCOC(=O)C=C(C)C CUR-0057497 [1,1,0,0,0,0|0,0,2]=4 94 B8R0.5 CCOC(=O)CC(=O)C CUR-0003002 [1,1,0,0,0,0|0,0,1]=3 95 B8R0.5 CCOC(=O)CC(=O)O CUR-0100749 [1,1,0,0,0,0|1,0,1]=4 96 B8R0.5 CCOC(=O)CC(=O)[O-] CUR-0102852 [1,1,0,0,0,0|1,0,1]=4 97 B8R0.5 CCOC(=O)CC(C)C CUR-0101017 [1,1,0,0,0,0|0,0,0]=2 98 B8R0.5 CCOC(=O)CC(C)N CUR-0017477 [1,1,0,0,0,0|0,0,0]=2 99 B8R0.5 CCOC(=O)C[N+](=O)[O-] CUR-0102001 [1,1,0,0,0,0|2,0,0]=4 100 B8R0.5 CCOC(=O)C[S+](C)C CUR-0022340 [1,1,0,0,0,0|1,0,0]=3 101 B8R0.5 CCOC(=O)\C=C(/C)\N CUR-0101944 [1,1,0,0,0,0|0,0,2]=4 102 B8R0.5 CCOC(=O)\C=C(\C)/[O-] CUR-0102419 [1,1,0,0,0,0|0,0,2]=4 103 B8R0.30 CCOS(=O)(=O)OCC CUR-0007146 [1,1,0,0,0,0|2,0,0]=4 104 B10R0.28 CC(C)(C)OC(=O)CCNN CUR-0153398 [0,2,0,0,0,0|2,0,0]=4 105 B10R0.28 CC(C)(C)OC(=O)NCCN CUR-0007212 [0,2,0,0,0,0|2,0,0]=4 106 B10R0.1 CCOC(=O)CCCCCN CUR-0021263 [0,2,0,0,0,0|0,0,0]=2 107 B10R0.2 CCCC(=O)CC(=O)OCC CUR-0102575 [0,2,0,0,0,0|0,0,0]=2 108 B10R0.2 CCCC(=O)OC(=O)CCC CUR-0102577 [0,2,0,0,0,0|1,0,1]=4 109 B10R0.2 CCOC(=O)CC(=O)OCC CUR-0024149 [0,2,0,0,0,0|0,0,1]=3 110 B10R0.83 CCCCOC(=O)C(CBr)Br CUR-0101120 [0,2,0,0,0,0|2,0,0]=4 111 B10R0.26 CCOC(=O)CC(=O)C(F)F CUR-0093295 [0,2,0,0,0,0|1,0,1]=4 112 B8R1.2 C1COCCC1CBr CUR-0017881 [1,0,0,1,0,0|1,0,1]=4 113 B8R1.2 C1COCCC1CN CUR-0016360 [1,0,0,1,0,0|1,0,1]=4 114 B8R1.2 C1COCCC1CN CUR-0101743 [1,0,0,1,0,0|1,0,1]=4 115 B8R1.2 C1COCCC1CO CUR-0025645 [1,0,0,1,0,0|1,0,1]=4 116 B8R1.2 CCC1CCCCN1 CUR-0101713 [1,0,0,1,0,0|2,0,0]=4 117 B8R1.5 CC1C(OCCN1)C CUR-0008066 [1,0,0,1,0,0|1,0,1]=4 118 B8R1.1 C1C(CNC1=O)CBr CUR-0022348 [1,0,0,1,0,0|2,0,0]=4 119 B8R1.1 C1C(CNC1=O)CN CUR-0046714 [1,0,0,1,0,0|2,0,0]=4 120 B8R1.1 C1C(CNC1=O)CO CUR-0098527 [1,0,0,1,0,0|2,0,0]=4 121 B8R1.1 C1CC(=O)NC1CN CUR-0094491 [1,0,0,1,0,0|2,0,0]=4 122 B8R1.1 C1CC(=O)NC1CO CUR-0028114 [1,0,0,1,0,0|2,0,0]=4 123 B8R1.1 CNC1CC(=O)NC1 CUR-0011593 [1,0,0,1,0,0|2,0,0]=4 124 B8R1.3 C1CC(=O)NCC1N CUR-0023298 [1,0,0,1,0,0|2,0,0]=4 125 B8R1.3 C1CC(=O)NCC1N CUR-0094615 [1,0,0,1,0,0|2,0,0]=4 126 B8R1.3 C=C1CCC(CC1)N CUR-0123168 [1,0,0,1,0,0|2,0,0]=4 127 B8R1.3 CC1CCC(=O)CC1 CUR-0016613 [1,0,0,1,0,0|0,0,0]=2 128 B8R1.3 CC1CCC(CC1)O CUR-0005881 [1,0,0,1,0,0|0,0,2]=4 129 B8R1.3 CN1CCC(=O)CC1 CUR-0101707 [1,0,0,1,0,0|1,0,0]=3 130 B8R1.3 C[C@H]1CC[C@@H](CC1)N CUR-0101712 [1,0,0,1,0,0|1,0,1]=4 131 B8R1.38 C1CC(C1)C(=O)CN CUR-0153392 [1,0,0,1,0,0|1,0,0]=3 132 B8R1.40 C1CC1NC(=O)CCl CUR-0019155 [1,0,0,1,0,0|2,0,0]=4 133 B8R1.4 C1CC(=O)OC(=O)C1 CUR-0009916 [1,0,0,1,0,0|1,0,1]=4 134 B8R1.4 CC1CCCC(=O)C1 CUR-0101702 [1,0,0,1,0,0|1,0,0]=3 135 B10R1.10 C1CN(CC(=O)N1)CCO CUR-0096567 [0,1,0,1,0,0|2,0,0]=4 136 B10R1.11 C1CCN(C1)C(=O)CCCl CUR-0029534 [0,1,0,1,0,0|2,0,0]=4 137 B10R1.29 C1CC(=O)N(C1)CCCCl CUR-0016346 [0,1,0,1,0,0|2,0,0]=4 138 B10R1.29 C1CC(=O)N(C1)CCCN CUR-0102200 [0,1,0,1,0,0|2,0,0]=4 139 B10R1.197 C1CC(=O)NCCC1CO CUR-0004047 [0,1,0,1,0,0|1,0,0]=3 140 B10R1.4 C1CCN(C(=O)C1)CCO CUR-0012979 [0,1,0,1,0,0|1,0,0]=3 141 B10R1.4 C1COCC(=O)N1CCCl CUR-0056322 [0,1,0,1,0,0|2,0,0]=4 142 B10R1.17 C1CCC(CC1)OCCBr CUR-0028853 [0,1,0,1,0,0|1,0,1]=4 143 B10R1.17 C1CCC(CC1)OCCO CUR-0013980 [0,1,0,1,0,0|1,0,1]=4 144 B10R2.62 C1CN2CCC1C(=O)C2 CUR-0102639 [0,0,0,2,0,0|2,0,0]=4 145 B10R2.71 C1CC2CC(=O)CC1N2 CUR-0021617 [0,0,0,2,0,0|2,0,0]=4 146 B10R2.71 C1CC2CC(=O)CC1O2 CUR-0002105 [0,0,0,2,0,0|2,0,0]=4