0 B10R1.172 C#CC1=CC(=CC=C1)C#C M131806 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.172 C1=CC(=CC(=C1)C#N)C#N D115360 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.172 C1=CC(=CC(=C1)C#N)C=O F100743 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.172 C1=CC(=CC(=C1)C#N)CBr B152141 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.172 C1=CC(=CC(=C1)C#N)CCl C153841 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.172 C1=CC(=CC(=C1)C#N)CN C178989 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.172 C1=CC(=CC(=C1)C#N)CO H124030 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.172 C1=CC(=CC(=C1)C=O)C=O I106945 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.172 C1=CC(=CC(=C1)C=O)CBr B186757 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.172 C1=CC(=CC(=C1)CBr)CBr A133958 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.172 C1=CC(=CC(=C1)CBr)CO B186756 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.172 C1=CC(=CC(=C1)CCl)CCl D106501 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.172 C1=CC(=CC(=C1)CN)CN X107227 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.172 C1=CC(=CC(=C1)CO)CN A183846 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.172 C1=CC(=CC(=C1)CO)CO B153087 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.172 C1=CC(=CC(=C1)CS)CS B101800 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.172 C1=CC(=CC(=C1)NN)C#N C183445 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.172 C=CC1=CC(=CC=C1)C=C D302176 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.172 C=CC1=CC(=CC=C1)C=O V168330 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.172 CCC1=CC(=CC=C1)C=O E192849 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.172 CCC1=CC(=CC=C1)CC D155005 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.172 CCC1=NC(=CC=C1)CC D195927 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.172 CCC1=NC=CC(=C1)C#N E191103 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.172 CNC1=CC(=CC=C1)OC M167275 [0,0,0,0,0,0|1,0,0]=1 24 B10R1.172 CNC1=NC(=CC=C1)OC M157814 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.172 COC1=CC(=CC=C1)OC D105919 [0,0,0,0,0,0|0,0,0]=0 26 B10R1.172 COC1=CC(=CN=C1)OC D587836 [0,0,0,0,0,0|1,0,0]=1 27 B10R1.172 COC1=CC(=NC=C1)C#N M184013 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.172 COC1=CC(=NC=C1)CN M191852 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.172 COC1=CC(=NC=C1)CO M167781 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.172 COC1=CC(=NC=C1)OC D182331 [0,0,0,0,0,0|1,0,0]=1 31 B10R1.172 COC1=CC(=NC=N1)OC D133895 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.172 COC1=CC=CC(=C1)C#C E123092 [0,0,0,0,0,0|1,0,1]=2 33 B10R1.172 COC1=CC=CC(=C1)C#N M107611 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.172 COC1=CC=CC(=C1)C=C V339129 [0,0,0,0,0,0|1,0,1]=2 35 B10R1.172 COC1=CC=CC(=C1)C=O M106420 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.172 COC1=CC=CC(=C1)CBr M299353 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.172 COC1=CC=CC(=C1)CCl M123139 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.172 COC1=CC=CC(=C1)CN M113479 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.172 COC1=CC=CC(=C1)CO M123137 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.172 COC1=CC=CC(=N1)C#N M195226 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.172 COC1=CC=CC(=N1)C=O M115767 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.172 COC1=CC=CC(=N1)CBr B191147 [0,0,0,0,0,0|3,0,0]=3 43 B10R1.172 COC1=CC=CC(=N1)CO M194298 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.172 COC1=CN=CC(=C1)C#N M183504 [0,0,0,0,0,0|3,0,0]=3 45 B10R1.172 COC1=CN=CC(=C1)C=O M115768 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.172 COC1=NC(=CC=C1)OC D120569 [0,0,0,0,0,0|1,0,0]=1 47 B10R1.172 COC1=NC(=NC=C1)OC D137580 [0,0,0,0,0,0|2,0,0]=2 48 B10R1.172 COC1=NC=CC(=C1)C=O M177294 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.172 COC1=NC=CC(=C1)CO M166644 [0,0,0,0,0,0|3,0,0]=3 50 B9R1.2 C#CC1=CC(=CC=C1)Br B304581 [1,0,0,0,0,0|2,0,1]=4 51 B9R1.2 C#CC1=CC(=CC=C1)Cl C110226 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.2 C#CC1=CC(=CC=C1)F W137137 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.2 C#CC1=CC(=CC=C1)N E109740 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.2 C#CC1=CC(=CC=C1)N E588043 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.2 C#CC1=CC(=CC=C1)O H113416 [1,0,0,0,0,0|1,0,1]=3 56 B9R1.2 C1=CC(=CC(=C1)Br)C#N B103597 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.2 C1=CC(=CC(=C1)Br)C=O B108056 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.2 C1=CC(=CC(=C1)Br)CBr B135903 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.2 C1=CC(=CC(=C1)Br)CCl B139457 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.2 C1=CC(=CC(=C1)Br)CN B131936 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.2 C1=CC(=CC(=C1)Br)CN B136310 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.2 C1=CC(=CC(=C1)Br)CO B103188 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.2 C1=CC(=CC(=C1)Br)NN B101715 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.2 C1=CC(=CC(=C1)Cl)C#N C137691 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.2 C1=CC(=CC(=C1)Cl)C=O C154036 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.2 C1=CC(=CC(=C1)Cl)CBr C106489 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.2 C1=CC(=CC(=C1)Cl)CCl C189170 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.2 C1=CC(=CC(=C1)Cl)CN C135515 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.2 C1=CC(=CC(=C1)Cl)CO C106488 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.2 C1=CC(=CC(=C1)Cl)NN C110270 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 C1=CC(=CC(=C1)F)C#N F120870 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.2 C1=CC(=CC(=C1)F)C=O F107121 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.2 C1=CC(=CC(=C1)F)CBr F107112 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.2 C1=CC(=CC(=C1)F)CCl F123352 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.2 C1=CC(=CC(=C1)F)CN F107964 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.2 C1=CC(=CC(=C1)F)CO F156601 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.2 C1=CC(=CC(=C1)F)NN F102558 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.2 C1=CC(=CC(=C1)I)C#N I103577 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.2 C1=CC(=CC(=C1)I)C=O I135884 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.2 C1=CC(=CC(=C1)I)CBr I133459 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.2 C1=CC(=CC(=C1)I)CN I113819 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.2 C1=CC(=CC(=C1)I)CN I468184 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.2 C1=CC(=CC(=C1)I)CO I157442 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.2 C1=CC(=CC(=C1)N)C#N A107198 [1,0,0,0,0,0|3,0,0]=4 85 B9R1.2 C1=CC(=CC(=C1)N)CN A151635 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.2 C1=CC(=CC(=C1)N)CO A151125 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.2 C1=CC(=CC(=C1)O)C#N C139371 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.2 C1=CC(=CC(=C1)O)C=O H104163 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.2 C1=CC(=CC(=C1)O)CN H407384 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.2 C1=CC(=CC(=C1)O)CO H137304 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.2 C1=CC(=CC(=C1)O)CO H501150 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.2 C=CC1=CC(=CC=C1)Br B121722 [1,0,0,0,0,0|2,0,1]=4 93 B9R1.2 C=CC1=CC(=CC=C1)Cl C121720 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.2 C=CC1=CC(=CC=C1)Cl C140515 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.2 C=CC1=CC(=CC=C1)F F121724 [1,0,0,0,0,0|2,0,1]=4 96 B9R1.2 C=CC1=CC(=CC=C1)N V138287 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.2 CC1=CC(=CC=C1)C#C E107733 [1,0,0,0,0,0|1,0,1]=3 98 B9R1.2 CC1=CC(=CC=C1)C#N T100294 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.2 CC1=CC(=CC=C1)C=C M158347 [1,0,0,0,0,0|1,0,1]=3 100 B9R1.2 CC1=CC(=CC=C1)C=O M157831 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.2 CC1=CC(=CC=C1)CBr B405679 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.2 CC1=CC(=CC=C1)CCl M101677 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.2 CC1=CC(=CC=C1)CN M158668 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.2 CC1=CC(=CC=C1)CO M157904 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.2 CC1=CC(=CC=C1)CS M588442 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.2 CC1=CC(=CC=C1)NC M107962 [1,0,0,0,0,0|1,0,0]=2 107 B9R1.2 CC1=CC(=CC=C1)NN T101274 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.2 CC1=CC(=CC=C1)OC M158111 [1,0,0,0,0,0|0,0,0]=1 109 B9R1.2 CC1=CC(=CC=C1)SC M351262 [1,0,0,0,0,0|0,1,0]=2 110 B9R1.2 CC1=CC(=CN=C1)C#N M170328 [1,0,0,0,0,0|3,0,0]=4 111 B9R1.2 CC1=CC(=CN=C1)CCl C178714 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.2 CC1=CC(=NC=C1)C#N C132269 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.2 CC1=CC(=NC=C1)C=O M124675 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.2 CC1=CC(=NC=C1)CN M586928 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.2 CC1=CC(=NC=C1)CN M588861 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.2 CC1=CC(=NC=C1)NN H589250 [1,0,0,0,0,0|3,0,0]=4 117 B9R1.2 CC1=CC(=NC=C1)OC M122668 [1,0,0,0,0,0|1,0,0]=2 118 B9R1.2 CC1=NC(=CC=C1)C#N C107723 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.2 CC1=NC(=CC=C1)C=O M101568 [1,0,0,0,0,0|3,0,0]=4 120 B9R1.2 CC1=NC(=CC=C1)CBr B589873 [1,0,0,0,0,0|3,0,0]=4 121 B9R1.2 CC1=NC(=CC=C1)CCl C405541 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.2 CC1=NC(=CC=C1)CN M194459 [1,0,0,0,0,0|3,0,0]=4 123 B9R1.2 CC1=NC(=CC=C1)CO M115780 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.2 CC1=NC(=CC=C1)OC M108062 [1,0,0,0,0,0|1,0,0]=2 125 B9R1.2 CC1=NC(=NC=C1)SC M124713 [1,0,0,0,0,0|2,1,0]=4 126 B9R1.2 CC1=NC=CC(=C1)CO M573438 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.2 CC1=NC=CC(=C1)OC M183081 [1,0,0,0,0,0|1,0,0]=2 128 B9R1.2 CCC1=CC(=CC=C1)Br B101889 [1,0,0,0,0,0|2,0,0]=3 129 B9R1.2 CCC1=CC(=CC=C1)Cl C589677 [1,0,0,0,0,0|2,0,0]=3 130 B9R1.2 CCC1=CC(=CC=C1)I E587883 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.2 CCC1=CC(=CC=C1)N E101873 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.2 CCC1=CC(=CC=C1)O E156226 [1,0,0,0,0,0|1,0,0]=2 133 B9R1.2 CCC1=CC(=NC=C1)N A123353 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.2 CCC1=CC=CC(=C1)C E113367 [1,0,0,0,0,0|1,0,0]=2 135 B9R1.2 CC[N+]1=CC=CC(=C1)C E121235 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.2 CC[N+]1=CC=CC(=C1)O E472644 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.2 CNC1=CC(=CC=C1)Br B194483 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.2 CNC1=CC(=CC=C1)Cl C153906 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.2 CNC1=CC(=CC=C1)F F168315 [1,0,0,0,0,0|2,0,0]=3 140 B9R1.2 CNC1=CC(=CC=C1)O M587311 [1,0,0,0,0,0|1,0,0]=2 141 B9R1.2 CNC1=CC(=NC=C1)F F587425 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.2 CNC1=NC(=CC=C1)Cl C195623 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.2 COC1=CC(=CC=C1)Br B100846 [1,0,0,0,0,0|1,0,0]=2 144 B9R1.2 COC1=CC(=CC=C1)Cl C106486 [1,0,0,0,0,0|1,0,0]=2 145 B9R1.2 COC1=CC(=CC=C1)F F120587 [1,0,0,0,0,0|1,0,0]=2 146 B9R1.2 COC1=CC(=CC=C1)I I123674 [1,0,0,0,0,0|1,0,0]=2 147 B9R1.2 COC1=CC(=CC=C1)S M101779 [1,0,0,0,0,0|0,1,0]=2 148 B9R1.2 COC1=CC(=CN=C1)Br B115755 [1,0,0,0,0,0|2,0,0]=3 149 B9R1.2 COC1=CC(=CN=C1)Cl C479903 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.2 COC1=CC(=NC=C1)Cl C119393 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.2 COC1=CC(=NC=C1)F F182150 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.2 COC1=CC(=NC=C1)N A151667 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.2 COC1=CC(=NC=N1)Cl C120232 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.2 COC1=CC(=NN=C1)Cl C172842 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.2 COC1=CC=CC(=C1)N A107482 [1,0,0,0,0,0|1,0,0]=2 156 B9R1.2 COC1=CC=CC(=C1)O M109432 [1,0,0,0,0,0|0,0,0]=1 157 B9R1.2 COC1=CC=CC(=C1)[CH2-] M300737 [1,0,0,0,0,0|0,0,1]=2 158 B9R1.2 COC1=CC=CC(=N1)N A119397 [1,0,0,0,0,0|2,0,0]=3 159 B9R1.2 COC1=CN=CC(=C1)O W132603 [1,0,0,0,0,0|1,0,0]=2 160 B9R1.2 COC1=NC(=CC=C1)Br B115753 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.2 COC1=NC(=CC=C1)Cl C115751 [1,0,0,0,0,0|2,0,0]=3 162 B9R1.2 COC1=NC(=CC=C1)F F179764 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.2 COC1=NC(=CC=C1)I I168070 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.2 COC1=NC(=NC=C1)Cl C138524 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.2 COC1=NC=CC(=C1)Br B178692 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.2 COC1=NC=CC(=C1)Cl C186239 [1,0,0,0,0,0|2,0,0]=3 167 B9R1.2 COC1=NC=CC(=C1)N M119976 [1,0,0,0,0,0|2,0,0]=3 168 B9R1.2 COC1=NC=CC(=N1)N M176143 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.2 COC1=NC=NC(=C1)N A333072 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.2 CSC1=CC(=CC=C1)Br B101842 [1,0,0,0,0,0|1,1,0]=3 171 B9R1.2 CSC1=CC(=CC=C1)Cl C101839 [1,0,0,0,0,0|1,1,0]=3 172 B9R1.2 CSC1=CC=CC(=C1)F F156685 [1,0,0,0,0,0|1,1,0]=3 173 B9R1.2 CSC1=CC=CC(=C1)N M101834 [1,0,0,0,0,0|1,1,0]=3 174 B9R1.2 [CH2-]C1=CC(=CC=C1)C#N C331829 [1,0,0,0,0,0|2,0,1]=4 175 B11R1.9 CC1=CC(=CC(=C1)OC)OC D135516 [0,1,0,0,0,0|0,0,0]=1 176 B11R1.9 COC1=CC(=CC(=C1)Br)OC B123683 [0,1,0,0,0,0|0,0,0]=1 177 B11R1.9 COC1=CC(=CC(=C1)C#N)F F184549 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.9 COC1=CC(=CC(=C1)C=O)Br B183268 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.9 COC1=CC(=CC(=C1)C=O)Cl C191375 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.9 COC1=CC(=CC(=C1)C=O)F F124174 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.9 COC1=CC(=CC(=C1)Cl)OC C139204 [0,1,0,0,0,0|0,0,0]=1 182 B11R1.9 COC1=CC(=CC(=C1)F)OC D122681 [0,1,0,0,0,0|0,0,0]=1 183 B11R1.9 COC1=CC(=CC(=C1)I)OC I588419 [0,1,0,0,0,0|0,0,0]=1 184 B11R1.9 COC1=CC(=CC(=C1)N)C#N A588504 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.9 COC1=CC(=CC(=C1)N)OC D103619 [0,1,0,0,0,0|0,0,0]=1 186 B11R1.9 COC1=CC(=CC(=C1)O)OC D136632 [0,1,0,0,0,0|0,0,0]=1 187 B11R1.9 COC1=CC(=NC(=N1)Cl)OC C124239 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.9 COC1=CC(=NC(=N1)N)OC A107384 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.9 COC1=CC(=NC(=N1)OC)Cl C153605 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.9 COC1=CC(=NC(=S)N1)OC D345156 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.9 COC1=NC(=NC(=C1)N)OC A133799 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.9 COC1=NC(=NC(=N1)Cl)OC C123027 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.9 COC1=NC(=NC(=N1)N)OC A181911 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.9 COC1=NC(=NC(=O)N1)OC D586322 [0,1,0,0,0,0|3,0,0]=4 195 B11R1.189 CCC1=CC(=CC=C1)N=C=O E341480 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.189 CCOC1=CC=CC(=C1)C=O E135710 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.189 CNCC1=CC(=CC=C1)OC M170257 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.189 COC1=CC=CC(=C1)CC#N M120894 [0,1,0,0,0,0|1,0,1]=3 199 B11R1.189 COC1=CC=CC(=C1)CCBr M354174 [0,1,0,0,0,0|1,0,0]=2 200 B11R1.189 COC1=CC=CC(=C1)CCN M123416 [0,1,0,0,0,0|1,0,0]=2 201 B11R1.189 COC1=CC=CC(=C1)CCO M136341 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.189 COC1=CC=CC(=C1)N=C=O M132043 [0,1,0,0,0,0|1,0,1]=3 203 B11R1.189 COC1=CC=CC(=C1)N=C=S M140584 [0,1,0,0,0,0|1,0,1]=3 204 B11R1.189 CSC1=CC=CC(=C1)N=C=S M140533 [0,1,0,0,0,0|1,1,1]=4 205 B11R1.266 B(C1=CC(=CC=C1)OC)(O)O M109430 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.266 B(C1=CC(=CC=C1)SC)(O)O M103214 [0,1,0,0,0,0|2,1,0]=4 207 B11R1.266 B(C1=CC(=NC=C1)OC)(O)O M304572 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.266 CC(=O)C1=CC(=CC=C1)OC M108015 [0,1,0,0,0,0|1,0,0]=2 209 B11R1.266 CC(=O)C1=CC(=CN=C1)OC M187711 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.266 CC(=O)C1=CC=CC(=C1)C#N A113380 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.266 CC(=O)C1=CC=CC(=C1)C=O A467286 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.266 CC(=O)C1=CC=CC(=C1)CCl C193344 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.266 CC(=O)C1=NC(=CC=C1)OC A115770 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.266 CC(C)C1=CC=CC(=C1)C=O I354280 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.266 CC(C)C1=NC(=CC=C1)OC I589226 [0,1,0,0,0,0|2,0,0]=3 216 B11R1.266 CC(C1=CC(=CC=C1)OC)O M168845 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.266 CCC1=CC(=CC=C1)C(=O)C E182976 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.266 CCC1=CC(=CC=C1)[N+](=O)[O-] E304520 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.266 CCC1=CC(=CC=C1)[N+](=O)[O-] E304521 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.266 CN(C)C1=CC(=CC=C1)OC N159574 [0,1,0,0,0,0|1,0,0]=2 221 B11R1.266 CN(C)C1=CC=CC(=C1)CO D168867 [0,1,0,0,0,0|3,0,0]=4 222 B11R1.266 CNC1=CC(=CC=C1)[N+](=O)[O-] N171211 [0,1,0,0,0,0|3,0,0]=4 223 B11R1.266 CNC1=CC=CC(=C1)C(=O)O M170712 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.266 COC1=CC(=NC=C1)C(=N)N M463332 [0,1,0,0,0,0|3,0,0]=4 225 B11R1.266 COC1=CC(=NC=C1)C(=O)N M187960 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.266 COC1=CC(=NC=C1)C(=O)O M169316 [0,1,0,0,0,0|3,0,0]=4 227 B11R1.266 COC1=CC=CC(=C1)C(=O)Cl M167858 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.266 COC1=CC=CC(=C1)C(=O)N M304055 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.266 COC1=CC=CC(=C1)C(=O)O M112614 [0,1,0,0,0,0|2,0,0]=3 230 B11R1.266 COC1=CC=CC(=C1)C(=S)N M469494 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.266 COC1=CC=CC(=N1)C(=O)N M349239 [0,1,0,0,0,0|3,0,0]=4 232 B11R1.266 COC1=CC=CC(=N1)C(=O)O M133345 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.266 COC1=CN=CC(=C1)C(=O)O M133272 [0,1,0,0,0,0|3,0,0]=4 234 B11R1.266 COC1=NC=CC(=C1)C(=O)O M119257 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.266 CSC1=CC=CC(=C1)C(=O)O M136480 [0,1,0,0,0,0|2,1,0]=4 236 B11R1.267 CC1=C(C=CC=C1OC)OC D155519 [0,1,0,0,0,0|0,0,0]=1 237 B11R1.267 CC1=C(C=CN=C1CO)OC M195415 [0,1,0,0,0,0|3,0,0]=4 238 B11R1.267 CCC1=C(C(=CC=C1)CC)N D105961 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.267 CCC1=C(C(=CC=C1)CC)N D105962 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.267 CCC1=C(C(=CC=C1)CC)O D586111 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.267 COC1=C(C(=CC=C1)OC)Br B134322 [0,1,0,0,0,0|0,0,0]=1 242 B11R1.267 COC1=C(C(=CC=C1)OC)Cl C194696 [0,1,0,0,0,0|0,0,0]=1 243 B11R1.267 COC1=C(C(=CC=C1)OC)I I138356 [0,1,0,0,0,0|0,0,0]=1 244 B11R1.267 COC1=C(C(=CC=C1)OC)N D122535 [0,1,0,0,0,0|0,0,0]=1 245 B11R1.267 COC1=C(C(=CC=C1)OC)O D128348 [0,1,0,0,0,0|0,0,0]=1 246 B11R1.267 COC1=C(C(=NC=N1)OC)N D587453 [0,1,0,0,0,0|2,0,0]=3 247 B11R1.267 COC1=CC=CC(=C1Cl)C#N C300899 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.267 COC1=CC=CC(=C1Cl)C=O C124147 [0,1,0,0,0,0|2,0,0]=3 249 B11R1.267 COC1=CC=CC(=C1F)C#N F182497 [0,1,0,0,0,0|2,0,0]=3 250 B11R1.267 COC1=CC=CC(=C1F)C=O F178941 [0,1,0,0,0,0|2,0,0]=3 251 B11R1.267 COC1=CC=CC(=C1N)C#N A181607 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.267 COC1=CC=CC(=C1N)CO A191970 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.267 COC1=CC=CC(=C1O)C=O V109636 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.267 COC1=CC=CC(=C1O)CO H157332 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.280 CC1=C(C=C(C=C1)C#N)OC M136274 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.280 CC1=C(C=C(C=C1)OC)OC D170028 [0,1,0,0,0,0|0,0,0]=1 257 B11R1.280 CCC1=C(C=CC(=C1)C#N)N A121620 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.280 CCC1=CC(=C(C=C1)O)C=O E344459 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.280 CCC1=CC(=C(C=C1)O)OC E111257 [0,1,0,0,0,0|1,0,0]=2 260 B11R1.280 COC1=C(C=CC(=C1)C#N)Br B180088 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.280 COC1=C(C=CC(=C1)C#N)F F124044 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.280 COC1=C(C=CC(=C1)C#N)N A182168 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.280 COC1=C(C=CC(=C1)C#N)O H156992 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.280 COC1=C(C=CC(=C1)C=C)O M137776 [0,1,0,0,0,0|1,0,1]=3 265 B11R1.280 COC1=C(C=CC(=C1)C=O)Br B184522 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.280 COC1=C(C=CC(=C1)C=O)Cl C190733 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.280 COC1=C(C=CC(=C1)C=O)F F108788 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.280 COC1=C(C=CC(=C1)C=O)O V100115 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.280 COC1=C(C=CC(=C1)C=O)O V128320 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.280 COC1=C(C=CC(=C1)C=O)O V141281 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.280 COC1=C(C=CC(=C1)C=O)O V420926 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.280 COC1=C(C=CC(=C1)C=O)O V431597 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.280 COC1=C(C=CC(=C1)CBr)F F181431 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.280 COC1=C(C=CC(=C1)CN)F A184856 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.280 COC1=C(C=CC(=C1)CN)O A586553 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.280 COC1=C(C=CC(=C1)CN)O V103080 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.280 COC1=C(C=CC(=C1)CO)F F132370 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.280 COC1=C(C=CC(=C1)CO)O H103777 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.280 COC1=CC(=C(C=C1)Br)C#N B167154 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.280 COC1=CC(=C(C=C1)Br)C=O B120909 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.280 COC1=CC(=C(C=C1)Br)CBr B122700 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.280 COC1=CC(=C(C=C1)Br)CO B181646 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.280 COC1=CC(=C(C=C1)Br)OC B111192 [0,1,0,0,0,0|0,0,0]=1 284 B11R1.280 COC1=CC(=C(C=C1)Cl)C=O C587089 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.280 COC1=CC(=C(C=C1)F)C#N F123975 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.280 COC1=CC(=C(C=C1)F)C=O F113846 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.280 COC1=CC(=C(C=C1)F)OC F167967 [0,1,0,0,0,0|0,0,0]=1 288 B11R1.280 COC1=CC(=C(C=C1)I)OC D155503 [0,1,0,0,0,0|0,0,0]=1 289 B11R1.280 COC1=CC(=C(C=C1)N)C#N A168906 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.280 COC1=CC(=C(C=C1)N)CO A589468 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.280 COC1=CC(=C(C=C1)O)C#N H588994 [0,1,0,0,0,0|2,0,0]=3 292 B11R1.280 COC1=CC(=C(C=C1)O)C=O H113429 [0,1,0,0,0,0|2,0,0]=3 293 B11R1.280 COC1=CC(=C(C=C1)O)OC D190590 [0,1,0,0,0,0|0,0,0]=1 294 B11R1.280 COC1=CC(=C(C=C1)S)OC D587856 [0,1,0,0,0,0|0,0,0]=1 295 B11R1.280 COC1=NC(=NC=C1Br)OC B121815 [0,1,0,0,0,0|2,0,0]=3 296 B11R1.280 COC1=NC(=NC=C1Cl)OC C336573 [0,1,0,0,0,0|2,0,0]=3 297 B11R1.280 COC1=NC(=NC=C1I)OC I123218 [0,1,0,0,0,0|2,0,0]=3 298 B9R0.26 COC(=CC(=O)OC)CCl M157972 [0,0,1,0,0,0|2,0,1]=4 299 B11R2.190 C=CC1=CC2=C(CC2)C=C1 V196176 [0,0,0,1,0,0|2,0,1]=4 300 B9R1.14 COC1=C(OC=C1)C=O M303443 [0,0,0,0,1,0|3,0,0]=4 301 B9R1.14 COC1=CSC=C1OC D103168 [0,0,0,0,1,0|1,0,0]=2 302 B9R1.21 COC1=CC=C(S1)C=O M588828 [0,0,0,0,1,0|3,0,0]=4 303 B9R1.21 COC1C=CC(O1)OC D107952 [0,0,0,0,1,0|1,0,2]=4 304 B8R0.19 CC(=CC(=O)OC)OC E170426 [1,0,1,0,0,0|1,0,1]=4 305 B8R0.6 CC=CC=CC(=O)OC M158512 [1,0,1,0,0,0|1,0,0]=3 306 B8R1.2 C#CC1=CC=CC=C1 P107030 [2,0,0,0,0,0|1,0,1]=4 307 B8R1.2 C#CC1=CC=CC=C1 P332820 [2,0,0,0,0,0|1,0,1]=4 308 B8R1.2 C1=CC=C(C=C1)C#N B104457 [2,0,0,0,0,0|2,0,0]=4 309 B8R1.2 C1=CC=C(C=C1)C#N B104458 [2,0,0,0,0,0|2,0,0]=4 310 B8R1.2 C1=CC=C(C=C1)C#N B110114 [2,0,0,0,0,0|2,0,0]=4 311 B8R1.2 C1=CC=C(C=C1)C#N B113726 [2,0,0,0,0,0|2,0,0]=4 312 B8R1.2 C1=CC=C(C=C1)C#N B119686 [2,0,0,0,0,0|2,0,0]=4 313 B8R1.2 C1=CC=C(C=C1)C#N B121683 [2,0,0,0,0,0|2,0,0]=4 314 B8R1.2 C1=CC=C(C=C1)C=O B110459 [2,0,0,0,0,0|2,0,0]=4 315 B8R1.2 C1=CC=C(C=C1)C=O B110460 [2,0,0,0,0,0|2,0,0]=4 316 B8R1.2 C1=CC=C(C=C1)C=O B110463 [2,0,0,0,0,0|2,0,0]=4 317 B8R1.2 C1=CC=C(C=C1)C=O B110464 [2,0,0,0,0,0|2,0,0]=4 318 B8R1.2 C1=CC=C(C=C1)C=O B266083 [2,0,0,0,0,0|2,0,0]=4 319 B8R1.2 C1=CC=C(C=C1)C=O B420281 [2,0,0,0,0,0|2,0,0]=4 320 B8R1.2 C1=CC=C(C=C1)C=O B472001 [2,0,0,0,0,0|2,0,0]=4 321 B8R1.2 C1=CC=C(C=C1)CBr B108549 [2,0,0,0,0,0|2,0,0]=4 322 B8R1.2 C1=CC=C(C=C1)CBr B471999 [2,0,0,0,0,0|2,0,0]=4 323 B8R1.2 C1=CC=C(C=C1)CBr B472021 [2,0,0,0,0,0|2,0,0]=4 324 B8R1.2 C1=CC=C(C=C1)CCl B110580 [2,0,0,0,0,0|2,0,0]=4 325 B8R1.2 C1=CC=C(C=C1)CCl B110581 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.2 C1=CC=C(C=C1)CCl B110582 [2,0,0,0,0,0|2,0,0]=4 327 B8R1.2 C1=CC=C(C=C1)CCl B141153 [2,0,0,0,0,0|2,0,0]=4 328 B8R1.2 C1=CC=C(C=C1)CCl B431204 [2,0,0,0,0,0|2,0,0]=4 329 B8R1.2 C1=CC=C(C=C1)CCl B472028 [2,0,0,0,0,0|2,0,0]=4 330 B8R1.2 C1=CC=C(C=C1)CCl B472041 [2,0,0,0,0,0|2,0,0]=4 331 B8R1.2 C1=CC=C(C=C1)CN A348464 [2,0,0,0,0,0|2,0,0]=4 332 B8R1.2 C1=CC=C(C=C1)CN B108477 [2,0,0,0,0,0|2,0,0]=4 333 B8R1.2 C1=CC=C(C=C1)CN B152179 [2,0,0,0,0,0|2,0,0]=4 334 B8R1.2 C1=CC=C(C=C1)CN B152887 [2,0,0,0,0,0|2,0,0]=4 335 B8R1.2 C1=CC=C(C=C1)CN B152949 [2,0,0,0,0,0|2,0,0]=4 336 B8R1.2 C1=CC=C(C=C1)CN B304428 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.2 C1=CC=C(C=C1)CN B485378 [2,0,0,0,0,0|2,0,0]=4 338 B8R1.2 C1=CC=C(C=C1)CN P493007 [2,0,0,0,0,0|2,0,0]=4 339 B8R1.2 C1=CC=C(C=C1)CN P493016 [2,0,0,0,0,0|2,0,0]=4 340 B8R1.2 C1=CC=C(C=C1)CN P493100 [2,0,0,0,0,0|2,0,0]=4 341 B8R1.2 C1=CC=C(C=C1)CO B108199 [2,0,0,0,0,0|2,0,0]=4 342 B8R1.2 C1=CC=C(C=C1)CO B108202 [2,0,0,0,0,0|2,0,0]=4 343 B8R1.2 C1=CC=C(C=C1)CO B108203 [2,0,0,0,0,0|2,0,0]=4 344 B8R1.2 C1=CC=C(C=C1)CO B108204 [2,0,0,0,0,0|2,0,0]=4 345 B8R1.2 C1=CC=C(C=C1)CO B108205 [2,0,0,0,0,0|2,0,0]=4 346 B8R1.2 C1=CC=C(C=C1)CO B163018 [2,0,0,0,0,0|2,0,0]=4 347 B8R1.2 C1=CC=C(C=C1)CO B346959 [2,0,0,0,0,0|2,0,0]=4 348 B8R1.2 C1=CC=C(C=C1)CO B420278 [2,0,0,0,0,0|2,0,0]=4 349 B8R1.2 C1=CC=C(C=C1)CO B472101 [2,0,0,0,0,0|2,0,0]=4 350 B8R1.2 C1=CC=C(C=C1)CS B109256 [2,0,0,0,0,0|2,0,0]=4 351 B8R1.2 C1=CC=C(C=C1)I=O I157626 [2,0,0,0,0,0|2,0,0]=4 352 B8R1.2 C1=CC=C(C=C1)N=O N159156 [2,0,0,0,0,0|2,0,0]=4 353 B8R1.2 C1=CC=C(C=C1)NN P104684 [2,0,0,0,0,0|2,0,0]=4 354 B8R1.2 C1=CC=C(C=C1)NN P108563 [2,0,0,0,0,0|2,0,0]=4 355 B8R1.2 C1=CC=C(C=C1)NN P112739 [2,0,0,0,0,0|2,0,0]=4 356 B8R1.2 C1=CC=C(C=C1)NN P579459 [2,0,0,0,0,0|2,0,0]=4 357 B8R1.2 C1=CC=C(C=C1)NO N131374 [2,0,0,0,0,0|2,0,0]=4 358 B8R1.2 C1=CC=C(C=C1)ON O464484 [2,0,0,0,0,0|1,0,0]=3 359 B8R1.2 C1=CC=C(C=C1)[As]=O P336440 [2,0,0,0,0,0|2,0,0]=4 360 B8R1.2 C1=CC=C(C=C1)[Hg]Cl P598721 [2,0,0,0,0,0|2,0,0]=4 361 B8R1.2 C1=CC=C(C=C1)[Se]Cl P160704 [2,0,0,0,0,0|1,1,0]=4 362 B8R1.2 C=CC1=CC=CC=C1 A304890 [2,0,0,0,0,0|1,0,1]=4 363 B8R1.2 C=CC1=CC=CC=C1 P107084 [2,0,0,0,0,0|1,0,1]=4 364 B8R1.2 C=CC1=CC=CC=C1 P107085 [2,0,0,0,0,0|1,0,1]=4 365 B8R1.2 C=CC1=CC=CC=C1 P107086 [2,0,0,0,0,0|1,0,1]=4 366 B8R1.2 C=CC1=CC=CC=C1 P107087 [2,0,0,0,0,0|1,0,1]=4 367 B8R1.2 C=CC1=CC=CC=C1 P107088 [2,0,0,0,0,0|1,0,1]=4 368 B8R1.2 C=CC1=CC=CC=C1 P107089 [2,0,0,0,0,0|1,0,1]=4 369 B8R1.2 C=CC1=CC=CC=C1 P107090 [2,0,0,0,0,0|1,0,1]=4 370 B8R1.2 C=CC1=CC=CC=C1 P107091 [2,0,0,0,0,0|1,0,1]=4 371 B8R1.2 C=CC1=CC=CC=C1 P107772 [2,0,0,0,0,0|1,0,1]=4 372 B8R1.2 C=CC1=CC=CC=C1 P107773 [2,0,0,0,0,0|1,0,1]=4 373 B8R1.2 C=CC1=CC=CC=C1 P107774 [2,0,0,0,0,0|1,0,1]=4 374 B8R1.2 C=CC1=CC=CC=C1 P107775 [2,0,0,0,0,0|1,0,1]=4 375 B8R1.2 C=CC1=CC=CC=C1 P107776 [2,0,0,0,0,0|1,0,1]=4 376 B8R1.2 C=CC1=CC=CC=C1 P107777 [2,0,0,0,0,0|1,0,1]=4 377 B8R1.2 C=CC1=CC=CC=C1 P107778 [2,0,0,0,0,0|1,0,1]=4 378 B8R1.2 C=CC1=CC=CC=C1 P107779 [2,0,0,0,0,0|1,0,1]=4 379 B8R1.2 C=CC1=CC=CC=C1 P107780 [2,0,0,0,0,0|1,0,1]=4 380 B8R1.2 C=CC1=CC=CC=C1 P107782 [2,0,0,0,0,0|1,0,1]=4 381 B8R1.2 C=CC1=CC=CC=C1 P107783 [2,0,0,0,0,0|1,0,1]=4 382 B8R1.2 C=CC1=CC=CC=C1 P107784 [2,0,0,0,0,0|1,0,1]=4 383 B8R1.2 C=CC1=CC=CC=C1 P107786 [2,0,0,0,0,0|1,0,1]=4 384 B8R1.2 C=CC1=CC=CC=C1 P107787 [2,0,0,0,0,0|1,0,1]=4 385 B8R1.2 C=CC1=CC=CC=C1 P107789 [2,0,0,0,0,0|1,0,1]=4 386 B8R1.2 C=CC1=CC=CC=C1 P107790 [2,0,0,0,0,0|1,0,1]=4 387 B8R1.2 C=CC1=CC=CC=C1 P107791 [2,0,0,0,0,0|1,0,1]=4 388 B8R1.2 C=CC1=CC=CC=C1 P107792 [2,0,0,0,0,0|1,0,1]=4 389 B8R1.2 C=CC1=CC=CC=C1 P107793 [2,0,0,0,0,0|1,0,1]=4 390 B8R1.2 C=CC1=CC=CC=C1 P107794 [2,0,0,0,0,0|1,0,1]=4 391 B8R1.2 C=CC1=CC=CC=C1 P107795 [2,0,0,0,0,0|1,0,1]=4 392 B8R1.2 C=CC1=CC=CC=C1 P107796 [2,0,0,0,0,0|1,0,1]=4 393 B8R1.2 C=CC1=CC=CC=C1 P107797 [2,0,0,0,0,0|1,0,1]=4 394 B8R1.2 C=CC1=CC=CC=C1 P107798 [2,0,0,0,0,0|1,0,1]=4 395 B8R1.2 C=CC1=CC=CC=C1 P107801 [2,0,0,0,0,0|1,0,1]=4 396 B8R1.2 C=CC1=CC=CC=C1 P107802 [2,0,0,0,0,0|1,0,1]=4 397 B8R1.2 C=CC1=CC=CC=C1 P107803 [2,0,0,0,0,0|1,0,1]=4 398 B8R1.2 C=CC1=CC=CC=C1 P107804 [2,0,0,0,0,0|1,0,1]=4 399 B8R1.2 C=CC1=CC=CC=C1 P107805 [2,0,0,0,0,0|1,0,1]=4 400 B8R1.2 C=CC1=CC=CC=C1 P107806 [2,0,0,0,0,0|1,0,1]=4 401 B8R1.2 C=CC1=CC=CC=C1 P107807 [2,0,0,0,0,0|1,0,1]=4 402 B8R1.2 C=CC1=CC=CC=C1 P107808 [2,0,0,0,0,0|1,0,1]=4 403 B8R1.2 C=CC1=CC=CC=C1 P107809 [2,0,0,0,0,0|1,0,1]=4 404 B8R1.2 C=CC1=CC=CC=C1 P107810 [2,0,0,0,0,0|1,0,1]=4 405 B8R1.2 C=CC1=CC=CC=C1 P107811 [2,0,0,0,0,0|1,0,1]=4 406 B8R1.2 C=CC1=CC=CC=C1 P107812 [2,0,0,0,0,0|1,0,1]=4 407 B8R1.2 C=CC1=CC=CC=C1 P107813 [2,0,0,0,0,0|1,0,1]=4 408 B8R1.2 C=CC1=CC=CC=C1 P107814 [2,0,0,0,0,0|1,0,1]=4 409 B8R1.2 C=CC1=CC=CC=C1 P119494 [2,0,0,0,0,0|1,0,1]=4 410 B8R1.2 C=CC1=CC=CC=C1 P119495 [2,0,0,0,0,0|1,0,1]=4 411 B8R1.2 C=CC1=CC=CC=C1 P119496 [2,0,0,0,0,0|1,0,1]=4 412 B8R1.2 C=CC1=CC=CC=C1 P119498 [2,0,0,0,0,0|1,0,1]=4 413 B8R1.2 C=CC1=CC=CC=C1 P119572 [2,0,0,0,0,0|1,0,1]=4 414 B8R1.2 C=CC1=CC=CC=C1 P304886 [2,0,0,0,0,0|1,0,1]=4 415 B8R1.2 C=CC1=CC=CC=C1 P304889 [2,0,0,0,0,0|1,0,1]=4 416 B8R1.2 C=CC1=CC=CC=C1 P434446 [2,0,0,0,0,0|1,0,1]=4 417 B8R1.2 C=CC1=CC=CC=C1 P434450 [2,0,0,0,0,0|1,0,1]=4 418 B8R1.2 C=CC1=CC=CC=C1 P434455 [2,0,0,0,0,0|1,0,1]=4 419 B8R1.2 C=CC1=CC=CC=C1 P476626 [2,0,0,0,0,0|1,0,1]=4 420 B8R1.2 C=CC1=CC=CC=C1 P490073 [2,0,0,0,0,0|1,0,1]=4 421 B8R1.2 C=CC1=CC=CC=C1 P638578 [2,0,0,0,0,0|1,0,1]=4 422 B8R1.2 C=CC1=CC=CC=C1 S110374 [2,0,0,0,0,0|1,0,1]=4 423 B8R1.2 C=CC1=CC=CC=C1 S110375 [2,0,0,0,0,0|1,0,1]=4 424 B8R1.2 C=CC1=CC=CC=C1 S110376 [2,0,0,0,0,0|1,0,1]=4 425 B8R1.2 C=CC1=CC=CC=C1 S110377 [2,0,0,0,0,0|1,0,1]=4 426 B8R1.2 C=CC1=CC=CC=C1 S110378 [2,0,0,0,0,0|1,0,1]=4 427 B8R1.2 C=CC1=CC=CC=C1 S121282 [2,0,0,0,0,0|1,0,1]=4 428 B8R1.2 CCC1=CC=CC=C1 E108144 [2,0,0,0,0,0|1,0,0]=3 429 B8R1.2 CCC1=CC=CC=C1 E108145 [2,0,0,0,0,0|1,0,0]=3 430 B8R1.2 CCC1=CC=CC=C1 E108146 [2,0,0,0,0,0|1,0,0]=3 431 B8R1.2 CCC1=CC=CC=C1 E108148 [2,0,0,0,0,0|1,0,0]=3 432 B8R1.2 CCC1=CC=CC=C1 E108149 [2,0,0,0,0,0|1,0,0]=3 433 B8R1.2 CCC1=CC=CC=C1 E117364 [2,0,0,0,0,0|1,0,0]=3 434 B8R1.2 CCC1=CC=CC=N1 E156565 [2,0,0,0,0,0|2,0,0]=4 435 B8R1.2 CCC1=CC=NC=C1 E106225 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.2 CCC1=CN=CC=C1 E156048 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.2 CC[N+]1=CC=CC=C1 E102660 [2,0,0,0,0,0|2,0,0]=4 438 B8R1.2 CC[N+]1=CC=CC=C1 E102661 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.2 CNC1=CC=CC=C1 M109539 [2,0,0,0,0,0|1,0,0]=3 440 B8R1.2 CNC1=CC=CC=C1 M109540 [2,0,0,0,0,0|1,0,0]=3 441 B8R1.2 CNC1=CC=CC=N1 M158828 [2,0,0,0,0,0|2,0,0]=4 442 B8R1.2 CNC1=CC=NC=C1 M119978 [2,0,0,0,0,0|2,0,0]=4 443 B8R1.2 CNC1=CN=CC=C1 M158833 [2,0,0,0,0,0|2,0,0]=4 444 B8R1.2 COC1=CC=CC=C1 A103680 [2,0,0,0,0,0|0,0,0]=2 445 B8R1.2 COC1=CC=CC=C1 A103683 [2,0,0,0,0,0|0,0,0]=2 446 B8R1.2 COC1=CC=CC=C1 A103684 [2,0,0,0,0,0|0,0,0]=2 447 B8R1.2 COC1=CC=CC=C1 A105952 [2,0,0,0,0,0|0,0,0]=2 448 B8R1.2 COC1=CC=CC=C1 A472026 [2,0,0,0,0,0|0,0,0]=2 449 B8R1.2 COC1=CC=CC=N1 M120557 [2,0,0,0,0,0|1,0,0]=3 450 B8R1.2 COC1=CC=NC=C1 M120571 [2,0,0,0,0,0|1,0,0]=3 451 B8R1.2 COC1=CN=CC=C1 M134006 [2,0,0,0,0,0|1,0,0]=3 452 B8R1.2 COC1=CN=CN=C1 M303416 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.2 COC1=NC=CN=C1 M136222 [2,0,0,0,0,0|2,0,0]=4 454 B8R1.2 COC1=NC=NC=C1 M158443 [2,0,0,0,0,0|2,0,0]=4 455 B8R1.2 COC1=NN=CC=C1 M157842 [2,0,0,0,0,0|2,0,0]=4 456 B8R1.2 CSC1=CC=CC=C1 T107511 [2,0,0,0,0,0|0,1,0]=3 457 B8R1.2 CSC1=CC=CC=N1 M132299 [2,0,0,0,0,0|1,1,0]=4 458 B8R1.2 C[Si]C1=CC=CC=C1 M338232 [2,0,0,0,0,0|1,0,0]=3 459 B8R1.2 [C-]#CC1=CC=CC=C1 C282525 [2,0,0,0,0,0|1,0,1]=4 460 B8R1.2 [C-]#CC1=CC=CC=C1 P331408 [2,0,0,0,0,0|1,0,1]=4 461 B8R1.4 C1=C(C=NC=C1Br)O B107719 [2,0,0,0,0,0|2,0,0]=4 462 B8R1.4 C1=C(C=NC=C1Cl)O C102606 [2,0,0,0,0,0|2,0,0]=4 463 B8R1.4 C1=C(C=NC=C1F)O F102605 [2,0,0,0,0,0|2,0,0]=4 464 B8R1.4 C1=C(C=NC=C1O)O P588846 [2,0,0,0,0,0|1,0,0]=3 465 B8R1.4 C1=CC(=CC(=C1)Br)Br D110983 [2,0,0,0,0,0|2,0,0]=4 466 B8R1.4 C1=CC(=CC(=C1)Br)Cl B106999 [2,0,0,0,0,0|2,0,0]=4 467 B8R1.4 C1=CC(=CC(=C1)Br)F B109686 [2,0,0,0,0,0|2,0,0]=4 468 B8R1.4 C1=CC(=CC(=C1)Br)N B103950 [2,0,0,0,0,0|2,0,0]=4 469 B8R1.4 C1=CC(=CC(=C1)Br)O B106994 [2,0,0,0,0,0|1,0,0]=3 470 B8R1.4 C1=CC(=CC(=C1)Br)O B106995 [2,0,0,0,0,0|1,0,0]=3 471 B8R1.4 C1=CC(=CC(=C1)Br)S B106987 [2,0,0,0,0,0|1,1,0]=4 472 B8R1.4 C1=CC(=CC(=C1)Cl)Cl D108531 [2,0,0,0,0,0|2,0,0]=4 473 B8R1.4 C1=CC(=CC(=C1)Cl)Cl D108532 [2,0,0,0,0,0|2,0,0]=4 474 B8R1.4 C1=CC(=CC(=C1)Cl)Cl D108536 [2,0,0,0,0,0|2,0,0]=4 475 B8R1.4 C1=CC(=CC(=C1)Cl)Cl D108538 [2,0,0,0,0,0|2,0,0]=4 476 B8R1.4 C1=CC(=CC(=C1)Cl)F C120580 [2,0,0,0,0,0|2,0,0]=4 477 B8R1.4 C1=CC(=CC(=C1)Cl)N C103948 [2,0,0,0,0,0|2,0,0]=4 478 B8R1.4 C1=CC(=CC(=C1)Cl)O C104273 [2,0,0,0,0,0|1,0,0]=3 479 B8R1.4 C1=CC(=CC(=C1)Cl)O C104276 [2,0,0,0,0,0|1,0,0]=3 480 B8R1.4 C1=CC(=CC(=C1)Cl)S C101765 [2,0,0,0,0,0|1,1,0]=4 481 B8R1.4 C1=CC(=CC(=C1)F)F D154172 [2,0,0,0,0,0|2,0,0]=4 482 B8R1.4 C1=CC(=CC(=C1)F)N F107123 [2,0,0,0,0,0|2,0,0]=4 483 B8R1.4 C1=CC(=CC(=C1)F)O F120588 [2,0,0,0,0,0|1,0,0]=3 484 B8R1.4 C1=CC(=CC(=C1)I)Br B103587 [2,0,0,0,0,0|2,0,0]=4 485 B8R1.4 C1=CC(=CC(=C1)I)Cl C124310 [2,0,0,0,0,0|2,0,0]=4 486 B8R1.4 C1=CC(=CC(=C1)I)F F115539 [2,0,0,0,0,0|2,0,0]=4 487 B8R1.4 C1=CC(=CC(=C1)I)I D185637 [2,0,0,0,0,0|2,0,0]=4 488 B8R1.4 C1=CC(=CC(=C1)I)N I103150 [2,0,0,0,0,0|2,0,0]=4 489 B8R1.4 C1=CC(=CC(=C1)I)O I103144 [2,0,0,0,0,0|1,0,0]=3 490 B8R1.4 C1=CC(=CC(=C1)N)N P101105 [2,0,0,0,0,0|2,0,0]=4 491 B8R1.4 C1=CC(=CC(=C1)N)N P111631 [2,0,0,0,0,0|2,0,0]=4 492 B8R1.4 C1=CC(=CC(=C1)N)N P111632 [2,0,0,0,0,0|2,0,0]=4 493 B8R1.4 C1=CC(=CC(=C1)N)N P113284 [2,0,0,0,0,0|2,0,0]=4 494 B8R1.4 C1=CC(=CC(=C1)O)N A108481 [2,0,0,0,0,0|1,0,0]=3 495 B8R1.4 C1=CC(=CC(=C1)O)N A108482 [2,0,0,0,0,0|1,0,0]=3 496 B8R1.4 C1=CC(=CC(=C1)O)N A113896 [2,0,0,0,0,0|1,0,0]=3 497 B8R1.4 C1=CC(=CC(=C1)O)N A301746 [2,0,0,0,0,0|1,0,0]=3 498 B8R1.4 C1=CC(=CC(=C1)O)O R111662 [2,0,0,0,0,0|0,0,0]=2 499 B8R1.4 C1=CC(=CC(=C1)O)O R111663 [2,0,0,0,0,0|0,0,0]=2 500 B8R1.4 C1=CC(=CC(=C1)S)F F101760 [2,0,0,0,0,0|1,1,0]=4 501 B8R1.4 C1=CC(=CC(=C1)S)N A107495 [2,0,0,0,0,0|1,1,0]=4 502 B8R1.4 C1=CC(=CC(=C1)S)O M101785 [2,0,0,0,0,0|0,1,0]=3 503 B8R1.4 C1=CC(=CC(=C1)S)S B152749 [2,0,0,0,0,0|0,2,0]=4 504 B8R1.4 C1=CC(=C[N+](=C1)[O-])O H137661 [2,0,0,0,0,0|1,0,1]=4 505 B8R1.4 C1=CC(=O)NC(=C1)O D165567 [2,0,0,0,0,0|1,0,1]=4 506 B8R1.4 C1=CNC(=O)C=C1O D110324 [2,0,0,0,0,0|1,0,1]=4 507 B8R1.4 CC1=CC(=CC=C1)Br B104640 [2,0,0,0,0,0|1,0,0]=3 508 B8R1.4 CC1=CC(=CC=C1)C X103345 [2,0,0,0,0,0|0,0,0]=2 509 B8R1.4 CC1=CC(=CC=C1)C X103348 [2,0,0,0,0,0|0,0,0]=2 510 B8R1.4 CC1=CC(=CC=C1)C X103350 [2,0,0,0,0,0|0,0,0]=2 511 B8R1.4 CC1=CC(=CC=C1)C X119707 [2,0,0,0,0,0|0,0,0]=2 512 B8R1.4 CC1=CC(=CC=C1)Cl C104627 [2,0,0,0,0,0|1,0,0]=3 513 B8R1.4 CC1=CC(=CC=C1)F F123650 [2,0,0,0,0,0|1,0,0]=3 514 B8R1.4 CC1=CC(=CC=C1)I I102000 [2,0,0,0,0,0|1,0,0]=3 515 B8R1.4 CC1=CC(=CC=C1)N M158301 [2,0,0,0,0,0|1,0,0]=3 516 B8R1.4 CC1=CC(=CC=C1)N T110548 [2,0,0,0,0,0|1,0,0]=3 517 B8R1.4 CC1=CC(=CC=C1)N T110549 [2,0,0,0,0,0|1,0,0]=3 518 B8R1.4 CC1=CC(=CC=C1)N T110550 [2,0,0,0,0,0|1,0,0]=3 519 B8R1.4 CC1=CC(=CC=C1)O C108242 [2,0,0,0,0,0|0,0,0]=2 520 B8R1.4 CC1=CC(=CC=C1)O C108243 [2,0,0,0,0,0|0,0,0]=2 521 B8R1.4 CC1=CC(=CC=C1)O C108245 [2,0,0,0,0,0|0,0,0]=2 522 B8R1.4 CC1=CC(=CC=C1)O C108246 [2,0,0,0,0,0|0,0,0]=2 523 B8R1.4 CC1=CC(=CC=C1)O C108247 [2,0,0,0,0,0|0,0,0]=2 524 B8R1.4 CC1=CC(=CC=C1)S M100575 [2,0,0,0,0,0|0,1,0]=3 525 B8R1.4 CC1=CC(=CN=C1)Br B120789 [2,0,0,0,0,0|2,0,0]=4 526 B8R1.4 CC1=CC(=CN=C1)C L106291 [2,0,0,0,0,0|1,0,0]=3 527 B8R1.4 CC1=CC(=CN=C1)Cl C191816 [2,0,0,0,0,0|2,0,0]=4 528 B8R1.4 CC1=CC(=CN=C1)F F184385 [2,0,0,0,0,0|2,0,0]=4 529 B8R1.4 CC1=CC(=CN=C1)N A134931 [2,0,0,0,0,0|2,0,0]=4 530 B8R1.4 CC1=CC(=CN=C1)O H129072 [2,0,0,0,0,0|1,0,0]=3 531 B8R1.4 CC1=CC(=C[C-]=C1)C D140723 [2,0,0,0,0,0|0,0,1]=3 532 B8R1.4 CC1=CC(=NC=C1)Br B115781 [2,0,0,0,0,0|2,0,0]=4 533 B8R1.4 CC1=CC(=NC=C1)C L109206 [2,0,0,0,0,0|1,0,0]=3 534 B8R1.4 CC1=CC(=NC=C1)Cl C119971 [2,0,0,0,0,0|2,0,0]=4 535 B8R1.4 CC1=CC(=NC=C1)F F138875 [2,0,0,0,0,0|2,0,0]=4 536 B8R1.4 CC1=CC(=NC=C1)N A107213 [2,0,0,0,0,0|2,0,0]=4 537 B8R1.4 CC1=CC(=NC=C1)N A107214 [2,0,0,0,0,0|2,0,0]=4 538 B8R1.4 CC1=CC(=NC=N1)C W132404 [2,0,0,0,0,0|2,0,0]=4 539 B8R1.4 CC1=CC(=O)NC=C1 H115748 [2,0,0,0,0,0|1,0,1]=4 540 B8R1.4 CC1=CC(=S)NC=C1 M404771 [2,0,0,0,0,0|1,1,0]=4 541 B8R1.4 CC1=CC=CC(=O)N1 H107721 [2,0,0,0,0,0|1,0,1]=4 542 B8R1.4 CC1=CC=CC(=S)N1 M168093 [2,0,0,0,0,0|1,1,0]=4 543 B8R1.4 CC1=CN=CC(=N1)C D154789 [2,0,0,0,0,0|2,0,0]=4 544 B8R1.4 CC1=C[N+](=CC=C1)[O-] M124329 [2,0,0,0,0,0|1,0,1]=4 545 B8R1.4 CC1=NC(=CC=C1)Br B101571 [2,0,0,0,0,0|2,0,0]=4 546 B8R1.4 CC1=NC(=CC=C1)C L105811 [2,0,0,0,0,0|1,0,0]=3 547 B8R1.4 CC1=NC(=CC=C1)C L105812 [2,0,0,0,0,0|1,0,0]=3 548 B8R1.4 CC1=NC(=CC=C1)Cl C124344 [2,0,0,0,0,0|2,0,0]=4 549 B8R1.4 CC1=NC(=CC=C1)F F119659 [2,0,0,0,0,0|2,0,0]=4 550 B8R1.4 CC1=NC(=CC=C1)N A107178 [2,0,0,0,0,0|2,0,0]=4 551 B8R1.4 CC1=NC=CC(=C1)Br B120727 [2,0,0,0,0,0|2,0,0]=4 552 B8R1.4 CC1=NC=CC(=C1)Br B591103 [2,0,0,0,0,0|2,0,0]=4 553 B8R1.4 CC1=NC=CC(=C1)Cl C133675 [2,0,0,0,0,0|2,0,0]=4 554 B8R1.4 CC1=NC=CC(=C1)N A103053 [2,0,0,0,0,0|2,0,0]=4 555 B8R1.4 Oc1cccc(O)c1 R111664 [2,0,0,0,0,0|0,0,0]=2 556 B10R0.59 COC(=O)CC=CC(=O)OC D170731 [0,1,1,0,0,0|1,0,1]=4 557 B10R1.2 C1=CC(=C(C(=C1)O)Br)C=O B182471 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.2 C1=CC(=C(C(=C1)O)Cl)C=O C193994 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.2 C1=CC(=C(C(=C1)O)F)C=O F586213 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.2 C1=CC(=C(C(=C1)O)O)C=O D122910 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.2 CC1=C(C(=CC=C1)C#N)Br B169138 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.2 CC1=C(C(=CC=C1)C#N)C D136198 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.2 CC1=C(C(=CC=C1)C#N)F F182301 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.2 CC1=C(C(=CC=C1)C=O)Br B189639 [1,1,0,0,0,0|2,0,0]=4 565 B10R1.2 CC1=C(C(=CC=C1)C=O)C D122616 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.2 CC1=C(C(=CC=C1)C=O)F F187765 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.2 CC1=C(C(=CC=C1)C=O)O M124154 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.2 CC1=C(C(=CC=C1)CBr)F F299937 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.2 CC1=C(C(=CC=C1)CCl)C D302497 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.2 CC1=C(C(=CC=C1)CO)C D155715 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.2 CC1=C(C(=CC=C1)CO)N A350887 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.2 CC1=C(C(=CC=C1)NN)C D130097 [1,1,0,0,0,0|2,0,0]=4 573 B10R1.2 CC1=C(C(=CC=C1)NN)C D589506 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.2 CC1=C(C(=CC=C1)OC)Br B588949 [1,1,0,0,0,0|0,0,0]=2 575 B10R1.2 CC1=C(C(=CC=C1)OC)C D123572 [1,1,0,0,0,0|0,0,0]=2 576 B10R1.2 CC1=C(C(=CC=C1)OC)N M122432 [1,1,0,0,0,0|0,0,0]=2 577 B10R1.2 CC1=C(C(=NC=C1)OC)Br B186221 [1,1,0,0,0,0|1,0,0]=3 578 B10R1.2 CC1=C(C=CC=C1Br)OC B183641 [1,1,0,0,0,0|1,0,0]=3 579 B10R1.2 CC1=C(C=CC=C1Cl)OC C153448 [1,1,0,0,0,0|1,0,0]=3 580 B10R1.2 CC1=C(C=CC=C1OC)N M122543 [1,1,0,0,0,0|1,0,0]=3 581 B10R1.2 CCC1=CC=CC(=C1C)C E156303 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.2 CCC1=CC=CC(=C1N)C M113273 [1,1,0,0,0,0|1,0,0]=3 583 B10R1.2 CCC1=CC=CC(=C1O)C E156227 [1,1,0,0,0,0|1,0,0]=3 584 B10R1.2 COC1=C(C(=CC=C1)Br)F B183493 [1,1,0,0,0,0|1,0,0]=3 585 B10R1.2 COC1=C(C(=CC=C1)Br)O B152682 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.2 COC1=C(C(=CC=C1)Cl)Cl D155544 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.2 COC1=C(C(=CC=C1)Cl)F C183246 [1,1,0,0,0,0|1,0,0]=3 588 B10R1.2 COC1=C(C(=CC=C1)F)F D115511 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.2 COC1=C(C(=CC=C1)F)O W134426 [1,1,0,0,0,0|1,0,0]=3 590 B10R1.2 COC1=C(C(=NC=C1)Cl)Br B587259 [1,1,0,0,0,0|2,0,0]=4 591 B10R1.2 COC1=CC=CC(=C1Br)N B179486 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.2 COC1=CC=CC(=C1Br)O B167079 [1,1,0,0,0,0|0,0,0]=2 593 B10R1.2 COC1=CC=CC(=C1Cl)N C172103 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.2 COC1=CC=CC(=C1N)O A589052 [1,1,0,0,0,0|0,0,0]=2 595 B10R1.2 COC1=CC=CC(=C1O)O M157868 [1,1,0,0,0,0|0,0,0]=2 596 B10R1.2 COC1=NC=CC(=C1N)N B301204 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.8 C1=C(C=C(C=C1O)Br)C#N B194994 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.8 C1=C(C=C(C=C1O)Br)C=O B191889 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.8 C1=C(C=C(C=C1O)Cl)C#N C153844 [1,1,0,0,0,0|2,0,0]=4 600 B10R1.8 C1=C(C=C(C=C1O)F)C#N F331697 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.8 C1=C(C=C(C=C1O)F)C=O F586168 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.8 C1=C(C=C(C=C1O)O)C=O D120469 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.8 C1=C(C=C(C=C1O)O)CO D123605 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.8 CC1=CC(=CC(=C1)Br)C#N B180527 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.8 CC1=CC(=CC(=C1)Br)OC B134915 [1,1,0,0,0,0|0,0,0]=2 606 B10R1.8 CC1=CC(=CC(=C1)C#N)C D588237 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.8 CC1=CC(=CC(=C1)C=O)C D155984 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.8 CC1=CC(=CC(=C1)CBr)C D111807 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.8 CC1=CC(=CC(=C1)CO)C D169187 [1,1,0,0,0,0|2,0,0]=4 610 B10R1.8 CC1=CC(=CC(=C1)Cl)C#N C182379 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.8 CC1=CC(=CC(=C1)F)C#N F120485 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.8 CC1=CC(=CC(=C1)F)C=O F120642 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.8 CC1=CC(=CC(=C1)F)C=O F140815 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.8 CC1=CC(=CC(=C1)F)OC F191249 [1,1,0,0,0,0|0,0,0]=2 615 B10R1.8 CC1=CC(=CC(=C1)NN)C D102566 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.8 CC1=CC(=CC(=C1)OC)C D155514 [1,1,0,0,0,0|0,0,0]=2 617 B10R1.8 CC1=CC(=CC(=C1)OC)O M158097 [1,1,0,0,0,0|0,0,0]=2 618 B10R1.8 CC1=CC(=CC(=O)O1)OC M352828 [1,1,0,0,0,0|1,0,0]=3 619 B10R1.8 CC1=CC(=NC(=N1)N)OC A151323 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.8 CCC1=CC(=CC(=C1)C)C E156311 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.8 CCC1=CC(=CC(=C1)F)F E156301 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.8 COC1=CC(=CC(=C1)Br)Br D124373 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.8 COC1=CC(=CC(=C1)Br)Cl B182113 [1,1,0,0,0,0|1,0,0]=3 624 B10R1.8 COC1=CC(=CC(=C1)Br)F B124374 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.8 COC1=CC(=CC(=C1)Cl)Cl D106511 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.8 COC1=CC(=CC(=C1)Cl)Cl D106512 [1,1,0,0,0,0|1,0,0]=3 627 B10R1.8 COC1=CC(=CC(=C1)Cl)F C153360 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.8 COC1=CC(=CC(=C1)F)F D103556 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.8 COC1=CC(=CC(=C1)N)Br B181939 [1,1,0,0,0,0|1,0,0]=3 630 B10R1.8 COC1=CC(=CC(=C1)N)Cl C586185 [1,1,0,0,0,0|1,0,0]=3 631 B10R1.8 COC1=CC(=CC(=C1)O)O M138499 [1,1,0,0,0,0|0,0,0]=2 632 B10R1.8 COC1=CC(=CC(=C1)O)O M473049 [1,1,0,0,0,0|0,0,0]=2 633 B10R1.8 COC1=CC(=NC(=C1)Br)Br D189911 [1,1,0,0,0,0|2,0,0]=4 634 B10R1.8 COC1=NC(=CC(=O)N1)O M191577 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.8 CSC1=CC(=CC(=C1)Cl)Cl D101841 [1,1,0,0,0,0|1,1,0]=4 636 B10R1.10 C1=CC(=CC(=C1)Br)CCN B101708 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.10 C1=CC(=CC(=C1)Br)CCO B102008 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.10 C1=CC(=CC(=C1)Cl)CCBr C167806 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.10 C1=CC(=CC(=C1)Cl)CCN C153963 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.10 C1=CC(=CC(=C1)Cl)CCO C153312 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.10 C1=CC(=CC(=C1)F)CCBr F135723 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.10 C1=CC(=CC(=C1)F)CCN W133696 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.10 C1=CC(=CC(=C1)F)CCO F156602 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.10 C1=CC(=CC(=C1)N)CCO A589356 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.10 C1=CC(=CC(=C1)O)CC#N M350354 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.10 C1=CC(=CC(=C1)O)CCO H167016 [1,1,0,0,0,0|1,0,0]=3 647 B10R1.10 CC1=CC(=CC=C1)CC#N M158779 [1,1,0,0,0,0|1,0,1]=4 648 B10R1.10 CC1=CC(=CC=C1)CC=C A169645 [1,1,0,0,0,0|1,0,1]=4 649 B10R1.10 CC1=CC(=CC=C1)CCBr M332837 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.10 CC1=CC(=CC=C1)CCCl C193160 [1,1,0,0,0,0|1,0,0]=3 651 B10R1.10 CC1=CC(=CC=C1)CCN M170979 [1,1,0,0,0,0|1,0,0]=3 652 B10R1.10 CC1=CC(=CC=C1)CCO M157912 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.10 CC1=CC(=CC=C1)CNC M158625 [1,1,0,0,0,0|1,0,0]=3 654 B10R1.10 CC1=CC(=CC=C1)N=C=O M103625 [1,1,0,0,0,0|1,0,1]=4 655 B10R1.10 CC1=CC(=CC=C1)N=C=S M158321 [1,1,0,0,0,0|1,0,1]=4 656 B10R1.10 CCCC1=CC=CC(=C1)C P160391 [1,1,0,0,0,0|1,0,0]=3 657 B10R1.10 CCNC1=CC=CC(=C1)C E140164 [1,1,0,0,0,0|1,0,0]=3 658 B10R1.10 CCOC1=CC(=CC=C1)Br B136517 [1,1,0,0,0,0|1,0,0]=3 659 B10R1.10 CCOC1=CC(=CC=C1)S E101783 [1,1,0,0,0,0|0,1,0]=3 660 B10R1.10 CCOC1=CC(=CN=C1)Br B152240 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.10 CCOC1=CC(=NC=C1)N A589357 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.10 CCOC1=CC=CC(=C1)N E101872 [1,1,0,0,0,0|1,0,0]=3 663 B10R1.10 CCOC1=CC=CC(=C1)O E156223 [1,1,0,0,0,0|0,0,0]=2 664 B10R1.10 CCOC1=NC(=CC=C1)Cl C154060 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.10 CCOC1=NC=CC(=C1)N A187936 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.10 CCOC1=NC=NC(=C1)C E339561 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.10 CCSC1=CC(=CC=C1)Br B168061 [1,1,0,0,0,0|1,1,0]=4 668 B10R1.10 CNCC1=CC(=CC=C1)Br B121859 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.10 CNCC1=CC(=CC=C1)Br B140813 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.10 CNCC1=CC(=CC=C1)Cl C170092 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.10 CNCC1=CC(=CC=C1)F F156708 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.10 CNCC1=CC(=CC=C1)N A151692 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.30 C1=CC(=C(C=C1O)C#N)Br B182389 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.30 C1=CC(=C(C=C1O)C#N)F F586245 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.30 C1=CC(=C(C=C1O)C=O)Br B135432 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.30 C1=CC(=C(C=C1O)C=O)F F178939 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.30 C1=CC(=C(C=C1O)C=O)O D109443 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.30 CC1=C(C=C(C=C1)Br)OC B136005 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.30 CC1=C(C=C(C=C1)F)OC F305032 [1,1,0,0,0,0|1,0,0]=3 680 B10R1.30 CC1=C(C=C(C=C1)N)OC M124256 [1,1,0,0,0,0|1,0,0]=3 681 B10R1.30 CC1=CC(=C(C=C1)Br)C#N B123973 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.30 CC1=CC(=C(C=C1)Br)C=O B187963 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.30 CC1=CC(=C(C=C1)Br)OC B196086 [1,1,0,0,0,0|0,0,0]=2 684 B10R1.30 CC1=CC(=C(C=C1)C)C=C D168401 [1,1,0,0,0,0|1,0,1]=4 685 B10R1.30 CC1=CC(=C(C=C1)C)C=O D301675 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.30 CC1=CC(=C(C=C1)C)NN D102568 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.30 CC1=CC(=C(C=C1)C)OC D155516 [1,1,0,0,0,0|0,0,0]=2 688 B10R1.30 CC1=CC(=C(C=C1)F)C#N F120482 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.30 CC1=CC(=C(C=C1)F)C=O F120636 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.30 CC1=CC(=C(C=C1)F)C=O F140814 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.30 CC1=CC(=C(C=C1)F)OC W135051 [1,1,0,0,0,0|0,0,0]=2 692 B10R1.30 CC1=CC(=C(C=C1)N)C#C E168613 [1,1,0,0,0,0|1,0,1]=4 693 B10R1.30 CC1=CC(=C(C=C1)N)C#N A140195 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.30 CC1=CC(=C(C=C1)N)CO A169771 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.30 CC1=CC(=C(C=C1)N)OC M472436 [1,1,0,0,0,0|0,0,0]=2 696 B10R1.30 CC1=CC(=C(C=C1)O)C=O M157866 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.30 CC1=CC(=C(C=C1)O)OC M158094 [1,1,0,0,0,0|0,0,0]=2 698 B10R1.30 CC1=CC(=C(N=C1)Cl)OC C166455 [1,1,0,0,0,0|1,0,0]=3 699 B10R1.30 CC1=CN=C(C(=N1)OC)C M302692 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.30 CC1=NC(=C(C=C1)Br)OC B589982 [1,1,0,0,0,0|1,0,0]=3 701 B10R1.30 CCC1=C(C=CC(=C1)Br)N B301247 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.30 CCC1=C(C=CC(=C1)C)C E404389 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.30 CCC1=C(C=CC(=C1)F)O E170137 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.30 CCC1=C(C=CC(=C1)O)Cl C153527 [1,1,0,0,0,0|1,0,0]=3 705 B10R1.30 CCC1=C(C=CC(=N1)C)O E134371 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.30 CCC1=C(C=CC(=N1)C)O E404399 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.30 CNC1=C(C=CC(=C1)Br)N B588778 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.30 COC1=C(C=CC(=C1)Br)Br D196105 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.30 COC1=C(C=CC(=C1)Br)Cl B124391 [1,1,0,0,0,0|1,0,0]=3 710 B10R1.30 COC1=C(C=CC(=C1)Br)F B120997 [1,1,0,0,0,0|1,0,0]=3 711 B10R1.30 COC1=C(C=CC(=C1)Br)N B122478 [1,1,0,0,0,0|1,0,0]=3 712 B10R1.30 COC1=C(C=CC(=C1)Br)O B102096 [1,1,0,0,0,0|1,0,0]=3 713 B10R1.30 COC1=C(C=CC(=C1)Cl)Br B124292 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.30 COC1=C(C=CC(=C1)Cl)Cl D191881 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.30 COC1=C(C=CC(=C1)Cl)O C153525 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.30 COC1=C(C=CC(=C1)F)Br B120994 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.30 COC1=C(C=CC(=C1)F)Cl C122584 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.30 COC1=C(C=CC(=C1)F)F D122594 [1,1,0,0,0,0|1,0,0]=3 719 B10R1.30 COC1=C(C=CC(=C1)F)N F136326 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.30 COC1=C(C=CC(=C1)F)N F182198 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.30 COC1=C(C=CC(=C1)F)O F156738 [1,1,0,0,0,0|1,0,0]=3 722 B10R1.30 COC1=C(C=CC(=C1)I)Br B186427 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.30 COC1=C(C=CC(=C1)I)Cl C191291 [1,1,0,0,0,0|1,0,0]=3 724 B10R1.30 COC1=C(C=CC(=C1)I)N I169689 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.30 COC1=C(C=CC(=C1)N)Br B122479 [1,1,0,0,0,0|1,0,0]=3 726 B10R1.30 COC1=C(C=CC(=C1)N)Cl C122526 [1,1,0,0,0,0|1,0,0]=3 727 B10R1.30 COC1=C(C=CC(=C1)N)F F185773 [1,1,0,0,0,0|1,0,0]=3 728 B10R1.30 COC1=C(C=CC(=C1)N)N D185909 [1,1,0,0,0,0|1,0,0]=3 729 B10R1.30 COC1=C(C=CC(=C1)N)O A122694 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.30 COC1=C(C=CC(=C1)N)O A493765 [1,1,0,0,0,0|1,0,0]=3 731 B10R1.30 COC1=C(C=CC(=C1)O)Br B123474 [1,1,0,0,0,0|0,0,0]=2 732 B10R1.30 COC1=C(C=CC(=C1)O)O M136895 [1,1,0,0,0,0|0,0,0]=2 733 B10R1.30 COC1=C(C=CC(=N1)Br)N A187873 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.30 COC1=C(N=CC(=C1)Br)Cl B138607 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.30 COC1=C(N=CC(=C1)Br)I B188523 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.30 COC1=C(N=CC(=C1)Br)N B184471 [1,1,0,0,0,0|2,0,0]=4 737 B10R1.30 COC1=CC(=NC=C1Br)F B586621 [1,1,0,0,0,0|2,0,0]=4 738 B10R1.30 COC1=CC(=NC=C1I)N L573549 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.30 COC1=CC(=NC=C1N)Cl C586813 [1,1,0,0,0,0|2,0,0]=4 740 B10R1.30 COC1=CC(=O)C=CC1=O M140181 [1,1,0,0,0,0|0,0,1]=3 741 B10R1.113 B(C1=CC(=CC=C1)C)(O)O T103179 [1,1,0,0,0,0|2,0,0]=4 742 B10R1.113 B(C1=CC(=CC=C1)O)(O)O H103194 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.113 C1=CC(=CC(=C1)O)C(=O)N H404550 [1,1,0,0,0,0|2,0,0]=4 744 B10R1.113 C1=CC(=CC(=C1)O)C(=O)O H104349 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.113 C1=CC(=CC(=C1)O)C(=O)O H427216 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.113 C1=CC(=CC(=C1)O)C(=O)[O-] S161402 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.113 C1=CC(=CC(=C1)O)[N+](=O)[O-] N100695 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.113 C1=CC(=CC(=C1)O)[N+](=O)[O-] N100696 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.113 C1=CC(=CC(=C1)O)[N+](=O)[O-] N100697 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.113 C1=CC(=CC(=C1)O)[N+](=O)[O-] N100700 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.113 C1=CC(=CC(=C1)O)[N+](=O)[O-] N299246 [1,1,0,0,0,0|2,0,0]=4 752 B10R1.113 C1=CC(=CC(=C1)O)[N+](=O)[O-] N349025 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.113 C1=CC(=CC(=C1)O)[N+](=O)[O-] N396567 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.113 CC(=O)C1=CC(=CC=C1)Br B106964 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl C139514 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.113 CC(=O)C1=CC(=CC=C1)F F122012 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.113 CC(=O)C1=CC(=CC=C1)F F299100 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.113 CC(=O)C1=CC(=CC=C1)I I122014 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.113 CC(=O)C1=CC(=CC=C1)N A107200 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.113 CC(=O)C1=CC(=CC=C1)O H106329 [1,1,0,0,0,0|1,0,0]=3 761 B10R1.113 CC(C)C1=CC(=CC=C1)Br B134202 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.113 CC(C)C1=CC(=CC=C1)N I107961 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.113 CC(C)C1=CC(=CC=C1)O I136677 [1,1,0,0,0,0|1,0,0]=3 764 B10R1.113 CC(C1=CC(=CC=C1)Br)N I132915 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.113 CC(C1=CC(=CC=C1)Br)N I133228 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.113 CC(C1=CC(=CC=C1)Br)O D303896 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.113 CC(C1=CC(=CC=C1)Br)O S587024 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.113 CC(C1=CC(=CC=C1)Cl)O C153311 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.113 CC(C1=CC(=CC=C1)F)N R194943 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.113 CC(C1=CC(=CC=C1)F)N S193436 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.113 CC(C1=CC(=CC=C1)F)O E492423 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.113 CC(C1=CC(=CC=C1)F)O R586867 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.113 CC(C1=CC(=CC=C1)O)O H157331 [1,1,0,0,0,0|1,0,0]=3 774 B10R1.113 CC1=CC(=CC=C1)C(=C)C D302222 [1,1,0,0,0,0|1,0,0]=3 775 B10R1.113 CC1=CC(=CC=C1)C(=O)C M122466 [1,1,0,0,0,0|1,0,0]=3 776 B10R1.113 CC1=CC(=CC=C1)C(=O)Cl T101293 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.113 CC1=CC(=CC=C1)C(=O)Cl T299642 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.113 CC1=CC(=CC=C1)C(=O)N B300415 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.113 CC1=CC(=CC=C1)C(=O)O T112606 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.113 CC1=CC(=CC=C1)C(C)C M158019 [1,1,0,0,0,0|1,0,0]=3 781 B10R1.113 CC1=CC(=CC=C1)C(C)N M194671 [1,1,0,0,0,0|1,0,0]=3 782 B10R1.113 CC1=CC(=CC=C1)N(C)C D140173 [1,1,0,0,0,0|1,0,0]=3 783 B10R1.113 CC1=CC(=CC=C1)[N+](=O)[O-] N105604 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.113 CC1=CC(=CC=C1)[N+](=O)[O-] N105605 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.113 CC1=CC(=CC=C1)[N+](=O)[O-] N105606 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.113 CC1=CC(=CC=C1)[N+](=O)[O-] N105608 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.113 CC1=CC(=NC=C1)C(=O)C A115766 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.113 CC1=NC(=CC=C1)C(=O)C A194623 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.113 CN(C)C1=CC(=CC=C1)Br B132166 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.113 CN(C)C1=CC(=CC=C1)Cl C153964 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.113 CN(C)C1=CC(=CC=C1)O D124561 [1,1,0,0,0,0|1,0,0]=3 792 B10R1.113 CN(C)C1=CC=CC(=C1)N D113423 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.113 CN(C)C1=CC=CC(=C1)N N588562 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.176 C1=CC(=C(C=C1C#N)O)Cl C589331 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.176 C1=CC(=C(C=C1C#N)O)F F182327 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.176 C1=CC(=C(C=C1C#N)O)I H588102 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.176 C1=CC(=C(C=C1C#N)O)O D154618 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.176 C1=CC(=C(C=C1C=O)O)O D108634 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.176 C1=CC(=C(C=C1C=O)O)O D108636 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.176 C1=CC(=C(C=C1C=O)O)O D130075 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.176 C1=CC(=C(C=C1CN)O)O D167718 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.176 C1=CC(=C(C=C1CO)O)O D155345 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.176 CC1=C(C=C(C=C1)C#N)C D168795 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.176 CC1=C(C=C(C=C1)C#N)O H184166 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.176 CC1=C(C=C(C=C1)C=O)C D123177 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.176 CC1=C(C=C(C=C1)CCl)C C189378 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.176 CC1=C(C=C(C=C1)CN)C D132092 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.176 CC1=C(C=C(C=C1)CO)C D331591 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.176 CC1=C(C=C(C=C1)NN)C D101717 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.176 CC1=C(C=C(C=C1)OC)Br B193028 [1,1,0,0,0,0|1,0,0]=3 811 B10R1.176 CC1=C(C=C(C=C1)OC)C D170479 [1,1,0,0,0,0|0,0,0]=2 812 B10R1.176 CC1=C(C=C(C=C1)OC)Cl C405497 [1,1,0,0,0,0|1,0,0]=3 813 B10R1.176 CC1=C(C=C(C=C1)OC)F F193262 [1,1,0,0,0,0|1,0,0]=3 814 B10R1.176 CC1=C(C=C(C=C1)OC)N W134180 [1,1,0,0,0,0|1,0,0]=3 815 B10R1.176 CC1=C(C=CC(=C1)C#C)F E331048 [1,1,0,0,0,0|1,0,1]=4 816 B10R1.176 CC1=C(C=CC(=C1)C#N)Br B122726 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.176 CC1=C(C=CC(=C1)C#N)Cl C193416 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.176 CC1=C(C=CC(=C1)C#N)F F120489 [1,1,0,0,0,0|2,0,0]=4 819 B10R1.176 CC1=C(C=CC(=C1)C#N)N A121619 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.176 CC1=C(C=CC(=C1)C#N)N A298928 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.176 CC1=C(C=CC(=C1)C=O)Br B186637 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.176 CC1=C(C=CC(=C1)C=O)Cl C353131 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.176 CC1=C(C=CC(=C1)C=O)F F120646 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.176 CC1=C(C=CC(=C1)C=O)O H124186 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.176 CC1=C(C=CC(=C1)CBr)F F129140 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.176 CC1=C(C=CC(=C1)CN)F F122788 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.176 CC1=C(C=CC(=C1)CO)Br B181609 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.176 CC1=C(C=CC(=C1)CO)F F183255 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.176 CC1=C(C=CC(=C1)NN)Cl C168713 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.176 CC1=C(C=CC(=C1)OC)Br B115843 [1,1,0,0,0,0|0,0,0]=2 831 B10R1.176 CC1=C(C=CC(=C1)OC)F W137121 [1,1,0,0,0,0|0,0,0]=2 832 B10R1.176 CC1=C(C=CC(=C1)OC)N M124249 [1,1,0,0,0,0|0,0,0]=2 833 B10R1.176 CC1=C(C=CC(=C1)OC)O H193776 [1,1,0,0,0,0|0,0,0]=2 834 B10R1.176 CC1=C(C=CC(=N1)OC)Br B120739 [1,1,0,0,0,0|1,0,0]=3 835 B10R1.176 CC1=C(C=CC(=N1)OC)N A184948 [1,1,0,0,0,0|1,0,0]=3 836 B10R1.176 CC1=CC(=NC=C1Br)OC W131917 [1,1,0,0,0,0|1,0,0]=3 837 B10R1.176 CC1=CC(=NC=C1N)OC A185897 [1,1,0,0,0,0|1,0,0]=3 838 B10R1.176 CCC1=CC(=C(C=C1)O)Br B589769 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.176 CCC1=CC(=C(C=C1)O)O E165960 [1,1,0,0,0,0|1,0,0]=3 840 B10R1.176 CNC1=CC(=C(C=C1)Cl)Cl D589045 [1,1,0,0,0,0|2,0,0]=4 841 B10R1.176 COC1=CC(=C(C=C1)Br)Cl B184846 [1,1,0,0,0,0|1,0,0]=3 842 B10R1.176 COC1=CC(=C(C=C1)Br)F B115514 [1,1,0,0,0,0|1,0,0]=3 843 B10R1.176 COC1=CC(=C(C=C1)Br)I B589246 [1,1,0,0,0,0|1,0,0]=3 844 B10R1.176 COC1=CC(=C(C=C1)Br)N B185457 [1,1,0,0,0,0|1,0,0]=3 845 B10R1.176 COC1=CC(=C(C=C1)Br)O B185723 [1,1,0,0,0,0|0,0,0]=2 846 B10R1.176 COC1=CC(=C(C=C1)Cl)Br B120329 [1,1,0,0,0,0|1,0,0]=3 847 B10R1.176 COC1=CC(=C(C=C1)Cl)F C133728 [1,1,0,0,0,0|1,0,0]=3 848 B10R1.176 COC1=CC(=C(C=C1)Cl)N C122489 [1,1,0,0,0,0|1,0,0]=3 849 B10R1.176 COC1=CC(=C(C=C1)Cl)N C134554 [1,1,0,0,0,0|1,0,0]=3 850 B10R1.176 COC1=CC(=C(C=C1)F)Br B576831 [1,1,0,0,0,0|1,0,0]=3 851 B10R1.176 COC1=CC(=C(C=C1)F)Cl C132066 [1,1,0,0,0,0|1,0,0]=3 852 B10R1.176 COC1=CC(=C(C=C1)F)F D155764 [1,1,0,0,0,0|1,0,0]=3 853 B10R1.176 COC1=CC(=C(C=C1)I)Br B184649 [1,1,0,0,0,0|1,0,0]=3 854 B10R1.176 COC1=CC(=C(C=C1)I)O I170223 [1,1,0,0,0,0|0,0,0]=2 855 B10R1.176 COC1=CC(=C(C=C1)N)Cl C192569 [1,1,0,0,0,0|1,0,0]=3 856 B10R1.176 COC1=CC(=C(C=C1)N)F F124247 [1,1,0,0,0,0|1,0,0]=3 857 B10R1.176 COC1=CC(=C(C=C1)N)I I175362 [1,1,0,0,0,0|1,0,0]=3 858 B10R1.176 COC1=CC(=C(C=C1)N)N D178847 [1,1,0,0,0,0|1,0,0]=3 859 B10R1.176 COC1=CC(=C(C=C1)N)N M299127 [1,1,0,0,0,0|1,0,0]=3 860 B10R1.176 COC1=CC(=C(C=C1)N)O H157084 [1,1,0,0,0,0|0,0,0]=2 861 B10R1.176 COC1=CC(=C(C=C1)O)Br B122555 [1,1,0,0,0,0|1,0,0]=3 862 B10R1.176 COC1=CC(=C(C=C1)O)Br B152684 [1,1,0,0,0,0|1,0,0]=3 863 B10R1.176 COC1=CC(=C(C=C1)O)Cl C124268 [1,1,0,0,0,0|1,0,0]=3 864 B10R1.176 COC1=CC(=C(C=C1)O)F F156740 [1,1,0,0,0,0|1,0,0]=3 865 B10R1.176 COC1=CC(=C(C=C1)O)N A299108 [1,1,0,0,0,0|1,0,0]=3 866 B10R1.176 COC1=NC(=C(C=C1)Br)Cl B186590 [1,1,0,0,0,0|2,0,0]=4 867 B10R1.176 COC1=NC(=C(C=C1)Br)F B586697 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.176 COC1=NC(=C(C=C1)Br)N B193667 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.176 COC1=NC(=C(C=C1)Cl)N A590054 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.176 COC1=NC(=C(C=C1)N)Br A181285 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.176 COC1=NC(=C(C=C1)N)Cl A169728 [1,1,0,0,0,0|2,0,0]=4 872 B10R1.176 COC1=NC=C(C(=C1)F)Br B578685 [1,1,0,0,0,0|2,0,0]=4 873 B12R1.11 B(C1=CC(=CC(=C1)Br)OC)(O)O B186929 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.11 B(C1=CC(=CC(=C1)Cl)OC)(O)O C188226 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.11 B(C1=CC(=CC(=C1)F)OC)(O)O F134081 [0,2,0,0,0,0|2,0,0]=4 876 B12R1.11 COC1=CC(=CC(=C1)C(=O)O)Br B123893 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.11 COC1=CC(=CC(=C1)C(=O)O)Cl C123898 [0,2,0,0,0,0|2,0,0]=4 878 B12R1.11 COC1=CC(=CC(=C1)C(=O)O)F F182155 [0,2,0,0,0,0|2,0,0]=4 879 B12R1.11 COC1=CC(=CC(=C1)[N+](=O)[O-])Br B153138 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.58 CCC1=CC(=CC(=C1)CC)CC T162069 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.58 CCC1=CC(=CC(=C1)CC)CC T162082 [0,2,0,0,0,0|2,0,0]=4 882 B12R1.58 COC1=CC(=CC(=C1)C#C)OC E156083 [0,2,0,0,0,0|0,0,0]=2 883 B12R1.58 COC1=CC(=CC(=C1)C#N)OC D123420 [0,2,0,0,0,0|0,0,0]=2 884 B12R1.58 COC1=CC(=CC(=C1)C=O)OC D123418 [0,2,0,0,0,0|0,0,0]=2 885 B12R1.58 COC1=CC(=CC(=C1)CBr)OC D121638 [0,2,0,0,0,0|0,0,0]=2 886 B12R1.58 COC1=CC(=CC(=C1)CN)OC D123487 [0,2,0,0,0,0|0,0,0]=2 887 B12R1.58 COC1=CC(=CC(=C1)CO)OC D123146 [0,2,0,0,0,0|0,0,0]=2 888 B12R1.58 COC1=CC(=CC(=C1)OC)OC T107286 [0,2,0,0,0,0|0,0,0]=2 889 B12R1.58 COC1=CC(=CC(=C1)OC)OC T425144 [0,2,0,0,0,0|0,0,0]=2 890 B12R1.58 COC1=CC(=NC(=N1)OC)OC T161682 [0,2,0,0,0,0|2,0,0]=4 891 B12R1.58 COC1=CC(=NC(=N1)SC)OC D343545 [0,2,0,0,0,0|2,0,0]=4 892 B12R1.235 CC1=CC(=C(C(=C1)OC)O)OC D155325 [0,2,0,0,0,0|0,0,0]=2 893 B12R1.235 CCC1=CC(=CC(=C1N)CC)Br B151819 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.235 CCC1=CC(=CC(=C1N)CC)C D192281 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.235 COC1=CC(=CC(=C1F)OC)Br B588021 [0,2,0,0,0,0|0,0,0]=2 896 B12R1.235 COC1=CC(=CC(=C1O)C=O)Br W134667 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.235 COC1=CC(=CC(=C1O)C=O)Cl C469672 [0,2,0,0,0,0|2,0,0]=4 898 B12R1.235 COC1=CC(=CC(=C1O)OC)O D131900 [0,2,0,0,0,0|0,0,0]=2 899 B12R1.235 COC1=CC(=O)C=C(C1=O)OC D154943 [0,2,0,0,0,0|0,0,0]=2 900 B12R1.300 CC1=CC(=CC(=C1O)OC)C#N H174975 [0,2,0,0,0,0|2,0,0]=4 901 B12R1.300 COC1=C(C(=CC(=C1)C#N)Br)O B152145 [0,2,0,0,0,0|2,0,0]=4 902 B12R1.300 COC1=C(C(=CC(=C1)C=O)Br)O B122967 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.300 COC1=C(C(=CC(=C1)C=O)Br)O B299031 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.300 COC1=C(C(=CC(=C1)C=O)Cl)O C168275 [0,2,0,0,0,0|2,0,0]=4 905 B12R1.300 COC1=C(C(=CC(=C1)C=O)F)O F124172 [0,2,0,0,0,0|2,0,0]=4 906 B12R1.300 COC1=C(C(=CC(=C1)C=O)I)O I157427 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.300 COC1=C(C(=CC(=C1)C=O)I)O I471291 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.300 COC1=C(C(=CC(=C1)CO)Cl)O C168442 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.300 COC1=CC(=CC(=C1O)O)C=O H193175 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.270 CCOC1=C(C=CC(=C1)C=O)O E107635 [0,2,0,0,0,0|2,0,0]=4 911 B12R1.270 CCOC1=C(C=CC(=C1)C=O)O E420925 [0,2,0,0,0,0|2,0,0]=4 912 B12R1.278 CCOC1=CC(=CC=C1)OCC D155735 [0,2,0,0,0,0|0,0,0]=2 913 B12R1.279 B(C1=CC(=CC=C1)OCC)(O)O E103205 [0,2,0,0,0,0|2,0,0]=4 914 B12R1.279 CCOC1=CC=CC(=C1)C(=O)O E185614 [0,2,0,0,0,0|2,0,0]=4 915 B12R1.279 CCOC1=CC=CC(=C1)[N+](=O)[O-] N159807 [0,2,0,0,0,0|2,0,0]=4 916 B12R1.279 COCC1=CC(=CC=C1)C(=O)O M183677 [0,2,0,0,0,0|2,0,0]=4 917 B12R1.280 CCOC1=CC=CC(=C1O)C=O E136337 [0,2,0,0,0,0|2,0,0]=4 918 B12R1.286 CC1=C(C=C(C=C1)CC#N)OC M194391 [0,2,0,0,0,0|1,0,1]=4 919 B12R1.286 CC=CC1=CC(=C(C=C1)O)OC I109576 [0,2,0,0,0,0|1,0,0]=3 920 B12R1.286 CC=CC1=CC(=C(C=C1)O)OC I109577 [0,2,0,0,0,0|1,0,0]=3 921 B12R1.286 CC=CC1=CC(=C(C=C1)O)OC I427191 [0,2,0,0,0,0|1,0,0]=3 922 B12R1.286 CCCC1=CC(=C(C=C1)O)OC M192495 [0,2,0,0,0,0|1,0,0]=3 923 B12R1.286 COC1=C(C=CC(=C1)C=NO)O V169275 [0,2,0,0,0,0|2,0,0]=4 924 B12R1.286 COC1=C(C=CC(=C1)CC#N)Br B586415 [0,2,0,0,0,0|1,0,1]=4 925 B12R1.286 COC1=C(C=CC(=C1)CC#N)O H170413 [0,2,0,0,0,0|1,0,1]=4 926 B12R1.286 COC1=C(C=CC(=C1)CC=C)O E110640 [0,2,0,0,0,0|1,0,1]=4 927 B12R1.286 COC1=C(C=CC(=C1)CC=C)O E110642 [0,2,0,0,0,0|1,0,1]=4 928 B12R1.286 COC1=C(C=CC(=C1)CC=C)O E427189 [0,2,0,0,0,0|1,0,1]=4 929 B12R1.286 COC1=C(C=CC(=C1)CCN)O A303971 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.286 COC1=C(C=CC(=C1)CCN)O M121758 [0,2,0,0,0,0|1,0,0]=3 931 B12R1.286 COC1=C(C=CC(=C1)CCN)O M419970 [0,2,0,0,0,0|1,0,0]=3 932 B12R1.286 COC1=C(C=CC(=C1)CCO)O H168903 [0,2,0,0,0,0|1,0,0]=3 933 B12R1.382 C#CCOC1=CC=CC(=C1)C=O P171012 [0,2,0,0,0,0|2,0,0]=4 934 B12R1.382 C1=CC(=CC(=C1)OCCO)C=O H157343 [0,2,0,0,0,0|2,0,0]=4 935 B12R1.382 COC1=CC(=CC=C1)OCC#N M170649 [0,2,0,0,0,0|0,0,0]=2 936 B12R1.382 COC1=CC=CC(=C1)CCCN M168141 [0,2,0,0,0,0|1,0,0]=3 937 B12R1.382 COC1=CC=CC(=C1)CN=C=O M171043 [0,2,0,0,0,0|1,0,1]=4 938 B12R1.435 CCC(=O)C1=CC(=CC=C1)OC M184135 [0,2,0,0,0,0|1,0,0]=3 939 B12R1.435 CCC1=NC(=CC=C1)C(=O)OC M189455 [0,2,0,0,0,0|2,0,0]=4 940 B12R1.435 COC(=O)C1=CC=CC(=C1)C#C M302153 [0,2,0,0,0,0|1,0,1]=4 941 B12R1.435 COC(=O)C1=CC=CC(=C1)C#N C353029 [0,2,0,0,0,0|2,0,0]=4 942 B12R1.435 COC(=O)C1=CC=CC(=C1)C=O M170769 [0,2,0,0,0,0|2,0,0]=4 943 B12R1.435 COC(=O)C1=CC=CC(=C1)CBr M122545 [0,2,0,0,0,0|2,0,0]=4 944 B12R1.435 COC1=CC(=NC=C1)C(=O)OC M138622 [0,2,0,0,0,0|1,0,0]=3 945 B12R1.435 COC1=CC=CC(=C1)C(=O)C=O M189890 [0,2,0,0,0,0|1,0,1]=4 946 B12R1.435 COC1=CC=CC(=C1)C(=O)CBr M158725 [0,2,0,0,0,0|1,0,0]=3 947 B12R1.435 COC1=CC=CC(=C1)C(=O)NN M158285 [0,2,0,0,0,0|2,0,0]=4 948 B12R1.435 COC1=CC=CC(=N1)C(=O)OC M169135 [0,2,0,0,0,0|1,0,0]=3 949 B12R1.435 COC1=CN=CC(=C1)C(=O)OC M169361 [0,2,0,0,0,0|1,0,0]=3 950 B12R1.438 C1=CC(=CC(=C1)OC(F)F)CN D192268 [0,2,0,0,0,0|2,0,0]=4 951 B12R1.438 CC(=O)CC1=CC(=CC=C1)OC M138635 [0,2,0,0,0,0|1,0,0]=3 952 B12R1.438 CC(=O)OC1=CC=CC(=C1)C=O A136562 [0,2,0,0,0,0|2,0,0]=4 953 B12R1.438 COC1=CC=CC(=C1)CC(=O)O M115481 [0,2,0,0,0,0|1,0,1]=4 954 B12R1.56 B(C1=CC(=C(C=C1)Br)OC)(O)O B586796 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.56 B(C1=CC(=C(C=C1)C)OC)(O)O M120103 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.56 B(C1=CC(=C(C=C1)Cl)OC)(O)O C187895 [0,2,0,0,0,0|2,0,0]=4 957 B12R1.56 B(C1=CC(=C(C=C1)F)OC)(O)O F120108 [0,2,0,0,0,0|2,0,0]=4 958 B12R1.56 CC(=O)C1=CC(=C(C=C1)F)OC F123263 [0,2,0,0,0,0|1,0,0]=3 959 B12R1.56 CC(=O)C1=CC(=C(C=C1)O)OC H156885 [0,2,0,0,0,0|1,0,0]=3 960 B12R1.56 CC(=O)C1=CC(=C(C=C1)O)OC H424289 [0,2,0,0,0,0|1,0,0]=3 961 B12R1.56 CC1=C(C=C(C=C1)C(=O)O)OC M123414 [0,2,0,0,0,0|2,0,0]=4 962 B12R1.56 CC1=C(C=C(C=C1)[N+](=O)[O-])OC M124370 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)Cl C153822 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)F F123929 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)N A122444 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)O V104428 [0,2,0,0,0,0|2,0,0]=4 967 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)O V420927 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.56 COC1=C(C=CC(=C1)C(=O)[O-])O S161403 [0,2,0,0,0,0|2,0,0]=4 969 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])Br B122581 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])Cl C122589 [0,2,0,0,0,0|2,0,0]=4 971 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])F F176516 [0,2,0,0,0,0|2,0,0]=4 972 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])I I122604 [0,2,0,0,0,0|2,0,0]=4 973 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])N M110095 [0,2,0,0,0,0|2,0,0]=4 974 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])O N159820 [0,2,0,0,0,0|2,0,0]=4 975 B12R1.258 CC(=C)C1=CC(=CC=C1)C(=C)C D155465 [0,2,0,0,0,0|2,0,0]=4 976 B12R1.258 CC(=O)C1=CC(=CC=C1)C(=O)C D121832 [0,2,0,0,0,0|2,0,0]=4 977 B12R1.258 CC(=O)C1=CC(=CC=C1)N(C)C D305276 [0,2,0,0,0,0|2,0,0]=4 978 B12R1.258 CC(C)C1=CC(=CC=C1)C(C)C D155006 [0,2,0,0,0,0|2,0,0]=4 979 B12R1.258 CC(C)C1=CC(=CC=C1)C(C)C D155022 [0,2,0,0,0,0|2,0,0]=4 980 B12R1.258 CN(C)C1=CC(=CC=C1)N(C)C B281461 [0,2,0,0,0,0|2,0,0]=4 981 B12R1.436 COC1=CC(=CC=C1)S(=O)(=O)Cl M586141 [0,2,0,0,0,0|1,1,0]=4 982 B12R1.436 COC1=CC=CC(=C1)C(F)(F)F M157958 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.436 [B-](C1=CC(=CC=C1)OC)(F)(F)F P160807 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.440 B(C1=C(C(=CC=C1)OC)F)(O)O F104233 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.440 CC1=C(C=CC=C1OC)C(=O)O M102148 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.440 CC1=C(C=CC=C1OC)[N+](=O)[O-] M124294 [0,2,0,0,0,0|2,0,0]=4 987 B12R1.440 COC1=CC=CC(=C1Br)C(=O)O B195523 [0,2,0,0,0,0|2,0,0]=4 988 B12R1.440 COC1=CC=CC(=C1Br)[N+](=O)[O-] B140250 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.440 COC1=CC=CC(=C1Cl)C(=O)O W136244 [0,2,0,0,0,0|2,0,0]=4 990 B12R1.440 COC1=CC=CC(=C1Cl)[N+](=O)[O-] C184278 [0,2,0,0,0,0|2,0,0]=4 991 B12R1.440 COC1=CC=CC(=C1F)C(=O)O F190752 [0,2,0,0,0,0|2,0,0]=4 992 B12R1.440 COC1=CC=CC(=C1N)C(=O)O A133637 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.440 COC1=CC=CC(=C1N)[N+](=O)[O-] A124291 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.440 COC1=CC=CC(=C1O)C(=O)O H135698 [0,2,0,0,0,0|2,0,0]=4 995 B12R1.453 B(C1=C(C=CC(=C1)OC)C)(O)O M194220 [0,2,0,0,0,0|2,0,0]=4 996 B12R1.453 B(C1=C(C=CC(=C1)OC)Cl)(O)O C331322 [0,2,0,0,0,0|2,0,0]=4 997 B12R1.453 B(C1=C(C=CC(=C1)OC)F)(O)O T120095 [0,2,0,0,0,0|2,0,0]=4 998 B12R1.453 CC(=O)C1=C(C=CC(=C1)OC)O H113427 [0,2,0,0,0,0|1,0,0]=3 999 B12R1.453 CC1=C(C=C(C=C1)OC)C(=O)O M183631 [0,2,0,0,0,0|2,0,0]=4 1000 B12R1.453 CC1=C(C=C(C=C1)OC)[N+](=O)[O-] M132182 [0,2,0,0,0,0|2,0,0]=4 1001 B12R1.453 COC1=CC(=C(C=C1)Br)C(=O)O B123410 [0,2,0,0,0,0|2,0,0]=4 1002 B12R1.453 COC1=CC(=C(C=C1)Br)[N+](=O)[O-] B122582 [0,2,0,0,0,0|2,0,0]=4 1003 B12R1.453 COC1=CC(=C(C=C1)Cl)C(=O)O C123876 [0,2,0,0,0,0|2,0,0]=4 1004 B12R1.453 COC1=CC(=C(C=C1)Cl)[N+](=O)[O-] C120330 [0,2,0,0,0,0|2,0,0]=4 1005 B12R1.453 COC1=CC(=C(C=C1)F)C(=O)O F134134 [0,2,0,0,0,0|2,0,0]=4 1006 B12R1.453 COC1=CC(=C(C=C1)F)[N+](=O)[O-] F136971 [0,2,0,0,0,0|2,0,0]=4 1007 B12R1.453 COC1=CC(=C(C=C1)I)C(=O)O I193855 [0,2,0,0,0,0|2,0,0]=4 1008 B12R1.453 COC1=CC(=C(C=C1)I)[N+](=O)[O-] I140454 [0,2,0,0,0,0|2,0,0]=4 1009 B12R1.453 COC1=CC(=C(C=C1)N)C(=O)N A182361 [0,2,0,0,0,0|2,0,0]=4 1010 B12R1.453 COC1=CC(=C(C=C1)N)C(=O)O A123845 [0,2,0,0,0,0|2,0,0]=4 1011 B12R1.453 COC1=CC(=C(C=C1)O)C(=O)O M107865 [0,2,0,0,0,0|2,0,0]=4 1012 B12R1.453 COC1=CC(=C(C=C1)O)[N+](=O)[O-] M132489 [0,2,0,0,0,0|2,0,0]=4 1013 B12R1.654 CC1=C(C=CC(=C1OC)Br)OC B151836 [0,2,0,0,0,0|0,0,0]=2 1014 B12R1.654 CCC1=C(C(=C(C=C1)Cl)CC)N C134107 [0,2,0,0,0,0|2,0,0]=4 1015 B12R1.654 COC1=C(C(=C(C=C1)Br)C=O)O B153189 [0,2,0,0,0,0|2,0,0]=4 1016 B12R1.654 COC1=C(C(=C(C=C1)Cl)C=O)F C165969 [0,2,0,0,0,0|2,0,0]=4 1017 B12R1.654 COC1=C(C(=C(C=C1)F)C=O)F D181639 [0,2,0,0,0,0|2,0,0]=4 1018 B12R1.654 COC1=C(C=CC(=C1F)C#N)F D119370 [0,2,0,0,0,0|2,0,0]=4 1019 B12R1.1879 COC1=C(C(=CC=C1)OC)C=O D134120 [0,2,0,0,0,0|0,0,0]=2 1020 B12R1.1879 COC1=C(C(=CC=C1)OC)OC T107440 [0,2,0,0,0,0|0,0,0]=2 1021 B12R1.1879 COC1=C(C(=CC=C1)OC)SC B300771 [0,2,0,0,0,0|0,0,0]=2 1022 B12R1.1879 COC1=CC=CC(=C1OC)C#N D133498 [0,2,0,0,0,0|2,0,0]=4 1023 B12R1.1879 COC1=CC=CC(=C1OC)C=O D137398 [0,2,0,0,0,0|2,0,0]=4 1024 B12R1.1879 COC1=CC=CC(=C1OC)CN D154180 [0,2,0,0,0,0|2,0,0]=4 1025 B12R1.1879 COC1=CC=CC(=C1OC)CO D137276 [0,2,0,0,0,0|2,0,0]=4 1026 B12R1.78 CCC1=CC(=C(C=C1)OC)OC E194090 [0,2,0,0,0,0|1,0,0]=3 1027 B12R1.78 COC1=C(C=C(C=C1)C#C)OC D589107 [0,2,0,0,0,0|1,0,1]=4 1028 B12R1.78 COC1=C(C=C(C=C1)C#N)OC D134348 [0,2,0,0,0,0|2,0,0]=4 1029 B12R1.78 COC1=C(C=C(C=C1)C=C)OC D134400 [0,2,0,0,0,0|1,0,1]=4 1030 B12R1.78 COC1=C(C=C(C=C1)C=O)OC D108637 [0,2,0,0,0,0|2,0,0]=4 1031 B12R1.78 COC1=C(C=C(C=C1)CCl)OC D186293 [0,2,0,0,0,0|2,0,0]=4 1032 B12R1.78 COC1=C(C=C(C=C1)CN)OC D113397 [0,2,0,0,0,0|2,0,0]=4 1033 B12R1.78 COC1=C(C=C(C=C1)CO)OC V162979 [0,2,0,0,0,0|2,0,0]=4 1034 B12R1.78 COC1=C(C=C(C=C1)CO)OC V426970 [0,2,0,0,0,0|2,0,0]=4 1035 B12R1.78 COC1=CC(=C(C=C1)C#N)OC D154447 [0,2,0,0,0,0|0,0,0]=2 1036 B12R1.78 COC1=CC(=C(C=C1)C=O)OC D155985 [0,2,0,0,0,0|0,0,0]=2 1037 B12R1.78 COC1=CC(=C(C=C1)CN)OC D123129 [0,2,0,0,0,0|0,0,0]=2 1038 B12R1.78 COC1=CC(=C(C=C1)CN)OC D168489 [0,2,0,0,0,0|0,0,0]=2 1039 B12R1.78 COC1=CC(=C(C=C1)CO)OC D134007 [0,2,0,0,0,0|0,0,0]=2 1040 B12R1.78 COC1=CC(=C(C=C1)OC)C#N D154453 [0,2,0,0,0,0|2,0,0]=4 1041 B12R1.78 COC1=CC(=C(C=C1)OC)C=O D111319 [0,2,0,0,0,0|2,0,0]=4 1042 B12R1.78 COC1=CC(=C(C=C1)OC)OC T107287 [0,2,0,0,0,0|0,0,0]=2 1043 B12R1.78 COC1=NC(=C(C=C1)C=O)OC D185402 [0,2,0,0,0,0|1,0,0]=3 1044 B12R1.78 COC1=NC(=NC=C1C=O)OC F356120 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.449 COC1=C(C=C(C(=C1)C#N)F)N A578640 [0,2,0,0,0,0|2,0,0]=4 1046 B12R1.449 COC1=C(C=C(C(=C1)C=O)Br)O B491448 [0,2,0,0,0,0|2,0,0]=4 1047 B12R1.449 COC1=C(C=C(C(=C1)C=O)F)F D294280 [0,2,0,0,0,0|2,0,0]=4 1048 B12R1.449 COC1=CC(=C(C=C1N)Cl)OC C153970 [0,2,0,0,0,0|0,0,0]=2 1049 B10R1.149 CN1C=CC=C1C(=O)OC M137211 [0,0,1,1,0,0|2,0,0]=4 1050 B10R2.31 C1CC2=C1C=CC(=C2)Br B132442 [1,0,0,1,0,0|2,0,0]=4 1051 B10R2.7 C1COC2=CSC=C2O1 E105649 [0,0,0,1,1,0|1,0,0]=3 1052 B12R2.44 C1OC2=C(O1)C=C(C=C2)C#N P111439 [0,1,0,1,0,0|2,0,0]=4 1053 B12R2.44 C1OC2=C(O1)C=C(C=C2)CN P133135 [0,1,0,1,0,0|2,0,0]=4 1054 B12R2.44 C1OC2=C(O1)C=C(C=C2)CO P160713 [0,1,0,1,0,0|2,0,0]=4 1055 B12R2.44 COC1=CC2=C(C=C1)C=CN2 M123429 [0,1,0,1,0,0|1,0,1]=4 1056 B12R2.44 COC1=CC2=C(C=C1)N=CN2 M124712 [0,1,0,1,0,0|1,0,1]=4 1057 B12R2.44 COC1=CC2=C(C=C1)N=CS2 M183487 [0,1,0,1,0,0|0,1,1]=4 1058 B12R2.44 COC1=CC2=C(C=C1)NC=C2 M111475 [0,1,0,1,0,0|1,0,1]=4 1059 B12R2.315 C1OC2=CC=CC(=C2O1)C=O M158040 [0,1,0,1,0,0|2,0,0]=4 1060 B12R2.315 C1OC2=CC=CC(=C2O1)CO B186519 [0,1,0,1,0,0|2,0,0]=4 1061 B12R2.315 COC1=C2C(=CC=C1)SC=N2 M588648 [0,1,0,1,0,0|0,1,1]=4 1062 B12R2.315 COC1=CC=CC2=C1C=CN2 M123499 [0,1,0,1,0,0|1,0,1]=4 1063 B12R2.315 COC1=CC=CC2=C1NC=C2 M123430 [0,1,0,1,0,0|1,0,1]=4 1064 B8R1.1 CC1=CC=C(O1)SC M133227 [1,0,0,0,1,0|1,1,0]=4 1065 B8R1.11 CC1=C(C=CO1)SC M102940 [1,0,0,0,1,0|1,1,0]=4 1066 B10R1.3 CCC1=CC=C(C=C1)CC D107652 [0,0,0,0,1,1|2,0,0]=4 1067 B10R1.3 CCC1=CC=C(C=C1)CC D107653 [0,0,0,0,1,1|2,0,0]=4 1068 B10R1.3 CCC1=CC=C(C=C1)OC E137475 [0,0,0,0,1,1|1,0,0]=3 1069 B10R1.3 CNC1=CC=C(C=C1)OC I133933 [0,0,0,0,1,1|1,0,0]=3 1070 B10R1.3 COC1=CC=C(C=C1)C#C M111332 [0,0,0,0,1,1|1,0,1]=4 1071 B10R1.3 COC1=CC=C(C=C1)C#N M111093 [0,0,0,0,1,1|2,0,0]=4 1072 B10R1.3 COC1=CC=C(C=C1)C=C M103131 [0,0,0,0,1,1|1,0,1]=4 1073 B10R1.3 COC1=CC=C(C=C1)C=O A108955 [0,0,0,0,1,1|2,0,0]=4 1074 B10R1.3 COC1=CC=C(C=C1)C=O A108956 [0,0,0,0,1,1|2,0,0]=4 1075 B10R1.3 COC1=CC=C(C=C1)C=O A108957 [0,0,0,0,1,1|2,0,0]=4 1076 B10R1.3 COC1=CC=C(C=C1)C=O A108958 [0,0,0,0,1,1|2,0,0]=4 1077 B10R1.3 COC1=CC=C(C=C1)C=O P421001 [0,0,0,0,1,1|2,0,0]=4 1078 B10R1.3 COC1=CC=C(C=C1)CCl M491599 [0,0,0,0,1,1|2,0,0]=4 1079 B10R1.3 COC1=CC=C(C=C1)CN M123767 [0,0,0,0,1,1|2,0,0]=4 1080 B10R1.3 COC1=CC=C(C=C1)CO M107568 [0,0,0,0,1,1|2,0,0]=4 1081 B10R1.3 COC1=CC=C(C=C1)CS M101790 [0,0,0,0,1,1|2,0,0]=4 1082 B10R1.3 COC1=CC=C(C=C1)CS M414622 [0,0,0,0,1,1|2,0,0]=4 1083 B10R1.3 COC1=CC=C(C=C1)OC D104711 [0,0,0,0,1,1|0,0,0]=2 1084 B10R1.3 COC1=CC=C(C=C1)OC D137778 [0,0,0,0,1,1|0,0,0]=2 1085 B10R1.3 COC1=CC=C(C=C1)SC M101846 [0,0,0,0,1,1|0,1,0]=3 1086 B10R1.3 COC1=CC=C(C=C1)[N+]#N M123217 [0,0,0,0,1,1|2,0,0]=4 1087 B10R1.3 COC1=CC=C(C=C1)[N+]#[C-] M165558 [0,0,0,0,1,1|1,0,1]=4 1088 B10R1.3 COC1=CN=C(C=C1)C#N M178084 [0,0,0,0,1,1|2,0,0]=4 1089 B10R1.3 COC1=CN=C(C=C1)C=O M182921 [0,0,0,0,1,1|2,0,0]=4 1090 B10R1.3 COC1=CN=C(C=C1)CO M190450 [0,0,0,0,1,1|2,0,0]=4 1091 B10R1.3 COC1=NC=C(C=C1)C#N M167622 [0,0,0,0,1,1|2,0,0]=4 1092 B10R1.3 COC1=NC=C(C=C1)C=O M115769 [0,0,0,0,1,1|2,0,0]=4 1093 B10R1.3 COC1=NC=C(C=C1)CN M177670 [0,0,0,0,1,1|2,0,0]=4 1094 B10R1.3 COC1=NC=C(C=C1)CO M176865 [0,0,0,0,1,1|2,0,0]=4 1095 B10R1.3 COC1=NN=C(C=C1)OC D303761 [0,0,0,0,1,1|1,0,0]=3