0 B10R0.6 CC(=O)CC(=O)OCCOC M109789 [0,0,0,0,0,0|2,0,1]=3 1 B10R0.6 CCCCCC(=O)OC(C)C I340872 [0,0,0,0,0,0|2,0,0]=2 2 B10R0.6 CCCCOC(=O)CC(=O)C B152871 [0,0,0,0,0,0|1,0,1]=2 3 B10R0.6 CCCCOC(=O)CC(C)C B152732 [0,0,0,0,0,0|0,0,0]=0 4 B9R0.2 CCCCCCCC(C)C M158518 [1,0,0,0,0,0|1,0,1]=3 5 B9R0.2 CCCCCCCC(C)C M406711 [1,0,0,0,0,0|1,0,1]=3 6 B9R0.2 CCCCCCCC(C)O N159697 [1,0,0,0,0,0|2,0,1]=4 7 B9R0.2 CCCCCCCC(C)O N298586 [1,0,0,0,0,0|2,0,1]=4 8 B9R0.4 CCCOC(=O)CC(=O)C P160059 [1,0,0,0,0,0|1,0,1]=3 9 B9R0.4 CCCOC(=O)CC(C)C D303979 [1,0,0,0,0,0|0,0,0]=1 10 B9R0.5 CCCC=CC(=O)OCC E117526 [1,0,0,0,0,0|2,0,1]=4 11 B9R0.5 CCCCCC(=O)CCC N158991 [1,0,0,0,0,0|1,0,0]=2 12 B9R0.5 CCCCCC(=O)OCC E103497 [1,0,0,0,0,0|2,0,0]=3 13 B9R0.5 CCCCCC(=O)OCC E103498 [1,0,0,0,0,0|2,0,0]=3 14 B9R0.5 CCCCCC(=O)OCC E103499 [1,0,0,0,0,0|2,0,0]=3 15 B9R0.5 CCCCCC(C)CCC M158520 [1,0,0,0,0,0|2,0,1]=4 16 B9R0.5 CCCCOC(=O)C=CC B152883 [1,0,0,0,0,0|0,0,2]=3 17 B9R0.5 CCCCOC(=O)C=CC B293404 [1,0,0,0,0,0|0,0,2]=3 18 B9R0.5 CCCCOC(=O)CC#N B133488 [1,0,0,0,0,0|1,0,1]=3 19 B9R0.5 CCCCOC(=O)CCC B103463 [1,0,0,0,0,0|0,0,0]=1 20 B9R0.5 CCCCOC(=O)CCC B103464 [1,0,0,0,0,0|0,0,0]=1 21 B9R0.5 CCCCOC(=O)CCS B340486 [1,0,0,0,0,0|1,0,0]=2 22 B9R0.5 CCOC(=O)CCCCBr E156150 [1,0,0,0,0,0|3,0,0]=4 23 B9R0.5 CCOC(=O)CCCCN E183506 [1,0,0,0,0,0|3,0,0]=4 24 B9R0.5 CCOCCC(=O)OCC E108066 [1,0,0,0,0,0|3,0,0]=4 25 B11R0.2 CCCCCOC(=O)CC(=O)C A151226 [0,1,0,0,0,0|1,0,1]=3 26 B11R0.6 CC(C)CCOC(=O)CC(=O)C I157526 [0,1,0,0,0,0|1,0,1]=3 27 B11R0.6 CC(C)CCOC(=O)CC(C)C I102633 [0,1,0,0,0,0|0,0,0]=1 28 B11R0.107 CCC(C)COC(=O)CC(C)C M404751 [0,1,0,0,0,0|0,0,0]=1 29 B11R0.165 CC(C)(C)OC(=O)CCCCBr T590574 [0,1,0,0,0,0|3,0,0]=4 30 B11R0.165 CC(C)(C)OC(=O)CCCCI T589494 [0,1,0,0,0,0|3,0,0]=4 31 B11R0.165 CC(C)(C)OC(=O)NCCCBr I136740 [0,1,0,0,0,0|3,0,0]=4 32 B11R0.165 CC(C)(C)OC(=O)NCCCCl N302262 [0,1,0,0,0,0|3,0,0]=4 33 B11R0.165 CC(C)(C)OC(=O)NCCCN B119879 [0,1,0,0,0,0|3,0,0]=4 34 B11R0.165 CC(C)(C)OC(=O)NCCCN B131606 [0,1,0,0,0,0|3,0,0]=4 35 B11R0.165 CC(C)(C)OC(=O)NCCCO T162674 [0,1,0,0,0,0|3,0,0]=4 36 B11R0.165 CC(C)(C)OC(=O)NCCNC N159015 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.34 CCCC1CC(=CC(=O)C1)C C347469 [0,0,0,1,0,0|1,0,2]=4 38 B9R0.47 CC(=C)C(=O)OCCOC E102359 [0,0,0,0,1,0|1,0,2]=4 39 B9R0.47 CC(=C)C(=O)OCCOC P109711 [0,0,0,0,1,0|1,0,2]=4 40 B9R0.47 CC(=C)C(=O)OCCOC P432527 [0,0,0,0,1,0|1,0,2]=4 41 B9R0.47 CC(=C)C(=O)OCCOC P432529 [0,0,0,0,1,0|1,0,2]=4 42 B9R0.47 CC(=C)C(=O)OCCOC P432531 [0,0,0,0,1,0|1,0,2]=4 43 B9R0.47 CC(=C)C(=O)OCCSC M468079 [0,0,0,0,1,0|1,0,2]=4 44 B9R0.47 CCCCCC(=O)C(=O)C O589566 [0,0,0,0,1,0|2,0,1]=4 45 B9R0.47 CCCCOC(=O)C(=C)C B110902 [0,0,0,0,1,0|0,0,2]=3 46 B9R0.47 CCCCOC(=O)C(=C)C B110903 [0,0,0,0,1,0|0,0,2]=3 47 B9R0.47 CCCCOC(=O)C(=C)C B110904 [0,0,0,0,1,0|0,0,2]=3 48 B9R0.47 CCCCOC(=O)C(C)C B152857 [0,0,0,0,1,0|0,0,0]=1 49 B9R0.47 CCCCOC(=O)C(C)O B111190 [0,0,0,0,1,0|1,0,0]=2 50 B9R0.47 CCCCOC(=O)C(C)O B303494 [0,0,0,0,1,0|1,0,0]=2 51 B11R0.46 CCCCCC(=O)OCC(C)C I110869 [0,0,0,0,0,1|1,0,0]=2 52 B11R0.46 CCCCOC(=O)CCC(=O)C B119906 [0,0,0,0,0,1|1,0,1]=3 53 B8R0.4 CCCCC=CCCO C153378 [2,0,0,0,0,0|2,0,0]=4 54 B8R0.4 CCCCCCCCC N103391 [2,0,0,0,0,0|1,0,1]=4 55 B8R0.4 CCCCCCCCC N103392 [2,0,0,0,0,0|1,0,1]=4 56 B8R0.4 CCCCCCCCC N103393 [2,0,0,0,0,0|1,0,1]=4 57 B8R0.4 CCCCCCCCC N119711 [2,0,0,0,0,0|1,0,1]=4 58 B8R0.4 CCCCNCCCC D111219 [2,0,0,0,0,0|1,0,1]=4 59 B8R0.4 CCCCNCCCC D189175 [2,0,0,0,0,0|1,0,1]=4 60 B8R0.4 CCCCNCCCC D345139 [2,0,0,0,0,0|1,0,1]=4 61 B8R0.4 CCCCNCCCC D404365 [2,0,0,0,0,0|1,0,1]=4 62 B8R0.4 CCCCNCCCC D404367 [2,0,0,0,0,0|1,0,1]=4 63 B8R0.4 CCCCNCCCC D431482 [2,0,0,0,0,0|1,0,1]=4 64 B8R0.4 CCCCNCCCC D494160 [2,0,0,0,0,0|1,0,1]=4 65 B8R0.4 CCCCOCCCC B110451 [2,0,0,0,0,0|0,0,1]=3 66 B8R0.4 CCCCOCCCC B110452 [2,0,0,0,0,0|0,0,1]=3 67 B8R0.4 CCCCOCCCC B110453 [2,0,0,0,0,0|0,0,1]=3 68 B8R0.4 CCCCOCCCC B119693 [2,0,0,0,0,0|0,0,1]=3 69 B8R0.4 CCCCOCCCC B194104 [2,0,0,0,0,0|0,0,1]=3 70 B8R0.4 CCCCOCCCN B152034 [2,0,0,0,0,0|1,0,1]=4 71 B8R0.4 CCCCSCCCC B136661 [2,0,0,0,0,0|0,1,1]=4 72 B8R0.7 CCCCCCC(C)Br B152446 [2,0,0,0,0,0|1,0,1]=4 73 B8R0.7 CCCCCCC(C)C M158524 [2,0,0,0,0,0|0,0,1]=3 74 B8R0.7 CCCCCCC(C)N A151716 [2,0,0,0,0,0|1,0,1]=4 75 B8R0.7 CCCCCCC(C)N I169738 [2,0,0,0,0,0|1,0,1]=4 76 B8R0.7 CCCCCCC(C)O O111525 [2,0,0,0,0,0|1,0,1]=4 77 B8R0.7 CCCCCCC(C)O O111526 [2,0,0,0,0,0|1,0,1]=4 78 B8R0.7 CCCCCCC(C)O O111527 [2,0,0,0,0,0|1,0,1]=4 79 B8R0.7 CCCCCCC(C)O O111528 [2,0,0,0,0,0|1,0,1]=4 80 B8R0.7 CCCCCCC(C)O R160889 [2,0,0,0,0,0|1,0,1]=4 81 B8R0.7 CCCCCCC(C)O S161171 [2,0,0,0,0,0|1,0,1]=4 82 B8R0.7 CCCCCCN(C)C N303722 [2,0,0,0,0,0|1,0,1]=4 83 B8R0.7 CCCCOCC(C)O B151801 [2,0,0,0,0,0|1,0,0]=3 84 B8R0.1 CCCC(=O)OCCC P100043 [2,0,0,0,0,0|0,0,0]=2 85 B8R0.1 CCCC(=O)OCCC P100044 [2,0,0,0,0,0|0,0,0]=2 86 B8R0.1 CCCCC(=O)C=CC O160046 [2,0,0,0,0,0|0,0,2]=4 87 B8R0.1 CCCCC(=O)CCC O160045 [2,0,0,0,0,0|0,0,0]=2 88 B8R0.1 CCCCC(=O)OCC E105293 [2,0,0,0,0,0|1,0,0]=3 89 B8R0.1 CCCCC(=O)OCC E105294 [2,0,0,0,0,0|1,0,0]=3 90 B8R0.1 CCCCC(=O)OCC E118465 [2,0,0,0,0,0|1,0,0]=3 91 B8R0.1 CCCCC(CCC)O O159906 [2,0,0,0,0,0|0,0,2]=4 92 B8R0.1 CCCOC(=O)CC#N P160480 [2,0,0,0,0,0|1,0,1]=4 93 B8R0.1 CCOC(=O)CCCBr E106908 [2,0,0,0,0,0|2,0,0]=4 94 B8R0.1 CCOC(=O)CCCBr E639064 [2,0,0,0,0,0|2,0,0]=4 95 B8R0.1 CCOC(=O)CCCCl E135072 [2,0,0,0,0,0|2,0,0]=4 96 B8R0.1 CCOC(=O)CCCCl E493598 [2,0,0,0,0,0|2,0,0]=4 97 B8R0.1 CCOC(=O)CCCN E122453 [2,0,0,0,0,0|2,0,0]=4 98 B8R0.1 CCOC(=O)CCC[CH2-] E465916 [2,0,0,0,0,0|1,0,1]=4 99 B8R0.1 CCOC(=O)CCSC E107629 [2,0,0,0,0,0|2,0,0]=4 100 B8R0.1 CCOCC(=O)OCC E195171 [2,0,0,0,0,0|2,0,0]=4 101 B8R0.5 CC(C)OC(=O)CCS M119588 [2,0,0,0,0,0|2,0,0]=4 102 B8R0.5 CC(C)OC(=O)OCCl C122340 [2,0,0,0,0,0|2,0,0]=4 103 B8R0.5 CCCC(=O)CC(C)C M158863 [2,0,0,0,0,0|0,0,0]=2 104 B8R0.5 CCCC(=O)OC(C)C I157502 [2,0,0,0,0,0|1,0,0]=3 105 B8R0.5 CCCC(C)CC(C)C D155226 [2,0,0,0,0,0|1,0,1]=4 106 B8R0.5 CCCC(C)CC(C)C D414618 [2,0,0,0,0,0|1,0,1]=4 107 B8R0.5 CCOC(=O)C=C(C)C E156154 [2,0,0,0,0,0|0,0,2]=4 108 B8R0.5 CCOC(=O)CC(=O)C E103937 [2,0,0,0,0,0|1,0,1]=4 109 B8R0.5 CCOC(=O)CC(=O)C E103939 [2,0,0,0,0,0|1,0,1]=4 110 B8R0.5 CCOC(=O)CC(=O)C E474098 [2,0,0,0,0,0|1,0,1]=4 111 B8R0.5 CCOC(=O)CC(C)C E108583 [2,0,0,0,0,0|0,0,0]=2 112 B8R0.5 CCOC(=O)CC(C)C E108585 [2,0,0,0,0,0|0,0,0]=2 113 B8R0.5 CCOC(=O)CC(C)N E170814 [2,0,0,0,0,0|1,0,0]=3 114 B8R0.5 CCOC(=O)CC(C)O E101452 [2,0,0,0,0,0|1,0,0]=3 115 B8R0.5 CCOC(=O)CC(C)O E118391 [2,0,0,0,0,0|1,0,0]=3 116 B8R0.5 CCOC(=O)CC(C)O E156467 [2,0,0,0,0,0|1,0,0]=3 117 B8R0.5 CCOC(=O)CN(C)C E136550 [2,0,0,0,0,0|1,0,0]=3 118 B8R0.5 CCOC(=O)C[S+](C)C E170751 [2,0,0,0,0,0|1,0,0]=3 119 B8R0.5 CCOC(=O)OC(C)Cl C102108 [2,0,0,0,0,0|2,0,0]=4 120 B8R0.6 CCCCCC(=O)CC O106928 [2,0,0,0,0,0|1,0,0]=3 121 B8R0.6 CCCCCC(=O)CC O106929 [2,0,0,0,0,0|1,0,0]=3 122 B8R0.6 CCCCCC(=O)OC M112312 [2,0,0,0,0,0|2,0,0]=4 123 B8R0.6 CCCCCC(=O)OC M112313 [2,0,0,0,0,0|2,0,0]=4 124 B8R0.6 CCCCCC(=O)OC M112314 [2,0,0,0,0,0|2,0,0]=4 125 B8R0.6 CCCCNC(=O)CCl N193799 [2,0,0,0,0,0|2,0,0]=4 126 B8R0.6 CCCCOC(=O)C=C B100034 [2,0,0,0,0,0|0,0,2]=4 127 B8R0.6 CCCCOC(=O)C=C B100035 [2,0,0,0,0,0|0,0,2]=4 128 B8R0.6 CCCCOC(=O)C=C B100036 [2,0,0,0,0,0|0,0,2]=4 129 B8R0.6 CCCCOC(=O)C=C B100037 [2,0,0,0,0,0|0,0,2]=4 130 B8R0.6 CCCCOC(=O)CC B152863 [2,0,0,0,0,0|0,0,0]=2 131 B8R0.6 CCCCOC(=O)CCl B152888 [2,0,0,0,0,0|1,0,0]=3 132 B8R0.6 CCCCOC(=O)CO B134012 [2,0,0,0,0,0|1,0,0]=3 133 B8R0.6 CCCCOC(=O)CO B493056 [2,0,0,0,0,0|1,0,0]=3 134 B8R0.6 CCCCOC(=O)CS B152740 [2,0,0,0,0,0|1,0,0]=3 135 B10R0.3 CCCC(=O)OCCC(C)C I108580 [1,1,0,0,0,0|0,0,2]=4 136 B10R0.3 CCCC(=O)OCCC(C)C I108581 [1,1,0,0,0,0|0,0,2]=4 137 B10R0.4 CC(C)CCCCCCCO I298943 [1,1,0,0,0,0|1,0,1]=4 138 B10R0.4 CCCCCCCCC(C)C M304432 [1,1,0,0,0,0|1,0,1]=4 139 B10R0.78 CCCCC(=O)OCC(C)C I302149 [1,1,0,0,0,0|2,0,0]=4 140 B10R0.97 CC(C)CCNCCC(C)C D154175 [1,1,0,0,0,0|1,0,1]=4 141 B10R0.97 CC(C)CCOCCC(C)C I100402 [1,1,0,0,0,0|0,0,1]=3 142 B10R0.18 CCCCC(=O)CC(=O)OC M158508 [1,1,0,0,0,0|1,0,1]=4 143 B10R0.28 CC(C)(C)OC(=O)CCCBr T179400 [1,1,0,0,0,0|2,0,0]=4 144 B10R0.28 CC(C)(C)OC(=O)CCCBr T189674 [1,1,0,0,0,0|2,0,0]=4 145 B10R0.28 CC(C)(C)OC(=O)CCCN H194085 [1,1,0,0,0,0|2,0,0]=4 146 B10R0.44 CC(C)CC(=O)CC(=O)OC M588645 [1,1,0,0,0,0|1,0,1]=4 147 B10R0.96 CC(C)CC(=O)OCC(C)C I157524 [1,1,0,0,0,0|0,0,0]=2 148 B10R0.96 CC(C)COC(=O)CC(=O)C I107308 [1,1,0,0,0,0|1,0,1]=4 149 B10R0.1 CCCCCCC(=O)CCC D154230 [1,1,0,0,0,0|1,0,0]=3 150 B10R0.1 CCCCCCC(=O)OCC E100047 [1,1,0,0,0,0|2,0,0]=4 151 B10R0.1 CCCCCCC(=O)OCC E305454 [1,1,0,0,0,0|2,0,0]=4 152 B10R0.1 CCCCCOC(=O)CCC A111359 [1,1,0,0,0,0|0,0,0]=2 153 B10R0.1 CCOC(=O)CCCCCBr E156144 [1,1,0,0,0,0|2,0,0]=4 154 B10R0.1 CCOC(=O)CCCCCN E193000 [1,1,0,0,0,0|2,0,0]=4 155 B10R0.1 CCOC(=O)CCCCCO E156101 [1,1,0,0,0,0|2,0,0]=4 156 B10R0.1 CCOCCCC(=O)OCC E341712 [1,1,0,0,0,0|2,0,0]=4 157 B10R0.1 CCOCCOC(=O)CC#N E136237 [1,1,0,0,0,0|1,0,1]=4 158 B10R0.2 CCCC(=O)OC(=O)CCC B108974 [1,1,0,0,0,0|0,0,1]=3 159 B10R0.2 CCCC(CC(=O)OCC)O E117524 [1,1,0,0,0,0|2,0,0]=4 160 B10R0.19 CCCCC(C(=O)OCC)Br E117976 [1,1,0,0,0,0|2,0,0]=4 161 B10R0.83 CCCCOC(=O)C(C)CC N303009 [1,1,0,0,0,0|0,0,0]=2 162 B10R0.91 CCCCC(=O)OCCCC B112311 [1,1,0,0,0,0|0,0,0]=2 163 B10R0.91 CCCCC(=O)OCCCC B115773 [1,1,0,0,0,0|0,0,0]=2 164 B10R0.91 CCCCCC(=O)OCCC P136440 [1,1,0,0,0,0|1,0,0]=3 165 B10R0.91 CCCCOC(=O)CN=C=O B152564 [1,1,0,0,0,0|1,0,1]=4 166 B10R0.82 CCC(COC(=O)C(=C)C)O H404570 [0,1,0,0,1,0|0,0,2]=4 167 B10R0.98 CC(C)CCOC(=O)C(C)C I157523 [0,1,0,0,1,0|0,0,0]=2 168 B10R0.98 CC(C)CCOC(=O)C(C)O I157469 [0,1,0,0,1,0|1,0,0]=3 169 B12R0.3 CC(C)CC(=O)OC(=O)CC(C)C I157685 [0,2,0,0,0,0|0,0,1]=3 170 B12R0.4 CCC=CCCOC(=O)CC(C)C H117498 [0,2,0,0,0,0|0,0,0]=2 171 B12R0.4 CCCCCCCC(=O)CC(C)C M158247 [0,2,0,0,0,0|1,0,0]=3 172 B12R0.4 CCCCCCCC(=O)OC(C)C I157711 [0,2,0,0,0,0|2,0,0]=4 173 B12R0.4 CCCCCCOC(=O)CC(=O)C H156878 [0,2,0,0,0,0|1,0,1]=4 174 B12R0.125 CC(C)(C)OC(=O)CCCCCI T589859 [0,2,0,0,0,0|2,0,0]=4 175 B12R0.125 CC(C)(C)OC(=O)CCCCCN T589462 [0,2,0,0,0,0|2,0,0]=4 176 B12R0.125 CC(C)(C)OC(=O)NCCCCBr T131783 [0,2,0,0,0,0|2,0,0]=4 177 B12R0.125 CC(C)(C)OC(=O)NCCCCN B102317 [0,2,0,0,0,0|2,0,0]=4 178 B12R0.125 CC(C)(C)OC(=O)NCCCCN B131605 [0,2,0,0,0,0|2,0,0]=4 179 B12R0.125 CC(C)(C)OC(=O)NCCCCO T134430 [0,2,0,0,0,0|2,0,0]=4 180 B12R0.125 CC(C)(C)OC(=O)NCCCNC T193430 [0,2,0,0,0,0|2,0,0]=4 181 B10R1.18 CC(C)CC1CCCCC1 I157550 [1,0,0,1,0,0|1,0,1]=4 182 B10R1.54 CC1COC(O1)CC(C)C I157438 [1,0,0,1,0,0|0,0,2]=4 183 B10R1.29 C1CC(=O)N(C1)CCCN A343191 [1,0,0,1,0,0|2,0,0]=4 184 B10R1.29 C1CC(=O)N(C1)CCCO H124556 [1,0,0,1,0,0|2,0,0]=4 185 B10R1.29 CCCCN1CCCC1=O B124554 [1,0,0,1,0,0|1,0,0]=3 186 B10R1.138 CCCC(=O)OCC1CO1 R119635 [1,0,0,1,0,0|1,0,0]=3 187 B10R1.138 CCCC(=O)OCC1CO1 S161249 [1,0,0,1,0,0|1,0,0]=3 188 B10R1.114 CC1(C(CCCC1=O)O)C S161361 [0,0,0,1,1,0|2,0,0]=4 189 B12R1.265 CC(C)(C)OC(=O)N1CCCC1 N119036 [0,1,0,1,0,0|2,0,0]=4 190 B12R1.265 CC(C)(C)OC(=O)N1CCCC1 N616574 [0,1,0,1,0,0|2,0,0]=4 191 B8R0.8 CCCCC(=O)C(=O)C H106591 [1,0,0,0,1,0|1,0,1]=4 192 B8R0.8 CCCCC(=O)C(C)C M158862 [1,0,0,0,1,0|0,0,0]=2 193 B8R0.8 CCCCC(C)C(C)C D155224 [1,0,0,0,1,0|1,0,1]=4 194 B8R0.8 CCCOC(=O)C(=C)C N338922 [1,0,0,0,1,0|0,0,2]=4 195 B8R0.8 CCCOC(=O)C(C)C P133971 [1,0,0,0,1,0|0,0,0]=2 196 B8R0.8 CCCOC(=O)C(C)O P160122 [1,0,0,0,1,0|1,0,0]=3 197 B8R0.8 CN(C)C(=O)CCOC M404748 [1,0,0,0,1,0|2,0,0]=4 198 B12R0.233 CCCCCC(=O)OCCC(C)C I101440 [0,0,0,0,0,2|1,0,0]=3