0 B8R0.4 BrCCCCCCCBr OR1556 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.4 C=CCCCCCCC OR01832 [0,0,0,0,0,0|1,0,3]=4 2 B8R0.4 CCCCCCCCBr OR9595 [0,0,0,0,0,0|1,0,2]=3 3 B8R0.4 CCCCCCCCN OR10078 [0,0,0,0,0,0|1,0,2]=3 4 B8R0.4 CCCCCCCCO OR40039 [0,0,0,0,0,0|0,0,2]=2 5 B8R0.4 CCCCCCOCC OR51881 [0,0,0,0,0,0|2,0,2]=4 6 B8R0.4 CCCCOCCCC OR9443 [0,0,0,0,0,0|2,0,1]=3 7 B8R0.4 NCCCCCCCN OR10104 [0,0,0,0,0,0|2,0,2]=4 8 B8R0.4 OCCCCCCCO OR53104 [0,0,0,0,0,0|1,0,2]=3 9 B7R0.1 BrCCCCCCBr OR4509 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.1 C#CCCCCCC OR5513 [1,0,0,0,0,0|1,0,2]=4 11 B7R0.1 CCCCCCC=O OR6047 [1,0,0,0,0,0|0,0,3]=4 12 B7R0.1 CCCCCCCBr OR2158 [1,0,0,0,0,0|1,0,1]=3 13 B7R0.1 CCCCCCCCl OR18055 [1,0,0,0,0,0|1,0,1]=3 14 B7R0.1 CCCCCCCI OR5427 [1,0,0,0,0,0|1,0,1]=3 15 B7R0.1 CCCCCC[Mg]Cl OR320008 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.1 CCCCCOCC OR51880 [1,0,0,0,0,0|1,0,1]=3 17 B7R0.1 CCCCNCCN OR6518 [1,0,0,0,0,0|2,0,0]=3 18 B7R0.1 CCCC\C=C\C=O OR6048 [1,0,0,0,0,0|0,0,2]=3 19 B7R0.1 ICCCCCCI OR3172 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.1 NCCCCCCN OR8838 [1,0,0,0,0,0|2,0,1]=4 21 B7R0.1 NCCCCCCO OR13708 [1,0,0,0,0,0|1,0,1]=3 22 B7R0.1 OCCCCCCBr OR10365 [1,0,0,0,0,0|1,0,1]=3 23 B7R0.1 OCCCCCCCl OR6510 [1,0,0,0,0,0|1,0,1]=3 24 B7R0.1 OCCCCCCO OR322268 [1,0,0,0,0,0|1,0,1]=3 25 B9R0.2 CCCCCCCC(=O)O OR6008 [0,1,0,0,0,0|0,0,3]=4 26 B9R0.2 CCCCCCC[C@@H](C)O OR304046 [0,1,0,0,0,0|0,0,2]=3 27 B9R0.2 CCCCC\C=C\B(O)O OR10493 [0,1,0,0,0,0|1,0,2]=4 28 B9R0.18 CCCCC(=O)CCCC OR10037 [0,1,0,0,0,0|1,0,1]=3 29 B9R0.18 CCCCC(O)CCCC OR10035 [0,1,0,0,0,0|1,0,2]=4 30 B9R0.45 BrCCCCCCCCBr OR28631 [0,1,0,0,0,0|1,0,2]=4 31 B9R0.45 CCCCCCCCCBr OR7540 [0,1,0,0,0,0|1,0,2]=4 32 B9R0.45 CCCCCCCCCI OR5499 [0,1,0,0,0,0|1,0,2]=4 33 B9R0.45 CCCCCCCCCN OR10077 [0,1,0,0,0,0|1,0,2]=4 34 B9R0.45 CCCCCCCCOC OR4701 [0,1,0,0,0,0|0,0,2]=3 35 B9R0.45 CCCCCCCC[Mg]Cl OR52539 [0,1,0,0,0,0|1,0,2]=4 36 B9R0.45 CCCCCC\C=C/CO OR52469 [0,1,0,0,0,0|0,0,2]=3 37 B9R0.45 NCCCCCCCCN OR10106 [0,1,0,0,0,0|1,0,2]=4 38 B9R0.45 OCCCCCCCCO OR2431 [0,1,0,0,0,0|0,0,2]=3 39 B9R0.45 OCCNCCNCCO OR014994 [0,1,0,0,0,0|2,0,1]=4 40 B9R0.45 OCCOCCOCCO OR46604 [0,1,0,0,0,0|2,0,1]=4 41 B9R1.8 CCC[C@@H]1CCCCN1 OR321207 [0,0,0,1,0,0|1,0,2]=4 42 B9R1.8 ClCCN1CCCCC1 OR0991 [0,0,0,1,0,0|2,0,1]=4 43 B9R1.8 ClCCN1CCCCC1 OR8736 [0,0,0,1,0,0|2,0,1]=4 44 B9R1.8 N#CCC1=CCCCC1 OR7121 [0,0,0,1,0,0|1,0,1]=3 45 B9R1.8 NCCN1CCCCC1 OR0812 [0,0,0,1,0,0|2,0,1]=4 46 B9R1.8 OCCC1CCCNC1 OR321304 [0,0,0,1,0,0|1,0,2]=4 47 B9R1.8 OCCC1CCNCC1 OR8972 [0,0,0,1,0,0|1,0,2]=4 48 B9R1.8 OCCC1CCOCC1 OR14942 [0,0,0,1,0,0|1,0,2]=4 49 B9R1.8 OCCN1CCNCC1 OR18310 [0,0,0,1,0,0|2,0,1]=4 50 B9R1.12 CCCCC1=CC=CO1 OR3223 [0,0,0,1,0,0|0,0,2]=3 51 B9R1.12 OCCCC1CCCC1 OR2028 [0,0,0,1,0,0|0,0,2]=3 52 B9R1.12 OCCOC1CCCC1 OR17957 [0,0,0,1,0,0|1,0,1]=3 53 B9R1.15 CN1CCOCC1CO OR55495 [0,0,0,1,0,0|2,0,1]=4 54 B9R1.15 CN1CCOC[C@@H]1CO OR55496 [0,0,0,1,0,0|2,0,1]=4 55 B9R1.15 CN1CCOC[C@H]1CO OR55497 [0,0,0,1,0,0|2,0,1]=4 56 B9R1.15 NC[C@@H]1CCCC[C@H]1O OR307540 [0,0,0,1,0,0|1,0,2]=4 57 B9R1.50 OC1CCCCCCC1 OR7566 [0,0,0,1,0,0|0,0,2]=3 58 B9R1.83 CCCCOC[C@@H]1CO1 OR60128 [0,0,0,1,0,0|1,0,1]=3 59 B6R0.6 C#CCCCCC OR5511 [2,0,0,0,0,0|1,0,1]=4 60 B6R0.6 C#CCCCCO OR30592 [2,0,0,0,0,0|0,0,2]=4 61 B6R0.6 C=CCCCCC OR01828 [2,0,0,0,0,0|0,0,2]=4 62 B6R0.6 C=CCCCCO OR14506 [2,0,0,0,0,0|0,0,2]=4 63 B6R0.6 CCCCCC=O OR6051 [2,0,0,0,0,0|0,0,2]=4 64 B6R0.6 CCCCCCCl OR52582 [2,0,0,0,0,0|1,0,0]=3 65 B6R0.6 CCCCCCI OR2177 [2,0,0,0,0,0|1,0,0]=3 66 B6R0.6 CCCCCCN OR5310 [2,0,0,0,0,0|1,0,0]=3 67 B6R0.6 CCCCCCS OR40389 [2,0,0,0,0,0|0,1,0]=3 68 B6R0.6 CCCCCNC OR60037 [2,0,0,0,0,0|1,0,1]=4 69 B6R0.6 CCCNCCC OR19539 [2,0,0,0,0,0|1,0,1]=4 70 B6R0.6 CCC\C=C\C=O OR6052 [2,0,0,0,0,0|0,0,2]=4 71 B6R0.6 CCOCOCC OR51849 [2,0,0,0,0,0|2,0,0]=4 72 B6R0.6 C\C=C\C=C\CO OR13712 [2,0,0,0,0,0|0,0,2]=4 73 B6R0.6 ClCCCCCBr OR24918 [2,0,0,0,0,0|2,0,0]=4 74 B6R0.6 ClCCCCCI OR2936 [2,0,0,0,0,0|2,0,0]=4 75 B6R0.6 NCCCCCN OR59990 [2,0,0,0,0,0|2,0,0]=4 76 B6R0.6 NCCCCCO OR10081 [2,0,0,0,0,0|1,0,0]=3 77 B6R0.6 NCCCCCO OR51934 [2,0,0,0,0,0|1,0,0]=3 78 B6R0.6 NCCCCCO OR55441 [2,0,0,0,0,0|1,0,0]=3 79 B6R0.6 NCCSCCO OR28868 [2,0,0,0,0,0|2,0,0]=4 80 B6R0.6 OCCCCCCl OR6509 [2,0,0,0,0,0|1,0,0]=3 81 B6R0.6 OCCNCCO OR40730 [2,0,0,0,0,0|2,0,0]=4 82 B6R0.6 OCCOCCO OR59808 [2,0,0,0,0,0|2,0,0]=4 83 B8R0.1 CCOC(=O)CCCBr OR14983 [1,1,0,0,0,0|2,0,0]=4 84 B8R0.1 CC\C=C\C(=O)OCC OR16435 [1,1,0,0,0,0|1,0,1]=4 85 B8R0.6 CCCCCC(=O)CC OR6025 [1,1,0,0,0,0|0,0,1]=3 86 B8R0.6 CCCCOC(=O)CCl OR25298 [1,1,0,0,0,0|2,0,0]=4 87 B8R0.6 CCCOCC(O)CO OR60027 [1,1,0,0,0,0|1,0,1]=4 88 B8R0.7 CCCCCC[C@H](C)O OR304045 [1,1,0,0,0,0|0,0,1]=3 89 B8R0.7 CCCC\C=C\B(O)O OR10494 [1,1,0,0,0,0|1,0,0]=3 90 B10R0.71 C=CCCCCCCCCO OR6018 [0,2,0,0,0,0|0,0,2]=4 91 B10R0.71 CCCCC\C=C\CCC=O OR6017 [0,2,0,0,0,0|0,0,1]=3 92 B10R0.71 OCCCCCCCCCBr OR3134 [0,2,0,0,0,0|0,0,2]=4 93 B10R0.71 OCCCCCCCCCO OR16970 [0,2,0,0,0,0|0,0,2]=4 94 B8R1.2 C#CC1=CCCCC1 OR13588 [1,0,0,1,0,0|0,0,2]=4 95 B8R1.2 CCC1CCCNC1 OR53185 [1,0,0,1,0,0|1,0,1]=4 96 B8R1.2 CCC1CNCCN1 OR16023 [1,0,0,1,0,0|2,0,0]=4 97 B8R1.2 CCC1COCCN1 OR308179 [1,0,0,1,0,0|2,0,0]=4 98 B8R1.2 CC[C@@H]1CCCCN1 OR321328 [1,0,0,1,0,0|1,0,1]=4 99 B8R1.2 CC[C@H]1CCCCN1 OR321204 [1,0,0,1,0,0|1,0,1]=4 100 B8R1.2 CC[C@H]1COCCN1 OR61132 [1,0,0,1,0,0|2,0,0]=4 101 B8R1.2 ClCC1CCCCO1 OR2054 [1,0,0,1,0,0|1,0,1]=4 102 B8R1.2 NCC1CCCCC1 OR5167 [1,0,0,1,0,0|1,0,1]=4 103 B8R1.2 NCC1CCCCN1 OR13713 [1,0,0,1,0,0|2,0,0]=4 104 B8R1.2 NCC1CCCCO1 OR110077 [1,0,0,1,0,0|1,0,1]=4 105 B8R1.2 NCC1CCCCO1 OR60205 [1,0,0,1,0,0|1,0,1]=4 106 B8R1.2 NCC1CNCCO1 OR103657 [1,0,0,1,0,0|2,0,0]=4 107 B8R1.2 OCC1CCC=CO1 OR6613 [1,0,0,1,0,0|1,0,1]=4 108 B8R1.2 OCC1CCCCN1 OR16434 [1,0,0,1,0,0|1,0,0]=3 109 B8R1.2 OCC1CCCCO1 OR5628 [1,0,0,1,0,0|1,0,0]=3 110 B8R1.2 OCC1CCCOC1 OR70047 [1,0,0,1,0,0|1,0,1]=4 111 B8R1.2 OCC1CCNCC1 OR3906 [1,0,0,1,0,0|1,0,1]=4 112 B8R1.2 OCC1CCOCC1 OR10585 [1,0,0,1,0,0|1,0,1]=4 113 B8R1.2 OCC1CCSCC1 OR30548 [1,0,0,1,0,0|1,0,1]=4 114 B8R1.2 OCC1COCCN1 OR926444 [1,0,0,1,0,0|2,0,0]=4 115 B8R1.2 OC[C@@H]1COCCN1 OR308127 [1,0,0,1,0,0|2,0,0]=4 116 B8R1.2 OC[C@H]1COCCN1 OR308126 [1,0,0,1,0,0|2,0,0]=4 117 B8R1.5 CC1CCCCC1O OR10028 [1,0,0,1,0,0|0,0,1]=3 118 B8R1.5 NC1CCCCC1O OR21260 [1,0,0,1,0,0|1,0,1]=4 119 B8R1.5 N[C@@H]1CCCC[C@@H]1O OR307602 [1,0,0,1,0,0|1,0,1]=4 120 B8R1.5 N[C@@H]1CCCC[C@H]1O OR307600 [1,0,0,1,0,0|1,0,1]=4 121 B8R1.5 N[C@@H]1CCCC[C@H]1O OR307601 [1,0,0,1,0,0|1,0,1]=4 122 B8R1.5 N[C@H]1CCCC[C@@H]1O OR70141 [1,0,0,1,0,0|1,0,1]=4 123 B8R1.5 N[C@H]1CCCC[C@H]1O OR350531 [1,0,0,1,0,0|1,0,1]=4 124 B8R1.5 O[C@@H]1CCCC[C@H]1O OR8451T [1,0,0,1,0,0|1,0,1]=4 125 B8R1.5 O[C@H]1CCCC[C@H]1O OR51977 [1,0,0,1,0,0|1,0,1]=4 126 B8R1.8 BrCCC1OCCO1 OR52533 [1,0,0,1,0,0|2,0,0]=4 127 B8R1.8 CCCC1=CC=CO1 OR3221 [1,0,0,1,0,0|0,0,2]=4 128 B8R1.8 ClCCN1CCCC1 OR0992 [1,0,0,1,0,0|2,0,0]=4 129 B8R1.8 NCCN1CCCC1 OR19557 [1,0,0,1,0,0|2,0,0]=4 130 B8R1.8 OCCC1CCNC1 OR315571 [1,0,0,1,0,0|1,0,1]=4 131 B8R1.11 CN1CCC[C@H]1CO OR14515 [1,0,0,1,0,0|1,0,1]=4 132 B8R1.22 OC1CCCCCC1 OR10091 [1,0,0,1,0,0|0,0,1]=3 133 B8R1.49 C1=CCCC=CCC1 OR46568 [1,0,0,1,0,0|0,0,2]=4 134 B8R1.49 C1=CCCC=CCC1 OR55009 [1,0,0,1,0,0|0,0,2]=4 135 B10R1.10 CCCC1CCCC(=O)C1 OR200161 [0,1,0,1,0,0|1,0,1]=4 136 B10R1.21 BrCCCCC1OCCO1 OR52318 [0,1,0,1,0,0|1,0,1]=4 137 B10R1.21 CCCCCC1=CC=CO1 OR3220 [0,1,0,1,0,0|0,0,2]=4 138 B10R1.85 OCCN1CCCNCC1 OR0518 [0,1,0,1,0,0|1,0,1]=4 139 B10R1.17 OCCCN1CCCCC1 OR24928 [0,1,0,1,0,0|0,0,2]=4 140 B10R1.20 OC[C@H]1CCCC[C@@H]1CO OR3201 [0,1,0,1,0,0|0,0,2]=4