0 B6R0.6 C(CCBr)CCBr CUR-0024921 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.6 C(CCCl)CC#N CUR-0016906 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.6 C(CCCl)CCBr CUR-0005784 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.6 C(CCO)CCO CUR-0010266 [0,0,0,0,0,0|2,1,1]=4 4 B6R0.6 C(CN=[N+]=[N-])CO CUR-0005323 [0,0,0,0,0,0|3,0,0]=3 5 B6R0.6 C(N=C=O)N=C=O CUR-0101568 [0,0,0,0,0,0|2,1,1]=4 6 B6R0.6 CCCCCCBr CUR-0023541 [0,0,0,0,0,0|2,0,1]=3 7 B6R0.6 CCCCCCC CUR-0101599 [0,0,0,0,0,0|2,0,1]=3 8 B6R0.6 CCCCCCI CUR-0008970 [0,0,0,0,0,0|2,0,1]=3 9 B6R0.6 CCCCCCN CUR-0100774 [0,0,0,0,0,0|2,0,1]=3 10 B6R0.6 CCCCCCO CUR-0025713 [0,0,0,0,0,0|1,1,1]=3 11 B6R0.6 CCCCNCC CUR-0101609 [0,0,0,0,0,0|1,0,2]=3 12 B6R0.6 CCCCOC=C CUR-0002040 [0,0,0,0,0,0|2,0,1]=3 13 B6R0.6 CCCNCCC CUR-0008343 [0,0,0,0,0,0|3,0,1]=4 14 B6R0.6 CCNCCC#N CUR-0021027 [0,0,0,0,0,0|3,0,1]=4 15 B6R0.6 CCOCCCN CUR-0101632 [0,0,0,0,0,0|3,0,1]=4 16 B6R0.6 CNCCCC#C CUR-0122249 [0,0,0,0,0,0|3,0,1]=4 17 B6R0.6 CNCCCCN CUR-0156103 [0,0,0,0,0,0|3,0,1]=4 18 B6R0.6 COCCN=C=O CUR-0101602 [0,0,0,0,0,0|1,1,0]=2 19 B5R0.2 C#CCCCO CUR-0101486 [1,0,0,0,0,0|2,0,1]=4 20 B5R0.2 C#CCN=C=O CUR-0021951 [1,0,0,0,0,0|0,1,2]=4 21 B5R0.2 C(CC#N)CCl CUR-0000109 [1,0,0,0,0,0|2,0,1]=4 22 B5R0.2 C(CC#N)CO CUR-0020823 [1,0,0,0,0,0|2,0,1]=4 23 B5R0.2 C(CCBr)CBr CUR-0026189 [1,0,0,0,0,0|2,0,1]=4 24 B5R0.2 C(CCBr)CCl CUR-0000065 [1,0,0,0,0,0|2,0,1]=4 25 B5R0.2 C(CCCl)CO CUR-0025105 [1,0,0,0,0,0|1,1,1]=4 26 B5R0.2 C(CCN)CN CUR-0016745 [1,0,0,0,0,0|2,0,1]=4 27 B5R0.2 C(CCO)CO CUR-0024794 [1,0,0,0,0,0|1,1,1]=4 28 B5R0.2 C(CCS)CN CUR-0119579 [1,0,0,0,0,0|1,0,2]=4 29 B5R0.2 C(CCl)N=C=O CUR-0029062 [1,0,0,0,0,0|1,1,0]=3 30 B5R0.2 C=CCCCN CUR-0089890 [1,0,0,0,0,0|2,0,1]=4 31 B5R0.2 C=CCN=C=S CUR-0101580 [1,0,0,0,0,0|0,0,2]=3 32 B5R0.2 CCCCC#N CUR-0002776 [1,0,0,0,0,0|1,0,1]=3 33 B5R0.2 CCCCC=O CUR-0020580 [1,0,0,0,0,0|0,1,1]=3 34 B5R0.2 CCCCCBr CUR-0020920 [1,0,0,0,0,0|1,0,1]=3 35 B5R0.2 CCCCCI CUR-0007389 [1,0,0,0,0,0|1,0,1]=3 36 B5R0.2 CCCCCN CUR-0101510 [1,0,0,0,0,0|1,0,1]=3 37 B5R0.2 CCCCCO CUR-0018736 [1,0,0,0,0,0|0,1,1]=3 38 B5R0.2 CCCCNC CUR-0101509 [1,0,0,0,0,0|0,0,2]=3 39 B5R0.2 CCCN=C=O CUR-0101493 [1,0,0,0,0,0|0,1,0]=2 40 B5R0.2 CCNCCCl CUR-0137711 [1,0,0,0,0,0|2,0,1]=4 41 B5R0.2 CCNCCO CUR-0101534 [1,0,0,0,0,0|1,1,1]=4 42 B5R0.2 CCOCCBr CUR-0026041 [1,0,0,0,0,0|2,0,1]=4 43 B5R0.2 CCOCCO CUR-0010841 [1,0,0,0,0,0|1,1,1]=4 44 B5R0.2 CNCCC#C CUR-0041404 [1,0,0,0,0,0|2,0,1]=4 45 B5R0.2 CNCCC#N CUR-0024199 [1,0,0,0,0,0|2,0,1]=4 46 B5R0.2 CNCCCN CUR-0101524 [1,0,0,0,0,0|1,0,2]=4 47 B5R0.2 CNCCNC CUR-0001888 [1,0,0,0,0,0|1,0,2]=4 48 B5R0.2 CNCCOC CUR-0101531 [1,0,0,0,0,0|1,0,2]=4 49 B5R0.2 COCCC#N CUR-0101494 [1,0,0,0,0,0|2,0,1]=4 50 B5R0.2 COCCCN CUR-0101530 [1,0,0,0,0,0|2,0,1]=4 51 B5R0.2 COCCNN CUR-0018740 [1,0,0,0,0,0|2,0,1]=4 52 B5R0.2 COCCOC CUR-0026380 [1,0,0,0,0,0|2,0,1]=4 53 B7R0.1 C(CCCBr)CCBr CUR-0100760 [0,1,0,0,0,0|2,0,1]=4 54 B7R0.1 C(CCCCl)CCO CUR-0102083 [0,1,0,0,0,0|1,1,1]=4 55 B7R0.1 C(CCCN)CCN CUR-0022953 [0,1,0,0,0,0|2,0,1]=4 56 B7R0.1 C(CCCO)CCN CUR-0101772 [0,1,0,0,0,0|1,1,1]=4 57 B7R0.1 CCCCCCC=O CUR-0101726 [0,1,0,0,0,0|1,1,1]=4 58 B7R0.1 CCCCCCCBr CUR-0012025 [0,1,0,0,0,0|2,0,1]=4 59 B7R0.1 CCCCCCCC CUR-0101732 [0,1,0,0,0,0|2,0,1]=4 60 B7R0.1 CCCCCCCI CUR-0002481 [0,1,0,0,0,0|2,0,1]=4 61 B7R0.1 CCCCCCCO CUR-0012442 [0,1,0,0,0,0|1,1,1]=4 62 B7R0.1 CCNCCNCC CUR-0019308 [0,1,0,0,0,0|1,0,2]=4 63 B7R0.4 CCCCNC(=O)N CUR-0101762 [0,1,0,0,0,0|0,1,2]=4 64 B7R0.4 CCCCOC(=O)C CUR-0026180 [0,1,0,0,0,0|1,1,1]=4 65 B7R0.4 CN(C)CCN=C=O CUR-0000295 [0,1,0,0,0,0|1,1,0]=3 66 B7R0.7 CC(COC)N=C=O CUR-0098998 [0,1,0,0,0,0|1,1,0]=3 67 B7R1.1 C1CCC(C1)C#N CUR-0101264 [0,0,0,1,0,0|2,0,1]=4 68 B7R1.1 C1CCC(C1)CBr CUR-0005007 [0,0,0,1,0,0|2,0,1]=4 69 B7R1.1 C1CCC(C1)CN CUR-0013562 [0,0,0,1,0,0|2,0,1]=4 70 B7R1.1 C1CCC(C1)CO CUR-0114427 [0,0,0,1,0,0|1,1,1]=4 71 B7R1.1 C1CCC(C1)NN CUR-0100745 [0,0,0,1,0,0|3,0,0]=4 72 B7R1.1 C1CCN(C1)C=O CUR-0050422 [0,0,0,1,0,0|0,1,2]=4 73 B7R1.1 CNC1CCCC1 CUR-0011121 [0,0,0,1,0,0|3,0,0]=4 74 B7R1.3 C1CCC(=O)CC1 CUR-0013382 [0,0,0,1,0,0|1,1,1]=4 75 B7R1.3 C1CCC(CC1)Br CUR-0027491 [0,0,0,1,0,0|2,0,1]=4 76 B7R1.3 C1CCC(CC1)N CUR-0004167 [0,0,0,1,0,0|2,0,1]=4 77 B7R1.3 C1CCC(CC1)O CUR-0020069 [0,0,0,1,0,0|1,1,1]=4 78 B7R1.3 C1CCNC(=O)C1 CUR-0002331 [0,0,0,1,0,0|0,1,2]=4 79 B7R1.3 C1CNC(=S)NC1 CUR-0101763 [0,0,0,1,0,0|1,0,2]=4 80 B7R1.3 CC1CCCCN1 CUR-0101581 [0,0,0,1,0,0|1,0,2]=4 81 B7R1.3 CC1CCCNC1 CUR-0013551 [0,0,0,1,0,0|3,0,0]=4 82 B7R1.3 CC1CCNCC1 CUR-0000849 [0,0,0,1,0,0|1,0,2]=4 83 B7R1.5 CC1CC1N=C=O CUR-0006486 [0,0,0,1,0,0|0,1,0]=2 84 B7R1.6 C1CC(C1)N=C=O CUR-0004501 [0,0,0,1,0,0|0,1,0]=2 85 B7R1.6 CCNC1CCC1 CUR-0028770 [0,0,0,1,0,0|1,0,2]=4 86 B7R1.7 C1CC1CN=C=O CUR-0022437 [0,0,0,1,0,0|0,1,0]=2 87 B7R1.24 C1CCCNCC1 CUR-0020867 [0,0,0,1,0,0|1,0,2]=4 88 B4R0.2 C(CBr)CBr CUR-0016721 [2,0,0,0,0,0|2,0,0]=4 89 B4R0.2 C(CCl)CBr CUR-0004377 [2,0,0,0,0,0|2,0,0]=4 90 B4R0.2 C(CN)CBr CUR-0103678 [2,0,0,0,0,0|1,0,1]=4 91 B4R0.2 C(CN)CCl CUR-0101958 [2,0,0,0,0,0|1,0,1]=4 92 B4R0.2 C(CN)CN CUR-0101462 [2,0,0,0,0,0|1,0,1]=4 93 B4R0.2 C(CN)CO CUR-0005687 [2,0,0,0,0,0|1,0,1]=4 94 B4R0.2 C(CO)CCl CUR-0004180 [2,0,0,0,0,0|1,1,0]=4 95 B4R0.2 C(CO)CO CUR-0007262 [2,0,0,0,0,0|1,1,0]=4 96 B4R0.2 C(CS)CS CUR-0006323 [2,0,0,0,0,0|1,0,1]=4 97 B4R0.2 CCCC#N CUR-0101440 [2,0,0,0,0,0|0,0,2]=4 98 B4R0.2 CCCC=O CUR-0100896 [2,0,0,0,0,0|0,1,1]=4 99 B4R0.2 CCCCBr CUR-0023794 [2,0,0,0,0,0|1,0,0]=3 100 B4R0.2 CCCCCl CUR-0023945 [2,0,0,0,0,0|1,0,0]=3 101 B4R0.2 CCCCI CUR-0001021 [2,0,0,0,0,0|1,0,0]=3 102 B4R0.2 CCCCN CUR-0017800 [2,0,0,0,0,0|0,0,1]=3 103 B4R0.2 CCCCN CUR-0101317 [2,0,0,0,0,0|0,0,1]=3 104 B4R0.2 CCCCO CUR-0016718 [2,0,0,0,0,0|0,1,0]=3 105 B4R0.2 CCCNN CUR-0022831 [2,0,0,0,0,0|1,0,1]=4 106 B4R0.2 CCN=C=O CUR-0101447 [2,0,0,0,0,0|0,1,0]=3 107 B4R0.2 CCN=C=S CUR-0006416 [2,0,0,0,0,0|0,0,0]=2 108 B4R0.2 CCNCC CUR-0022731 [2,0,0,0,0,0|1,0,1]=4 109 B4R0.2 CCNCC CUR-0101285 [2,0,0,0,0,0|1,0,1]=4 110 B4R0.2 CNCCI CUR-0017490 [2,0,0,0,0,0|2,0,0]=4 111 B4R0.2 CNCCO CUR-0011813 [2,0,0,0,0,0|1,1,0]=4 112 B4R0.2 COCCBr CUR-0009505 [2,0,0,0,0,0|2,0,0]=4 113 B4R0.2 COCCCl CUR-0000941 [2,0,0,0,0,0|2,0,0]=4 114 B4R0.2 COCCN CUR-0012344 [2,0,0,0,0,0|1,0,1]=4 115 B4R0.2 COCCO CUR-0101466 [2,0,0,0,0,0|1,1,0]=4 116 B4R0.2 CSCCN CUR-0101544 [2,0,0,0,0,0|1,0,1]=4 117 B6R0.1 CCCC(C)C=O CUR-0101597 [1,1,0,0,0,0|0,1,1]=4 118 B6R0.4 CC(C)CCNN CUR-0019174 [1,1,0,0,0,0|1,0,1]=4 119 B6R0.4 CC(C)CCON CUR-0153393 [1,1,0,0,0,0|2,0,0]=4 120 B6R0.4 CC(C)CN=C=O CUR-0095337 [1,1,0,0,0,0|0,1,0]=3 121 B6R0.4 CC(CCC#C)O CUR-0038064 [1,1,0,0,0,0|1,0,1]=4 122 B6R0.4 CC(CCC#N)Br CUR-0049988 [1,1,0,0,0,0|1,0,1]=4 123 B6R0.4 CCCCC(=O)C CUR-0101595 [1,1,0,0,0,0|0,1,1]=4 124 B6R0.4 CCCCC(=O)Cl CUR-0101805 [1,1,0,0,0,0|0,1,1]=4 125 B6R0.4 CCCCC(=O)O CUR-0101620 [1,1,0,0,0,0|0,1,1]=4 126 B6R1.1 C1CCC=CC1 CUR-0022869 [1,0,0,1,0,0|1,0,1]=4 127 B6R1.2 C1CCC(=O)C1 CUR-0027028 [1,0,0,1,0,0|0,1,1]=4 128 B6R1.2 C1CCC(C1)Br CUR-0025546 [1,0,0,1,0,0|1,0,1]=4 129 B6R1.2 C1CCC(C1)N CUR-0006172 [1,0,0,1,0,0|1,0,1]=4 130 B6R1.2 C1CCC(C1)O CUR-0021370 [1,0,0,1,0,0|0,1,1]=4 131 B6R1.2 CN1CCCC1 CUR-0101495 [1,0,0,1,0,0|0,0,2]=4 132 B6R1.3 C1CC1CNN CUR-0028773 [1,0,0,1,0,0|1,0,1]=4 133 B6R1.3 C1CC1CON CUR-0121722 [1,0,0,1,0,0|2,0,0]=4 134 B6R1.3 C1CC1N=C=O CUR-0027996 [1,0,0,1,0,0|0,1,0]=3 135 B6R1.3 CNCC1CC1 CUR-0090189 [1,0,0,1,0,0|0,0,2]=4 136 B6R1.4 CC1CCC1N CUR-0163343 [1,0,0,1,0,0|1,0,1]=4 137 B6R1.4 CC1CCC1O CUR-0090358 [1,0,0,1,0,0|0,1,1]=4 138 B6R1.6 C1CC(C1)CBr CUR-0003993 [1,0,0,1,0,0|1,0,1]=4 139 B6R1.6 C1CC(C1)CO CUR-0022828 [1,0,0,1,0,0|0,1,1]=4 140 B6R1.6 C1CC(C1)NN CUR-0100630 [1,0,0,1,0,0|1,0,1]=4 141 B6R1.6 CNC1CCC1 CUR-0010771 [1,0,0,1,0,0|0,0,2]=4 142 B8R1.8 C1C=CCC1N=C=O CUR-0021126 [0,1,0,1,0,0|0,1,1]=4 143 B8R1.8 C1CCC(C1)N=C=O CUR-0101692 [0,1,0,1,0,0|0,1,0]=3 144 B8R1.8 C1COCC1N=C=O CUR-0026873 [0,1,0,1,0,0|0,1,0]=3 145 B8R1.8 C1CSCC1N=[N+]=[N-] CUR-0127168 [0,1,0,1,0,0|2,0,0]=4