0 B7R0.7 CCCC(=O)OCC CUR-0005973 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.7 CCNC(=S)NCC CUR-0101996 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.7 CCOC(=O)CCBr CUR-0103086 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.7 CCOC(=O)CCCl CUR-0017965 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.7 CCOC(=O)OCC CUR-0003960 [0,0,0,0,0,0|1,0,1]=2 5 B7R0.7 CCOC(C)OCC CUR-0008227 [0,0,0,0,0,0|0,0,0]=0 6 B7R0.7 CCOP(=O)OCC CUR-0027645 [0,0,0,0,0,0|2,0,0]=2 7 B6R0.1 CC(CCN)OC CUR-0122797 [1,0,0,0,0,0|2,0,0]=3 8 B6R0.1 CC(CSC)NC CUR-0022342 [1,0,0,0,0,0|3,0,0]=4 9 B6R0.1 CCC(=O)OCC CUR-0101621 [1,0,0,0,0,0|1,0,1]=3 10 B6R0.1 CCCC(C)C=O CUR-0101597 [1,0,0,0,0,0|2,0,1]=4 11 B6R0.1 CCOC(=O)CBr CUR-0001682 [1,0,0,0,0,0|2,0,1]=4 12 B6R0.1 CCOC(=O)CCl CUR-0015757 [1,0,0,0,0,0|2,0,1]=4 13 B6R0.1 CCOC(=O)CF CUR-0101650 [1,0,0,0,0,0|2,0,1]=4 14 B6R0.1 CCOC(=O)CN CUR-0024509 [1,0,0,0,0,0|2,0,1]=4 15 B6R0.1 CCOC(=O)CO CUR-0101638 [1,0,0,0,0,0|2,0,1]=4 16 B6R0.6 CCCCCCBr CUR-0023541 [1,0,0,0,0,0|3,0,0]=4 17 B6R0.6 CCCCCCC CUR-0101599 [1,0,0,0,0,0|2,0,0]=3 18 B6R0.6 CCCCCCI CUR-0008970 [1,0,0,0,0,0|3,0,0]=4 19 B6R0.6 CCCCCCN CUR-0100774 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.6 CCCCCCO CUR-0025713 [1,0,0,0,0,0|3,0,0]=4 21 B6R0.6 CCCCNCC CUR-0101609 [1,0,0,0,0,0|2,0,0]=3 22 B6R0.6 CCCCOC=C CUR-0002040 [1,0,0,0,0,0|1,0,2]=4 23 B6R0.6 CCCNCCC CUR-0008343 [1,0,0,0,0,0|3,0,0]=4 24 B6R0.6 CCOCCCN CUR-0101632 [1,0,0,0,0,0|2,0,0]=3 25 B8R0.1 CCCCC(=O)OCC CUR-0101964 [0,1,0,0,0,0|2,0,1]=4 26 B8R0.1 CCOC(=O)CCCBr CUR-0018304 [0,1,0,0,0,0|2,0,1]=4 27 B8R0.1 CCOC(=O)CCCCl CUR-0009890 [0,1,0,0,0,0|2,0,1]=4 28 B8R0.3 CCC(C(=O)OCC)Br CUR-0103357 [0,1,0,0,0,0|2,0,1]=4 29 B8R0.5 CCOC(=O)CC(C)C CUR-0101017 [0,1,0,0,0,0|2,0,1]=4 30 B8R0.5 CCOC(=O)CC(C)N CUR-0017477 [0,1,0,0,0,0|2,0,1]=4 31 B8R0.22 CCOC(C=C)OCC CUR-0101965 [0,1,0,0,0,0|0,0,1]=2 32 B8R0.22 CCOC(CBr)OCC CUR-0007493 [0,1,0,0,0,0|0,0,0]=1 33 B8R0.22 CCOC(CN)OCC CUR-0018705 [0,1,0,0,0,0|0,0,0]=1 34 B8R0.30 CCOS(=O)(=O)OCC CUR-0007146 [0,1,0,0,0,0|2,0,0]=3 35 B8R1.4 CC1CC(CNC1)C CUR-0101710 [0,0,0,1,0,0|3,0,0]=4 36 B8R1.4 CC1CCCC(C1)O CUR-0017679 [0,0,0,1,0,0|3,0,0]=4 37 B8R1.4 CC1CCCC(N1)C CUR-0101708 [0,0,0,1,0,0|2,0,0]=3 38 B8R1.4 CC1CNCC(O1)C CUR-0023957 [0,0,0,1,0,0|2,0,0]=3 39 B8R1.4 CC1COCC(N1)C CUR-0013452 [0,0,0,1,0,0|3,0,0]=4 40 B8R1.4 C[C@@H]1CCC[C@@H](N1)C CUR-0100904 [0,0,0,1,0,0|2,0,0]=3 41 B8R1.4 C[C@@H]1CNC[C@@H](O1)C CUR-0101741 [0,0,0,1,0,0|2,0,0]=3 42 B8R1.8 C1CC(OC1)CNN CUR-0029161 [0,0,0,1,0,0|3,0,0]=4 43 B8R1.8 C1CCC(C1)CCN CUR-0004406 [0,0,0,1,0,0|3,0,0]=4 44 B8R1.8 C1COC(O1)CCBr CUR-0103089 [0,0,0,1,0,0|3,0,0]=4 45 B8R1.8 CNCC1CCCO1 CUR-0000545 [0,0,0,1,0,0|2,0,0]=3 46 B8R1.11 CC1CCCC1CN CUR-0083631 [0,0,0,1,0,0|3,0,0]=4 47 B8R1.22 C1CCC(=O)OCC1 CUR-0101418 [0,0,0,1,0,0|2,0,1]=4 48 B8R1.22 C1CCCC(CC1)N CUR-0011742 [0,0,0,1,0,0|3,0,0]=4 49 B5R0.1 CC(C)CCBr CUR-0002757 [2,0,0,0,0,0|2,0,0]=4 50 B5R0.1 CC(C)CCN CUR-0101511 [2,0,0,0,0,0|2,0,0]=4 51 B5R0.1 CC(C)CCO CUR-0003416 [2,0,0,0,0,0|2,0,0]=4 52 B5R0.1 CC(CCO)O CUR-0003759 [2,0,0,0,0,0|2,0,0]=4 53 B5R0.1 CCCC(C)O CUR-0023615 [2,0,0,0,0,0|1,0,0]=3 54 B5R0.1 CCOC(=O)C CUR-0101519 [2,0,0,0,0,0|0,0,2]=4 55 B5R0.2 CCCCCBr CUR-0020920 [2,0,0,0,0,0|2,0,0]=4 56 B5R0.2 CCCCCI CUR-0007389 [2,0,0,0,0,0|2,0,0]=4 57 B5R0.2 CCCCCN CUR-0101510 [2,0,0,0,0,0|2,0,0]=4 58 B5R0.2 CCCCCO CUR-0018736 [2,0,0,0,0,0|2,0,0]=4 59 B5R0.2 CCCCNC CUR-0101509 [2,0,0,0,0,0|2,0,0]=4 60 B5R0.2 CCNCCCl CUR-0137711 [2,0,0,0,0,0|2,0,0]=4 61 B5R0.2 CCNCCO CUR-0101534 [2,0,0,0,0,0|2,0,0]=4 62 B5R0.2 CCOCCBr CUR-0026041 [2,0,0,0,0,0|1,0,0]=3 63 B5R0.2 CCOCCO CUR-0010841 [2,0,0,0,0,0|1,0,0]=3 64 B5R0.2 CCO\C=C\C CUR-0101289 [2,0,0,0,0,0|0,0,2]=4 65 B5R0.2 CNCCOC CUR-0101531 [2,0,0,0,0,0|2,0,0]=4 66 B5R0.2 COCCCN CUR-0101530 [2,0,0,0,0,0|2,0,0]=4 67 B5R0.2 COCCOC CUR-0026380 [2,0,0,0,0,0|2,0,0]=4 68 B5R0.3 CC(CO)CO CUR-0101538 [2,0,0,0,0,0|2,0,0]=4 69 B5R0.3 CCC(=O)CC CUR-0101500 [2,0,0,0,0,0|1,0,1]=4 70 B5R0.3 CCC(C)CO CUR-0101523 [2,0,0,0,0,0|1,0,0]=3 71 B5R0.3 CCC(C)NN CUR-0004060 [2,0,0,0,0,0|2,0,0]=4 72 B5R0.3 CCC(CC)Br CUR-0020873 [2,0,0,0,0,0|1,0,0]=3 73 B5R0.3 CCC(CO)N CUR-0101528 [2,0,0,0,0,0|2,0,0]=4 74 B5R0.3 COC(=O)OC CUR-0101536 [2,0,0,0,0,0|1,0,1]=4 75 B5R0.3 COP(=O)OC CUR-0016444 [2,0,0,0,0,0|2,0,0]=4 76 B7R0.3 CCOCC(CN)O CUR-0096148 [1,1,0,0,0,0|2,0,0]=4 77 B7R0.5 CCCC(C)C(C)N CUR-0034233 [1,1,0,0,0,0|1,0,0]=3 78 B7R0.5 CCOC(=O)C(C)Br CUR-0103087 [1,1,0,0,0,0|1,0,1]=4 79 B7R0.1 CCCCCCCBr CUR-0012025 [1,1,0,0,0,0|2,0,0]=4 80 B7R0.1 CCCCCCCC CUR-0101732 [1,1,0,0,0,0|2,0,0]=4 81 B7R0.1 CCCCCCCI CUR-0002481 [1,1,0,0,0,0|2,0,0]=4 82 B7R0.1 CCCCCCCO CUR-0012442 [1,1,0,0,0,0|2,0,0]=4 83 B7R0.1 CCNCCNCC CUR-0019308 [1,1,0,0,0,0|2,0,0]=4 84 B7R0.4 CC(C)OCCCN CUR-0101773 [1,1,0,0,0,0|2,0,0]=4 85 B7R0.4 CC(C)OCCCO CUR-0010579 [1,1,0,0,0,0|2,0,0]=4 86 B7R0.4 CCCCOC(=O)C CUR-0026180 [1,1,0,0,0,0|1,0,1]=4 87 B9R0.5 CCO\C=C\C(=O)OCC CUR-0102229 [0,2,0,0,0,0|1,0,1]=4 88 B9R0.35 CCOC(=O)C(=O)OCC CUR-0007606 [0,2,0,0,0,0|1,0,1]=4 89 B9R0.53 CC(C)OP(=O)OC(C)C CUR-0006620 [0,2,0,0,0,0|2,0,0]=4 90 B9R0.17 CCOC(OCC)OCC CUR-0017610 [0,2,0,0,0,0|0,0,0]=2 91 B9R0.17 CCOP(OCC)OCC CUR-0020369 [0,2,0,0,0,0|1,0,0]=3 92 B7R1.1 C1CC(OC1)CBr CUR-0102737 [1,0,0,1,0,0|1,0,0]=3 93 B7R1.1 C1CC(OC1)CCl CUR-0000752 [1,0,0,1,0,0|1,0,0]=3 94 B7R1.1 C1CC(OC1)CN CUR-0022405 [1,0,0,1,0,0|1,0,0]=3 95 B7R1.1 C1CC(OC1)CO CUR-0021816 [1,0,0,1,0,0|1,0,0]=3 96 B7R1.1 C1CCC(C1)CBr CUR-0005007 [1,0,0,1,0,0|2,0,0]=4 97 B7R1.1 C1CCC(C1)CN CUR-0013562 [1,0,0,1,0,0|2,0,0]=4 98 B7R1.1 C1CCC(C1)CO CUR-0114427 [1,0,0,1,0,0|2,0,0]=4 99 B7R1.1 C1COC(O1)CBr CUR-0102803 [1,0,0,1,0,0|2,0,0]=4 100 B7R1.1 CCC1=NCCO1 CUR-0101578 [1,0,0,1,0,0|1,0,1]=4 101 B7R1.1 CNC1CCCC1 CUR-0011121 [1,0,0,1,0,0|2,0,0]=4 102 B7R1.1 COC1=NCCC1 CUR-0119549 [1,0,0,1,0,0|1,0,1]=4 103 B7R1.2 CC1CCC(=O)O1 CUR-0101591 [1,0,0,1,0,0|1,0,1]=4 104 B7R1.2 CC1COC(=O)O1 CUR-0101613 [1,0,0,1,0,0|1,0,1]=4 105 B7R1.3 C1CCC(CC1)Br CUR-0027491 [1,0,0,1,0,0|2,0,0]=4 106 B7R1.3 C1CCC(CC1)N CUR-0004167 [1,0,0,1,0,0|2,0,0]=4 107 B7R1.3 C1CCC(CC1)O CUR-0020069 [1,0,0,1,0,0|2,0,0]=4 108 B7R1.3 CC1CCCCN1 CUR-0101581 [1,0,0,1,0,0|1,0,0]=3 109 B7R1.3 CC1CCCNC1 CUR-0013551 [1,0,0,1,0,0|2,0,0]=4 110 B7R1.3 CC1CCNCC1 CUR-0000849 [1,0,0,1,0,0|2,0,0]=4 111 B7R1.3 CC1CNCCN1 CUR-0101598 [1,0,0,1,0,0|2,0,0]=4 112 B7R1.6 CCNC1CCC1 CUR-0028770 [1,0,0,1,0,0|1,0,0]=3 113 B7R1.7 CCOCC1CO1 CUR-0006249 [1,0,0,1,0,0|2,0,0]=4 114 B7R1.24 C1CCCNCC1 CUR-0020867 [1,0,0,1,0,0|2,0,0]=4 115 B7R1.24 C1CNCCOC1 CUR-0101276 [1,0,0,1,0,0|2,0,0]=4 116 B9R1.8 C1COC(OC1)CCBr CUR-0103359 [0,1,0,1,0,0|2,0,0]=4 117 B9R1.8 CCNC1CCCCC1 CUR-0101907 [0,1,0,1,0,0|2,0,0]=4 118 B9R1.8 CCOC1CCC=CO1 CUR-0101924 [0,1,0,1,0,0|0,0,1]=3 119 B9R1.8 CNCC1COCCO1 CUR-0035349 [0,1,0,1,0,0|2,0,0]=4 120 B9R1.8 COCC1CNCCO1 CUR-0004722 [0,1,0,1,0,0|2,0,0]=4 121 B9R1.12 C1CCC(C1)NCCO CUR-0026824 [0,1,0,1,0,0|2,0,0]=4 122 B9R1.12 C1CCC(C1)OCCBr CUR-0015477 [0,1,0,1,0,0|1,0,0]=3 123 B9R1.12 C1CCC(C1)OCCO CUR-0011672 [0,1,0,1,0,0|1,0,0]=3 124 B9R1.3 CC1CCCC(C1=O)C CUR-0022583 [0,1,0,1,0,0|2,0,0]=4 125 B9R1.34 CC1OC(OC(O1)C)C CUR-0022850 [0,1,0,1,0,0|0,0,0]=2 126 B9R1.175 CCOC1(CCC1)CN CUR-0122281 [0,1,0,1,0,0|1,0,0]=3 127 B9R2.68 C1CC2CNCC1O2 CUR-0006999 [0,0,0,2,0,0|2,0,0]=4