0 B10R1.10 CCCC1CCCC(=O)O1 HR123755 [0,0,0,0,0,0|2,1,1]=4 1 B10R1.10 CCCC1CCOC(C)S1 HR107120 [0,0,0,0,0,0|0,0,0]=0 2 B10R1.10 CCCC1CCOC(C)S1 HR131955 [0,0,0,0,0,0|0,0,0]=0 3 B9R1.8 BrCCC1CCCCC1 HR103562 [1,0,0,0,0,0|3,0,0]=4 4 B9R1.8 BrCCN1CCOCC1 HR106063 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.8 BrCCN1CCOCC1 HR115201 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.8 BrCCN1CCOCC1 HR120974 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.8 CCCC1CCCCN1 HR117183 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.8 CCCC1CCNCC1 HR111340 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.8 CCCN1CCNCC1 HR149066 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.8 CCNC1CCCCC1 HR123083 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.8 CCOC1CCCCC1 HR101065 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.8 COCC1CCCCN1 HR112101 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.8 COCC1CCCCN1 HR119913 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.8 COCC1CCNCC1 HR115290 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.8 COCC1CCNCC1 HR118346 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.8 ClCCN1CCOCC1 HR127182 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.8 ClCCN1CCOCC1 QUJB00803 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.8 NCCC1CCCCC1 HR104236 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.8 NCCC1CCCCC1 HR146888 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.8 NCCC1CCCCN1 HR146075 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.8 NCCC1CCCCN1 HR146076 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.8 NCCC1CCCCN1 HR146077 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.8 NCCC1CCNCC1 HR119010 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.8 NCCC1CCNCC1 HR145993 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.8 NCCC1CCOCC1 HR9727 [1,0,0,0,0,0|2,0,0]=3 26 B9R1.8 NCCN1CCOCC1 HR136158 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.8 OCCC1CCCCC1 HR113490 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.8 OCCC1CCCCN1 DIXM01403 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.8 OCCC1CCCCN1 HR138293 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.8 OCCC1CCCCN1 HR145127 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.8 OCCC1CCCCN1 HR145951 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.8 OCCC1CCNCC1 HR123742 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.8 OCCC1CCOCC1 HR107398 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.8 OCCN1CCOCC1 HR131649 [1,0,0,0,0,0|3,0,0]=4 35 B9R0.2 CC(=O)OCCCCCBr HR100599 [0,0,1,0,0,0|1,1,1]=4 36 B9R0.2 CC(=O)OCCCCCCl HR101013 [0,0,1,0,0,0|1,1,1]=4 37 B9R0.2 CC(C)CCCCCCO HR100685 [0,0,1,0,0,0|3,0,0]=4 38 B9R0.2 CCCCCCCC(C)=O HR133915 [0,0,1,0,0,0|1,1,1]=4 39 B9R0.2 CCCCCCCC(C)O HR140839 [0,0,1,0,0,0|1,1,0]=3 40 B9R0.2 CCCCCCOC(=O)Cl HR102112 [0,0,1,0,0,0|1,1,1]=4 41 B9R0.5 CCCCCC(O)CCC HR100209 [0,0,1,0,0,0|1,1,0]=3 42 B9R0.5 CCOCCC(=O)OCC HR122912 [0,0,1,0,0,0|1,1,1]=4 43 B9R0.17 CCCC(OCC)OCC HR130564 [0,0,1,0,0,0|2,1,0]=4 44 B9R0.17 CCCP(CCC)CCC HR129140 [0,0,1,0,0,0|3,0,0]=4 45 B9R0.17 CCOC(CCCl)OCC HR134128 [0,0,1,0,0,0|2,1,0]=4 46 B9R0.17 CCOC(CCN)OCC HR143095 [0,0,1,0,0,0|2,1,0]=4 47 B9R0.34 CCCC(C)CC(C)CC HR100997 [0,0,1,0,0,0|2,0,0]=3 48 B9R1.7 CCCC1CCC(=O)O1 HR132110 [0,0,0,0,1,0|1,1,1]=4 49 B9R1.33 CN1CCCC1CCCl HR118734 [0,0,0,0,1,0|3,0,0]=4 50 B9R1.33 CN1CCCC1CCCl HR122673 [0,0,0,0,1,0|3,0,0]=4 51 B9R1.33 CN1CCCC1CCN HR127358 [0,0,0,0,1,0|3,0,0]=4 52 B9R1.33 CN1CCCC1CCN HR136120 [0,0,0,0,1,0|3,0,0]=4 53 B9R1.33 CN1CCCC1CCN HR146012 [0,0,0,0,1,0|3,0,0]=4 54 B9R1.33 CN1CCCC1CCN HR146095 [0,0,0,0,1,0|3,0,0]=4 55 B9R1.33 CN1CCCC1CCO HR133704 [0,0,0,0,1,0|3,0,0]=4 56 B8R0.4 CCCCCCCCBr HR138347 [1,0,1,0,0,0|2,0,0]=4 57 B8R0.4 CCCCCCCCC HR133812 [1,0,1,0,0,0|1,0,0]=3 58 B8R0.4 CCCCCCCCCl HR138099 [1,0,1,0,0,0|2,0,0]=4 59 B8R0.4 CCCCCCCCI HR131564 [1,0,1,0,0,0|2,0,0]=4 60 B8R0.4 CCCCCCCCN HR100583 [1,0,1,0,0,0|2,0,0]=4 61 B8R0.4 CCCCCCCCN HR125500 [1,0,1,0,0,0|2,0,0]=4 62 B8R0.4 CCCCCCCCO HR101140 [1,0,1,0,0,0|1,1,0]=4 63 B8R0.4 CCCCCCCCO HR127849 [1,0,1,0,0,0|1,1,0]=4 64 B8R0.4 CCCCNCCCC HR147605 [1,0,1,0,0,0|2,0,0]=4 65 B8R0.4 CCCCSCCCC HR138897 [1,0,1,0,0,0|1,0,0]=3 66 B8R0.4 CCCC[SnH4+2]CCCC HR126830 [1,0,1,0,0,0|2,0,0]=4 67 B8R0.4 CCCC[SnH4+2]CCCC HR135636 [1,0,1,0,0,0|2,0,0]=4 68 B8R0.4 CCOCCCOCC HR107801 [1,0,1,0,0,0|1,0,0]=3 69 B8R0.4 CCOCCOCCBr HR105165 [1,0,1,0,0,0|2,0,0]=4 70 B8R0.4 CCOCCOCCO HR129783 [1,0,1,0,0,0|2,0,0]=4 71 B8R0.7 CC(C)CCCCCO HR101450 [1,0,1,0,0,0|2,0,0]=4 72 B8R0.7 CC(C)CCCCCO HR144906 [1,0,1,0,0,0|2,0,0]=4 73 B8R0.7 CCCCCCC(C)=O HR138624 [1,0,1,0,0,0|0,1,1]=4 74 B8R0.7 CCCCCCC(C)Br HR126862 [1,0,1,0,0,0|1,0,0]=3 75 B8R0.7 CCCCCCC(C)N HR132596 [1,0,1,0,0,0|1,0,0]=3 76 B8R0.7 CCCCCCC(C)N HR139394 [1,0,1,0,0,0|1,0,0]=3 77 B8R0.7 CCCCCCC(C)O HR125954 [1,0,1,0,0,0|0,1,0]=3 78 B8R0.7 CCCCCCC(C)O HR128561 [1,0,1,0,0,0|0,1,0]=3 79 B8R0.7 CCCCCCC(C)O HR132915 [1,0,1,0,0,0|0,1,0]=3 80 B8R0.7 CCCCCCC(C)O HR133230 [1,0,1,0,0,0|0,1,0]=3 81 B8R0.7 CCCCCCC(C)S HR114461 [1,0,1,0,0,0|0,0,0]=2 82 B8R0.7 CCCCOCC(C)O HR132803 [1,0,1,0,0,0|1,1,0]=4 83 B8R0.1 CCCCC(Br)CCC HR120549 [1,0,1,0,0,0|1,0,0]=3 84 B8R0.6 CCC(C)CCCCO HR119961 [1,0,1,0,0,0|2,0,0]=4 85 B8R0.6 CCCCCC(O)CC HR112896 [1,0,1,0,0,0|1,1,0]=4 86 B8R0.6 CCCCCC(O)CC HR113840 [1,0,1,0,0,0|1,1,0]=4 87 B8R0.22 CCCC(CC=O)SC HR125808 [1,0,1,0,0,0|0,0,2]=4 88 B8R0.22 CCCC(CCO)SC HR134221 [1,0,1,0,0,0|0,0,0]=2 89 B8R0.22 CCOC(CO)OCC HR144791 [1,0,1,0,0,0|1,1,0]=4 90 B8R1.2 BrCC1CCOCC1 HR129098 [2,0,0,0,0,0|2,0,0]=4 91 B8R1.2 CCC1CCCCN1 HR101681 [2,0,0,0,0,0|2,0,0]=4 92 B8R1.2 CCC1CCCCN1 HR145962 [2,0,0,0,0,0|2,0,0]=4 93 B8R1.2 CCC1CCCCN1 HR145963 [2,0,0,0,0,0|2,0,0]=4 94 B8R1.2 CCC1CCNCC1 HR101692 [2,0,0,0,0,0|2,0,0]=4 95 B8R1.2 CNC1CCOCC1 HR30275 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.2 ICC1CCOCC1 HR116556 [2,0,0,0,0,0|2,0,0]=4 97 B8R1.2 NCC1CCOCC1 HR133329 [2,0,0,0,0,0|2,0,0]=4 98 B8R1.2 OCC1CCOCC1 HR131711 [2,0,0,0,0,0|2,0,0]=4 99 B8R1.2 OCC1CCOCO1 HR137723 [2,0,0,0,0,0|1,1,0]=4 100 B8R1.4 CC1CC(O)CCO1 HR120725 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.4 CC1CC(O)CCO1 HR121039 [2,0,0,0,0,0|2,0,0]=4 102 B8R1.4 CC1CCCC(C)C1 HR101015 [2,0,0,0,0,0|2,0,0]=4 103 B8R1.4 CC1CCCC(C)N1 HR120277 [2,0,0,0,0,0|2,0,0]=4 104 B8R1.4 CC1CCCC(C)N1 HR140810 [2,0,0,0,0,0|2,0,0]=4 105 B8R1.4 CC1CCNC(C)C1 HR147221 [2,0,0,0,0,0|2,0,0]=4 106 B10R0.3 CCCC(S)CCOC(C)=O HR124543 [0,1,1,0,0,0|0,1,1]=4 107 B10R0.4 CC(C)CCCCCCCO HR105072 [0,1,1,0,0,0|2,0,0]=4 108 B10R0.4 CC(C)CCCCCCCO HR120527 [0,1,1,0,0,0|2,0,0]=4 109 B10R0.4 CCCCCCCCC(C)C HR147297 [0,1,1,0,0,0|2,0,0]=4 110 B10R0.4 CCCCCCCOC(C)=O HR112433 [0,1,1,0,0,0|0,1,1]=4 111 B10R0.4 CCCCOCCOC(C)=O HR128411 [0,1,1,0,0,0|0,1,1]=4 112 B10R0.74 CCCCCCOC(=O)CC HR129626 [0,1,1,0,0,0|0,1,1]=4 113 B10R0.74 CCOCCCOC(O)CC HR133343 [0,1,1,0,0,0|1,1,0]=4 114 B10R0.2 CCCC(O)CC(=O)OCC HR135411 [0,1,1,0,0,0|0,1,1]=4 115 B10R1.171 CC1(C)OCCC(CO)O1 HR145860 [1,1,0,0,0,0|1,1,0]=4 116 B10R1.171 CC1(C)OCCC(CO)O1 HR145861 [1,1,0,0,0,0|1,1,0]=4 117 B10R1.171 CC1(C)OCCC(CO)O1 HR145862 [1,1,0,0,0,0|1,1,0]=4 118 B10R1.1 CCCC1CCC(=O)CC1 HR138542 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.1 CCCC1CCC(O)CC1 HR125084 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.15 CCC(O)C1CCCCN1 HR149513 [1,1,0,0,0,0|2,0,0]=4 121 B10R1.17 BrCCCC1CCCCC1 HR119209 [1,1,0,0,0,0|2,0,0]=4 122 B10R1.17 CCCCC1CCNCC1 HR146751 [1,1,0,0,0,0|2,0,0]=4 123 B10R1.17 CCCCC1CCNCC1 HR150954 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.17 CCCCN1CCOCC1 HR16812 [1,1,0,0,0,0|2,0,0]=4 125 B10R1.17 COCCC1CCCCN1 HR146074 [1,1,0,0,0,0|2,0,0]=4 126 B10R1.17 COCCC1CCNCC1 HR150901 [1,1,0,0,0,0|2,0,0]=4 127 B10R1.17 ClCCCN1CCOCC1 COCQ01603 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.17 NCCCC1CCNCC1 HR106692 [1,1,0,0,0,0|2,0,0]=4 129 B10R1.17 NCCCN1CCOCC1 HR134354 [1,1,0,0,0,0|2,0,0]=4 130 B10R1.17 OCCCC1CCNCC1 HR143930 [1,1,0,0,0,0|2,0,0]=4 131 B10R1.17 OCCCN1CCOCC1 HR134709 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.54 CC(C)CC1OCC(C)O1 HR109094 [0,1,0,0,1,0|1,1,0]=4 133 B10R1.95 CC1(C)OCC(CCO)O1 HR117759 [0,1,0,0,1,0|1,1,0]=4 134 B10R1.95 CC1(C)OCC(CCO)O1 HR118076 [0,1,0,0,1,0|1,1,0]=4 135 B10R1.95 CC1(C)OCC(CCO)O1 HR137481 [0,1,0,0,1,0|1,1,0]=4 136 B12R1.101 CC(C)CC1SC(C)NC(C)S1 HR124571 [0,2,0,0,0,0|2,0,0]=4 137 B12R1.438 CC(C)CN1CCOC(CN)C1 HR102595 [0,2,0,0,0,0|2,0,0]=4 138 B10R1.21 CCCNCC1CCCO1 HR112996 [0,0,1,1,0,0|2,0,0]=4 139 B10R1.397 CCOC(OCC)C1CO1 HR130130 [0,0,1,1,0,0|1,1,0]=4 140 B10R2.408 B1C2CCCC1CCC2 HR118185 [1,0,0,1,0,0|2,0,0]=4 141 B10R2.408 C1CC2CCCC(C1)P2 HR145182 [1,0,0,1,0,0|2,0,0]=4 142 B10R2.484 C1CC2(C1)CCNCC2 HR146001 [1,0,0,1,0,0|2,0,0]=4 143 B10R2.484 C1CC2(CCO1)CNC2 HR30226 [1,0,0,1,0,0|2,0,0]=4 144 B10R2.138 C1CCC2CCC(C1)P2 HR145570 [0,0,0,1,1,0|1,0,0]=3 145 B12R3.1615 C1CC2C3CCC(C3)C2C1 HR116941 [0,0,0,2,0,0|2,0,0]=4 146 B12R3.1615 C1CC2C3CCC(C3)C2C1 HR128345 [0,0,0,2,0,0|2,0,0]=4 147 B12R3.1615 C1CC2C3CCC(C3)C2C1 HR137196 [0,0,0,2,0,0|2,0,0]=4 148 B12R3.321 C1C2CC3CC1CC(C2)C3 HR123556 [0,0,0,2,0,0|2,0,0]=4 149 B8R1.8 CCNC1CCNC1 HR121226 [1,0,0,0,1,0|2,0,0]=4 150 B8R1.8 CCNC1CCNC1 HR121540 [1,0,0,0,1,0|2,0,0]=4 151 B8R1.8 COCC1CCCN1 HR112924 [1,0,0,0,1,0|2,0,0]=4 152 B8R1.8 COCC1CCCN1 HR118289 [1,0,0,0,1,0|2,0,0]=4 153 B8R1.8 NCCC1CCCC1 HR111513 [1,0,0,0,1,0|2,0,0]=4 154 B8R1.8 NCCC1CCCC1 HR146891 [1,0,0,0,1,0|2,0,0]=4 155 B8R1.8 OCCC1CCCC1 HR111073 [1,0,0,0,1,0|2,0,0]=4 156 B8R1.8 OCCC1CCCN1 HR100505 [1,0,0,0,1,0|2,0,0]=4 157 B8R1.8 OCCC1CCNC1 HR146149 [1,0,0,0,1,0|2,0,0]=4 158 B8R1.8 OCCC1CCNC1 HR146150 [1,0,0,0,1,0|2,0,0]=4 159 B8R1.8 OCCC1CCNC1 HR146151 [1,0,0,0,1,0|2,0,0]=4