0 B9R1.1 C#CC1=CC=C(C=C1)Br B100857 [0,0,0,0,0,0|1,0,2]=3 1 B9R1.1 C#CC1=CC=C(C=C1)Cl C115544 [0,0,0,0,0,0|1,0,2]=3 2 B9R1.1 C#CC1=CC=C(C=C1)F E115545 [0,0,0,0,0,0|1,0,2]=3 3 B9R1.1 C#CC1=CC=C(C=C1)N E156336 [0,0,0,0,0,0|1,0,2]=3 4 B9R1.1 C#CC1=CN=C(C=C1)F E590351 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.1 C#CC1=NC=C(C=C1)Br B152260 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.1 C1=C(C=NC(=N1)N)C=O A123166 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.1 C1=CC(=CC=C1C#N)Br B152383 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.1 C1=CC(=CC=C1C#N)Cl C105375 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.1 C1=CC(=CC=C1C#N)F F120871 [0,0,0,0,0,0|2,0,1]=3 10 B9R1.1 C1=CC(=CC=C1C#N)I I103578 [0,0,0,0,0,0|2,0,1]=3 11 B9R1.1 C1=CC(=CC=C1C#N)N A107274 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.1 C1=CC(=CC=C1C#N)O H115122 [0,0,0,0,0,0|1,0,1]=2 13 B9R1.1 C1=CC(=CC=C1C#N)O H115123 [0,0,0,0,0,0|1,0,1]=2 14 B9R1.1 C1=CC(=CC=C1C#N)S M184058 [0,0,0,0,0,0|1,1,1]=3 15 B9R1.1 C1=CC(=CC=C1C=O)Br B109177 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.1 C1=CC(=CC=C1C=O)Br B419287 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.1 C1=CC(=CC=C1C=O)Cl C104155 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.1 C1=CC(=CC=C1C=O)F F109178 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.1 C1=CC(=CC=C1C=O)I I138274 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.1 C1=CC(=CC=C1C=O)N A303975 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.1 C1=CC(=CC=C1C=O)N A405596 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.1 C1=CC(=CC=C1C=O)O H100420 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.1 C1=CC(=CC=C1C=O)O H100421 [0,0,0,0,0,0|1,0,0]=1 24 B9R1.1 C1=CC(=CC=C1C=O)O H431620 [0,0,0,0,0,0|1,0,0]=1 25 B9R1.1 C1=CC(=CC=C1CBr)Br B171105 [0,0,0,0,0,0|2,0,1]=3 26 B9R1.1 C1=CC(=CC=C1CBr)Cl C135867 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.1 C1=CC(=CC=C1CBr)F F120595 [0,0,0,0,0,0|2,0,1]=3 28 B9R1.1 C1=CC(=CC=C1CBr)I I122909 [0,0,0,0,0,0|2,0,1]=3 29 B9R1.1 C1=CC(=CC=C1CCl)Br B113785 [0,0,0,0,0,0|2,0,1]=3 30 B9R1.1 C1=CC(=CC=C1CCl)Cl C106513 [0,0,0,0,0,0|2,0,1]=3 31 B9R1.1 C1=CC(=CC=C1CCl)F F100905 [0,0,0,0,0,0|2,0,1]=3 32 B9R1.1 C1=CC(=CC=C1CN)Br B133133 [0,0,0,0,0,0|2,0,1]=3 33 B9R1.1 C1=CC(=CC=C1CN)Br B136595 [0,0,0,0,0,0|2,0,1]=3 34 B9R1.1 C1=CC(=CC=C1CN)Cl C117222 [0,0,0,0,0,0|2,0,1]=3 35 B9R1.1 C1=CC(=CC=C1CN)Cl C493514 [0,0,0,0,0,0|2,0,1]=3 36 B9R1.1 C1=CC(=CC=C1CN)F F111212 [0,0,0,0,0,0|2,0,1]=3 37 B9R1.1 C1=CC(=CC=C1CN)F F292633 [0,0,0,0,0,0|2,0,1]=3 38 B9R1.1 C1=CC(=CC=C1CN)F F292646 [0,0,0,0,0,0|2,0,1]=3 39 B9R1.1 C1=CC(=CC=C1CN)F F404486 [0,0,0,0,0,0|2,0,1]=3 40 B9R1.1 C1=CC(=CC=C1CN)I I171122 [0,0,0,0,0,0|2,0,1]=3 41 B9R1.1 C1=CC(=CC=C1CN)N A151636 [0,0,0,0,0,0|2,0,1]=3 42 B9R1.1 C1=CC(=CC=C1CN)N A193875 [0,0,0,0,0,0|2,0,1]=3 43 B9R1.1 C1=CC(=CC=C1CN)O A139192 [0,0,0,0,0,0|1,0,1]=2 44 B9R1.1 C1=CC(=CC=C1CN)O A187992 [0,0,0,0,0,0|1,0,1]=2 45 B9R1.1 C1=CC(=CC=C1CO)Br B139372 [0,0,0,0,0,0|2,0,1]=3 46 B9R1.1 C1=CC(=CC=C1CO)Cl C109479 [0,0,0,0,0,0|2,0,1]=3 47 B9R1.1 C1=CC(=CC=C1CO)F F156598 [0,0,0,0,0,0|2,0,1]=3 48 B9R1.1 C1=CC(=CC=C1CO)I I138398 [0,0,0,0,0,0|2,0,1]=3 49 B9R1.1 C1=CC(=CC=C1CO)N A107272 [0,0,0,0,0,0|2,0,1]=3 50 B9R1.1 C1=CC(=CC=C1CO)O H107912 [0,0,0,0,0,0|1,0,1]=2 51 B9R1.1 C1=CC(=CC=C1CS)Br B101799 [0,0,0,0,0,0|2,0,1]=3 52 B9R1.1 C1=CC(=CC=C1CS)Cl C101789 [0,0,0,0,0,0|2,0,1]=3 53 B9R1.1 C1=CC(=CC=C1CS)F F101796 [0,0,0,0,0,0|2,0,1]=3 54 B9R1.1 C1=CC(=CC=C1N=O)O N159523 [0,0,0,0,0,0|2,0,0]=2 55 B9R1.1 C1=CC(=CC=C1NN)Br B109685 [0,0,0,0,0,0|3,0,0]=3 56 B9R1.1 C1=CC(=CC=C1NN)Br B141295 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.1 C1=CC(=CC=C1NN)Br B185411 [0,0,0,0,0,0|3,0,0]=3 58 B9R1.1 C1=CC(=CC=C1NN)Br B193346 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.1 C1=CC(=CC=C1NN)Cl C110269 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.1 C1=CC(=CC=C1NN)Cl C153656 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.1 C1=CC(=CC=C1NN)F F110267 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.1 C1=CC(=CC=C1NN)I I166921 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.1 C1=CC(=CC=C1NN)I I194278 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.1 C1=CC(=CC=C1[N+]#N)Br B152895 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.1 C1=CC(=NC=C1Br)C#N B107722 [0,0,0,0,0,0|3,0,1]=4 66 B9R1.1 C1=CC(=NC=C1Br)C=O B119147 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.1 C1=CC(=NC=C1Br)CN B182096 [0,0,0,0,0,0|3,0,1]=4 68 B9R1.1 C1=CC(=NC=C1Br)CO B121986 [0,0,0,0,0,0|3,0,1]=4 69 B9R1.1 C1=CC(=NC=C1Br)NN B139270 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.1 C1=CC(=NC=C1C#N)Br B151862 [0,0,0,0,0,0|3,0,1]=4 71 B9R1.1 C1=CC(=NC=C1C#N)Cl C123447 [0,0,0,0,0,0|3,0,1]=4 72 B9R1.1 C1=CC(=NC=C1C#N)F F176363 [0,0,0,0,0,0|3,0,1]=4 73 B9R1.1 C1=CC(=NC=C1C#N)N A151661 [0,0,0,0,0,0|3,0,1]=4 74 B9R1.1 C1=CC(=NC=C1C=O)Br B115763 [0,0,0,0,0,0|3,0,0]=3 75 B9R1.1 C1=CC(=NC=C1C=O)Cl C122666 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.1 C1=CC(=NC=C1C=O)F F185975 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.1 C1=CC(=NC=C1C=O)N A177224 [0,0,0,0,0,0|3,0,0]=3 78 B9R1.1 C1=CC(=NC=C1CBr)Cl B182268 [0,0,0,0,0,0|3,0,1]=4 79 B9R1.1 C1=CC(=NC=C1CCl)Cl C106558 [0,0,0,0,0,0|3,0,1]=4 80 B9R1.1 C1=CC(=NC=C1CN)Cl A113916 [0,0,0,0,0,0|3,0,1]=4 81 B9R1.1 C1=CC(=NC=C1CO)Br B123090 [0,0,0,0,0,0|3,0,1]=4 82 B9R1.1 C1=CC(=NC=C1CO)Cl C154056 [0,0,0,0,0,0|3,0,1]=4 83 B9R1.1 C1=CC(=NC=C1CO)F F184294 [0,0,0,0,0,0|3,0,1]=4 84 B9R1.1 C1=CC(=NC=C1CO)N A136079 [0,0,0,0,0,0|3,0,1]=4 85 B9R1.1 C1=CC(=NC=C1Cl)C#N C154079 [0,0,0,0,0,0|3,0,1]=4 86 B9R1.1 C1=CC(=NC=C1Cl)C=O C154077 [0,0,0,0,0,0|3,0,0]=3 87 B9R1.1 C1=CC(=NC=C1Cl)NN C183340 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.1 C1=CC(=NC=C1F)C#N C119652 [0,0,0,0,0,0|3,0,1]=4 89 B9R1.1 C1=CC(=NC=C1F)CN A589490 [0,0,0,0,0,0|3,0,1]=4 90 B9R1.1 C1=CC(=NC=C1F)CO F177498 [0,0,0,0,0,0|3,0,1]=4 91 B9R1.1 C1=CC(=NC=C1N)C#N A123440 [0,0,0,0,0,0|3,0,1]=4 92 B9R1.1 C1=CC(=NC=C1O)C#N H177767 [0,0,0,0,0,0|2,0,1]=3 93 B9R1.1 C1=CC(=NC=C1O)C=O H192663 [0,0,0,0,0,0|2,0,0]=2 94 B9R1.1 C1=CC(=O)NC=C1C=O H179130 [0,0,0,0,0,0|2,0,1]=3 95 B9R1.1 C1=C[N+](=CC=C1C#N)[O-] C153946 [0,0,0,0,0,0|2,0,2]=4 96 B9R1.1 C1=C[N+](=CC=C1CO)[O-] P168730 [0,0,0,0,0,0|2,0,2]=4 97 B9R1.1 C=CC1=CC=C(C=C1)Br B102167 [0,0,0,0,0,0|1,0,0]=1 98 B9R1.1 C=CC1=CC=C(C=C1)Cl C121719 [0,0,0,0,0,0|1,0,0]=1 99 B9R1.1 C=CC1=CC=C(C=C1)F F107117 [0,0,0,0,0,0|1,0,0]=1 100 B9R1.1 C=CC1=CC=C(C=C1)F F407667 [0,0,0,0,0,0|1,0,0]=1 101 B9R1.1 C=CC1=CC=C(C=C1)N A151485 [0,0,0,0,0,0|1,0,0]=1 102 B9R1.1 C=CC1=CC=C(C=C1)O H189096 [0,0,0,0,0,0|0,0,0]=0 103 B9R1.1 CC1=CC=C(C=C1)C#C E106375 [0,0,0,0,0,0|1,0,2]=3 104 B9R1.1 CC1=CC=C(C=C1)C#N P160229 [0,0,0,0,0,0|2,0,1]=3 105 B9R1.1 CC1=CC=C(C=C1)C=C M158348 [0,0,0,0,0,0|1,0,0]=1 106 B9R1.1 CC1=CC=C(C=C1)C=O M105910 [0,0,0,0,0,0|2,0,0]=2 107 B9R1.1 CC1=CC=C(C=C1)CBr M109534 [0,0,0,0,0,0|2,0,1]=3 108 B9R1.1 CC1=CC=C(C=C1)CCl A101683 [0,0,0,0,0,0|2,0,1]=3 109 B9R1.1 CC1=CC=C(C=C1)CCl A164460 [0,0,0,0,0,0|2,0,1]=3 110 B9R1.1 CC1=CC=C(C=C1)CN M158669 [0,0,0,0,0,0|2,0,1]=3 111 B9R1.1 CC1=CC=C(C=C1)CO M113648 [0,0,0,0,0,0|2,0,1]=3 112 B9R1.1 CC1=CC=C(C=C1)CS M113646 [0,0,0,0,0,0|2,0,1]=3 113 B9R1.1 CC1=CC=C(C=C1)NC N159024 [0,0,0,0,0,0|2,0,1]=3 114 B9R1.1 CC1=CC=C(C=C1)NN T109603 [0,0,0,0,0,0|3,0,0]=3 115 B9R1.1 CC1=CC=C(C=C1)OC M106728 [0,0,0,0,0,0|2,0,1]=3 116 B9R1.1 CC1=CC=C(C=C1)SC M101848 [0,0,0,0,0,0|2,0,1]=3 117 B9R1.1 CC1=CN=C(C=C1)C#N C132411 [0,0,0,0,0,0|3,0,1]=4 118 B9R1.1 CC1=CN=C(C=C1)C=O M170606 [0,0,0,0,0,0|3,0,0]=3 119 B9R1.1 CC1=CN=C(C=C1)CN M589171 [0,0,0,0,0,0|3,0,1]=4 120 B9R1.1 CC1=CN=C(C=C1)OC M181247 [0,0,0,0,0,0|3,0,1]=4 121 B9R1.1 CC1=CN=C(C=N1)C=O M176646 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.1 CC1=NC=C(C=C1)C#N C140251 [0,0,0,0,0,0|3,0,1]=4 123 B9R1.1 CC1=NC=C(C=C1)C=O W134999 [0,0,0,0,0,0|3,0,0]=3 124 B9R1.1 CC1=NC=C(C=C1)CO W136158 [0,0,0,0,0,0|3,0,1]=4 125 B9R1.1 CCC1=CC=C(C=C1)Br B101890 [0,0,0,0,0,0|1,0,2]=3 126 B9R1.1 CCC1=CC=C(C=C1)Br B141181 [0,0,0,0,0,0|1,0,2]=3 127 B9R1.1 CCC1=CC=C(C=C1)C E123489 [0,0,0,0,0,0|1,0,2]=3 128 B9R1.1 CCC1=CC=C(C=C1)Cl C171229 [0,0,0,0,0,0|1,0,2]=3 129 B9R1.1 CCC1=CC=C(C=C1)I E189089 [0,0,0,0,0,0|1,0,2]=3 130 B9R1.1 CCC1=CC=C(C=C1)N E102230 [0,0,0,0,0,0|1,0,2]=3 131 B9R1.1 CCC1=CC=C(C=C1)O E115497 [0,0,0,0,0,0|0,0,2]=2 132 B9R1.1 CCC1=CC=C(C=C1)S E156190 [0,0,0,0,0,0|0,1,2]=3 133 B9R1.1 CCC1=CN=C(C=C1)C E101695 [0,0,0,0,0,0|2,0,2]=4 134 B9R1.1 CCC1=CN=C(C=C1)N E587963 [0,0,0,0,0,0|2,0,2]=4 135 B9R1.1 CC[N+]1=CC=C(C=C1)C E303436 [0,0,0,0,0,0|2,0,2]=4 136 B9R1.1 CNC1=CC=C(C=C1)Br B304406 [0,0,0,0,0,0|2,0,1]=3 137 B9R1.1 CNC1=CC=C(C=C1)Cl C139458 [0,0,0,0,0,0|2,0,1]=3 138 B9R1.1 CNC1=CC=C(C=C1)F F170454 [0,0,0,0,0,0|2,0,1]=3 139 B9R1.1 CNC1=CC=C(C=C1)N N589686 [0,0,0,0,0,0|2,0,1]=3 140 B9R1.1 CNC1=CN=C(C=C1)Br B586167 [0,0,0,0,0,0|3,0,1]=4 141 B9R1.1 COC1=CC=C(C=C1)Br B108656 [0,0,0,0,0,0|2,0,1]=3 142 B9R1.1 COC1=CC=C(C=C1)Cl C113571 [0,0,0,0,0,0|2,0,1]=3 143 B9R1.1 COC1=CC=C(C=C1)F F123675 [0,0,0,0,0,0|2,0,1]=3 144 B9R1.1 COC1=CC=C(C=C1)I I107035 [0,0,0,0,0,0|2,0,1]=3 145 B9R1.1 COC1=CC=C(C=C1)I L359048 [0,0,0,0,0,0|2,0,1]=3 146 B9R1.1 COC1=CC=C(C=C1)N A106071 [0,0,0,0,0,0|2,0,1]=3 147 B9R1.1 COC1=CC=C(C=C1)N A615348 [0,0,0,0,0,0|2,0,1]=3 148 B9R1.1 COC1=CC=C(C=C1)N P160121 [0,0,0,0,0,0|2,0,1]=3 149 B9R1.1 COC1=CC=C(C=C1)O M104222 [0,0,0,0,0,0|1,0,1]=2 150 B9R1.1 COC1=CC=C(C=C1)S M101780 [0,0,0,0,0,0|1,1,1]=3 151 B9R1.1 COC1=CC=C(O)C=C1 M408201 [0,0,0,0,0,0|1,0,1]=2 152 B9R1.1 COC1=CC=[N+](C=C1)[O-] M119964 [0,0,0,0,0,0|2,0,2]=4 153 B9R1.1 COC1=CC=[N+](C=C1)[O-] M168481 [0,0,0,0,0,0|2,0,2]=4 154 B9R1.1 COC1=CN=C(C=C1)Br B179025 [0,0,0,0,0,0|3,0,1]=4 155 B9R1.1 COC1=CN=C(C=C1)Cl C190823 [0,0,0,0,0,0|3,0,1]=4 156 B9R1.1 COC1=CN=C(C=C1)F F190725 [0,0,0,0,0,0|3,0,1]=4 157 B9R1.1 COC1=CN=C(C=C1)N M171668 [0,0,0,0,0,0|3,0,1]=4 158 B9R1.1 COC1=NC=C(C=C1)Br B115758 [0,0,0,0,0,0|3,0,1]=4 159 B9R1.1 COC1=NC=C(C=C1)Cl C120716 [0,0,0,0,0,0|3,0,1]=4 160 B9R1.1 COC1=NC=C(C=C1)F F120714 [0,0,0,0,0,0|3,0,1]=4 161 B9R1.1 COC1=NC=C(C=C1)I I132230 [0,0,0,0,0,0|3,0,1]=4 162 B9R1.1 COC1=NC=C(C=C1)N A151664 [0,0,0,0,0,0|3,0,1]=4 163 B9R1.1 COC1=NC=C(C=C1)N A400674 [0,0,0,0,0,0|3,0,1]=4 164 B9R1.1 COC1=NC=C(C=C1)O H184927 [0,0,0,0,0,0|2,0,1]=3 165 B9R1.1 CSC1=CC=C(C=C1)Br B101844 [0,0,0,0,0,0|2,0,1]=3 166 B9R1.1 CSC1=CC=C(C=C1)Cl C101840 [0,0,0,0,0,0|2,0,1]=3 167 B9R1.1 CSC1=CC=C(C=C1)F F101837 [0,0,0,0,0,0|2,0,1]=3 168 B9R1.1 CSC1=CC=C(C=C1)N M101835 [0,0,0,0,0,0|2,0,1]=3 169 B9R1.1 CSC1=CC=C(C=C1)O M100813 [0,0,0,0,0,0|1,0,1]=2 170 B9R1.1 CSC1=CC=C(C=C1)S M101782 [0,0,0,0,0,0|1,1,1]=3 171 B9R1.1 CSC1=NC=C(C=C1)Br B122969 [0,0,0,0,0,0|3,0,1]=4 172 B9R1.1 [C-]#[N+]C1=CC=C(C=C1)Br B303469 [0,0,0,0,0,0|2,0,1]=3 173 B9R1.1 [C-]#[N+]C1=CC=C(C=C1)F F300626 [0,0,0,0,0,0|2,0,1]=3 174 B8R1.2 C#CC1=CC=CC=C1 P107030 [1,0,0,0,0,0|0,0,2]=3 175 B8R1.2 C#CC1=CC=CC=C1 P332820 [1,0,0,0,0,0|0,0,2]=3 176 B8R1.2 C#CC1=CC=CC=N1 E106166 [1,0,0,0,0,0|1,0,2]=4 177 B8R1.2 C#CC1=CC=NC=C1 E115761 [1,0,0,0,0,0|1,0,2]=4 178 B8R1.2 C#CC1=CC=NC=C1 E156047 [1,0,0,0,0,0|1,0,2]=4 179 B8R1.2 C#CC1=CN=CC=C1 E101379 [1,0,0,0,0,0|1,0,2]=4 180 B8R1.2 C1=C(C=NC=N1)C=O P123455 [1,0,0,0,0,0|3,0,0]=4 181 B8R1.2 C1=CC(=CN=C1)C#N N104919 [1,0,0,0,0,0|2,0,1]=4 182 B8R1.2 C1=CC(=CN=C1)C=O P106877 [1,0,0,0,0,0|2,0,0]=3 183 B8R1.2 C1=CC(=CN=C1)CBr B137612 [1,0,0,0,0,0|2,0,1]=4 184 B8R1.2 C1=CC(=CN=C1)CCl P135883 [1,0,0,0,0,0|2,0,1]=4 185 B8R1.2 C1=CC(=CN=C1)CN P160053 [1,0,0,0,0,0|2,0,1]=4 186 B8R1.2 C1=CC(=CN=C1)CO P106580 [1,0,0,0,0,0|2,0,1]=4 187 B8R1.2 C1=CC=C(C=C1)C#N B104457 [1,0,0,0,0,0|1,0,1]=3 188 B8R1.2 C1=CC=C(C=C1)C#N B104458 [1,0,0,0,0,0|1,0,1]=3 189 B8R1.2 C1=CC=C(C=C1)C#N B110114 [1,0,0,0,0,0|1,0,1]=3 190 B8R1.2 C1=CC=C(C=C1)C#N B113726 [1,0,0,0,0,0|1,0,1]=3 191 B8R1.2 C1=CC=C(C=C1)C#N B119686 [1,0,0,0,0,0|1,0,1]=3 192 B8R1.2 C1=CC=C(C=C1)C#N B121683 [1,0,0,0,0,0|1,0,1]=3 193 B8R1.2 C1=CC=C(C=C1)C=O B110459 [1,0,0,0,0,0|1,0,0]=2 194 B8R1.2 C1=CC=C(C=C1)C=O B110460 [1,0,0,0,0,0|1,0,0]=2 195 B8R1.2 C1=CC=C(C=C1)C=O B110463 [1,0,0,0,0,0|1,0,0]=2 196 B8R1.2 C1=CC=C(C=C1)C=O B110464 [1,0,0,0,0,0|1,0,0]=2 197 B8R1.2 C1=CC=C(C=C1)C=O B266083 [1,0,0,0,0,0|1,0,0]=2 198 B8R1.2 C1=CC=C(C=C1)C=O B420281 [1,0,0,0,0,0|1,0,0]=2 199 B8R1.2 C1=CC=C(C=C1)C=O B472001 [1,0,0,0,0,0|1,0,0]=2 200 B8R1.2 C1=CC=C(C=C1)CBr B108549 [1,0,0,0,0,0|1,0,1]=3 201 B8R1.2 C1=CC=C(C=C1)CBr B471999 [1,0,0,0,0,0|1,0,1]=3 202 B8R1.2 C1=CC=C(C=C1)CBr B472021 [1,0,0,0,0,0|1,0,1]=3 203 B8R1.2 C1=CC=C(C=C1)CCl B110580 [1,0,0,0,0,0|1,0,1]=3 204 B8R1.2 C1=CC=C(C=C1)CCl B110581 [1,0,0,0,0,0|1,0,1]=3 205 B8R1.2 C1=CC=C(C=C1)CCl B110582 [1,0,0,0,0,0|1,0,1]=3 206 B8R1.2 C1=CC=C(C=C1)CCl B141153 [1,0,0,0,0,0|1,0,1]=3 207 B8R1.2 C1=CC=C(C=C1)CCl B431204 [1,0,0,0,0,0|1,0,1]=3 208 B8R1.2 C1=CC=C(C=C1)CCl B472028 [1,0,0,0,0,0|1,0,1]=3 209 B8R1.2 C1=CC=C(C=C1)CCl B472041 [1,0,0,0,0,0|1,0,1]=3 210 B8R1.2 C1=CC=C(C=C1)CN A348464 [1,0,0,0,0,0|1,0,1]=3 211 B8R1.2 C1=CC=C(C=C1)CN B108477 [1,0,0,0,0,0|1,0,1]=3 212 B8R1.2 C1=CC=C(C=C1)CN B152179 [1,0,0,0,0,0|1,0,1]=3 213 B8R1.2 C1=CC=C(C=C1)CN B152887 [1,0,0,0,0,0|1,0,1]=3 214 B8R1.2 C1=CC=C(C=C1)CN B152949 [1,0,0,0,0,0|1,0,1]=3 215 B8R1.2 C1=CC=C(C=C1)CN B304428 [1,0,0,0,0,0|1,0,1]=3 216 B8R1.2 C1=CC=C(C=C1)CN B485378 [1,0,0,0,0,0|1,0,1]=3 217 B8R1.2 C1=CC=C(C=C1)CN P493007 [1,0,0,0,0,0|1,0,1]=3 218 B8R1.2 C1=CC=C(C=C1)CN P493016 [1,0,0,0,0,0|1,0,1]=3 219 B8R1.2 C1=CC=C(C=C1)CN P493100 [1,0,0,0,0,0|1,0,1]=3 220 B8R1.2 C1=CC=C(C=C1)CO B108199 [1,0,0,0,0,0|1,0,1]=3 221 B8R1.2 C1=CC=C(C=C1)CO B108202 [1,0,0,0,0,0|1,0,1]=3 222 B8R1.2 C1=CC=C(C=C1)CO B108203 [1,0,0,0,0,0|1,0,1]=3 223 B8R1.2 C1=CC=C(C=C1)CO B108204 [1,0,0,0,0,0|1,0,1]=3 224 B8R1.2 C1=CC=C(C=C1)CO B108205 [1,0,0,0,0,0|1,0,1]=3 225 B8R1.2 C1=CC=C(C=C1)CO B163018 [1,0,0,0,0,0|1,0,1]=3 226 B8R1.2 C1=CC=C(C=C1)CO B346959 [1,0,0,0,0,0|1,0,1]=3 227 B8R1.2 C1=CC=C(C=C1)CO B420278 [1,0,0,0,0,0|1,0,1]=3 228 B8R1.2 C1=CC=C(C=C1)CO B472101 [1,0,0,0,0,0|1,0,1]=3 229 B8R1.2 C1=CC=C(C=C1)CS B109256 [1,0,0,0,0,0|1,0,1]=3 230 B8R1.2 C1=CC=C(C=C1)I=O I157626 [1,0,0,0,0,0|2,0,0]=3 231 B8R1.2 C1=CC=C(C=C1)N=O N159156 [1,0,0,0,0,0|2,0,0]=3 232 B8R1.2 C1=CC=C(C=C1)NN P104684 [1,0,0,0,0,0|2,0,0]=3 233 B8R1.2 C1=CC=C(C=C1)NN P108563 [1,0,0,0,0,0|2,0,0]=3 234 B8R1.2 C1=CC=C(C=C1)NN P112739 [1,0,0,0,0,0|2,0,0]=3 235 B8R1.2 C1=CC=C(C=C1)NN P579459 [1,0,0,0,0,0|2,0,0]=3 236 B8R1.2 C1=CC=C(C=C1)NO N131374 [1,0,0,0,0,0|2,0,0]=3 237 B8R1.2 C1=CC=C(C=C1)ON O464484 [1,0,0,0,0,0|2,0,0]=3 238 B8R1.2 C1=CC=C(C=C1)[As]=O P336440 [1,0,0,0,0,0|2,0,0]=3 239 B8R1.2 C1=CC=C(C=C1)[Hg]Cl P598721 [1,0,0,0,0,0|2,0,0]=3 240 B8R1.2 C1=CC=C(C=C1)[Se]Cl P160704 [1,0,0,0,0,0|2,0,0]=3 241 B8R1.2 C1=CC=NC(=C1)C#N P106583 [1,0,0,0,0,0|2,0,1]=4 242 B8R1.2 C1=CC=NC(=C1)C=O P105912 [1,0,0,0,0,0|2,0,0]=3 243 B8R1.2 C1=CC=NC(=C1)CBr B169474 [1,0,0,0,0,0|2,0,1]=4 244 B8R1.2 C1=CC=NC(=C1)CCl C117226 [1,0,0,0,0,0|2,0,1]=4 245 B8R1.2 C1=CC=NC(=C1)CN P107146 [1,0,0,0,0,0|2,0,1]=4 246 B8R1.2 C1=CC=NC(=C1)CO P106578 [1,0,0,0,0,0|2,0,1]=4 247 B8R1.2 C1=CC=NC(=C1)NN H133458 [1,0,0,0,0,0|3,0,0]=4 248 B8R1.2 C1=CN=C(C=N1)C=O P176847 [1,0,0,0,0,0|3,0,0]=4 249 B8R1.2 C1=CN=CC=C1C#N P110335 [1,0,0,0,0,0|2,0,1]=4 250 B8R1.2 C1=CN=CC=C1C=O P105913 [1,0,0,0,0,0|2,0,0]=3 251 B8R1.2 C1=CN=CC=C1CBr B135280 [1,0,0,0,0,0|2,0,1]=4 252 B8R1.2 C1=CN=CC=C1CCl C107154 [1,0,0,0,0,0|2,0,1]=4 253 B8R1.2 C1=CN=CC=C1CN A107215 [1,0,0,0,0,0|2,0,1]=4 254 B8R1.2 C1=CN=CC=C1CN P194376 [1,0,0,0,0,0|2,0,1]=4 255 B8R1.2 C1=CN=CC=C1CO P107414 [1,0,0,0,0,0|2,0,1]=4 256 B8R1.2 C1=CN=CC=C1NN H175681 [1,0,0,0,0,0|3,0,0]=4 257 B8R1.2 C=CC1=CC=CC=C1 A304890 [1,0,0,0,0,0|0,0,0]=1 258 B8R1.2 C=CC1=CC=CC=C1 P107084 [1,0,0,0,0,0|0,0,0]=1 259 B8R1.2 C=CC1=CC=CC=C1 P107085 [1,0,0,0,0,0|0,0,0]=1 260 B8R1.2 C=CC1=CC=CC=C1 P107086 [1,0,0,0,0,0|0,0,0]=1 261 B8R1.2 C=CC1=CC=CC=C1 P107087 [1,0,0,0,0,0|0,0,0]=1 262 B8R1.2 C=CC1=CC=CC=C1 P107088 [1,0,0,0,0,0|0,0,0]=1 263 B8R1.2 C=CC1=CC=CC=C1 P107089 [1,0,0,0,0,0|0,0,0]=1 264 B8R1.2 C=CC1=CC=CC=C1 P107090 [1,0,0,0,0,0|0,0,0]=1 265 B8R1.2 C=CC1=CC=CC=C1 P107091 [1,0,0,0,0,0|0,0,0]=1 266 B8R1.2 C=CC1=CC=CC=C1 P107772 [1,0,0,0,0,0|0,0,0]=1 267 B8R1.2 C=CC1=CC=CC=C1 P107773 [1,0,0,0,0,0|0,0,0]=1 268 B8R1.2 C=CC1=CC=CC=C1 P107774 [1,0,0,0,0,0|0,0,0]=1 269 B8R1.2 C=CC1=CC=CC=C1 P107775 [1,0,0,0,0,0|0,0,0]=1 270 B8R1.2 C=CC1=CC=CC=C1 P107776 [1,0,0,0,0,0|0,0,0]=1 271 B8R1.2 C=CC1=CC=CC=C1 P107777 [1,0,0,0,0,0|0,0,0]=1 272 B8R1.2 C=CC1=CC=CC=C1 P107778 [1,0,0,0,0,0|0,0,0]=1 273 B8R1.2 C=CC1=CC=CC=C1 P107779 [1,0,0,0,0,0|0,0,0]=1 274 B8R1.2 C=CC1=CC=CC=C1 P107780 [1,0,0,0,0,0|0,0,0]=1 275 B8R1.2 C=CC1=CC=CC=C1 P107782 [1,0,0,0,0,0|0,0,0]=1 276 B8R1.2 C=CC1=CC=CC=C1 P107783 [1,0,0,0,0,0|0,0,0]=1 277 B8R1.2 C=CC1=CC=CC=C1 P107784 [1,0,0,0,0,0|0,0,0]=1 278 B8R1.2 C=CC1=CC=CC=C1 P107786 [1,0,0,0,0,0|0,0,0]=1 279 B8R1.2 C=CC1=CC=CC=C1 P107787 [1,0,0,0,0,0|0,0,0]=1 280 B8R1.2 C=CC1=CC=CC=C1 P107789 [1,0,0,0,0,0|0,0,0]=1 281 B8R1.2 C=CC1=CC=CC=C1 P107790 [1,0,0,0,0,0|0,0,0]=1 282 B8R1.2 C=CC1=CC=CC=C1 P107791 [1,0,0,0,0,0|0,0,0]=1 283 B8R1.2 C=CC1=CC=CC=C1 P107792 [1,0,0,0,0,0|0,0,0]=1 284 B8R1.2 C=CC1=CC=CC=C1 P107793 [1,0,0,0,0,0|0,0,0]=1 285 B8R1.2 C=CC1=CC=CC=C1 P107794 [1,0,0,0,0,0|0,0,0]=1 286 B8R1.2 C=CC1=CC=CC=C1 P107795 [1,0,0,0,0,0|0,0,0]=1 287 B8R1.2 C=CC1=CC=CC=C1 P107796 [1,0,0,0,0,0|0,0,0]=1 288 B8R1.2 C=CC1=CC=CC=C1 P107797 [1,0,0,0,0,0|0,0,0]=1 289 B8R1.2 C=CC1=CC=CC=C1 P107798 [1,0,0,0,0,0|0,0,0]=1 290 B8R1.2 C=CC1=CC=CC=C1 P107801 [1,0,0,0,0,0|0,0,0]=1 291 B8R1.2 C=CC1=CC=CC=C1 P107802 [1,0,0,0,0,0|0,0,0]=1 292 B8R1.2 C=CC1=CC=CC=C1 P107803 [1,0,0,0,0,0|0,0,0]=1 293 B8R1.2 C=CC1=CC=CC=C1 P107804 [1,0,0,0,0,0|0,0,0]=1 294 B8R1.2 C=CC1=CC=CC=C1 P107805 [1,0,0,0,0,0|0,0,0]=1 295 B8R1.2 C=CC1=CC=CC=C1 P107806 [1,0,0,0,0,0|0,0,0]=1 296 B8R1.2 C=CC1=CC=CC=C1 P107807 [1,0,0,0,0,0|0,0,0]=1 297 B8R1.2 C=CC1=CC=CC=C1 P107808 [1,0,0,0,0,0|0,0,0]=1 298 B8R1.2 C=CC1=CC=CC=C1 P107809 [1,0,0,0,0,0|0,0,0]=1 299 B8R1.2 C=CC1=CC=CC=C1 P107810 [1,0,0,0,0,0|0,0,0]=1 300 B8R1.2 C=CC1=CC=CC=C1 P107811 [1,0,0,0,0,0|0,0,0]=1 301 B8R1.2 C=CC1=CC=CC=C1 P107812 [1,0,0,0,0,0|0,0,0]=1 302 B8R1.2 C=CC1=CC=CC=C1 P107813 [1,0,0,0,0,0|0,0,0]=1 303 B8R1.2 C=CC1=CC=CC=C1 P107814 [1,0,0,0,0,0|0,0,0]=1 304 B8R1.2 C=CC1=CC=CC=C1 P119494 [1,0,0,0,0,0|0,0,0]=1 305 B8R1.2 C=CC1=CC=CC=C1 P119495 [1,0,0,0,0,0|0,0,0]=1 306 B8R1.2 C=CC1=CC=CC=C1 P119496 [1,0,0,0,0,0|0,0,0]=1 307 B8R1.2 C=CC1=CC=CC=C1 P119498 [1,0,0,0,0,0|0,0,0]=1 308 B8R1.2 C=CC1=CC=CC=C1 P119572 [1,0,0,0,0,0|0,0,0]=1 309 B8R1.2 C=CC1=CC=CC=C1 P304886 [1,0,0,0,0,0|0,0,0]=1 310 B8R1.2 C=CC1=CC=CC=C1 P304889 [1,0,0,0,0,0|0,0,0]=1 311 B8R1.2 C=CC1=CC=CC=C1 P434446 [1,0,0,0,0,0|0,0,0]=1 312 B8R1.2 C=CC1=CC=CC=C1 P434450 [1,0,0,0,0,0|0,0,0]=1 313 B8R1.2 C=CC1=CC=CC=C1 P434455 [1,0,0,0,0,0|0,0,0]=1 314 B8R1.2 C=CC1=CC=CC=C1 P476626 [1,0,0,0,0,0|0,0,0]=1 315 B8R1.2 C=CC1=CC=CC=C1 P490073 [1,0,0,0,0,0|0,0,0]=1 316 B8R1.2 C=CC1=CC=CC=C1 P638578 [1,0,0,0,0,0|0,0,0]=1 317 B8R1.2 C=CC1=CC=CC=C1 S110374 [1,0,0,0,0,0|0,0,0]=1 318 B8R1.2 C=CC1=CC=CC=C1 S110375 [1,0,0,0,0,0|0,0,0]=1 319 B8R1.2 C=CC1=CC=CC=C1 S110376 [1,0,0,0,0,0|0,0,0]=1 320 B8R1.2 C=CC1=CC=CC=C1 S110377 [1,0,0,0,0,0|0,0,0]=1 321 B8R1.2 C=CC1=CC=CC=C1 S110378 [1,0,0,0,0,0|0,0,0]=1 322 B8R1.2 C=CC1=CC=CC=C1 S121282 [1,0,0,0,0,0|0,0,0]=1 323 B8R1.2 C=CC1=CC=CC=N1 V106227 [1,0,0,0,0,0|1,0,0]=2 324 B8R1.2 C=CC1=CC=NC=C1 P303219 [1,0,0,0,0,0|1,0,0]=2 325 B8R1.2 C=CC1=CC=NC=C1 P303220 [1,0,0,0,0,0|1,0,0]=2 326 B8R1.2 C=CC1=CC=NC=C1 P466518 [1,0,0,0,0,0|1,0,0]=2 327 B8R1.2 C=CC1=CC=NC=C1 V105595 [1,0,0,0,0,0|1,0,0]=2 328 B8R1.2 C=CC1=CN=CC=C1 V138030 [1,0,0,0,0,0|1,0,0]=2 329 B8R1.2 CCC1=CC=CC=C1 E108144 [1,0,0,0,0,0|0,0,2]=3 330 B8R1.2 CCC1=CC=CC=C1 E108145 [1,0,0,0,0,0|0,0,2]=3 331 B8R1.2 CCC1=CC=CC=C1 E108146 [1,0,0,0,0,0|0,0,2]=3 332 B8R1.2 CCC1=CC=CC=C1 E108148 [1,0,0,0,0,0|0,0,2]=3 333 B8R1.2 CCC1=CC=CC=C1 E108149 [1,0,0,0,0,0|0,0,2]=3 334 B8R1.2 CCC1=CC=CC=C1 E117364 [1,0,0,0,0,0|0,0,2]=3 335 B8R1.2 CCC1=CC=CC=N1 E156565 [1,0,0,0,0,0|1,0,2]=4 336 B8R1.2 CCC1=CC=NC=C1 E106225 [1,0,0,0,0,0|1,0,2]=4 337 B8R1.2 CCC1=CN=CC=C1 E156048 [1,0,0,0,0,0|1,0,2]=4 338 B8R1.2 CC[N+]1=CC=CC=C1 E102660 [1,0,0,0,0,0|1,0,2]=4 339 B8R1.2 CC[N+]1=CC=CC=C1 E102661 [1,0,0,0,0,0|1,0,2]=4 340 B8R1.2 CNC1=CC=CC=C1 M109539 [1,0,0,0,0,0|1,0,1]=3 341 B8R1.2 CNC1=CC=CC=C1 M109540 [1,0,0,0,0,0|1,0,1]=3 342 B8R1.2 CNC1=CC=CC=N1 M158828 [1,0,0,0,0,0|2,0,1]=4 343 B8R1.2 CNC1=CC=NC=C1 M119978 [1,0,0,0,0,0|2,0,1]=4 344 B8R1.2 CNC1=CN=CC=C1 M158833 [1,0,0,0,0,0|2,0,1]=4 345 B8R1.2 COC1=CC=CC=C1 A103680 [1,0,0,0,0,0|1,0,1]=3 346 B8R1.2 COC1=CC=CC=C1 A103683 [1,0,0,0,0,0|1,0,1]=3 347 B8R1.2 COC1=CC=CC=C1 A103684 [1,0,0,0,0,0|1,0,1]=3 348 B8R1.2 COC1=CC=CC=C1 A105952 [1,0,0,0,0,0|1,0,1]=3 349 B8R1.2 COC1=CC=CC=C1 A472026 [1,0,0,0,0,0|1,0,1]=3 350 B8R1.2 COC1=CC=CC=N1 M120557 [1,0,0,0,0,0|2,0,1]=4 351 B8R1.2 COC1=CC=NC=C1 M120571 [1,0,0,0,0,0|2,0,1]=4 352 B8R1.2 COC1=CN=CC=C1 M134006 [1,0,0,0,0,0|2,0,1]=4 353 B8R1.2 CSC1=CC=CC=C1 T107511 [1,0,0,0,0,0|1,0,1]=3 354 B8R1.2 CSC1=CC=CC=N1 M132299 [1,0,0,0,0,0|2,0,1]=4 355 B8R1.2 C[Si]C1=CC=CC=C1 M338232 [1,0,0,0,0,0|0,1,1]=3 356 B8R1.2 [C-]#CC1=CC=CC=C1 C282525 [1,0,0,0,0,0|0,0,2]=3 357 B8R1.2 [C-]#CC1=CC=CC=C1 P331408 [1,0,0,0,0,0|0,0,2]=3 358 B8R1.3 C1=C(C=NC(=N1)Br)O B172861 [1,0,0,0,0,0|3,0,0]=4 359 B8R1.3 C1=C(C=NC(=N1)Cl)O C176622 [1,0,0,0,0,0|3,0,0]=4 360 B8R1.3 C1=CC(=CC=C1Br)Br D104691 [1,0,0,0,0,0|2,0,0]=3 361 B8R1.3 C1=CC(=CC=C1Br)Br D104693 [1,0,0,0,0,0|2,0,0]=3 362 B8R1.3 C1=CC(=CC=C1Br)Br D121273 [1,0,0,0,0,0|2,0,0]=3 363 B8R1.3 C1=CC(=CC=C1Br)I B107004 [1,0,0,0,0,0|2,0,0]=3 364 B8R1.3 C1=CC(=CC=C1Cl)Br B106076 [1,0,0,0,0,0|2,0,0]=3 365 B8R1.3 C1=CC(=CC=C1Cl)Br B106077 [1,0,0,0,0,0|2,0,0]=3 366 B8R1.3 C1=CC(=CC=C1Cl)Cl D104666 [1,0,0,0,0,0|2,0,0]=3 367 B8R1.3 C1=CC(=CC=C1Cl)Cl D104668 [1,0,0,0,0,0|2,0,0]=3 368 B8R1.3 C1=CC(=CC=C1Cl)Cl D104670 [1,0,0,0,0,0|2,0,0]=3 369 B8R1.3 C1=CC(=CC=C1Cl)Cl D104676 [1,0,0,0,0,0|2,0,0]=3 370 B8R1.3 C1=CC(=CC=C1Cl)Cl D115108 [1,0,0,0,0,0|2,0,0]=3 371 B8R1.3 C1=CC(=CC=C1Cl)Cl D123306 [1,0,0,0,0,0|2,0,0]=3 372 B8R1.3 C1=CC(=CC=C1Cl)I C101940 [1,0,0,0,0,0|2,0,0]=3 373 B8R1.3 C1=CC(=CC=C1F)Br B107758 [1,0,0,0,0,0|2,0,0]=3 374 B8R1.3 C1=CC(=CC=C1F)Cl C122649 [1,0,0,0,0,0|2,0,0]=3 375 B8R1.3 C1=CC(=CC=C1F)F D113734 [1,0,0,0,0,0|2,0,0]=3 376 B8R1.3 C1=CC(=CC=C1F)I F100907 [1,0,0,0,0,0|2,0,0]=3 377 B8R1.3 C1=CC(=CC=C1F)S F101761 [1,0,0,0,0,0|1,1,0]=3 378 B8R1.3 C1=CC(=CC=C1I)I D111116 [1,0,0,0,0,0|2,0,0]=3 379 B8R1.3 C1=CC(=CC=C1N)Br B103946 [1,0,0,0,0,0|2,0,0]=3 380 B8R1.3 C1=CC(=CC=C1N)Cl C103934 [1,0,0,0,0,0|2,0,0]=3 381 B8R1.3 C1=CC(=CC=C1N)Cl C103935 [1,0,0,0,0,0|2,0,0]=3 382 B8R1.3 C1=CC(=CC=C1N)Cl C103936 [1,0,0,0,0,0|2,0,0]=3 383 B8R1.3 C1=CC(=CC=C1N)Cl C103945 [1,0,0,0,0,0|2,0,0]=3 384 B8R1.3 C1=CC(=CC=C1N)Cl C141217 [1,0,0,0,0,0|2,0,0]=3 385 B8R1.3 C1=CC(=CC=C1N)F F103204 [1,0,0,0,0,0|2,0,0]=3 386 B8R1.3 C1=CC(=CC=C1N)F F404104 [1,0,0,0,0,0|2,0,0]=3 387 B8R1.3 C1=CC(=CC=C1N)F F404490 [1,0,0,0,0,0|2,0,0]=3 388 B8R1.3 C1=CC(=CC=C1N)I I107029 [1,0,0,0,0,0|2,0,0]=3 389 B8R1.3 C1=CC(=CC=C1N)N D117081 [1,0,0,0,0,0|2,0,0]=3 390 B8R1.3 C1=CC(=CC=C1N)N P108424 [1,0,0,0,0,0|2,0,0]=3 391 B8R1.3 C1=CC(=CC=C1N)N P108425 [1,0,0,0,0,0|2,0,0]=3 392 B8R1.3 C1=CC(=CC=C1N)N P108426 [1,0,0,0,0,0|2,0,0]=3 393 B8R1.3 C1=CC(=CC=C1N)N P128784 [1,0,0,0,0,0|2,0,0]=3 394 B8R1.3 C1=CC(=CC=C1N)N P292856 [1,0,0,0,0,0|2,0,0]=3 395 B8R1.3 C1=CC(=CC=C1N)N P302258 [1,0,0,0,0,0|2,0,0]=3 396 B8R1.3 C1=CC(=CC=C1N)N p115806 [1,0,0,0,0,0|2,0,0]=3 397 B8R1.3 C1=CC(=CC=C1N)O A100496 [1,0,0,0,0,0|1,0,0]=2 398 B8R1.3 C1=CC(=CC=C1N)O A110564 [1,0,0,0,0,0|1,0,0]=2 399 B8R1.3 C1=CC(=CC=C1N)O A110566 [1,0,0,0,0,0|1,0,0]=2 400 B8R1.3 C1=CC(=CC=C1N)S A107494 [1,0,0,0,0,0|1,1,0]=3 401 B8R1.3 C1=CC(=CC=C1N)S A163041 [1,0,0,0,0,0|1,1,0]=3 402 B8R1.3 C1=CC(=CC=C1O)Br B100691 [1,0,0,0,0,0|1,0,0]=2 403 B8R1.3 C1=CC(=CC=C1O)Br B100692 [1,0,0,0,0,0|1,0,0]=2 404 B8R1.3 C1=CC(=CC=C1O)Cl C108253 [1,0,0,0,0,0|1,0,0]=2 405 B8R1.3 C1=CC(=CC=C1O)Cl C108254 [1,0,0,0,0,0|1,0,0]=2 406 B8R1.3 C1=CC(=CC=C1O)Cl C108255 [1,0,0,0,0,0|1,0,0]=2 407 B8R1.3 C1=CC(=CC=C1O)Cl C108256 [1,0,0,0,0,0|1,0,0]=2 408 B8R1.3 C1=CC(=CC=C1O)F F107127 [1,0,0,0,0,0|1,0,0]=2 409 B8R1.3 C1=CC(=CC=C1O)I I107037 [1,0,0,0,0,0|1,0,0]=2 410 B8R1.3 C1=CC(=CC=C1O)O H108945 [1,0,0,0,0,0|1,0,0]=2 411 B8R1.3 C1=CC(=CC=C1O)O H108946 [1,0,0,0,0,0|1,0,0]=2 412 B8R1.3 C1=CC(=CC=C1O)O H108947 [1,0,0,0,0,0|1,0,0]=2 413 B8R1.3 C1=CC(=CC=C1O)O H431621 [1,0,0,0,0,0|1,0,0]=2 414 B8R1.3 C1=CC(=CC=C1O)S M101786 [1,0,0,0,0,0|1,0,0]=2 415 B8R1.3 C1=CC(=CC=C1S)Br B101773 [1,0,0,0,0,0|1,1,0]=3 416 B8R1.3 C1=CC(=CC=C1S)Cl C101766 [1,0,0,0,0,0|1,1,0]=3 417 B8R1.3 C1=CC(=CC=C1S)S B151928 [1,0,0,0,0,0|1,1,0]=3 418 B8R1.3 C1=CC(=NC=C1Br)Br D101561 [1,0,0,0,0,0|3,0,0]=4 419 B8R1.3 C1=CC(=NC=C1Br)Cl B123411 [1,0,0,0,0,0|3,0,0]=4 420 B8R1.3 C1=CC(=NC=C1Br)F B110259 [1,0,0,0,0,0|3,0,0]=4 421 B8R1.3 C1=CC(=NC=C1Br)I B120792 [1,0,0,0,0,0|3,0,0]=4 422 B8R1.3 C1=CC(=NC=C1Br)N A101197 [1,0,0,0,0,0|3,0,0]=4 423 B8R1.3 C1=CC(=NC=C1Cl)Br B102594 [1,0,0,0,0,0|3,0,0]=4 424 B8R1.3 C1=CC(=NC=C1Cl)Cl D120567 [1,0,0,0,0,0|3,0,0]=4 425 B8R1.3 C1=CC(=NC=C1Cl)F C110260 [1,0,0,0,0,0|3,0,0]=4 426 B8R1.3 C1=CC(=NC=C1Cl)I C168964 [1,0,0,0,0,0|3,0,0]=4 427 B8R1.3 C1=CC(=NC=C1Cl)N A107183 [1,0,0,0,0,0|3,0,0]=4 428 B8R1.3 C1=CC(=NC=C1F)Br B111195 [1,0,0,0,0,0|3,0,0]=4 429 B8R1.3 C1=CC(=NC=C1F)Cl C102598 [1,0,0,0,0,0|3,0,0]=4 430 B8R1.3 C1=CC(=NC=C1F)F D124342 [1,0,0,0,0,0|3,0,0]=4 431 B8R1.3 C1=CC(=NC=C1F)I F181837 [1,0,0,0,0,0|3,0,0]=4 432 B8R1.3 C1=CC(=NC=C1F)N A101607 [1,0,0,0,0,0|3,0,0]=4 433 B8R1.3 C1=CC(=NC=C1I)Br B122970 [1,0,0,0,0,0|3,0,0]=4 434 B8R1.3 C1=CC(=NC=C1I)Cl C119410 [1,0,0,0,0,0|3,0,0]=4 435 B8R1.3 C1=CC(=NC=C1I)F F119657 [1,0,0,0,0,0|3,0,0]=4 436 B8R1.3 C1=CC(=NC=C1I)I D166168 [1,0,0,0,0,0|3,0,0]=4 437 B8R1.3 C1=CC(=NC=C1I)N A129106 [1,0,0,0,0,0|3,0,0]=4 438 B8R1.3 C1=CC(=NC=C1N)Br A101199 [1,0,0,0,0,0|3,0,0]=4 439 B8R1.3 C1=CC(=NC=C1N)Cl A124240 [1,0,0,0,0,0|3,0,0]=4 440 B8R1.3 C1=CC(=NC=C1N)F A119632 [1,0,0,0,0,0|3,0,0]=4 441 B8R1.3 C1=CC(=NC=C1N)I A588630 [1,0,0,0,0,0|3,0,0]=4 442 B8R1.3 C1=CC(=NC=C1N)N D134973 [1,0,0,0,0,0|3,0,0]=4 443 B8R1.3 C1=CC(=NC=C1N)N D135606 [1,0,0,0,0,0|3,0,0]=4 444 B8R1.3 C1=CC(=NC=C1O)Br B102604 [1,0,0,0,0,0|2,0,0]=3 445 B8R1.3 C1=CC(=NC=C1O)Br B399634 [1,0,0,0,0,0|2,0,0]=3 446 B8R1.3 C1=CC(=NC=C1O)Cl C102603 [1,0,0,0,0,0|2,0,0]=3 447 B8R1.3 C1=CC(=NC=C1O)F F102601 [1,0,0,0,0,0|2,0,0]=3 448 B8R1.3 C1=CC(=NC=C1O)N A185200 [1,0,0,0,0,0|2,0,0]=3 449 B8R1.3 C1=CC(=O)C=CC1=O B108670 [1,0,0,0,0,0|1,0,1]=3 450 B8R1.3 C1=CC(=O)C=CC1=O B108671 [1,0,0,0,0,0|1,0,1]=3 451 B8R1.3 C1=CC(=O)C=CC1=O B108672 [1,0,0,0,0,0|1,0,1]=3 452 B8R1.3 C1=CC(=O)C=CC1=O Q104677 [1,0,0,0,0,0|1,0,1]=3 453 B8R1.3 C1=CC(=O)NC=C1Br B152104 [1,0,0,0,0,0|2,0,1]=4 454 B8R1.3 C1=CC(=O)NC=C1Cl C136324 [1,0,0,0,0,0|2,0,1]=4 455 B8R1.3 C1=CC(=O)NC=C1F F102599 [1,0,0,0,0,0|2,0,1]=4 456 B8R1.3 C1=CC(=O)NC=C1I W131730 [1,0,0,0,0,0|2,0,1]=4 457 B8R1.3 C1=CC(=O)NC=C1N A120454 [1,0,0,0,0,0|2,0,1]=4 458 B8R1.3 C1=C[N+](=CC=C1Cl)[O-] C124261 [1,0,0,0,0,0|2,0,1]=4 459 B8R1.3 CC1=CC=C(C=C1)Br B108900 [1,0,0,0,0,0|1,0,1]=3 460 B8R1.3 CC1=CC=C(C=C1)C X103333 [1,0,0,0,0,0|1,0,1]=3 461 B8R1.3 CC1=CC=C(C=C1)C X103334 [1,0,0,0,0,0|1,0,1]=3 462 B8R1.3 CC1=CC=C(C=C1)C X103336 [1,0,0,0,0,0|1,0,1]=3 463 B8R1.3 CC1=CC=C(C=C1)C X103338 [1,0,0,0,0,0|1,0,1]=3 464 B8R1.3 CC1=CC=C(C=C1)C X103339 [1,0,0,0,0,0|1,0,1]=3 465 B8R1.3 CC1=CC=C(C=C1)C X103342 [1,0,0,0,0,0|1,0,1]=3 466 B8R1.3 CC1=CC=C(C=C1)C X119715 [1,0,0,0,0,0|1,0,1]=3 467 B8R1.3 CC1=CC=C(C=C1)C X128149 [1,0,0,0,0,0|1,0,1]=3 468 B8R1.3 CC1=CC=C(C=C1)Cl C104628 [1,0,0,0,0,0|1,0,1]=3 469 B8R1.3 CC1=CC=C(C=C1)Cl C104629 [1,0,0,0,0,0|1,0,1]=3 470 B8R1.3 CC1=CC=C(C=C1)Cl C113011 [1,0,0,0,0,0|1,0,1]=3 471 B8R1.3 CC1=CC=C(C=C1)Cl C113012 [1,0,0,0,0,0|1,0,1]=3 472 B8R1.3 CC1=CC=C(C=C1)Cl C128161 [1,0,0,0,0,0|1,0,1]=3 473 B8R1.3 CC1=CC=C(C=C1)F F107110 [1,0,0,0,0,0|1,0,1]=3 474 B8R1.3 CC1=CC=C(C=C1)I I118363 [1,0,0,0,0,0|1,0,1]=3 475 B8R1.3 CC1=CC=C(C=C1)N T108450 [1,0,0,0,0,0|1,0,1]=3 476 B8R1.3 CC1=CC=C(C=C1)N T108451 [1,0,0,0,0,0|1,0,1]=3 477 B8R1.3 CC1=CC=C(C=C1)N T111232 [1,0,0,0,0,0|1,0,1]=3 478 B8R1.3 CC1=CC=C(C=C1)O C108248 [1,0,0,0,0,0|0,0,1]=2 479 B8R1.3 CC1=CC=C(C=C1)O C108249 [1,0,0,0,0,0|0,0,1]=2 480 B8R1.3 CC1=CC=C(C=C1)O C108250 [1,0,0,0,0,0|0,0,1]=2 481 B8R1.3 CC1=CC=C(C=C1)O C108251 [1,0,0,0,0,0|0,0,1]=2 482 B8R1.3 CC1=CC=C(C=C1)O C108252 [1,0,0,0,0,0|0,0,1]=2 483 B8R1.3 CC1=CC=C(C=C1)O C108640 [1,0,0,0,0,0|0,0,1]=2 484 B8R1.3 CC1=CC=C(C=C1)O C108641 [1,0,0,0,0,0|0,0,1]=2 485 B8R1.3 CC1=CC=C(C=C1)O C128202 [1,0,0,0,0,0|0,0,1]=2 486 B8R1.3 CC1=CC=C(C=C1)S T109389 [1,0,0,0,0,0|0,1,1]=3 487 B8R1.3 CC1=CC=[N+](C=C1)C D588274 [1,0,0,0,0,0|2,0,1]=4 488 B8R1.3 CC1=CC=[N+](C=C1)[O-] M158852 [1,0,0,0,0,0|1,0,2]=4 489 B8R1.3 CC1=CN=C(C=C1)Br B120720 [1,0,0,0,0,0|2,0,1]=4 490 B8R1.3 CC1=CN=C(C=C1)C L111803 [1,0,0,0,0,0|2,0,1]=4 491 B8R1.3 CC1=CN=C(C=C1)Cl C122971 [1,0,0,0,0,0|2,0,1]=4 492 B8R1.3 CC1=CN=C(C=C1)F F120713 [1,0,0,0,0,0|2,0,1]=4 493 B8R1.3 CC1=CN=C(C=C1)N A107505 [1,0,0,0,0,0|2,0,1]=4 494 B8R1.3 CC1=CNC(=O)C=C1 H107715 [1,0,0,0,0,0|1,0,2]=4 495 B8R1.3 CC1=CNC(=S)C=C1 M405751 [1,0,0,0,0,0|1,1,1]=4 496 B8R1.3 CC1=NC=C(C=C1)Br B123445 [1,0,0,0,0,0|2,0,1]=4 497 B8R1.3 CC1=NC=C(C=C1)Cl C186235 [1,0,0,0,0,0|2,0,1]=4 498 B8R1.3 CC1=NC=C(C=C1)F F489688 [1,0,0,0,0,0|2,0,1]=4 499 B8R1.3 CC1=NC=C(C=C1)N A103049 [1,0,0,0,0,0|2,0,1]=4 500 B8R1.3 CC1=NC=C(C=C1)O H156935 [1,0,0,0,0,0|1,0,1]=3 501 B8R1.3 CC1=NC=C(C=N1)O M588838 [1,0,0,0,0,0|2,0,1]=4 502 B8R1.3 CC1=[C-]C=C(C=C1)F F579402 [1,0,0,0,0,0|1,0,2]=4 503 B10R1.1 C1=CC(=CC=C1CC#N)Br B100849 [0,1,0,0,0,0|1,0,2]=4 504 B10R1.1 C1=CC(=CC=C1CC#N)Cl C124714 [0,1,0,0,0,0|1,0,2]=4 505 B10R1.1 C1=CC(=CC=C1CC#N)F F156616 [0,1,0,0,0,0|1,0,2]=4 506 B10R1.1 C1=CC(=CC=C1CC#N)I I170725 [0,1,0,0,0,0|1,0,2]=4 507 B10R1.1 C1=CC(=CC=C1CC#N)N A107271 [0,1,0,0,0,0|1,0,2]=4 508 B10R1.1 C1=CC(=CC=C1CC#N)O H121848 [0,1,0,0,0,0|0,0,2]=3 509 B10R1.1 C1=CC(=CC=C1CCBr)Br B167924 [0,1,0,0,0,0|1,0,2]=4 510 B10R1.1 C1=CC(=CC=C1CCBr)Cl C121844 [0,1,0,0,0,0|1,0,2]=4 511 B10R1.1 C1=CC(=CC=C1CCBr)F F121611 [0,1,0,0,0,0|1,0,2]=4 512 B10R1.1 C1=CC(=CC=C1CCBr)O H167212 [0,1,0,0,0,0|0,0,2]=3 513 B10R1.1 C1=CC(=CC=C1CCCl)F F156671 [0,1,0,0,0,0|1,0,2]=4 514 B10R1.1 C1=CC(=CC=C1CCN)Br B101709 [0,1,0,0,0,0|1,0,2]=4 515 B10R1.1 C1=CC(=CC=C1CCN)Br B494194 [0,1,0,0,0,0|1,0,2]=4 516 B10R1.1 C1=CC(=CC=C1CCN)Br B494196 [0,1,0,0,0,0|1,0,2]=4 517 B10R1.1 C1=CC(=CC=C1CCN)Cl C153968 [0,1,0,0,0,0|1,0,2]=4 518 B10R1.1 C1=CC(=CC=C1CCN)Cl C493551 [0,1,0,0,0,0|1,0,2]=4 519 B10R1.1 C1=CC(=CC=C1CCN)F F131906 [0,1,0,0,0,0|1,0,2]=4 520 B10R1.1 C1=CC(=CC=C1CCN)F F292669 [0,1,0,0,0,0|1,0,2]=4 521 B10R1.1 C1=CC(=CC=C1CCN)F F302836 [0,1,0,0,0,0|1,0,2]=4 522 B10R1.1 C1=CC(=CC=C1CCN)F F493198 [0,1,0,0,0,0|1,0,2]=4 523 B10R1.1 C1=CC(=CC=C1CCN)N A151503 [0,1,0,0,0,0|1,0,2]=4 524 B10R1.1 C1=CC(=CC=C1CCN)O T105543 [0,1,0,0,0,0|0,0,2]=3 525 B10R1.1 C1=CC(=CC=C1CCN)O T107153 [0,1,0,0,0,0|0,0,2]=3 526 B10R1.1 C1=CC(=CC=C1CCN)O T424437 [0,1,0,0,0,0|0,0,2]=3 527 B10R1.1 C1=CC(=CC=C1CCO)Br B153115 [0,1,0,0,0,0|1,0,2]=4 528 B10R1.1 C1=CC(=CC=C1CCO)Cl C121856 [0,1,0,0,0,0|1,0,2]=4 529 B10R1.1 C1=CC(=CC=C1CCO)F F136730 [0,1,0,0,0,0|1,0,2]=4 530 B10R1.1 C1=CC(=CC=C1CCO)N A151120 [0,1,0,0,0,0|1,0,2]=4 531 B10R1.1 C1=CC(=CC=C1CCO)O H106325 [0,1,0,0,0,0|0,0,2]=3 532 B10R1.1 C1=CC(=CC=C1CCO)O H118576 [0,1,0,0,0,0|0,0,2]=3 533 B10R1.1 C1=CC(=CC=C1CCO)O H424324 [0,1,0,0,0,0|0,0,2]=3 534 B10R1.1 C1=CC(=CC=C1CON)F A184897 [0,1,0,0,0,0|2,0,1]=4 535 B10R1.1 C1=CC(=CC=C1N)N=[N+]=[N-] A352348 [0,1,0,0,0,0|3,0,0]=4 536 B10R1.1 C1=CC(=CC=C1N=C=O)Br B120150 [0,1,0,0,0,0|2,0,1]=4 537 B10R1.1 C1=CC(=CC=C1N=C=O)Cl C102129 [0,1,0,0,0,0|2,0,1]=4 538 B10R1.1 C1=CC(=CC=C1N=C=O)F F156778 [0,1,0,0,0,0|2,0,1]=4 539 B10R1.1 C1=CC(=CC=C1N=C=O)I I352477 [0,1,0,0,0,0|2,0,1]=4 540 B10R1.1 C1=CC(=CC=C1N=C=S)Br B140608 [0,1,0,0,0,0|2,0,1]=4 541 B10R1.1 C1=CC(=CC=C1N=C=S)Cl C140606 [0,1,0,0,0,0|2,0,1]=4 542 B10R1.1 C1=CC(=CC=C1N=C=S)F F101902 [0,1,0,0,0,0|2,0,1]=4 543 B10R1.1 C1=CC(=CC=C1N=C=S)I I140607 [0,1,0,0,0,0|2,0,1]=4 544 B10R1.1 C1=CC(=CC=C1NC=O)Br N342559 [0,1,0,0,0,0|2,0,0]=3 545 B10R1.1 C1=CC(=CC=C1NC=O)Cl N159268 [0,1,0,0,0,0|2,0,0]=3 546 B10R1.1 C1=CC(=CC=C1NC=O)F N159255 [0,1,0,0,0,0|2,0,0]=3 547 B10R1.1 C=CCC1=CC=C(C=C1)O A589273 [0,1,0,0,0,0|0,0,0]=1 548 B10R1.1 CC1=CC=C(C=C1)CC#N P160068 [0,1,0,0,0,0|1,0,2]=4 549 B10R1.1 CC1=CC=C(C=C1)CC=C A169644 [0,1,0,0,0,0|1,0,0]=2 550 B10R1.1 CC1=CC=C(C=C1)CC=O P586228 [0,1,0,0,0,0|1,0,1]=3 551 B10R1.1 CC1=CC=C(C=C1)CCBr M469504 [0,1,0,0,0,0|1,0,2]=4 552 B10R1.1 CC1=CC=C(C=C1)CCN M493506 [0,1,0,0,0,0|1,0,2]=4 553 B10R1.1 CC1=CC=C(C=C1)CCN P101999 [0,1,0,0,0,0|1,0,2]=4 554 B10R1.1 CC1=CC=C(C=C1)CCO I135268 [0,1,0,0,0,0|1,0,2]=4 555 B10R1.1 CC1=CC=C(C=C1)CNC N300479 [0,1,0,0,0,0|1,0,2]=4 556 B10R1.1 CC1=CC=C(C=C1)N=C=O T106835 [0,1,0,0,0,0|2,0,1]=4 557 B10R1.1 CC1=CC=C(C=C1)N=C=S P160464 [0,1,0,0,0,0|2,0,1]=4 558 B10R1.1 CC1=CC=C(C=C1)NC=O M158337 [0,1,0,0,0,0|2,0,0]=3 559 B10R1.1 CCCC1=CC=C(C=C1)Br B101884 [0,1,0,0,0,0|1,0,2]=4 560 B10R1.1 CCCC1=CC=C(C=C1)C P160392 [0,1,0,0,0,0|1,0,2]=4 561 B10R1.1 CCCC1=CC=C(C=C1)Cl C303901 [0,1,0,0,0,0|1,0,2]=4 562 B10R1.1 CCCC1=CC=C(C=C1)N P136525 [0,1,0,0,0,0|1,0,2]=4 563 B10R1.1 CCCC1=CC=C(C=C1)O P136692 [0,1,0,0,0,0|0,0,2]=3 564 B10R1.1 CCNC1=CC=C(C=C1)C N158982 [0,1,0,0,0,0|1,0,2]=4 565 B10R1.1 CCOC1=CC=C(C=C1)Br B113334 [0,1,0,0,0,0|1,0,2]=4 566 B10R1.1 CCOC1=CC=C(C=C1)Cl C304178 [0,1,0,0,0,0|1,0,2]=4 567 B10R1.1 CCOC1=CC=C(C=C1)F F156673 [0,1,0,0,0,0|1,0,2]=4 568 B10R1.1 CCOC1=CC=C(C=C1)I I111883 [0,1,0,0,0,0|1,0,2]=4 569 B10R1.1 CCOC1=CC=C(C=C1)N E108459 [0,1,0,0,0,0|1,0,2]=4 570 B10R1.1 CCOC1=CC=C(C=C1)N P160470 [0,1,0,0,0,0|1,0,2]=4 571 B10R1.1 CCOC1=CC=C(C=C1)O E124314 [0,1,0,0,0,0|0,0,2]=3 572 B10R1.1 CNCC1=CC=C(C=C1)Br B186104 [0,1,0,0,0,0|1,0,2]=4 573 B10R1.1 CNCC1=CC=C(C=C1)Cl C153967 [0,1,0,0,0,0|1,0,2]=4 574 B10R1.1 CNCC1=CC=C(C=C1)F F156709 [0,1,0,0,0,0|1,0,2]=4 575 B10R1.1 COCC1=CC=C(C=C1)Br B181671 [0,1,0,0,0,0|1,0,2]=4 576 B10R1.1 COCC1=CC=C(C=C1)O M170858 [0,1,0,0,0,0|0,0,2]=3 577 B10R1.3 C#CC1=CC=C(C=C1)C#C D101575 [0,1,0,0,0,0|1,0,2]=4 578 B10R1.3 C#CC1=CC=C(C=C1)C#N E138638 [0,1,0,0,0,0|1,0,2]=4 579 B10R1.3 C#CC1=CC=C(C=C1)C=O E139128 [0,1,0,0,0,0|2,0,0]=3 580 B10R1.3 C#CC1=CC=C(C=C1)CCl C586270 [0,1,0,0,0,0|1,0,2]=4 581 B10R1.3 C#CC1=CC=C(C=C1)CO E302152 [0,1,0,0,0,0|0,0,2]=3 582 B10R1.3 C1=CC(=CC=C1C#N)C#N D111053 [0,1,0,0,0,0|2,0,1]=4 583 B10R1.3 C1=CC(=CC=C1C#N)NN C102562 [0,1,0,0,0,0|2,0,1]=4 584 B10R1.3 C1=CC(=CC=C1C=O)C#N F100751 [0,1,0,0,0,0|2,0,0]=3 585 B10R1.3 C1=CC(=CC=C1C=O)C=O P105980 [0,1,0,0,0,0|1,0,1]=3 586 B10R1.3 C1=CC(=CC=C1CBr)C#N C153839 [0,1,0,0,0,0|2,0,1]=4 587 B10R1.3 C1=CC(=CC=C1CBr)C=O B184885 [0,1,0,0,0,0|2,0,0]=3 588 B10R1.3 C1=CC(=CC=C1CBr)CBr D100654 [0,1,0,0,0,0|2,0,1]=4 589 B10R1.3 C1=CC(=CC=C1CCl)C#N C101656 [0,1,0,0,0,0|2,0,1]=4 590 B10R1.3 C1=CC(=CC=C1CCl)C=O C194802 [0,1,0,0,0,0|2,0,0]=3 591 B10R1.3 C1=CC(=CC=C1CCl)CCl D104515 [0,1,0,0,0,0|2,0,1]=4 592 B10R1.3 C1=CC(=CC=C1CN)C#N A132657 [0,1,0,0,0,0|2,0,1]=4 593 B10R1.3 C1=CC(=CC=C1CN)CN P292859 [0,1,0,0,0,0|2,0,1]=4 594 B10R1.3 C1=CC(=CC=C1CN)CN X113802 [0,1,0,0,0,0|2,0,1]=4 595 B10R1.3 C1=CC(=CC=C1CN)CO A184295 [0,1,0,0,0,0|1,0,1]=3 596 B10R1.3 C1=CC(=CC=C1CO)C#N H124046 [0,1,0,0,0,0|1,0,1]=3 597 B10R1.3 C1=CC(=CC=C1CO)C=O H193722 [0,1,0,0,0,0|1,0,0]=2 598 B10R1.3 C1=CC(=CC=C1CO)CCl W131919 [0,1,0,0,0,0|1,0,1]=3 599 B10R1.3 C1=CC(=CC=C1CO)CO B107001 [0,1,0,0,0,0|1,0,1]=3 600 B10R1.3 C1=CC(=CC=C1CS)CS B101791 [0,1,0,0,0,0|1,1,1]=4 601 B10R1.3 C1=CC(=CC=C1NO)N=O B101359 [0,1,0,0,0,0|2,0,0]=3 602 B10R1.3 C1=CC(=NC=C1C=O)C#N F181154 [0,1,0,0,0,0|3,0,0]=4 603 B10R1.3 C=CC1=CC=C(C=C1)C#N C478980 [0,1,0,0,0,0|1,0,0]=2 604 B10R1.3 C=CC1=CC=C(C=C1)C=C P466823 [0,1,0,0,0,0|1,0,0]=2 605 B10R1.3 C=CC1=CC=C(C=C1)C=O V587715 [0,1,0,0,0,0|0,0,1]=2 606 B10R1.3 C=CC1=CC=C(C=C1)CCl V141224 [0,1,0,0,0,0|1,0,0]=2 607 B10R1.3 C=CC1=CC=C(C=C1)CCl V592268 [0,1,0,0,0,0|1,0,0]=2 608 B10R1.3 C=CC1=CC=C(C=C1)CN V123986 [0,1,0,0,0,0|1,0,0]=2 609 B10R1.3 CCC1=CC=C(C=C1)C#C E115541 [0,1,0,0,0,0|1,0,2]=4 610 B10R1.3 CCC1=CC=C(C=C1)C#N E169049 [0,1,0,0,0,0|1,0,2]=4 611 B10R1.3 CCC1=CC=C(C=C1)C=O E102795 [0,1,0,0,0,0|2,0,0]=3 612 B10R1.3 CCC1=CC=C(C=C1)CC D107652 [0,1,0,0,0,0|1,0,2]=4 613 B10R1.3 CCC1=CC=C(C=C1)CC D107653 [0,1,0,0,0,0|1,0,2]=4 614 B10R1.3 CCC1=CC=C(C=C1)CCl E299918 [0,1,0,0,0,0|1,0,2]=4 615 B10R1.3 CCC1=CC=C(C=C1)CCl E399766 [0,1,0,0,0,0|1,0,2]=4 616 B10R1.3 CCC1=CC=C(C=C1)CO E156110 [0,1,0,0,0,0|0,0,2]=3 617 B10R1.3 CCC1=CC=C(C=C1)NN E185066 [0,1,0,0,0,0|1,0,2]=4 618 B10R1.3 CCC1=CC=C(C=C1)OC E137475 [0,1,0,0,0,0|0,0,2]=3 619 B10R1.3 CNC1=CC=C(C=C1)C#N M184657 [0,1,0,0,0,0|2,0,1]=4 620 B10R1.3 CNC1=CC=C(C=C1)OC I133933 [0,1,0,0,0,0|1,0,1]=3 621 B10R1.3 COC1=CC=C(C=C1)C#C M111332 [0,1,0,0,0,0|0,0,2]=3 622 B10R1.3 COC1=CC=C(C=C1)C#N M111093 [0,1,0,0,0,0|1,0,1]=3 623 B10R1.3 COC1=CC=C(C=C1)C=C M103131 [0,1,0,0,0,0|0,0,0]=1 624 B10R1.3 COC1=CC=C(C=C1)C=O A108955 [0,1,0,0,0,0|1,0,0]=2 625 B10R1.3 COC1=CC=C(C=C1)C=O A108956 [0,1,0,0,0,0|1,0,0]=2 626 B10R1.3 COC1=CC=C(C=C1)C=O A108957 [0,1,0,0,0,0|1,0,0]=2 627 B10R1.3 COC1=CC=C(C=C1)C=O A108958 [0,1,0,0,0,0|1,0,0]=2 628 B10R1.3 COC1=CC=C(C=C1)C=O P421001 [0,1,0,0,0,0|1,0,0]=2 629 B10R1.3 COC1=CC=C(C=C1)CCl M491599 [0,1,0,0,0,0|1,0,1]=3 630 B10R1.3 COC1=CC=C(C=C1)CN M123767 [0,1,0,0,0,0|1,0,1]=3 631 B10R1.3 COC1=CC=C(C=C1)CO M107568 [0,1,0,0,0,0|1,0,1]=3 632 B10R1.3 COC1=CC=C(C=C1)CS M101790 [0,1,0,0,0,0|1,0,1]=3 633 B10R1.3 COC1=CC=C(C=C1)CS M414622 [0,1,0,0,0,0|1,0,1]=3 634 B10R1.3 COC1=CC=C(C=C1)OC D104711 [0,1,0,0,0,0|1,0,1]=3 635 B10R1.3 COC1=CC=C(C=C1)OC D137778 [0,1,0,0,0,0|1,0,1]=3 636 B10R1.3 COC1=CC=C(C=C1)SC M101846 [0,1,0,0,0,0|1,0,1]=3 637 B10R1.3 COC1=CC=C(C=C1)[N+]#N M123217 [0,1,0,0,0,0|2,0,0]=3 638 B10R1.3 COC1=CC=C(C=C1)[N+]#[C-] M165558 [0,1,0,0,0,0|1,0,1]=3 639 B10R1.3 COC1=CN=C(C=C1)C#N M178084 [0,1,0,0,0,0|2,0,1]=4 640 B10R1.3 COC1=CN=C(C=C1)C=O M182921 [0,1,0,0,0,0|2,0,0]=3 641 B10R1.3 COC1=CN=C(C=C1)CO M190450 [0,1,0,0,0,0|2,0,1]=4 642 B10R1.3 COC1=NC=C(C=C1)C#N M167622 [0,1,0,0,0,0|2,0,1]=4 643 B10R1.3 COC1=NC=C(C=C1)C=O M115769 [0,1,0,0,0,0|2,0,0]=3 644 B10R1.3 COC1=NC=C(C=C1)CN M177670 [0,1,0,0,0,0|2,0,1]=4 645 B10R1.3 COC1=NC=C(C=C1)CO M176865 [0,1,0,0,0,0|2,0,1]=4 646 B10R1.3 COC1=NC=C(C=N1)C=O F337248 [0,1,0,0,0,0|3,0,0]=4 647 B10R1.3 CSC1=CC=C(C=C1)C#N M101849 [0,1,0,0,0,0|1,1,1]=4 648 B10R1.3 CSC1=CC=C(C=C1)C=O P133663 [0,1,0,0,0,0|1,1,0]=3 649 B10R1.3 CSC1=CC=C(C=C1)CCl M101851 [0,1,0,0,0,0|1,1,1]=4 650 B10R1.3 CSC1=CC=C(C=C1)CO M101850 [0,1,0,0,0,0|1,0,1]=3 651 B10R1.13 B(C1=CC=C(C=C1)Br)(O)O B103545 [0,1,0,0,0,0|3,0,0]=4 652 B10R1.13 B(C1=CC=C(C=C1)Br)(O)O B396370 [0,1,0,0,0,0|3,0,0]=4 653 B10R1.13 B(C1=CC=C(C=C1)C)(O)O P290670 [0,1,0,0,0,0|3,0,0]=4 654 B10R1.13 B(C1=CC=C(C=C1)C)(O)O P396101 [0,1,0,0,0,0|3,0,0]=4 655 B10R1.13 B(C1=CC=C(C=C1)C)(O)O T111324 [0,1,0,0,0,0|3,0,0]=4 656 B10R1.13 B(C1=CC=C(C=C1)Cl)(O)O C103544 [0,1,0,0,0,0|3,0,0]=4 657 B10R1.13 B(C1=CC=C(C=C1)Cl)(O)O C396376 [0,1,0,0,0,0|3,0,0]=4 658 B10R1.13 B(C1=CC=C(C=C1)F)(O)O F111213 [0,1,0,0,0,0|3,0,0]=4 659 B10R1.13 B(C1=CC=C(C=C1)F)(O)O F396105 [0,1,0,0,0,0|3,0,0]=4 660 B10R1.13 B(C1=CC=C(C=C1)I)(O)O I170694 [0,1,0,0,0,0|3,0,0]=4 661 B10R1.13 B(C1=CC=C(C=C1)N)(O)O A120027 [0,1,0,0,0,0|3,0,0]=4 662 B10R1.13 B(C1=CC=C(C=C1)O)(O)O C107574 [0,1,0,0,0,0|2,0,0]=3 663 B10R1.13 B(C1=CC=C(C=C1)S)(O)O M120060 [0,1,0,0,0,0|2,1,0]=4 664 B10R1.13 C1=CC(=CC=C1C(=N)N)Br B140178 [0,1,0,0,0,0|2,0,0]=3 665 B10R1.13 C1=CC(=CC=C1C(=N)N)Cl C153625 [0,1,0,0,0,0|2,0,0]=3 666 B10R1.13 C1=CC(=CC=C1C(=N)N)F F140179 [0,1,0,0,0,0|2,0,0]=3 667 B10R1.13 C1=CC(=CC=C1C(=N)N)N A113930 [0,1,0,0,0,0|2,0,0]=3 668 B10R1.13 C1=CC(=CC=C1C(=N)N)O H121877 [0,1,0,0,0,0|1,0,0]=2 669 B10R1.13 C1=CC(=CC=C1C(=O)Cl)Br B103223 [0,1,0,0,0,0|2,0,0]=3 670 B10R1.13 C1=CC(=CC=C1C(=O)Cl)Cl C106079 [0,1,0,0,0,0|2,0,0]=3 671 B10R1.13 C1=CC(=CC=C1C(=O)Cl)F F109226 [0,1,0,0,0,0|2,0,0]=3 672 B10R1.13 C1=CC(=CC=C1C(=O)Cl)I I157591 [0,1,0,0,0,0|2,0,0]=3 673 B10R1.13 C1=CC(=CC=C1C(=O)N)Br B133990 [0,1,0,0,0,0|2,0,0]=3 674 B10R1.13 C1=CC(=CC=C1C(=O)N)Cl C153725 [0,1,0,0,0,0|2,0,0]=3 675 B10R1.13 C1=CC(=CC=C1C(=O)N)F F109724 [0,1,0,0,0,0|2,0,0]=3 676 B10R1.13 C1=CC(=CC=C1C(=O)N)I I135499 [0,1,0,0,0,0|2,0,0]=3 677 B10R1.13 C1=CC(=CC=C1C(=O)N)N A107276 [0,1,0,0,0,0|2,0,0]=3 678 B10R1.13 C1=CC(=CC=C1C(=O)N)O H157094 [0,1,0,0,0,0|1,0,0]=2 679 B10R1.13 C1=CC(=CC=C1C(=O)O)Br B104344 [0,1,0,0,0,0|2,0,0]=3 680 B10R1.13 C1=CC(=CC=C1C(=O)O)Cl C104333 [0,1,0,0,0,0|2,0,0]=3 681 B10R1.13 C1=CC(=CC=C1C(=O)O)Cl C104334 [0,1,0,0,0,0|2,0,0]=3 682 B10R1.13 C1=CC(=CC=C1C(=O)O)Cl C433417 [0,1,0,0,0,0|2,0,0]=3 683 B10R1.13 C1=CC(=CC=C1C(=O)O)F F105088 [0,1,0,0,0,0|2,0,0]=3 684 B10R1.13 C1=CC(=CC=C1C(=O)O)F F105089 [0,1,0,0,0,0|2,0,0]=3 685 B10R1.13 C1=CC(=CC=C1C(=O)O)I I105098 [0,1,0,0,0,0|2,0,0]=3 686 B10R1.13 C1=CC(=CC=C1C(=O)O)N A108862 [0,1,0,0,0,0|2,0,0]=3 687 B10R1.13 C1=CC(=CC=C1C(=O)O)N A108863 [0,1,0,0,0,0|2,0,0]=3 688 B10R1.13 C1=CC(=CC=C1C(=O)O)N A421766 [0,1,0,0,0,0|2,0,0]=3 689 B10R1.13 C1=CC(=CC=C1C(=O)O)N A432150 [0,1,0,0,0,0|2,0,0]=3 690 B10R1.13 C1=CC(=CC=C1C(=O)O)O H108508 [0,1,0,0,0,0|1,0,0]=2 691 B10R1.13 C1=CC(=CC=C1C(=O)O)O H108509 [0,1,0,0,0,0|1,0,0]=2 692 B10R1.13 C1=CC(=CC=C1C(=O)O)O P427231 [0,1,0,0,0,0|1,0,0]=2 693 B10R1.13 C1=CC(=CC=C1C(=O)O)S M100780 [0,1,0,0,0,0|1,1,0]=3 694 B10R1.13 C1=CC(=CC=C1C(=O)O)S M431355 [0,1,0,0,0,0|1,1,0]=3 695 B10R1.13 C1=CC(=CC=C1C(=O)[O-])F S358726 [0,1,0,0,0,0|2,0,0]=3 696 B10R1.13 C1=CC(=CC=C1C(=O)[O-])N A111607 [0,1,0,0,0,0|2,0,0]=3 697 B10R1.13 C1=CC(=CC=C1C(=O)[O-])N A111608 [0,1,0,0,0,0|2,0,0]=3 698 B10R1.13 C1=CC(=CC=C1C(=O)[O-])N A167159 [0,1,0,0,0,0|2,0,0]=3 699 B10R1.13 C1=CC(=CC=C1C(=O)[O-])N A474259 [0,1,0,0,0,0|2,0,0]=3 700 B10R1.13 C1=CC(=CC=C1C(=O)[O-])O H105643 [0,1,0,0,0,0|1,0,0]=2 701 B10R1.13 C1=CC(=CC=C1C(=O)[O-])O H105644 [0,1,0,0,0,0|1,0,0]=2 702 B10R1.13 C1=CC(=CC=C1C(=S)N)Br B140152 [0,1,0,0,0,0|2,0,0]=3 703 B10R1.13 C1=CC(=CC=C1C(=S)N)Cl C140150 [0,1,0,0,0,0|2,0,0]=3 704 B10R1.13 C1=CC(=CC=C1C(=S)N)O H101894 [0,1,0,0,0,0|1,0,0]=2 705 B10R1.13 C1=CC(=CC=C1C(Cl)Cl)F F156706 [0,1,0,0,0,0|2,0,1]=4 706 B10R1.13 C1=CC(=CC=C1C(F)F)Br B184912 [0,1,0,0,0,0|2,0,1]=4 707 B10R1.13 C1=CC(=CC=C1F)S(=O)[O-] S195189 [0,1,0,0,0,0|3,0,0]=4 708 B10R1.13 C1=CC(=CC=C1N)[N+](=O)[O-] N111641 [0,1,0,0,0,0|3,0,0]=4 709 B10R1.13 C1=CC(=CC=C1N)[N+](=O)[O-] N111643 [0,1,0,0,0,0|3,0,0]=4 710 B10R1.13 C1=CC(=CC=C1N)[N+](=O)[O-] N117383 [0,1,0,0,0,0|3,0,0]=4 711 B10R1.13 C1=CC(=CC=C1N)[N+](=O)[O-] N158959 [0,1,0,0,0,0|3,0,0]=4 712 B10R1.13 C1=CC(=CC=C1N)[N+](=O)[O-] P276604 [0,1,0,0,0,0|3,0,0]=4 713 B10R1.13 C1=CC(=CC=C1S(=O)[O-])Cl C134302 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])Br B153155 [0,1,0,0,0,0|3,0,0]=4 715 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])Cl C108539 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])Cl C108540 [0,1,0,0,0,0|3,0,0]=4 717 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])Cl C108541 [0,1,0,0,0,0|3,0,0]=4 718 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])Cl C108542 [0,1,0,0,0,0|3,0,0]=4 719 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])F F107055 [0,1,0,0,0,0|3,0,0]=4 720 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])I I107038 [0,1,0,0,0,0|3,0,0]=4 721 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])O N108643 [0,1,0,0,0,0|2,0,0]=3 722 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])O N591132 [0,1,0,0,0,0|2,0,0]=3 723 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])O P572406 [0,1,0,0,0,0|2,0,0]=3 724 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])S N101757 [0,1,0,0,0,0|2,1,0]=4 725 B10R1.13 C1=CC(=CC=C1[N+](=O)[O-])[O-] N304726 [0,1,0,0,0,0|2,0,1]=4 726 B10R1.13 C1=CC(=NC=C1Br)C(=O)O B151859 [0,1,0,0,0,0|3,0,0]=4 727 B10R1.13 C1=CC(=NC=C1C(=O)Cl)Cl C113581 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.13 C1=CC(=NC=C1C(=O)N)Br B187814 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.13 C1=CC(=NC=C1C(=O)N)Cl C154058 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.13 C1=CC(=NC=C1C(=O)N)N A112600 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.13 C1=CC(=NC=C1C(=O)O)Br B151851 [0,1,0,0,0,0|3,0,0]=4 732 B10R1.13 C1=CC(=NC=C1C(=O)O)Cl C128115 [0,1,0,0,0,0|3,0,0]=4 733 B10R1.13 C1=CC(=NC=C1C(=O)O)F F170170 [0,1,0,0,0,0|3,0,0]=4 734 B10R1.13 C1=CC(=NC=C1C(=O)O)N A113866 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.13 C1=CC(=NC=C1Cl)C(=O)O C137081 [0,1,0,0,0,0|3,0,0]=4 736 B10R1.13 C1=CC(=NC=C1F)C(=O)O F137992 [0,1,0,0,0,0|3,0,0]=4 737 B10R1.13 C1=CC(=NC=C1N)C(=O)O A123111 [0,1,0,0,0,0|3,0,0]=4 738 B10R1.13 C1=CC(=NC=C1N)C(=S)N A471765 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.13 C1=CC(=NC=C1O)C(=O)O H156934 [0,1,0,0,0,0|2,0,0]=3 740 B10R1.13 C1=CC(=NC=C1O)[N+](=O)[O-] H191090 [0,1,0,0,0,0|3,0,0]=4 741 B10R1.13 C1=CC(=O)NC=C1C(=O)O H108017 [0,1,0,0,0,0|2,0,1]=4 742 B10R1.13 C1=CC(=O)NC=C1C(=O)O H108018 [0,1,0,0,0,0|2,0,1]=4 743 B10R1.13 C1=CC(=O)NC=C1C(=O)O H424315 [0,1,0,0,0,0|2,0,1]=4 744 B10R1.13 C1=CC(=O)OC=C1C(=O)O C153427 [0,1,0,0,0,0|2,0,1]=4 745 B10R1.13 C1=CC(=O)OC=C1C(=O)O C197213 [0,1,0,0,0,0|2,0,1]=4 746 B10R1.13 C1=C[N+](=CC=C1C(=O)O)[O-] I157692 [0,1,0,0,0,0|2,0,1]=4 747 B10R1.13 CC(=C)C1=CC=C(C=C1)F F156644 [0,1,0,0,0,0|1,0,0]=2 748 B10R1.13 CC(=C)C1=CC=C(C=C1)O P193379 [0,1,0,0,0,0|0,0,0]=1 749 B10R1.13 CC(=O)C1=CC=C(C=C1)Br B106981 [0,1,0,0,0,0|1,0,1]=3 750 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl C103870 [0,1,0,0,0,0|1,0,1]=3 751 B10R1.13 CC(=O)C1=CC=C(C=C1)F F101384 [0,1,0,0,0,0|1,0,1]=3 752 B10R1.13 CC(=O)C1=CC=C(C=C1)I I107027 [0,1,0,0,0,0|1,0,1]=3 753 B10R1.13 CC(=O)C1=CC=C(C=C1)N A110613 [0,1,0,0,0,0|1,0,1]=3 754 B10R1.13 CC(=O)C1=CC=C(C=C1)N A110614 [0,1,0,0,0,0|1,0,1]=3 755 B10R1.13 CC(=O)C1=CC=C(C=C1)N A151685 [0,1,0,0,0,0|1,0,1]=3 756 B10R1.13 CC(=O)C1=CC=C(C=C1)O H102969 [0,1,0,0,0,0|0,0,1]=2 757 B10R1.13 CC(=O)C1=CC=C(C=C1)S M407301 [0,1,0,0,0,0|0,1,1]=3 758 B10R1.13 CC(=O)C1=CN=C(C=C1)Br B115765 [0,1,0,0,0,0|2,0,1]=4 759 B10R1.13 CC(=O)C1=CN=C(C=C1)Cl A151743 [0,1,0,0,0,0|2,0,1]=4 760 B10R1.13 CC(=O)C1=CN=C(C=C1)F F186855 [0,1,0,0,0,0|2,0,1]=4 761 B10R1.13 CC(=O)C1=NC=C(C=C1)Br B182791 [0,1,0,0,0,0|2,0,1]=4 762 B10R1.13 CC(=O)C1=NC=C(C=C1)O H194521 [0,1,0,0,0,0|1,0,1]=3 763 B10R1.13 CC(C)C1=CC=C(C=C1)Br B102079 [0,1,0,0,0,0|1,0,2]=4 764 B10R1.13 CC(C)C1=CC=C(C=C1)I I587659 [0,1,0,0,0,0|1,0,2]=4 765 B10R1.13 CC(C)C1=CC=C(C=C1)N I101369 [0,1,0,0,0,0|1,0,2]=4 766 B10R1.13 CC(C)C1=CC=C(C=C1)N I106863 [0,1,0,0,0,0|1,0,2]=4 767 B10R1.13 CC(C)C1=CC=C(C=C1)O I101756 [0,1,0,0,0,0|0,0,2]=3 768 B10R1.13 CC(C)C1=CC=C(C=C1)S I101777 [0,1,0,0,0,0|0,1,2]=4 769 B10R1.13 CC(C1=CC=C(C=C1)Br)N B113790 [0,1,0,0,0,0|1,0,2]=4 770 B10R1.13 CC(C1=CC=C(C=C1)Br)N B151926 [0,1,0,0,0,0|1,0,2]=4 771 B10R1.13 CC(C1=CC=C(C=C1)Br)N R138868 [0,1,0,0,0,0|1,0,2]=4 772 B10R1.13 CC(C1=CC=C(C=C1)Br)N R409459 [0,1,0,0,0,0|1,0,2]=4 773 B10R1.13 CC(C1=CC=C(C=C1)Br)O B153117 [0,1,0,0,0,0|1,0,2]=4 774 B10R1.13 CC(C1=CC=C(C=C1)Br)O I131837 [0,1,0,0,0,0|1,0,2]=4 775 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C111118 [0,1,0,0,0,0|1,0,2]=4 776 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C171312 [0,1,0,0,0,0|1,0,2]=4 777 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C185668 [0,1,0,0,0,0|1,0,2]=4 778 B10R1.13 CC(C1=CC=C(C=C1)Cl)N R588512 [0,1,0,0,0,0|1,0,2]=4 779 B10R1.13 CC(C1=CC=C(C=C1)Cl)O C153305 [0,1,0,0,0,0|1,0,2]=4 780 B10R1.13 CC(C1=CC=C(C=C1)Cl)O S196166 [0,1,0,0,0,0|1,0,2]=4 781 B10R1.13 CC(C1=CC=C(C=C1)F)N F122770 [0,1,0,0,0,0|1,0,2]=4 782 B10R1.13 CC(C1=CC=C(C=C1)F)N R303591 [0,1,0,0,0,0|1,0,2]=4 783 B10R1.13 CC(C1=CC=C(C=C1)F)O F156599 [0,1,0,0,0,0|1,0,2]=4 784 B10R1.13 CC(C1=CC=C(C=C1)I)N I195715 [0,1,0,0,0,0|1,0,2]=4 785 B10R1.13 CC(C1=CC=C(C=C1)I)N L489513 [0,1,0,0,0,0|1,0,2]=4 786 B10R1.13 CC(C1=CC=C(C=C1)I)N R489522 [0,1,0,0,0,0|1,0,2]=4 787 B10R1.13 CC(C1=CC=C(C=C1)I)N S489515 [0,1,0,0,0,0|1,0,2]=4 788 B10R1.13 CC(C1=CC=C(C=C1)N)O H167342 [0,1,0,0,0,0|1,0,2]=4 789 B10R1.13 CC(C1=CC=C(C=C1)O)O H192225 [0,1,0,0,0,0|0,0,2]=3 790 B10R1.13 CC1=CC=C(C=C1)C(=C)C I157628 [0,1,0,0,0,0|1,0,0]=2 791 B10R1.13 CC1=CC=C(C=C1)C(=N)N M135239 [0,1,0,0,0,0|2,0,0]=3 792 B10R1.13 CC1=CC=C(C=C1)C(=O)C M106726 [0,1,0,0,0,0|1,0,1]=3 793 B10R1.13 CC1=CC=C(C=C1)C(=O)C M140798 [0,1,0,0,0,0|1,0,1]=3 794 B10R1.13 CC1=CC=C(C=C1)C(=O)Cl T106376 [0,1,0,0,0,0|2,0,0]=3 795 B10R1.13 CC1=CC=C(C=C1)C(=O)N P160467 [0,1,0,0,0,0|2,0,0]=3 796 B10R1.13 CC1=CC=C(C=C1)C(=O)O T104320 [0,1,0,0,0,0|2,0,0]=3 797 B10R1.13 CC1=CC=C(C=C1)C(=O)O T119535 [0,1,0,0,0,0|2,0,0]=3 798 B10R1.13 CC1=CC=C(C=C1)C(=O)O T305431 [0,1,0,0,0,0|2,0,0]=3 799 B10R1.13 CC1=CC=C(C=C1)C(=S)N M140148 [0,1,0,0,0,0|2,0,0]=3 800 B10R1.13 CC1=CC=C(C=C1)C(C)C D102667 [0,1,0,0,0,0|1,0,2]=4 801 B10R1.13 CC1=CC=C(C=C1)C(C)C D118512 [0,1,0,0,0,0|1,0,2]=4 802 B10R1.13 CC1=CC=C(C=C1)C(C)C I105448 [0,1,0,0,0,0|1,0,2]=4 803 B10R1.13 CC1=CC=C(C=C1)C(C)C I105449 [0,1,0,0,0,0|1,0,2]=4 804 B10R1.13 CC1=CC=C(C=C1)C(C)C I105451 [0,1,0,0,0,0|1,0,2]=4 805 B10R1.13 CC1=CC=C(C=C1)C(C)N D113666 [0,1,0,0,0,0|1,0,2]=4 806 B10R1.13 CC1=CC=C(C=C1)C(C)N P160184 [0,1,0,0,0,0|1,0,2]=4 807 B10R1.13 CC1=CC=C(C=C1)C(C)N R160847 [0,1,0,0,0,0|1,0,2]=4 808 B10R1.13 CC1=CC=C(C=C1)C(C)O P160711 [0,1,0,0,0,0|1,0,2]=4 809 B10R1.13 CC1=CC=C(C=C1)N(C)C N158974 [0,1,0,0,0,0|2,0,1]=4 810 B10R1.13 CC1=CC=C(C=C1)S(=O)C M304998 [0,1,0,0,0,0|2,0,1]=4 811 B10R1.13 CC1=CC=C(C=C1)S(=O)N I168991 [0,1,0,0,0,0|3,0,0]=4 812 B10R1.13 CC1=CC=C(C=C1)S(=O)N S161364 [0,1,0,0,0,0|3,0,0]=4 813 B10R1.13 CC1=CC=C(C=C1)S(=O)[O-] L348763 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.13 CC1=CC=C(C=C1)S(=O)[O-] S100400 [0,1,0,0,0,0|3,0,0]=4 815 B10R1.13 CC1=CC=C(C=C1)S(=O)[O-] S100401 [0,1,0,0,0,0|3,0,0]=4 816 B10R1.13 CC1=CC=C(C=C1)S(=O)[O-] S161159 [0,1,0,0,0,0|3,0,0]=4 817 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] N104645 [0,1,0,0,0,0|3,0,0]=4 818 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] N104647 [0,1,0,0,0,0|3,0,0]=4 819 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] N118455 [0,1,0,0,0,0|3,0,0]=4 820 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] N119545 [0,1,0,0,0,0|3,0,0]=4 821 B10R1.13 CC1=CN=C(C=C1)C(=O)C A185017 [0,1,0,0,0,0|2,0,1]=4 822 B10R1.13 CC1=CN=C(C=C1)C(=O)O M193433 [0,1,0,0,0,0|3,0,0]=4 823 B10R1.13 CC1=NC=C(C=C1)C(=O)C A123439 [0,1,0,0,0,0|2,0,1]=4 824 B10R1.13 CC1=NC=C(C=C1)C(=O)N M139191 [0,1,0,0,0,0|3,0,0]=4 825 B10R1.13 CC1=NC=C(C=C1)C(=O)O M128104 [0,1,0,0,0,0|3,0,0]=4 826 B10R1.13 CN(C)C1=CC=C(C=C1)Br B120305 [0,1,0,0,0,0|2,0,1]=4 827 B10R1.13 CN(C)C1=CC=C(C=C1)F F156712 [0,1,0,0,0,0|2,0,1]=4 828 B10R1.13 CN(C)C1=CC=C(C=C1)N D100438 [0,1,0,0,0,0|2,0,1]=4 829 B10R1.13 CN(C)C1=CC=C(C=C1)N D105596 [0,1,0,0,0,0|2,0,1]=4 830 B10R1.13 CN(C)C1=CC=C(C=C1)N D106285 [0,1,0,0,0,0|2,0,1]=4 831 B10R1.13 CN(C)C1=CC=C(C=C1)N D110992 [0,1,0,0,0,0|2,0,1]=4 832 B10R1.13 CN(C)C1=CC=C(C=C1)N D110993 [0,1,0,0,0,0|2,0,1]=4 833 B10R1.13 CN(C)C1=CC=C(C=C1)N I168425 [0,1,0,0,0,0|2,0,1]=4 834 B10R1.13 CN(C)C1=CC=C(C=C1)O D194230 [0,1,0,0,0,0|1,0,1]=3 835 B10R1.13 CN(C)C1=CC=C(C=C1)S D155401 [0,1,0,0,0,0|1,1,1]=4 836 B10R1.13 CS(=O)C1=CC=C(C=C1)Br B188392 [0,1,0,0,0,0|2,0,1]=4 837 B10R1.13 C[S+](C)C1=CC=C(C=C1)O H156984 [0,1,0,0,0,0|1,0,1]=3 838 B10R1.25 C#CC1=C(C=C(C=C1)F)F E156343 [0,1,0,0,0,0|1,0,2]=4 839 B10R1.25 C1=C(C(=CN=C1Cl)C=O)Cl D586277 [0,1,0,0,0,0|3,0,0]=4 840 B10R1.25 C1=C(C(=CN=C1Cl)C=O)N A586085 [0,1,0,0,0,0|3,0,0]=4 841 B10R1.25 C1=C(C=NC(=C1N)C=O)Br A173233 [0,1,0,0,0,0|3,0,0]=4 842 B10R1.25 C1=CC(=C(C=C1Br)Br)CO D154156 [0,1,0,0,0,0|2,0,1]=4 843 B10R1.25 C1=CC(=C(C=C1Br)Cl)C#N B133022 [0,1,0,0,0,0|2,0,1]=4 844 B10R1.25 C1=CC(=C(C=C1Br)Cl)C=O B132006 [0,1,0,0,0,0|2,0,0]=3 845 B10R1.25 C1=CC(=C(C=C1Br)Cl)CO B182302 [0,1,0,0,0,0|2,0,1]=4 846 B10R1.25 C1=CC(=C(C=C1Br)F)C#N B113795 [0,1,0,0,0,0|2,0,1]=4 847 B10R1.25 C1=CC(=C(C=C1Br)F)C=O B113798 [0,1,0,0,0,0|2,0,0]=3 848 B10R1.25 C1=CC(=C(C=C1Br)F)CBr B120594 [0,1,0,0,0,0|2,0,1]=4 849 B10R1.25 C1=CC(=C(C=C1Br)F)CCl B152645 [0,1,0,0,0,0|2,0,1]=4 850 B10R1.25 C1=CC(=C(C=C1Br)F)CO B168173 [0,1,0,0,0,0|2,0,1]=4 851 B10R1.25 C1=CC(=C(C=C1Br)F)NN B184807 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.25 C1=CC(=C(C=C1Br)N)C#N A183558 [0,1,0,0,0,0|2,0,1]=4 853 B10R1.25 C1=CC(=C(C=C1Br)N)CO A188537 [0,1,0,0,0,0|2,0,1]=4 854 B10R1.25 C1=CC(=C(C=C1Br)O)C#N B124037 [0,1,0,0,0,0|2,0,1]=4 855 B10R1.25 C1=CC(=C(C=C1Br)O)C=O B124175 [0,1,0,0,0,0|2,0,0]=3 856 B10R1.25 C1=CC(=C(C=C1Cl)Br)C#N B185308 [0,1,0,0,0,0|2,0,1]=4 857 B10R1.25 C1=CC(=C(C=C1Cl)Br)C=O B177580 [0,1,0,0,0,0|2,0,0]=3 858 B10R1.25 C1=CC(=C(C=C1Cl)Cl)C#N D100631 [0,1,0,0,0,0|2,0,1]=4 859 B10R1.25 C1=CC(=C(C=C1Cl)Cl)C=O D100690 [0,1,0,0,0,0|2,0,0]=3 860 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CBr B191953 [0,1,0,0,0,0|2,0,1]=4 861 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CCl D405586 [0,1,0,0,0,0|2,0,1]=4 862 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CN D154480 [0,1,0,0,0,0|2,0,1]=4 863 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CO D154151 [0,1,0,0,0,0|2,0,1]=4 864 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CO D422163 [0,1,0,0,0,0|2,0,1]=4 865 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CS D155416 [0,1,0,0,0,0|2,0,1]=4 866 B10R1.25 C1=CC(=C(C=C1Cl)Cl)NN D113549 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.25 C1=CC(=C(C=C1Cl)F)C#N C120903 [0,1,0,0,0,0|2,0,1]=4 868 B10R1.25 C1=CC(=C(C=C1Cl)F)C=O C120609 [0,1,0,0,0,0|2,0,0]=3 869 B10R1.25 C1=CC(=C(C=C1Cl)F)CBr C153563 [0,1,0,0,0,0|2,0,1]=4 870 B10R1.25 C1=CC(=C(C=C1Cl)F)CO C185242 [0,1,0,0,0,0|2,0,1]=4 871 B10R1.25 C1=CC(=C(C=C1Cl)F)NN C185760 [0,1,0,0,0,0|3,0,0]=4 872 B10R1.25 C1=CC(=C(C=C1Cl)I)C#N C589650 [0,1,0,0,0,0|2,0,1]=4 873 B10R1.25 C1=CC(=C(C=C1Cl)N)C#N A133325 [0,1,0,0,0,0|2,0,1]=4 874 B10R1.25 C1=CC(=C(C=C1Cl)N)CO A169996 [0,1,0,0,0,0|2,0,1]=4 875 B10R1.25 C1=CC(=C(C=C1Cl)O)C#N C183577 [0,1,0,0,0,0|2,0,1]=4 876 B10R1.25 C1=CC(=C(C=C1Cl)O)C=O C140242 [0,1,0,0,0,0|2,0,0]=3 877 B10R1.25 C1=CC(=C(C=C1F)Br)C#N B107979 [0,1,0,0,0,0|2,0,1]=4 878 B10R1.25 C1=CC(=C(C=C1F)Br)C=O B120674 [0,1,0,0,0,0|2,0,0]=3 879 B10R1.25 C1=CC(=C(C=C1F)Br)CO B133187 [0,1,0,0,0,0|2,0,1]=4 880 B10R1.25 C1=CC(=C(C=C1F)Cl)C#N C124502 [0,1,0,0,0,0|2,0,1]=4 881 B10R1.25 C1=CC(=C(C=C1F)Cl)C=O C120604 [0,1,0,0,0,0|2,0,0]=3 882 B10R1.25 C1=CC(=C(C=C1F)Cl)CBr C123478 [0,1,0,0,0,0|2,0,1]=4 883 B10R1.25 C1=CC(=C(C=C1F)Cl)CCl C153561 [0,1,0,0,0,0|2,0,1]=4 884 B10R1.25 C1=CC(=C(C=C1F)Cl)CN C124426 [0,1,0,0,0,0|2,0,1]=4 885 B10R1.25 C1=CC(=C(C=C1F)Cl)CO C133066 [0,1,0,0,0,0|2,0,1]=4 886 B10R1.25 C1=CC(=C(C=C1F)F)C#N D120893 [0,1,0,0,0,0|2,0,1]=4 887 B10R1.25 C1=CC(=C(C=C1F)F)C=O D120656 [0,1,0,0,0,0|2,0,0]=3 888 B10R1.25 C1=CC(=C(C=C1F)F)CBr D120599 [0,1,0,0,0,0|2,0,1]=4 889 B10R1.25 C1=CC(=C(C=C1F)F)CCl D122811 [0,1,0,0,0,0|2,0,1]=4 890 B10R1.25 C1=CC(=C(C=C1F)F)CN D122767 [0,1,0,0,0,0|2,0,1]=4 891 B10R1.25 C1=CC(=C(C=C1F)F)CO D154518 [0,1,0,0,0,0|2,0,1]=4 892 B10R1.25 C1=CC(=C(C=C1F)F)NN D102569 [0,1,0,0,0,0|3,0,0]=4 893 B10R1.25 C1=CC(=C(C=C1F)F)NN D184373 [0,1,0,0,0,0|3,0,0]=4 894 B10R1.25 C1=CC(=C(C=C1F)N)C#N A186701 [0,1,0,0,0,0|2,0,1]=4 895 B10R1.25 C1=CC(=C(C=C1F)O)C#N F587833 [0,1,0,0,0,0|2,0,1]=4 896 B10R1.25 C1=CC(=C(C=C1F)O)C=O F124183 [0,1,0,0,0,0|2,0,0]=3 897 B10R1.25 C1=CC(=C(C=C1N)Br)C#N A133899 [0,1,0,0,0,0|2,0,1]=4 898 B10R1.25 C1=CC(=C(C=C1N)Cl)C#N A122704 [0,1,0,0,0,0|2,0,1]=4 899 B10R1.25 C1=CC(=C(C=C1N)F)C#N A185034 [0,1,0,0,0,0|2,0,1]=4 900 B10R1.25 C1=CC(=C(C=C1O)Br)C=O B588246 [0,1,0,0,0,0|1,0,0]=2 901 B10R1.25 C1=CC(=C(C=C1O)Cl)C#N C123974 [0,1,0,0,0,0|1,0,1]=3 902 B10R1.25 C1=CC(=C(C=C1O)Cl)C=O W134215 [0,1,0,0,0,0|1,0,0]=2 903 B10R1.25 C1=CC(=C(C=C1O)F)C#N F103201 [0,1,0,0,0,0|1,0,1]=3 904 B10R1.25 C1=CC(=C(C=C1O)F)C=O F124151 [0,1,0,0,0,0|1,0,0]=2 905 B10R1.25 C1=CC(=C(C=C1O)O)C=O D106474 [0,1,0,0,0,0|1,0,0]=2 906 B10R1.25 C1=CC(=NC(=C1C=O)Cl)Br B165963 [0,1,0,0,0,0|3,0,0]=4 907 B10R1.25 C1=CC(=NC(=C1C=O)Cl)Cl D154201 [0,1,0,0,0,0|3,0,0]=4 908 B10R1.25 C1=CC(=NC(=C1C=O)F)F D181754 [0,1,0,0,0,0|3,0,0]=4 909 B10R1.25 CC1=C(C=CC(=C1)Br)C#N B120898 [0,1,0,0,0,0|2,0,1]=4 910 B10R1.25 CC1=C(C=CC(=C1)Br)C=O B134372 [0,1,0,0,0,0|2,0,0]=3 911 B10R1.25 CC1=C(C=CC(=C1)Br)CN B193071 [0,1,0,0,0,0|2,0,1]=4 912 B10R1.25 CC1=C(C=CC(=C1)Br)CN M491375 [0,1,0,0,0,0|2,0,1]=4 913 B10R1.25 CC1=C(C=CC(=C1)Br)CO B153118 [0,1,0,0,0,0|2,0,1]=4 914 B10R1.25 CC1=C(C=CC(=C1)Br)OC B122705 [0,1,0,0,0,0|2,0,1]=4 915 B10R1.25 CC1=C(C=CC(=C1)Cl)C#N C120841 [0,1,0,0,0,0|2,0,1]=4 916 B10R1.25 CC1=C(C=CC(=C1)Cl)C=O C193235 [0,1,0,0,0,0|2,0,0]=3 917 B10R1.25 CC1=C(C=CC(=C1)Cl)CO C153314 [0,1,0,0,0,0|2,0,1]=4 918 B10R1.25 CC1=C(C=CC(=C1)Cl)OC C153447 [0,1,0,0,0,0|2,0,1]=4 919 B10R1.25 CC1=C(C=CC(=C1)Cl)[N+]#N F113048 [0,1,0,0,0,0|3,0,0]=4 920 B10R1.25 CC1=C(C=CC(=C1)F)C#N F120487 [0,1,0,0,0,0|2,0,1]=4 921 B10R1.25 CC1=C(C=CC(=C1)F)C=O F120645 [0,1,0,0,0,0|2,0,0]=3 922 B10R1.25 CC1=C(C=CC(=C1)F)CBr F137397 [0,1,0,0,0,0|2,0,1]=4 923 B10R1.25 CC1=C(C=CC(=C1)N)C#N A483334 [0,1,0,0,0,0|2,0,1]=4 924 B10R1.25 CC1=C(C=CC(=C1)N)OC M140237 [0,1,0,0,0,0|2,0,1]=4 925 B10R1.25 CC1=C(C=CC(=C1)O)SC M158095 [0,1,0,0,0,0|1,0,1]=3 926 B10R1.25 CC1=C(C=CC(=N1)Cl)C=O C187655 [0,1,0,0,0,0|3,0,0]=4 927 B10R1.25 CC1=CC(=C(C=C1)C#N)Br W135911 [0,1,0,0,0,0|2,0,1]=4 928 B10R1.25 CC1=CC(=C(C=C1)C#N)C D154445 [0,1,0,0,0,0|2,0,1]=4 929 B10R1.25 CC1=CC(=C(C=C1)C#N)Cl C182776 [0,1,0,0,0,0|2,0,1]=4 930 B10R1.25 CC1=CC(=C(C=C1)C#N)F F120481 [0,1,0,0,0,0|2,0,1]=4 931 B10R1.25 CC1=CC(=C(C=C1)C#N)N A123969 [0,1,0,0,0,0|2,0,1]=4 932 B10R1.25 CC1=CC(=C(C=C1)C#N)O H182292 [0,1,0,0,0,0|2,0,1]=4 933 B10R1.25 CC1=CC(=C(C=C1)C=O)Br B186774 [0,1,0,0,0,0|2,0,0]=3 934 B10R1.25 CC1=CC(=C(C=C1)C=O)C D103125 [0,1,0,0,0,0|2,0,0]=3 935 B10R1.25 CC1=CC(=C(C=C1)C=O)Cl C135937 [0,1,0,0,0,0|2,0,0]=3 936 B10R1.25 CC1=CC(=C(C=C1)C=O)F F120634 [0,1,0,0,0,0|2,0,0]=3 937 B10R1.25 CC1=CC(=C(C=C1)C=O)O H124155 [0,1,0,0,0,0|2,0,0]=3 938 B10R1.25 CC1=CC(=C(C=C1)CCl)C D304725 [0,1,0,0,0,0|2,0,1]=4 939 B10R1.25 CC1=CC(=C(C=C1)CO)C D155716 [0,1,0,0,0,0|2,0,1]=4 940 B10R1.25 CC1=CC(=C(C=C1)CO)Cl C588985 [0,1,0,0,0,0|2,0,1]=4 941 B10R1.25 CC1=CC(=C(C=C1)NN)C D102567 [0,1,0,0,0,0|3,0,0]=4 942 B10R1.25 CC1=CC(=C(C=C1)OC)Br B135797 [0,1,0,0,0,0|2,0,1]=4 943 B10R1.25 CC1=CC(=C(C=C1)OC)N M114090 [0,1,0,0,0,0|2,0,1]=4 944 B10R1.25 CC1=CC(=C(C=C1)OC)N M131613 [0,1,0,0,0,0|2,0,1]=4 945 B10R1.25 CC1=CC(=C(C=C1)OC)O M124273 [0,1,0,0,0,0|2,0,1]=4 946 B10R1.25 CC1=CC(=CN=C1C=O)Br B355007 [0,1,0,0,0,0|3,0,0]=4 947 B10R1.25 CC1=CC(=NC=C1C=O)Cl C187656 [0,1,0,0,0,0|3,0,0]=4 948 B10R1.25 CCC1=C(C=C(C=C1)C)C E156304 [0,1,0,0,0,0|1,0,2]=4 949 B10R1.25 CCC1=C(C=C(C=C1)O)O E100551 [0,1,0,0,0,0|0,0,2]=3 950 B10R1.25 CNC1=C(C=C(C=C1)Br)Br D469616 [0,1,0,0,0,0|2,0,1]=4 951 B10R1.25 CNC1=C(C=C(C=C1)Cl)Cl D169801 [0,1,0,0,0,0|2,0,1]=4 952 B10R1.25 CNC1=C(C=C(C=C1)Cl)N C194119 [0,1,0,0,0,0|2,0,1]=4 953 B10R1.25 COC1=C(C=C(C=C1)Br)Br D132966 [0,1,0,0,0,0|2,0,1]=4 954 B10R1.25 COC1=C(C=C(C=C1)Br)Cl B357163 [0,1,0,0,0,0|2,0,1]=4 955 B10R1.25 COC1=C(C=C(C=C1)Br)F B101646 [0,1,0,0,0,0|2,0,1]=4 956 B10R1.25 COC1=C(C=C(C=C1)Br)N B134097 [0,1,0,0,0,0|2,0,1]=4 957 B10R1.25 COC1=C(C=C(C=C1)Br)O B137212 [0,1,0,0,0,0|2,0,1]=4 958 B10R1.25 COC1=C(C=C(C=C1)Cl)Br B101886 [0,1,0,0,0,0|2,0,1]=4 959 B10R1.25 COC1=C(C=C(C=C1)Cl)Cl D155538 [0,1,0,0,0,0|2,0,1]=4 960 B10R1.25 COC1=C(C=C(C=C1)Cl)F C332053 [0,1,0,0,0,0|2,0,1]=4 961 B10R1.25 COC1=C(C=C(C=C1)Cl)I C189153 [0,1,0,0,0,0|2,0,1]=4 962 B10R1.25 COC1=C(C=C(C=C1)Cl)N C153904 [0,1,0,0,0,0|2,0,1]=4 963 B10R1.25 COC1=C(C=C(C=C1)Cl)O C193052 [0,1,0,0,0,0|2,0,1]=4 964 B10R1.25 COC1=C(C=C(C=C1)F)Br B120999 [0,1,0,0,0,0|2,0,1]=4 965 B10R1.25 COC1=C(C=C(C=C1)F)Cl C122583 [0,1,0,0,0,0|2,0,1]=4 966 B10R1.25 COC1=C(C=C(C=C1)F)F D122592 [0,1,0,0,0,0|2,0,1]=4 967 B10R1.25 COC1=C(C=C(C=C1)F)N F122496 [0,1,0,0,0,0|2,0,1]=4 968 B10R1.25 COC1=C(C=C(C=C1)F)N F598725 [0,1,0,0,0,0|2,0,1]=4 969 B10R1.25 COC1=C(C=C(C=C1)F)O F186288 [0,1,0,0,0,0|2,0,1]=4 970 B10R1.25 COC1=C(C=C(C=C1)I)F F193110 [0,1,0,0,0,0|2,0,1]=4 971 B10R1.25 COC1=C(C=C(C=C1)I)N I136035 [0,1,0,0,0,0|2,0,1]=4 972 B10R1.25 COC1=C(C=C(C=C1)N)Br B135326 [0,1,0,0,0,0|2,0,1]=4 973 B10R1.25 COC1=C(C=C(C=C1)N)Cl C124254 [0,1,0,0,0,0|2,0,1]=4 974 B10R1.25 COC1=C(C=C(C=C1)N)F F120575 [0,1,0,0,0,0|2,0,1]=4 975 B10R1.25 COC1=C(C=C(C=C1)N)I I139236 [0,1,0,0,0,0|2,0,1]=4 976 B10R1.25 COC1=C(C=C(C=C1)N)N D154686 [0,1,0,0,0,0|2,0,1]=4 977 B10R1.25 COC1=C(C=C(C=C1)N)N D573312 [0,1,0,0,0,0|2,0,1]=4 978 B10R1.25 COC1=C(C=C(C=C1)N)N M114086 [0,1,0,0,0,0|2,0,1]=4 979 B10R1.25 COC1=C(C=C(C=C1)N)O H157240 [0,1,0,0,0,0|2,0,1]=4 980 B10R1.25 COC1=C(C=C(C=C1)O)Br B182087 [0,1,0,0,0,0|1,0,1]=3 981 B10R1.25 COC1=C(C=C(C=C1)O)F F193465 [0,1,0,0,0,0|1,0,1]=3 982 B10R1.25 COC1=C(C=C(C=C1)O)O M304130 [0,1,0,0,0,0|1,0,1]=3 983 B10R1.176 C#CC1=CC(=C(C=C1)Cl)Cl D469350 [0,1,0,0,0,0|1,0,2]=4 984 B10R1.176 C#CC1=CC(=C(C=C1)F)F D167294 [0,1,0,0,0,0|1,0,2]=4 985 B10R1.176 C1=C(C=NC(=C1F)Br)C=O B586695 [0,1,0,0,0,0|3,0,0]=4 986 B10R1.176 C1=C(OC=C(C1=O)O)CO K105452 [0,1,0,0,0,0|2,0,1]=4 987 B10R1.176 C1=C(OC=C(C1=O)O)CO K140848 [0,1,0,0,0,0|2,0,1]=4 988 B10R1.176 C1=C(OC=C(C1=O)O)CO K424322 [0,1,0,0,0,0|2,0,1]=4 989 B10R1.176 C1=CC(=C(C=C1C#N)Br)F B120882 [0,1,0,0,0,0|2,0,1]=4 990 B10R1.176 C1=CC(=C(C=C1C#N)Br)I B178664 [0,1,0,0,0,0|2,0,1]=4 991 B10R1.176 C1=CC(=C(C=C1C#N)Br)N A151560 [0,1,0,0,0,0|2,0,1]=4 992 B10R1.176 C1=CC(=C(C=C1C#N)Br)O B120887 [0,1,0,0,0,0|1,0,1]=3 993 B10R1.176 C1=CC(=C(C=C1C#N)Cl)Br B185310 [0,1,0,0,0,0|2,0,1]=4 994 B10R1.176 C1=CC(=C(C=C1C#N)Cl)Cl D117875 [0,1,0,0,0,0|2,0,1]=4 995 B10R1.176 C1=CC(=C(C=C1C#N)Cl)F C120881 [0,1,0,0,0,0|2,0,1]=4 996 B10R1.176 C1=CC(=C(C=C1C#N)Cl)I C573542 [0,1,0,0,0,0|2,0,1]=4 997 B10R1.176 C1=CC(=C(C=C1C#N)Cl)N A122706 [0,1,0,0,0,0|2,0,1]=4 998 B10R1.176 C1=CC(=C(C=C1C#N)Cl)O C135594 [0,1,0,0,0,0|1,0,1]=3 999 B10R1.176 C1=CC(=C(C=C1C#N)F)Br B123532 [0,1,0,0,0,0|2,0,1]=4 1000 B10R1.176 C1=CC(=C(C=C1C#N)F)Cl C120839 [0,1,0,0,0,0|2,0,1]=4 1001 B10R1.176 C1=CC(=C(C=C1C#N)F)F D122740 [0,1,0,0,0,0|2,0,1]=4 1002 B10R1.176 C1=CC(=C(C=C1C#N)F)I F122745 [0,1,0,0,0,0|2,0,1]=4 1003 B10R1.176 C1=CC(=C(C=C1C#N)F)N A122718 [0,1,0,0,0,0|2,0,1]=4 1004 B10R1.176 C1=CC(=C(C=C1C#N)F)O F122744 [0,1,0,0,0,0|1,0,1]=3 1005 B10R1.176 C1=CC(=C(C=C1C#N)I)Br B178712 [0,1,0,0,0,0|2,0,1]=4 1006 B10R1.176 C1=CC(=C(C=C1C#N)I)N A120891 [0,1,0,0,0,0|2,0,1]=4 1007 B10R1.176 C1=CC(=C(C=C1C#N)N)Cl A133477 [0,1,0,0,0,0|2,0,1]=4 1008 B10R1.176 C1=CC(=C(C=C1C#N)N)F A124017 [0,1,0,0,0,0|2,0,1]=4 1009 B10R1.176 C1=CC(=C(C=C1C#N)N)I A589829 [0,1,0,0,0,0|2,0,1]=4 1010 B10R1.176 C1=CC(=C(C=C1C#N)N)N D124014 [0,1,0,0,0,0|2,0,1]=4 1011 B10R1.176 C1=CC(=C(C=C1C#N)N)O A181547 [0,1,0,0,0,0|1,0,1]=3 1012 B10R1.176 C1=CC(=C(C=C1C#N)O)Cl C589331 [0,1,0,0,0,0|2,0,1]=4 1013 B10R1.176 C1=CC(=C(C=C1C#N)O)F F182327 [0,1,0,0,0,0|2,0,1]=4 1014 B10R1.176 C1=CC(=C(C=C1C#N)O)I H588102 [0,1,0,0,0,0|2,0,1]=4 1015 B10R1.176 C1=CC(=C(C=C1C#N)O)O D154618 [0,1,0,0,0,0|1,0,1]=3 1016 B10R1.176 C1=CC(=C(C=C1C=O)Br)Br D133582 [0,1,0,0,0,0|2,0,0]=3 1017 B10R1.176 C1=CC(=C(C=C1C=O)Br)Cl B590391 [0,1,0,0,0,0|2,0,0]=3 1018 B10R1.176 C1=CC(=C(C=C1C=O)Br)F B120677 [0,1,0,0,0,0|2,0,0]=3 1019 B10R1.176 C1=CC(=C(C=C1C=O)Br)O B102178 [0,1,0,0,0,0|1,0,0]=2 1020 B10R1.176 C1=CC(=C(C=C1C=O)Cl)Br B190026 [0,1,0,0,0,0|2,0,0]=3 1021 B10R1.176 C1=CC(=C(C=C1C=O)Cl)Cl D100689 [0,1,0,0,0,0|2,0,0]=3 1022 B10R1.176 C1=CC(=C(C=C1C=O)Cl)F C120608 [0,1,0,0,0,0|2,0,0]=3 1023 B10R1.176 C1=CC(=C(C=C1C=O)Cl)O C133077 [0,1,0,0,0,0|1,0,0]=2 1024 B10R1.176 C1=CC(=C(C=C1C=O)F)Br B120678 [0,1,0,0,0,0|2,0,0]=3 1025 B10R1.176 C1=CC(=C(C=C1C=O)F)Cl C120611 [0,1,0,0,0,0|2,0,0]=3 1026 B10R1.176 C1=CC(=C(C=C1C=O)F)F D120660 [0,1,0,0,0,0|2,0,0]=3 1027 B10R1.176 C1=CC(=C(C=C1C=O)F)O F124318 [0,1,0,0,0,0|1,0,0]=2 1028 B10R1.176 C1=CC(=C(C=C1C=O)I)O H194131 [0,1,0,0,0,0|1,0,0]=2 1029 B10R1.176 C1=CC(=C(C=C1C=O)O)O D108634 [0,1,0,0,0,0|1,0,0]=2 1030 B10R1.176 C1=CC(=C(C=C1C=O)O)O D108636 [0,1,0,0,0,0|1,0,0]=2 1031 B10R1.176 C1=CC(=C(C=C1C=O)O)O D130075 [0,1,0,0,0,0|1,0,0]=2 1032 B10R1.176 C1=CC(=C(C=C1CBr)Br)F B134543 [0,1,0,0,0,0|2,0,1]=4 1033 B10R1.176 C1=CC(=C(C=C1CBr)Cl)Cl D182371 [0,1,0,0,0,0|2,0,1]=4 1034 B10R1.176 C1=CC(=C(C=C1CBr)Cl)F C122802 [0,1,0,0,0,0|2,0,1]=4 1035 B10R1.176 C1=CC(=C(C=C1CBr)F)Br B132624 [0,1,0,0,0,0|2,0,1]=4 1036 B10R1.176 C1=CC(=C(C=C1CBr)F)Cl C122818 [0,1,0,0,0,0|2,0,1]=4 1037 B10R1.176 C1=CC(=C(C=C1CBr)F)F D120602 [0,1,0,0,0,0|2,0,1]=4 1038 B10R1.176 C1=CC(=C(C=C1CCl)Cl)Cl D165515 [0,1,0,0,0,0|2,0,1]=4 1039 B10R1.176 C1=CC(=C(C=C1CCl)F)F D120478 [0,1,0,0,0,0|2,0,1]=4 1040 B10R1.176 C1=CC(=C(C=C1CN)Cl)Cl D122964 [0,1,0,0,0,0|2,0,1]=4 1041 B10R1.176 C1=CC(=C(C=C1CN)Cl)F C113579 [0,1,0,0,0,0|2,0,1]=4 1042 B10R1.176 C1=CC(=C(C=C1CN)F)Br B589556 [0,1,0,0,0,0|2,0,1]=4 1043 B10R1.176 C1=CC(=C(C=C1CN)F)Cl C194761 [0,1,0,0,0,0|2,0,1]=4 1044 B10R1.176 C1=CC(=C(C=C1CN)F)F D155250 [0,1,0,0,0,0|2,0,1]=4 1045 B10R1.176 C1=CC(=C(C=C1CN)O)O D167718 [0,1,0,0,0,0|1,0,1]=3 1046 B10R1.176 C1=CC(=C(C=C1CO)Br)Cl B183729 [0,1,0,0,0,0|2,0,1]=4 1047 B10R1.176 C1=CC(=C(C=C1CO)Br)F B122794 [0,1,0,0,0,0|2,0,1]=4 1048 B10R1.176 C1=CC(=C(C=C1CO)Br)O B133783 [0,1,0,0,0,0|1,0,1]=3 1049 B10R1.176 C1=CC(=C(C=C1CO)Cl)Cl D154150 [0,1,0,0,0,0|2,0,1]=4 1050 B10R1.176 C1=CC(=C(C=C1CO)Cl)F C137482 [0,1,0,0,0,0|2,0,1]=4 1051 B10R1.176 C1=CC(=C(C=C1CO)F)Br B135371 [0,1,0,0,0,0|2,0,1]=4 1052 B10R1.176 C1=CC(=C(C=C1CO)F)Cl C182593 [0,1,0,0,0,0|2,0,1]=4 1053 B10R1.176 C1=CC(=C(C=C1CO)F)F D122815 [0,1,0,0,0,0|2,0,1]=4 1054 B10R1.176 C1=CC(=C(C=C1CO)O)O D155345 [0,1,0,0,0,0|1,0,1]=3 1055 B10R1.176 C1=CC(=C(C=C1NN)Cl)Cl D113550 [0,1,0,0,0,0|3,0,0]=4 1056 B10R1.176 C1=CC(=C(C=C1NN)Cl)F C182121 [0,1,0,0,0,0|3,0,0]=4 1057 B10R1.176 C1=CC(=C(C=C1NN)F)F D187522 [0,1,0,0,0,0|3,0,0]=4 1058 B10R1.176 CC1=C(C=C(C=C1)C#N)Br B120889 [0,1,0,0,0,0|2,0,1]=4 1059 B10R1.176 CC1=C(C=C(C=C1)C#N)C D168795 [0,1,0,0,0,0|2,0,1]=4 1060 B10R1.176 CC1=C(C=C(C=C1)C#N)Cl W136125 [0,1,0,0,0,0|2,0,1]=4 1061 B10R1.176 CC1=C(C=C(C=C1)C#N)F F120484 [0,1,0,0,0,0|2,0,1]=4 1062 B10R1.176 CC1=C(C=C(C=C1)C#N)I I170326 [0,1,0,0,0,0|2,0,1]=4 1063 B10R1.176 CC1=C(C=C(C=C1)C#N)N A185526 [0,1,0,0,0,0|2,0,1]=4 1064 B10R1.176 CC1=C(C=C(C=C1)C#N)O H184166 [0,1,0,0,0,0|2,0,1]=4 1065 B10R1.176 CC1=C(C=C(C=C1)C=O)Br B153186 [0,1,0,0,0,0|2,0,0]=3 1066 B10R1.176 CC1=C(C=C(C=C1)C=O)C D123177 [0,1,0,0,0,0|2,0,0]=3 1067 B10R1.176 CC1=C(C=C(C=C1)C=O)Cl C124170 [0,1,0,0,0,0|2,0,0]=3 1068 B10R1.176 CC1=C(C=C(C=C1)C=O)F F124173 [0,1,0,0,0,0|2,0,0]=3 1069 B10R1.176 CC1=C(C=C(C=C1)CCl)C C189378 [0,1,0,0,0,0|2,0,1]=4 1070 B10R1.176 CC1=C(C=C(C=C1)CN)C D132092 [0,1,0,0,0,0|2,0,1]=4 1071 B10R1.176 CC1=C(C=C(C=C1)CO)C D331591 [0,1,0,0,0,0|2,0,1]=4 1072 B10R1.176 CC1=C(C=C(C=C1)CO)N A151061 [0,1,0,0,0,0|2,0,1]=4 1073 B10R1.176 CC1=C(C=C(C=C1)NN)C D101717 [0,1,0,0,0,0|3,0,0]=4 1074 B10R1.176 CC1=C(C=C(C=C1)NN)Cl C134208 [0,1,0,0,0,0|3,0,0]=4 1075 B10R1.176 CC1=C(C=C(C=C1)OC)Br B193028 [0,1,0,0,0,0|2,0,1]=4 1076 B10R1.176 CC1=C(C=C(C=C1)OC)C D170479 [0,1,0,0,0,0|2,0,1]=4 1077 B10R1.176 CC1=C(C=C(C=C1)OC)Cl C405497 [0,1,0,0,0,0|2,0,1]=4 1078 B10R1.176 CC1=C(C=C(C=C1)OC)F F193262 [0,1,0,0,0,0|2,0,1]=4 1079 B10R1.176 CC1=C(C=C(C=C1)OC)N W134180 [0,1,0,0,0,0|2,0,1]=4 1080 B10R1.176 CC1=C(C=CC(=C1)C#C)F E331048 [0,1,0,0,0,0|1,0,2]=4 1081 B10R1.176 CC1=C(C=CC(=C1)C#N)Br B122726 [0,1,0,0,0,0|2,0,1]=4 1082 B10R1.176 CC1=C(C=CC(=C1)C#N)Cl C193416 [0,1,0,0,0,0|2,0,1]=4 1083 B10R1.176 CC1=C(C=CC(=C1)C#N)F F120489 [0,1,0,0,0,0|2,0,1]=4 1084 B10R1.176 CC1=C(C=CC(=C1)C#N)N A121619 [0,1,0,0,0,0|2,0,1]=4 1085 B10R1.176 CC1=C(C=CC(=C1)C#N)N A298928 [0,1,0,0,0,0|2,0,1]=4 1086 B10R1.176 CC1=C(C=CC(=C1)C=O)Br B186637 [0,1,0,0,0,0|2,0,0]=3 1087 B10R1.176 CC1=C(C=CC(=C1)C=O)Cl C353131 [0,1,0,0,0,0|2,0,0]=3 1088 B10R1.176 CC1=C(C=CC(=C1)C=O)F F120646 [0,1,0,0,0,0|2,0,0]=3 1089 B10R1.176 CC1=C(C=CC(=C1)C=O)O H124186 [0,1,0,0,0,0|1,0,0]=2 1090 B10R1.176 CC1=C(C=CC(=C1)CBr)F F129140 [0,1,0,0,0,0|2,0,1]=4 1091 B10R1.176 CC1=C(C=CC(=C1)CN)F F122788 [0,1,0,0,0,0|2,0,1]=4 1092 B10R1.176 CC1=C(C=CC(=C1)CO)Br B181609 [0,1,0,0,0,0|2,0,1]=4 1093 B10R1.176 CC1=C(C=CC(=C1)CO)F F183255 [0,1,0,0,0,0|2,0,1]=4 1094 B10R1.176 CC1=C(C=CC(=C1)NN)Cl C168713 [0,1,0,0,0,0|3,0,0]=4 1095 B10R1.176 CC1=C(C=CC(=C1)OC)Br B115843 [0,1,0,0,0,0|2,0,1]=4 1096 B10R1.176 CC1=C(C=CC(=C1)OC)F W137121 [0,1,0,0,0,0|2,0,1]=4 1097 B10R1.176 CC1=C(C=CC(=C1)OC)N M124249 [0,1,0,0,0,0|2,0,1]=4 1098 B10R1.176 CC1=C(C=CC(=C1)OC)O H193776 [0,1,0,0,0,0|1,0,1]=3 1099 B10R1.176 CCC1=CC(=C(C=C1)O)Br B589769 [0,1,0,0,0,0|0,0,2]=3 1100 B10R1.176 CCC1=CC(=C(C=C1)O)O E165960 [0,1,0,0,0,0|0,0,2]=3 1101 B10R1.176 CNC1=CC(=C(C=C1)Cl)Cl D589045 [0,1,0,0,0,0|2,0,1]=4 1102 B10R1.176 COC1=CC(=C(C=C1)Br)Cl B184846 [0,1,0,0,0,0|2,0,1]=4 1103 B10R1.176 COC1=CC(=C(C=C1)Br)F B115514 [0,1,0,0,0,0|2,0,1]=4 1104 B10R1.176 COC1=CC(=C(C=C1)Br)I B589246 [0,1,0,0,0,0|2,0,1]=4 1105 B10R1.176 COC1=CC(=C(C=C1)Br)N B185457 [0,1,0,0,0,0|2,0,1]=4 1106 B10R1.176 COC1=CC(=C(C=C1)Br)O B185723 [0,1,0,0,0,0|2,0,1]=4 1107 B10R1.176 COC1=CC(=C(C=C1)Cl)Br B120329 [0,1,0,0,0,0|2,0,1]=4 1108 B10R1.176 COC1=CC(=C(C=C1)Cl)F C133728 [0,1,0,0,0,0|2,0,1]=4 1109 B10R1.176 COC1=CC(=C(C=C1)Cl)N C122489 [0,1,0,0,0,0|2,0,1]=4 1110 B10R1.176 COC1=CC(=C(C=C1)Cl)N C134554 [0,1,0,0,0,0|2,0,1]=4 1111 B10R1.176 COC1=CC(=C(C=C1)F)Br B576831 [0,1,0,0,0,0|2,0,1]=4 1112 B10R1.176 COC1=CC(=C(C=C1)F)Cl C132066 [0,1,0,0,0,0|2,0,1]=4 1113 B10R1.176 COC1=CC(=C(C=C1)F)F D155764 [0,1,0,0,0,0|2,0,1]=4 1114 B10R1.176 COC1=CC(=C(C=C1)I)Br B184649 [0,1,0,0,0,0|2,0,1]=4 1115 B10R1.176 COC1=CC(=C(C=C1)I)O I170223 [0,1,0,0,0,0|2,0,1]=4 1116 B10R1.176 COC1=CC(=C(C=C1)N)Cl C192569 [0,1,0,0,0,0|2,0,1]=4 1117 B10R1.176 COC1=CC(=C(C=C1)N)F F124247 [0,1,0,0,0,0|2,0,1]=4 1118 B10R1.176 COC1=CC(=C(C=C1)N)I I175362 [0,1,0,0,0,0|2,0,1]=4 1119 B10R1.176 COC1=CC(=C(C=C1)N)N D178847 [0,1,0,0,0,0|2,0,1]=4 1120 B10R1.176 COC1=CC(=C(C=C1)N)N M299127 [0,1,0,0,0,0|2,0,1]=4 1121 B10R1.176 COC1=CC(=C(C=C1)N)O H157084 [0,1,0,0,0,0|2,0,1]=4 1122 B10R1.176 COC1=CC(=C(C=C1)O)Br B122555 [0,1,0,0,0,0|1,0,1]=3 1123 B10R1.176 COC1=CC(=C(C=C1)O)Br B152684 [0,1,0,0,0,0|1,0,1]=3 1124 B10R1.176 COC1=CC(=C(C=C1)O)Cl C124268 [0,1,0,0,0,0|1,0,1]=3 1125 B10R1.176 COC1=CC(=C(C=C1)O)F F156740 [0,1,0,0,0,0|1,0,1]=3 1126 B10R1.176 COC1=CC(=C(C=C1)O)N A299108 [0,1,0,0,0,0|1,0,1]=3 1127 B10R2.31 C1CC2=C1C=CC(=C2)Br B132442 [0,0,0,1,0,0|1,0,2]=4 1128 B8R1.1 C1=C(NC=C1Br)C=O B590754 [0,0,0,0,1,0|3,0,0]=4 1129 B8R1.1 C1=C(OC(=C1)Br)C=O B111879 [0,0,0,0,1,0|3,0,0]=4 1130 B8R1.1 C1=C(OC(=C1)Cl)C=O D303050 [0,0,0,0,1,0|3,0,0]=4 1131 B8R1.1 C1=C(OC=C1Br)C=O B151893 [0,0,0,0,1,0|3,0,0]=4 1132 B8R1.1 C1=C(SC(=C1)Br)C=O B101864 [0,0,0,0,1,0|3,0,0]=4 1133 B8R1.1 C1=C(SC(=C1)Cl)C=O C123084 [0,0,0,0,1,0|3,0,0]=4 1134 B8R1.1 C1=C(SC=C1Br)C=O B153194 [0,0,0,0,1,0|3,0,0]=4 1135 B8R1.1 CC1=CC=C(N1)C=O M586541 [0,0,0,0,1,0|3,0,0]=4 1136 B8R1.1 CC1=CC=C(O1)C=O M102952 [0,0,0,0,1,0|3,0,0]=4 1137 B8R1.1 CC1=CC=C(O1)C=O M425132 [0,0,0,0,1,0|3,0,0]=4 1138 B8R1.1 CC1=CC=C(S1)C=O M157937 [0,0,0,0,1,0|3,0,0]=4 1139 B8R1.1 CC1=CSC(=C1)C=O M171140 [0,0,0,0,1,0|3,0,0]=4 1140 B7R0.4 CC=CC=CC(=O)O H431430 [1,0,1,0,0,0|1,0,1]=4 1141 B7R0.4 CC=CC=CC(=O)O S101106 [1,0,1,0,0,0|1,0,1]=4 1142 B7R0.4 CC=CC=CC(=O)O S101108 [1,0,1,0,0,0|1,0,1]=4 1143 B7R0.4 CC=CC=CC(=O)O S101109 [1,0,1,0,0,0|1,0,1]=4 1144 B7R0.4 CC=CC=CC(=O)O S101111 [1,0,1,0,0,0|1,0,1]=4 1145 B7R0.4 CC=CC=CC(=O)O S420601 [1,0,1,0,0,0|1,0,1]=4 1146 B7R1.3 Brc1ccccc1 B128157 [2,0,0,0,0,0|1,0,0]=3 1147 B7R1.3 C1=C(C=NC=N1)O P175938 [2,0,0,0,0,0|2,0,0]=4 1148 B7R1.3 C1=CC(=CN=C1)Br B106977 [2,0,0,0,0,0|2,0,0]=4 1149 B7R1.3 C1=CC(=CN=C1)Cl C106490 [2,0,0,0,0,0|2,0,0]=4 1150 B7R1.3 C1=CC(=CN=C1)F F119663 [2,0,0,0,0,0|2,0,0]=4 1151 B7R1.3 C1=CC(=CN=C1)I I101566 [2,0,0,0,0,0|2,0,0]=4 1152 B7R1.3 C1=CC(=CN=C1)N A107134 [2,0,0,0,0,0|2,0,0]=4 1153 B7R1.3 C1=CC(=CN=C1)N A107135 [2,0,0,0,0,0|2,0,0]=4 1154 B7R1.3 C1=CC(=CN=C1)O H106342 [2,0,0,0,0,0|1,0,0]=3 1155 B7R1.3 C1=CC(=CN=C1)O H434905 [2,0,0,0,0,0|1,0,0]=3 1156 B7R1.3 C1=CC(=O)NC=C1 H108693 [2,0,0,0,0,0|1,0,1]=4 1157 B7R1.3 C1=CC(=O)NC=C1 H421556 [2,0,0,0,0,0|1,0,1]=4 1158 B7R1.3 C1=CC(=O)OC=C1 A136345 [2,0,0,0,0,0|1,0,1]=4 1159 B7R1.3 C1=CC(=S)NC=C1 M101871 [2,0,0,0,0,0|1,1,0]=4 1160 B7R1.3 C1=CC=C(C=C1)Br B103388 [2,0,0,0,0,0|1,0,0]=3 1161 B7R1.3 C1=CC=C(C=C1)Br B103389 [2,0,0,0,0,0|1,0,0]=3 1162 B7R1.3 C1=CC=C(C=C1)Br B103390 [2,0,0,0,0,0|1,0,0]=3 1163 B7R1.3 C1=CC=C(C=C1)Br B121294 [2,0,0,0,0,0|1,0,0]=3 1164 B7R1.3 C1=CC=C(C=C1)Br B473807 [2,0,0,0,0,0|1,0,0]=3 1165 B7R1.3 C1=CC=C(C=C1)Cl C105081 [2,0,0,0,0,0|1,0,0]=3 1166 B7R1.3 C1=CC=C(C=C1)Cl C105082 [2,0,0,0,0,0|1,0,0]=3 1167 B7R1.3 C1=CC=C(C=C1)Cl C105083 [2,0,0,0,0,0|1,0,0]=3 1168 B7R1.3 C1=CC=C(C=C1)Cl C105084 [2,0,0,0,0,0|1,0,0]=3 1169 B7R1.3 C1=CC=C(C=C1)Cl C119461 [2,0,0,0,0,0|1,0,0]=3 1170 B7R1.3 C1=CC=C(C=C1)Cl C342726 [2,0,0,0,0,0|1,0,0]=3 1171 B7R1.3 C1=CC=C(C=C1)Cl C431386 [2,0,0,0,0,0|1,0,0]=3 1172 B7R1.3 C1=CC=C(C=C1)Cl C639739 [2,0,0,0,0,0|1,0,0]=3 1173 B7R1.3 C1=CC=C(C=C1)F F107096 [2,0,0,0,0,0|1,0,0]=3 1174 B7R1.3 C1=CC=C(C=C1)F F107098 [2,0,0,0,0,0|1,0,0]=3 1175 B7R1.3 C1=CC=C(C=C1)F F107099 [2,0,0,0,0,0|1,0,0]=3 1176 B7R1.3 C1=CC=C(C=C1)F F107100 [2,0,0,0,0,0|1,0,0]=3 1177 B7R1.3 C1=CC=C(C=C1)F F128178 [2,0,0,0,0,0|1,0,0]=3 1178 B7R1.3 C1=CC=C(C=C1)F F128179 [2,0,0,0,0,0|1,0,0]=3 1179 B7R1.3 C1=CC=C(C=C1)I I104581 [2,0,0,0,0,0|1,0,0]=3 1180 B7R1.3 C1=CC=C(C=C1)I I104582 [2,0,0,0,0,0|1,0,0]=3 1181 B7R1.3 C1=CC=C(C=C1)N A108448 [2,0,0,0,0,0|1,0,0]=3 1182 B7R1.3 C1=CC=C(C=C1)N A111640 [2,0,0,0,0,0|1,0,0]=3 1183 B7R1.3 C1=CC=C(C=C1)N A112119 [2,0,0,0,0,0|1,0,0]=3 1184 B7R1.3 C1=CC=C(C=C1)N A112120 [2,0,0,0,0,0|1,0,0]=3 1185 B7R1.3 C1=CC=C(C=C1)N A112122 [2,0,0,0,0,0|1,0,0]=3 1186 B7R1.3 C1=CC=C(C=C1)N A112123 [2,0,0,0,0,0|1,0,0]=3 1187 B7R1.3 C1=CC=C(C=C1)N A112124 [2,0,0,0,0,0|1,0,0]=3 1188 B7R1.3 C1=CC=C(C=C1)N A112125 [2,0,0,0,0,0|1,0,0]=3 1189 B7R1.3 C1=CC=C(C=C1)N A117353 [2,0,0,0,0,0|1,0,0]=3 1190 B7R1.3 C1=CC=C(C=C1)N A117354 [2,0,0,0,0,0|1,0,0]=3 1191 B7R1.3 C1=CC=C(C=C1)N A117355 [2,0,0,0,0,0|1,0,0]=3 1192 B7R1.3 C1=CC=C(C=C1)N A121681 [2,0,0,0,0,0|1,0,0]=3 1193 B7R1.3 C1=CC=C(C=C1)N A133014 [2,0,0,0,0,0|1,0,0]=3 1194 B7R1.3 C1=CC=C(C=C1)N A135834 [2,0,0,0,0,0|1,0,0]=3 1195 B7R1.3 C1=CC=C(C=C1)N A151130 [2,0,0,0,0,0|1,0,0]=3 1196 B7R1.3 C1=CC=C(C=C1)N A151150 [2,0,0,0,0,0|1,0,0]=3 1197 B7R1.3 C1=CC=C(C=C1)N A283803 [2,0,0,0,0,0|1,0,0]=3 1198 B7R1.3 C1=CC=C(C=C1)N A344406 [2,0,0,0,0,0|1,0,0]=3 1199 B7R1.3 C1=CC=C(C=C1)N P492994 [2,0,0,0,0,0|1,0,0]=3 1200 B7R1.3 C1=CC=C(C=C1)N P492999 [2,0,0,0,0,0|1,0,0]=3 1201 B7R1.3 C1=CC=C(C=C1)O P100761 [2,0,0,0,0,0|0,0,0]=2 1202 B7R1.3 C1=CC=C(C=C1)O P100762 [2,0,0,0,0,0|0,0,0]=2 1203 B7R1.3 C1=CC=C(C=C1)O P100765 [2,0,0,0,0,0|0,0,0]=2 1204 B7R1.3 C1=CC=C(C=C1)O P100767 [2,0,0,0,0,0|0,0,0]=2 1205 B7R1.3 C1=CC=C(C=C1)O P100769 [2,0,0,0,0,0|0,0,0]=2 1206 B7R1.3 C1=CC=C(C=C1)O P100770 [2,0,0,0,0,0|0,0,0]=2 1207 B7R1.3 C1=CC=C(C=C1)O P121281 [2,0,0,0,0,0|0,0,0]=2 1208 B7R1.3 C1=CC=C(C=C1)O P128316 [2,0,0,0,0,0|0,0,0]=2 1209 B7R1.3 C1=CC=C(C=C1)O P397150 [2,0,0,0,0,0|0,0,0]=2 1210 B7R1.3 C1=CC=C(C=C1)O P472012 [2,0,0,0,0,0|0,0,0]=2 1211 B7R1.3 C1=CC=C(C=C1)[O-] P171611 [2,0,0,0,0,0|0,0,1]=3 1212 B7R1.3 C1=CC=C(C=C1)[O-] S110499 [2,0,0,0,0,0|0,0,1]=3 1213 B7R1.3 C1=CC=C(C=C1)[O-] S190796 [2,0,0,0,0,0|0,0,1]=3 1214 B7R1.3 C1=CC=C(C=C1)[S-] C355238 [2,0,0,0,0,0|0,1,0]=3 1215 B7R1.3 C1=CC=C(C=C1)[S-] S195897 [2,0,0,0,0,0|0,1,0]=3 1216 B7R1.3 C1=CC=C(C=C1)[Se] B121193 [2,0,0,0,0,0|0,1,0]=3 1217 B7R1.3 C1=CC=C(C=C1)[Si] P160608 [2,0,0,0,0,0|0,1,0]=3 1218 B7R1.3 C1=CC=NC(=C1)Br B109679 [2,0,0,0,0,0|2,0,0]=4 1219 B7R1.3 C1=CC=NC(=C1)Cl C104870 [2,0,0,0,0,0|2,0,0]=4 1220 B7R1.3 C1=CC=NC(=C1)F F120342 [2,0,0,0,0,0|2,0,0]=4 1221 B7R1.3 C1=CC=NC(=C1)I I111393 [2,0,0,0,0,0|2,0,0]=4 1222 B7R1.3 C1=CC=NC(=C1)N A105221 [2,0,0,0,0,0|2,0,0]=4 1223 B7R1.3 C1=CC=NC(=C1)N A105222 [2,0,0,0,0,0|2,0,0]=4 1224 B7R1.3 C1=CC=[N+](C=C1)F F156747 [2,0,0,0,0,0|2,0,0]=4 1225 B7R1.3 C1=CC=[N+](C=C1)N A151659 [2,0,0,0,0,0|2,0,0]=4 1226 B7R1.3 C1=CC=[N+](C=C1)[O-] P119965 [2,0,0,0,0,0|1,0,1]=4 1227 B7R1.3 C1=CC=[N+](C=C1)[O-] P165276 [2,0,0,0,0,0|1,0,1]=4 1228 B7R1.3 C1=CN=CC=C1Br B102732 [2,0,0,0,0,0|2,0,0]=4 1229 B7R1.3 C1=CN=CC=C1Br B152112 [2,0,0,0,0,0|2,0,0]=4 1230 B7R1.3 C1=CN=CC=C1Br B302216 [2,0,0,0,0,0|2,0,0]=4 1231 B7R1.3 C1=CN=CC=C1Cl C118400 [2,0,0,0,0,0|2,0,0]=4 1232 B7R1.3 C1=CN=CC=C1Cl C119940 [2,0,0,0,0,0|2,0,0]=4 1233 B7R1.3 C1=CN=CC=C1I I100877 [2,0,0,0,0,0|2,0,0]=4 1234 B7R1.3 C1=CN=CC=C1N A113920 [2,0,0,0,0,0|2,0,0]=4 1235 B7R1.3 C1=CNC=CC1=O H106341 [2,0,0,0,0,0|1,0,1]=4 1236 B7R1.3 C1=CNC=CC1=S M118290 [2,0,0,0,0,0|1,1,0]=4 1237 B7R1.3 C1=COC=CC1=O H157137 [2,0,0,0,0,0|1,0,1]=4 1238 B7R1.3 CC1=CC=CC=C1 T102274 [2,0,0,0,0,0|0,0,1]=3 1239 B7R1.3 CC1=CC=CC=C1 T102275 [2,0,0,0,0,0|0,0,1]=3 1240 B7R1.3 CC1=CC=CC=C1 T102276 [2,0,0,0,0,0|0,0,1]=3 1241 B7R1.3 CC1=CC=CC=C1 T399619 [2,0,0,0,0,0|0,0,1]=3 1242 B7R1.3 CC1=CC=CC=C1 T399633 [2,0,0,0,0,0|0,0,1]=3 1243 B7R1.3 CC1=CC=CC=C1 T399640 [2,0,0,0,0,0|0,0,1]=3 1244 B7R1.3 CC1=CC=CC=C1 T399643 [2,0,0,0,0,0|0,0,1]=3 1245 B7R1.3 CC1=CC=CC=C1 T399652 [2,0,0,0,0,0|0,0,1]=3 1246 B7R1.3 CC1=CC=CC=C1 T399677 [2,0,0,0,0,0|0,0,1]=3 1247 B7R1.3 CC1=CC=CC=C1 T399681 [2,0,0,0,0,0|0,0,1]=3 1248 B7R1.3 CC1=CC=CC=N1 M108694 [2,0,0,0,0,0|1,0,1]=4 1249 B7R1.3 CC1=CC=CC=N1 M108695 [2,0,0,0,0,0|1,0,1]=4 1250 B7R1.3 CC1=CC=CC=N1 P122349 [2,0,0,0,0,0|1,0,1]=4 1251 B7R1.3 CC1=CC=NC=C1 P105226 [2,0,0,0,0,0|1,0,1]=4 1252 B7R1.3 CC1=CN=CC=C1 P109209 [2,0,0,0,0,0|1,0,1]=4 1253 B7R1.3 CC1=CN=CC=C1 P109210 [2,0,0,0,0,0|1,0,1]=4 1254 B7R1.3 C[N+]1=CC=CC=C1 M302265 [2,0,0,0,0,0|1,0,1]=4 1255 B7R1.3 Cc1ccccn1 M141144 [2,0,0,0,0,0|1,0,1]=4 1256 B7R1.3 Oc1ccccc1 BWY272999 [2,0,0,0,0,0|0,0,0]=2 1257 B7R1.3 Oc1ccccc1 BWY273026 [2,0,0,0,0,0|0,0,0]=2 1258 B7R1.3 Oc1ccccc1 P100768 [2,0,0,0,0,0|0,0,0]=2 1259 B7R1.3 Oc1ccccc1 P117348 [2,0,0,0,0,0|0,0,0]=2 1260 B7R1.3 [CH2-]C1=CC=CC=C1 B465975 [2,0,0,0,0,0|0,0,1]=3 1261 B9R1.2 C#CC1=CC(=CC=C1)Br B304581 [1,1,0,0,0,0|0,0,2]=4 1262 B9R1.2 C#CC1=CC(=CC=C1)Cl C110226 [1,1,0,0,0,0|0,0,2]=4 1263 B9R1.2 C#CC1=CC(=CC=C1)F W137137 [1,1,0,0,0,0|0,0,2]=4 1264 B9R1.2 C#CC1=CC(=CC=C1)N E109740 [1,1,0,0,0,0|0,0,2]=4 1265 B9R1.2 C#CC1=CC(=CC=C1)N E588043 [1,1,0,0,0,0|0,0,2]=4 1266 B9R1.2 C#CC1=CC(=CC=C1)O H113416 [1,1,0,0,0,0|0,0,2]=4 1267 B9R1.2 C1=C(C=NC=C1Br)C=O B111394 [1,1,0,0,0,0|2,0,0]=4 1268 B9R1.2 C1=C(C=NC=C1Cl)C=O C165987 [1,1,0,0,0,0|2,0,0]=4 1269 B9R1.2 C1=C(C=NC=C1F)C=O F176383 [1,1,0,0,0,0|2,0,0]=4 1270 B9R1.2 C1=C(C=NC=C1I)C=O I340108 [1,1,0,0,0,0|2,0,0]=4 1271 B9R1.2 C1=CC(=CC(=C1)Br)C#N B103597 [1,1,0,0,0,0|1,0,1]=4 1272 B9R1.2 C1=CC(=CC(=C1)Br)C=O B108056 [1,1,0,0,0,0|1,0,0]=3 1273 B9R1.2 C1=CC(=CC(=C1)Br)CBr B135903 [1,1,0,0,0,0|1,0,1]=4 1274 B9R1.2 C1=CC(=CC(=C1)Br)CCl B139457 [1,1,0,0,0,0|1,0,1]=4 1275 B9R1.2 C1=CC(=CC(=C1)Br)CN B131936 [1,1,0,0,0,0|1,0,1]=4 1276 B9R1.2 C1=CC(=CC(=C1)Br)CN B136310 [1,1,0,0,0,0|1,0,1]=4 1277 B9R1.2 C1=CC(=CC(=C1)Br)CO B103188 [1,1,0,0,0,0|1,0,1]=4 1278 B9R1.2 C1=CC(=CC(=C1)Br)NN B101715 [1,1,0,0,0,0|2,0,0]=4 1279 B9R1.2 C1=CC(=CC(=C1)Cl)C#N C137691 [1,1,0,0,0,0|1,0,1]=4 1280 B9R1.2 C1=CC(=CC(=C1)Cl)C=O C154036 [1,1,0,0,0,0|1,0,0]=3 1281 B9R1.2 C1=CC(=CC(=C1)Cl)CBr C106489 [1,1,0,0,0,0|1,0,1]=4 1282 B9R1.2 C1=CC(=CC(=C1)Cl)CCl C189170 [1,1,0,0,0,0|1,0,1]=4 1283 B9R1.2 C1=CC(=CC(=C1)Cl)CN C135515 [1,1,0,0,0,0|1,0,1]=4 1284 B9R1.2 C1=CC(=CC(=C1)Cl)CO C106488 [1,1,0,0,0,0|1,0,1]=4 1285 B9R1.2 C1=CC(=CC(=C1)Cl)NN C110270 [1,1,0,0,0,0|2,0,0]=4 1286 B9R1.2 C1=CC(=CC(=C1)F)C#N F120870 [1,1,0,0,0,0|1,0,1]=4 1287 B9R1.2 C1=CC(=CC(=C1)F)C=O F107121 [1,1,0,0,0,0|1,0,0]=3 1288 B9R1.2 C1=CC(=CC(=C1)F)CBr F107112 [1,1,0,0,0,0|1,0,1]=4 1289 B9R1.2 C1=CC(=CC(=C1)F)CCl F123352 [1,1,0,0,0,0|1,0,1]=4 1290 B9R1.2 C1=CC(=CC(=C1)F)CN F107964 [1,1,0,0,0,0|1,0,1]=4 1291 B9R1.2 C1=CC(=CC(=C1)F)CO F156601 [1,1,0,0,0,0|1,0,1]=4 1292 B9R1.2 C1=CC(=CC(=C1)F)NN F102558 [1,1,0,0,0,0|2,0,0]=4 1293 B9R1.2 C1=CC(=CC(=C1)I)C#N I103577 [1,1,0,0,0,0|1,0,1]=4 1294 B9R1.2 C1=CC(=CC(=C1)I)C=O I135884 [1,1,0,0,0,0|1,0,0]=3 1295 B9R1.2 C1=CC(=CC(=C1)I)CBr I133459 [1,1,0,0,0,0|1,0,1]=4 1296 B9R1.2 C1=CC(=CC(=C1)I)CN I113819 [1,1,0,0,0,0|1,0,1]=4 1297 B9R1.2 C1=CC(=CC(=C1)I)CN I468184 [1,1,0,0,0,0|1,0,1]=4 1298 B9R1.2 C1=CC(=CC(=C1)I)CO I157442 [1,1,0,0,0,0|1,0,1]=4 1299 B9R1.2 C1=CC(=CC(=C1)N)C#N A107198 [1,1,0,0,0,0|1,0,1]=4 1300 B9R1.2 C1=CC(=CC(=C1)N)CN A151635 [1,1,0,0,0,0|1,0,1]=4 1301 B9R1.2 C1=CC(=CC(=C1)N)CO A151125 [1,1,0,0,0,0|1,0,1]=4 1302 B9R1.2 C1=CC(=CC(=C1)O)C#N C139371 [1,1,0,0,0,0|1,0,1]=4 1303 B9R1.2 C1=CC(=CC(=C1)O)C=O H104163 [1,1,0,0,0,0|1,0,0]=3 1304 B9R1.2 C1=CC(=CC(=C1)O)CN H407384 [1,1,0,0,0,0|1,0,1]=4 1305 B9R1.2 C1=CC(=CC(=C1)O)CO H137304 [1,1,0,0,0,0|1,0,1]=4 1306 B9R1.2 C1=CC(=CC(=C1)O)CO H501150 [1,1,0,0,0,0|1,0,1]=4 1307 B9R1.2 C1=CC(=NC(=C1)Br)C=O B115762 [1,1,0,0,0,0|2,0,0]=4 1308 B9R1.2 C1=CC(=NC(=C1)Cl)C=O C154078 [1,1,0,0,0,0|2,0,0]=4 1309 B9R1.2 C1=CC(=NC(=C1)F)C=O F182684 [1,1,0,0,0,0|2,0,0]=4 1310 B9R1.2 C1=CN=C(C=C1C=O)Br B138072 [1,1,0,0,0,0|2,0,0]=4 1311 B9R1.2 C1=CN=C(C=C1C=O)Cl W136070 [1,1,0,0,0,0|2,0,0]=4 1312 B9R1.2 C1=CN=C(C=C1C=O)F F166943 [1,1,0,0,0,0|2,0,0]=4 1313 B9R1.2 C1=CN=C(C=C1Cl)C=O C176987 [1,1,0,0,0,0|2,0,0]=4 1314 B9R1.2 C=CC1=CC(=CC=C1)Br B121722 [1,1,0,0,0,0|0,0,0]=2 1315 B9R1.2 C=CC1=CC(=CC=C1)Cl C121720 [1,1,0,0,0,0|0,0,0]=2 1316 B9R1.2 C=CC1=CC(=CC=C1)Cl C140515 [1,1,0,0,0,0|0,0,0]=2 1317 B9R1.2 C=CC1=CC(=CC=C1)F F121724 [1,1,0,0,0,0|0,0,0]=2 1318 B9R1.2 C=CC1=CC(=CC=C1)N V138287 [1,1,0,0,0,0|0,0,0]=2 1319 B9R1.2 CC1=CC(=CC=C1)C#C E107733 [1,1,0,0,0,0|0,0,2]=4 1320 B9R1.2 CC1=CC(=CC=C1)C#N T100294 [1,1,0,0,0,0|1,0,1]=4 1321 B9R1.2 CC1=CC(=CC=C1)C=C M158347 [1,1,0,0,0,0|0,0,0]=2 1322 B9R1.2 CC1=CC(=CC=C1)C=O M157831 [1,1,0,0,0,0|1,0,0]=3 1323 B9R1.2 CC1=CC(=CC=C1)CBr B405679 [1,1,0,0,0,0|1,0,1]=4 1324 B9R1.2 CC1=CC(=CC=C1)CCl M101677 [1,1,0,0,0,0|1,0,1]=4 1325 B9R1.2 CC1=CC(=CC=C1)CN M158668 [1,1,0,0,0,0|1,0,1]=4 1326 B9R1.2 CC1=CC(=CC=C1)CO M157904 [1,1,0,0,0,0|1,0,1]=4 1327 B9R1.2 CC1=CC(=CC=C1)CS M588442 [1,1,0,0,0,0|1,0,1]=4 1328 B9R1.2 CC1=CC(=CC=C1)NC M107962 [1,1,0,0,0,0|1,0,1]=4 1329 B9R1.2 CC1=CC(=CC=C1)NN T101274 [1,1,0,0,0,0|2,0,0]=4 1330 B9R1.2 CC1=CC(=CC=C1)OC M158111 [1,1,0,0,0,0|1,0,1]=4 1331 B9R1.2 CC1=CC(=CC=C1)SC M351262 [1,1,0,0,0,0|1,0,1]=4 1332 B9R1.2 CC1=CC(=NC=C1)C=O M124675 [1,1,0,0,0,0|2,0,0]=4 1333 B9R1.2 CC1=NC(=CC=C1)C=O M101568 [1,1,0,0,0,0|2,0,0]=4 1334 B9R1.2 CCC1=CC(=CC=C1)Br B101889 [1,1,0,0,0,0|0,0,2]=4 1335 B9R1.2 CCC1=CC(=CC=C1)Cl C589677 [1,1,0,0,0,0|0,0,2]=4 1336 B9R1.2 CCC1=CC(=CC=C1)I E587883 [1,1,0,0,0,0|0,0,2]=4 1337 B9R1.2 CCC1=CC(=CC=C1)N E101873 [1,1,0,0,0,0|0,0,2]=4 1338 B9R1.2 CCC1=CC(=CC=C1)O E156226 [1,1,0,0,0,0|0,0,2]=4 1339 B9R1.2 CCC1=CC=CC(=C1)C E113367 [1,1,0,0,0,0|0,0,2]=4 1340 B9R1.2 CNC1=CC(=CC=C1)Br B194483 [1,1,0,0,0,0|1,0,1]=4 1341 B9R1.2 CNC1=CC(=CC=C1)Cl C153906 [1,1,0,0,0,0|1,0,1]=4 1342 B9R1.2 CNC1=CC(=CC=C1)F F168315 [1,1,0,0,0,0|1,0,1]=4 1343 B9R1.2 CNC1=CC(=CC=C1)O M587311 [1,1,0,0,0,0|1,0,1]=4 1344 B9R1.2 COC1=CC(=CC=C1)Br B100846 [1,1,0,0,0,0|1,0,1]=4 1345 B9R1.2 COC1=CC(=CC=C1)Cl C106486 [1,1,0,0,0,0|1,0,1]=4 1346 B9R1.2 COC1=CC(=CC=C1)F F120587 [1,1,0,0,0,0|1,0,1]=4 1347 B9R1.2 COC1=CC(=CC=C1)I I123674 [1,1,0,0,0,0|1,0,1]=4 1348 B9R1.2 COC1=CC(=CC=C1)S M101779 [1,1,0,0,0,0|1,0,1]=4 1349 B9R1.2 COC1=CC=CC(=C1)N A107482 [1,1,0,0,0,0|1,0,1]=4 1350 B9R1.2 COC1=CC=CC(=C1)O M109432 [1,1,0,0,0,0|1,0,1]=4 1351 B9R1.2 COC1=CC=CC(=C1)[CH2-] M300737 [1,1,0,0,0,0|1,0,1]=4 1352 B9R1.2 CSC1=CC(=CC=C1)Br B101842 [1,1,0,0,0,0|1,0,1]=4 1353 B9R1.2 CSC1=CC(=CC=C1)Cl C101839 [1,1,0,0,0,0|1,0,1]=4 1354 B9R1.2 CSC1=CC=CC(=C1)F F156685 [1,1,0,0,0,0|1,0,1]=4 1355 B9R1.2 CSC1=CC=CC(=C1)N M101834 [1,1,0,0,0,0|1,0,1]=4 1356 B9R1.2 [CH2-]C1=CC(=CC=C1)C#N C331829 [1,1,0,0,0,0|1,0,1]=4 1357 B9R1.6 B(C1=CC=CC=C1)(Cl)Cl D155799 [1,1,0,0,0,0|2,0,0]=4 1358 B9R1.6 B(C1=CC=CC=C1)(O)O P107045 [1,1,0,0,0,0|2,0,0]=4 1359 B9R1.6 B(C1=CC=CC=C1)(O)O P168612 [1,1,0,0,0,0|2,0,0]=4 1360 B9R1.6 B(C1=CC=CC=C1)(O)O P396095 [1,1,0,0,0,0|2,0,0]=4 1361 B9R1.6 C1=CC(=CN=C1)C(=N)N P160050 [1,1,0,0,0,0|2,0,0]=4 1362 B9R1.6 C1=CC(=CN=C1)C(=O)Cl N107157 [1,1,0,0,0,0|2,0,0]=4 1363 B9R1.6 C1=CC(=CN=C1)C(=O)N BWY396895 [1,1,0,0,0,0|2,0,0]=4 1364 B9R1.6 C1=CC(=CN=C1)C(=O)N BWY396901 [1,1,0,0,0,0|2,0,0]=4 1365 B9R1.6 C1=CC(=CN=C1)C(=O)N N105042 [1,1,0,0,0,0|2,0,0]=4 1366 B9R1.6 C1=CC(=CN=C1)C(=O)N N105043 [1,1,0,0,0,0|2,0,0]=4 1367 B9R1.6 C1=CC(=CN=C1)C(=O)N N108086 [1,1,0,0,0,0|2,0,0]=4 1368 B9R1.6 C1=CC(=CN=C1)C(=O)N N108087 [1,1,0,0,0,0|2,0,0]=4 1369 B9R1.6 C1=CC(=CN=C1)C(=O)N N434628 [1,1,0,0,0,0|2,0,0]=4 1370 B9R1.6 C1=CC(=CN=C1)C(=O)O N103652 [1,1,0,0,0,0|2,0,0]=4 1371 B9R1.6 C1=CC(=CN=C1)C(=O)O N103654 [1,1,0,0,0,0|2,0,0]=4 1372 B9R1.6 C1=CC(=CN=C1)C(=O)O N118655 [1,1,0,0,0,0|2,0,0]=4 1373 B9R1.6 C1=CC(=CN=C1)C(=O)O N118656 [1,1,0,0,0,0|2,0,0]=4 1374 B9R1.6 C1=CC(=CN=C1)C(=O)O N433033 [1,1,0,0,0,0|2,0,0]=4 1375 B9R1.6 C1=CC(=CN=C1)C(=O)[O-] S161385 [1,1,0,0,0,0|2,0,0]=4 1376 B9R1.6 C1=CC(=CN=C1)C(=S)N T161553 [1,1,0,0,0,0|2,0,0]=4 1377 B9R1.6 C1=CC=C(C=C1)C(=N)N B100938 [1,1,0,0,0,0|1,0,0]=3 1378 B9R1.6 C1=CC=C(C=C1)C(=N)N B100967 [1,1,0,0,0,0|1,0,0]=3 1379 B9R1.6 C1=CC=C(C=C1)C(=N)N B349126 [1,1,0,0,0,0|1,0,0]=3 1380 B9R1.6 C1=CC=C(C=C1)C(=N)N B422069 [1,1,0,0,0,0|1,0,0]=3 1381 B9R1.6 C1=CC=C(C=C1)C(=O)Br B152056 [1,1,0,0,0,0|1,0,0]=3 1382 B9R1.6 C1=CC=C(C=C1)C(=O)Cl B104565 [1,1,0,0,0,0|1,0,0]=3 1383 B9R1.6 C1=CC=C(C=C1)C(=O)Cl B104566 [1,1,0,0,0,0|1,0,0]=3 1384 B9R1.6 C1=CC=C(C=C1)C(=O)Cl B305868 [1,1,0,0,0,0|1,0,0]=3 1385 B9R1.6 C1=CC=C(C=C1)C(=O)F B152051 [1,1,0,0,0,0|1,0,0]=3 1386 B9R1.6 C1=CC=C(C=C1)C(=O)N B110551 [1,1,0,0,0,0|1,0,0]=3 1387 B9R1.6 C1=CC=C(C=C1)C(=O)N B110552 [1,1,0,0,0,0|1,0,0]=3 1388 B9R1.6 C1=CC=C(C=C1)C(=O)N B118608 [1,1,0,0,0,0|1,0,0]=3 1389 B9R1.6 C1=CC=C(C=C1)C(=O)O B116254 [1,1,0,0,0,0|1,0,0]=3 1390 B9R1.6 C1=CC=C(C=C1)C(=O)O B116255 [1,1,0,0,0,0|1,0,0]=3 1391 B9R1.6 C1=CC=C(C=C1)C(=O)O B116256 [1,1,0,0,0,0|1,0,0]=3 1392 B9R1.6 C1=CC=C(C=C1)C(=O)O B116259 [1,1,0,0,0,0|1,0,0]=3 1393 B9R1.6 C1=CC=C(C=C1)C(=O)O B116260 [1,1,0,0,0,0|1,0,0]=3 1394 B9R1.6 C1=CC=C(C=C1)C(=O)O B116262 [1,1,0,0,0,0|1,0,0]=3 1395 B9R1.6 C1=CC=C(C=C1)C(=O)O B117657 [1,1,0,0,0,0|1,0,0]=3 1396 B9R1.6 C1=CC=C(C=C1)C(=O)O B119541 [1,1,0,0,0,0|1,0,0]=3 1397 B9R1.6 C1=CC=C(C=C1)C(=O)O B291747 [1,1,0,0,0,0|1,0,0]=3 1398 B9R1.6 C1=CC=C(C=C1)C(=O)O B302170 [1,1,0,0,0,0|1,0,0]=3 1399 B9R1.6 C1=CC=C(C=C1)C(=O)O B425323 [1,1,0,0,0,0|1,0,0]=3 1400 B9R1.6 C1=CC=C(C=C1)C(=O)O B433248 [1,1,0,0,0,0|1,0,0]=3 1401 B9R1.6 C1=CC=C(C=C1)C(=O)S T161810 [1,1,0,0,0,0|1,0,0]=3 1402 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] A112559 [1,1,0,0,0,0|1,0,0]=3 1403 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] A112561 [1,1,0,0,0,0|1,0,0]=3 1404 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] C347199 [1,1,0,0,0,0|1,0,0]=3 1405 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] C349185 [1,1,0,0,0,0|1,0,0]=3 1406 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] L102020 [1,1,0,0,0,0|1,0,0]=3 1407 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] P104052 [1,1,0,0,0,0|1,0,0]=3 1408 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] S104124 [1,1,0,0,0,0|1,0,0]=3 1409 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] S104125 [1,1,0,0,0,0|1,0,0]=3 1410 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] S104127 [1,1,0,0,0,0|1,0,0]=3 1411 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] S104128 [1,1,0,0,0,0|1,0,0]=3 1412 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] S124683 [1,1,0,0,0,0|1,0,0]=3 1413 B9R1.6 C1=CC=C(C=C1)C(=O)[O-] S424558 [1,1,0,0,0,0|1,0,0]=3 1414 B9R1.6 C1=CC=C(C=C1)C(=S)N T111125 [1,1,0,0,0,0|1,0,0]=3 1415 B9R1.6 C1=CC=C(C=C1)C(Br)Br D300412 [1,1,0,0,0,0|1,0,1]=4 1416 B9R1.6 C1=CC=C(C=C1)C(F)F D404169 [1,1,0,0,0,0|1,0,1]=4 1417 B9R1.6 C1=CC=C(C=C1)P(Cl)Cl P103165 [1,1,0,0,0,0|2,0,0]=4 1418 B9R1.6 C1=CC=C(C=C1)S(=O)O B589671 [1,1,0,0,0,0|2,0,0]=4 1419 B9R1.6 C1=CC=C(C=C1)S(=O)[O-] B111697 [1,1,0,0,0,0|2,0,0]=4 1420 B9R1.6 C1=CC=C(C=C1)S(=O)[O-] S131677 [1,1,0,0,0,0|2,0,0]=4 1421 B9R1.6 C1=CC=C(C=C1)[N+](=O)[O-] N116216 [1,1,0,0,0,0|2,0,0]=4 1422 B9R1.6 C1=CC=C(C=C1)[N+](=O)[O-] N116217 [1,1,0,0,0,0|2,0,0]=4 1423 B9R1.6 C1=CC=C(C=C1)[N+](=O)[O-] N116219 [1,1,0,0,0,0|2,0,0]=4 1424 B9R1.6 C1=CC=C(C=C1)[N+](=O)[O-] N116220 [1,1,0,0,0,0|2,0,0]=4 1425 B9R1.6 C1=CC=C(C=C1)[N+](=O)[O-] N116222 [1,1,0,0,0,0|2,0,0]=4 1426 B9R1.6 C1=CC=C(C=C1)[N+](=O)[O-] N123719 [1,1,0,0,0,0|2,0,0]=4 1427 B9R1.6 C1=CC=C(C=C1)[N+](=O)[O-] N346210 [1,1,0,0,0,0|2,0,0]=4 1428 B9R1.6 C1=CC=C(C=C1)[P+](=O)O P160701 [1,1,0,0,0,0|2,0,0]=4 1429 B9R1.6 C1=CC=C(C=C1)[Se](=O)O B152925 [1,1,0,0,0,0|2,0,0]=4 1430 B9R1.6 C1=CC=NC(=C1)C(=N)N A130010 [1,1,0,0,0,0|2,0,0]=4 1431 B9R1.6 C1=CC=NC(=C1)C(=O)Cl P133422 [1,1,0,0,0,0|2,0,0]=4 1432 B9R1.6 C1=CC=NC(=C1)C(=O)N P138238 [1,1,0,0,0,0|2,0,0]=4 1433 B9R1.6 C1=CC=NC(=C1)C(=O)O D118689 [1,1,0,0,0,0|2,0,0]=4 1434 B9R1.6 C1=CC=NC(=C1)C(=O)O P101920 [1,1,0,0,0,0|2,0,0]=4 1435 B9R1.6 C1=CC=NC(=C1)C(=O)O P160049 [1,1,0,0,0,0|2,0,0]=4 1436 B9R1.6 C1=CC=NC(=C1)C(=O)[O-] C101910 [1,1,0,0,0,0|2,0,0]=4 1437 B9R1.6 C1=CC=NC(=C1)C(=O)[O-] C421694 [1,1,0,0,0,0|2,0,0]=4 1438 B9R1.6 C1=CN=CC=C1C(=N)N A134096 [1,1,0,0,0,0|2,0,0]=4 1439 B9R1.6 C1=CN=CC=C1C(=N)N A184477 [1,1,0,0,0,0|2,0,0]=4 1440 B9R1.6 C1=CN=CC=C1C(=O)Cl I107934 [1,1,0,0,0,0|2,0,0]=4 1441 B9R1.6 C1=CN=CC=C1C(=O)N I106833 [1,1,0,0,0,0|2,0,0]=4 1442 B9R1.6 C1=CN=CC=C1C(=O)O I101094 [1,1,0,0,0,0|2,0,0]=4 1443 B9R1.6 C1=CN=CC=C1C(=O)O I424705 [1,1,0,0,0,0|2,0,0]=4 1444 B9R1.6 C1=CN=CC=C1C(=O)[O-] S161415 [1,1,0,0,0,0|2,0,0]=4 1445 B9R1.6 C1=CN=CC=C1C(=S)N T161552 [1,1,0,0,0,0|2,0,0]=4 1446 B9R1.6 C=C(C1=CC=CC=C1)Br A189239 [1,1,0,0,0,0|0,0,0]=2 1447 B9R1.6 CC(=C)C1=CC=CC=C1 M104900 [1,1,0,0,0,0|0,0,0]=2 1448 B9R1.6 CC(=C)C1=CC=CC=C1 M104901 [1,1,0,0,0,0|0,0,0]=2 1449 B9R1.6 CC(=C)C1=CC=CC=C1 P347730 [1,1,0,0,0,0|0,0,0]=2 1450 B9R1.6 CC(=C)C1=CC=CC=C1 P491419 [1,1,0,0,0,0|0,0,0]=2 1451 B9R1.6 CC(=O)C1=CC=CC=C1 A103666 [1,1,0,0,0,0|0,0,1]=3 1452 B9R1.6 CC(=O)C1=CC=CC=C1 A103667 [1,1,0,0,0,0|0,0,1]=3 1453 B9R1.6 CC(=O)C1=CC=CC=C1 A103669 [1,1,0,0,0,0|0,0,1]=3 1454 B9R1.6 CC(=O)C1=CC=CC=C1 A427211 [1,1,0,0,0,0|0,0,1]=3 1455 B9R1.6 CC(=O)C1=CC=CC=C1 A471960 [1,1,0,0,0,0|0,0,1]=3 1456 B9R1.6 CC(=O)C1=CC=CC=C1 A474131 [1,1,0,0,0,0|0,0,1]=3 1457 B9R1.6 CC(=O)C1=CC=CC=C1 A474138 [1,1,0,0,0,0|0,0,1]=3 1458 B9R1.6 CC(=O)C1=CC=CC=N1 A106232 [1,1,0,0,0,0|1,0,1]=4 1459 B9R1.6 CC(=O)C1=CC=CC=N1 A106233 [1,1,0,0,0,0|1,0,1]=4 1460 B9R1.6 CC(=O)C1=CC=NC=C1 A102942 [1,1,0,0,0,0|1,0,1]=4 1461 B9R1.6 CC(=O)C1=CN=CC=C1 A106235 [1,1,0,0,0,0|1,0,1]=4 1462 B9R1.6 CC(=O)C1=CN=CC=C1 A106236 [1,1,0,0,0,0|1,0,1]=4 1463 B9R1.6 CC(C)C1=CC=CC=C1 I101049 [1,1,0,0,0,0|0,0,2]=4 1464 B9R1.6 CC(C)C1=CC=CC=C1 I101050 [1,1,0,0,0,0|0,0,2]=4 1465 B9R1.6 CC(C)C1=CC=CC=C1 I101052 [1,1,0,0,0,0|0,0,2]=4 1466 B9R1.6 CC(C1=CC=CC=C1)Br B104540 [1,1,0,0,0,0|0,0,2]=4 1467 B9R1.6 CC(C1=CC=CC=C1)Cl C107586 [1,1,0,0,0,0|0,0,2]=4 1468 B9R1.6 CC(C1=CC=CC=C1)N M105678 [1,1,0,0,0,0|0,0,2]=4 1469 B9R1.6 CC(C1=CC=CC=C1)N M105679 [1,1,0,0,0,0|0,0,2]=4 1470 B9R1.6 CC(C1=CC=CC=C1)N M106714 [1,1,0,0,0,0|0,0,2]=4 1471 B9R1.6 CC(C1=CC=CC=C1)N M141280 [1,1,0,0,0,0|0,0,2]=4 1472 B9R1.6 CC(C1=CC=CC=C1)N R432669 [1,1,0,0,0,0|0,0,2]=4 1473 B9R1.6 CC(C1=CC=CC=C1)N R432670 [1,1,0,0,0,0|0,0,2]=4 1474 B9R1.6 CC(C1=CC=CC=C1)N R432682 [1,1,0,0,0,0|0,0,2]=4 1475 B9R1.6 CC(C1=CC=CC=C1)N S135224 [1,1,0,0,0,0|0,0,2]=4 1476 B9R1.6 CC(C1=CC=CC=C1)N S432505 [1,1,0,0,0,0|0,0,2]=4 1477 B9R1.6 CC(C1=CC=CC=C1)O P100878 [1,1,0,0,0,0|0,0,2]=4 1478 B9R1.6 CC(C1=CC=CC=C1)O P103660 [1,1,0,0,0,0|0,0,2]=4 1479 B9R1.6 CC(C1=CC=CC=C1)O P113820 [1,1,0,0,0,0|0,0,2]=4 1480 B9R1.6 CC(C1=CC=CC=C1)O P165285 [1,1,0,0,0,0|0,0,2]=4 1481 B9R1.6 CN(C)C1=CC=CC=C1 D100060 [1,1,0,0,0,0|1,0,1]=4 1482 B9R1.6 CN(C)C1=CC=CC=C1 D100061 [1,1,0,0,0,0|1,0,1]=4 1483 B9R1.6 CN(C)C1=CC=CC=C1 D100063 [1,1,0,0,0,0|1,0,1]=4 1484 B9R1.6 CN(C1=CC=CC=C1)N M298692 [1,1,0,0,0,0|1,0,1]=4 1485 B9R1.6 CP(C)C1=CC=CC=C1 C118698 [1,1,0,0,0,0|1,0,1]=4 1486 B9R1.6 CP(C)C1=CC=CC=C1 D115603 [1,1,0,0,0,0|1,0,1]=4 1487 B9R1.6 CS(=O)C1=CC=CC=C1 M158079 [1,1,0,0,0,0|1,0,1]=4 1488 B9R1.6 CS(=O)C1=CC=CC=C1 M464276 [1,1,0,0,0,0|1,0,1]=4 1489 B9R1.6 C[Si](=O)C1=CC=CC=C1 P331251 [1,1,0,0,0,0|0,1,1]=4 1490 B9R1.6 C[Si](C)C1=CC=CC=C1 D111809 [1,1,0,0,0,0|0,1,1]=4 1491 B9R1.6 NC(=O)C1=CC=CN=C1 N407906 [1,1,0,0,0,0|2,0,0]=4 1492 B9R1.6 OC(=O)C1=CC=CN=C1 N407808 [1,1,0,0,0,0|2,0,0]=4 1493 B9R1.8 C1=CC(=CN=C1)C=NO P166345 [1,1,0,0,0,0|2,0,0]=4 1494 B9R1.8 C1=CC=C(C=C1)C#CBr B464040 [1,1,0,0,0,0|0,0,2]=4 1495 B9R1.8 C1=CC=C(C=C1)C#CCl C464026 [1,1,0,0,0,0|0,0,2]=4 1496 B9R1.8 C1=CC=C(C=C1)C=CBr B152003 [1,1,0,0,0,0|0,0,0]=2 1497 B9R1.8 C1=CC=C(C=C1)C=NN B589372 [1,1,0,0,0,0|1,0,0]=3 1498 B9R1.8 C1=CC=C(C=C1)C=NO T135657 [1,1,0,0,0,0|1,0,0]=3 1499 B9R1.8 C1=CC=C(C=C1)CC=O P105078 [1,1,0,0,0,0|0,0,1]=3 1500 B9R1.8 C1=CC=C(C=C1)CC=O P105080 [1,1,0,0,0,0|0,0,1]=3 1501 B9R1.8 C1=CC=C(C=C1)CC=O P420978 [1,1,0,0,0,0|0,0,1]=3 1502 B9R1.8 C1=CC=C(C=C1)CCBr B106895 [1,1,0,0,0,0|0,0,2]=4 1503 B9R1.8 C1=CC=C(C=C1)CCCl C136679 [1,1,0,0,0,0|0,0,2]=4 1504 B9R1.8 C1=CC=C(C=C1)CCI I138375 [1,1,0,0,0,0|0,0,2]=4 1505 B9R1.8 C1=CC=C(C=C1)CCN P105641 [1,1,0,0,0,0|0,0,2]=4 1506 B9R1.8 C1=CC=C(C=C1)CCN P160641 [1,1,0,0,0,0|0,0,2]=4 1507 B9R1.8 C1=CC=C(C=C1)CCN P290339 [1,1,0,0,0,0|0,0,2]=4 1508 B9R1.8 C1=CC=C(C=C1)CCN P408003 [1,1,0,0,0,0|0,0,2]=4 1509 B9R1.8 C1=CC=C(C=C1)CCN P421867 [1,1,0,0,0,0|0,0,2]=4 1510 B9R1.8 C1=CC=C(C=C1)CCN P425250 [1,1,0,0,0,0|0,0,2]=4 1511 B9R1.8 C1=CC=C(C=C1)CCN P491880 [1,1,0,0,0,0|0,0,2]=4 1512 B9R1.8 C1=CC=C(C=C1)CCN P493037 [1,1,0,0,0,0|0,0,2]=4 1513 B9R1.8 C1=CC=C(C=C1)CCN P493125 [1,1,0,0,0,0|0,0,2]=4 1514 B9R1.8 C1=CC=C(C=C1)CCO P108195 [1,1,0,0,0,0|0,0,2]=4 1515 B9R1.8 C1=CC=C(C=C1)CCO P108197 [1,1,0,0,0,0|0,0,2]=4 1516 B9R1.8 C1=CC=C(C=C1)CCO P424995 [1,1,0,0,0,0|0,0,2]=4 1517 B9R1.8 C1=CC=C(C=C1)CCS P160530 [1,1,0,0,0,0|0,0,2]=4 1518 B9R1.8 C1=CC=C(C=C1)CNN B122576 [1,1,0,0,0,0|1,0,1]=4 1519 B9R1.8 C1=CC=C(C=C1)CNN B137990 [1,1,0,0,0,0|1,0,1]=4 1520 B9R1.8 C1=CC=C(C=C1)CNN B464175 [1,1,0,0,0,0|1,0,1]=4 1521 B9R1.8 C1=CC=C(C=C1)CNO I137166 [1,1,0,0,0,0|1,0,1]=4 1522 B9R1.8 C1=CC=C(C=C1)CON O159948 [1,1,0,0,0,0|1,0,1]=4 1523 B9R1.8 C1=CC=C(C=C1)CON O189173 [1,1,0,0,0,0|1,0,1]=4 1524 B9R1.8 C1=CC=C(C=C1)N=C=O P304914 [1,1,0,0,0,0|1,0,1]=4 1525 B9R1.8 C1=CC=C(C=C1)N=C=S P110634 [1,1,0,0,0,0|1,0,1]=4 1526 B9R1.8 C1=CC=C(C=C1)N=C=S P110635 [1,1,0,0,0,0|1,0,1]=4 1527 B9R1.8 C1=CC=C(C=C1)N=C=S P110636 [1,1,0,0,0,0|1,0,1]=4 1528 B9R1.8 C1=CC=C(C=C1)N=S=O N159148 [1,1,0,0,0,0|2,0,0]=4 1529 B9R1.8 C1=CC=C(C=C1)N=[N+]=[N-] A462925 [1,1,0,0,0,0|2,0,0]=4 1530 B9R1.8 C1=CC=C(C=C1)NC=O F112354 [1,1,0,0,0,0|1,0,0]=3 1531 B9R1.8 C1=CC=C(C=C1)OC=O P305264 [1,1,0,0,0,0|1,0,0]=3 1532 B9R1.8 C1=CC=C(C=C1)SCCl C101827 [1,1,0,0,0,0|1,0,1]=4 1533 B9R1.8 C1=CC=C(C=C1)[Se]C#N P168654 [1,1,0,0,0,0|1,0,1]=4 1534 B9R1.8 C1=CC=NC(=C1)C=NO P160056 [1,1,0,0,0,0|2,0,0]=4 1535 B9R1.8 C1=CN=CC=C1C=NO P160054 [1,1,0,0,0,0|2,0,0]=4 1536 B9R1.8 C=CCC1=CC=CC=C1 A101037 [1,1,0,0,0,0|0,0,0]=2 1537 B9R1.8 C=CSC1=CC=CC=C1 P101810 [1,1,0,0,0,0|0,0,0]=2 1538 B9R1.8 C=C[CH-]C1=CC=CC=C1 P129181 [1,1,0,0,0,0|0,0,0]=2 1539 B9R1.8 CC#CC1=CC=CC=C1 P141240 [1,1,0,0,0,0|0,0,2]=4 1540 B9R1.8 CC=CC1=CC=CC=C1 C153576 [1,1,0,0,0,0|0,0,0]=2 1541 B9R1.8 CC=CC1=CC=CC=C1 M136687 [1,1,0,0,0,0|0,0,0]=2 1542 B9R1.8 CC=CC1=CC=CC=C1 T134052 [1,1,0,0,0,0|0,0,0]=2 1543 B9R1.8 CC=CC1=CC=CC=C1 T301941 [1,1,0,0,0,0|0,0,0]=2 1544 B9R1.8 CCCC1=CC=CC=C1 P104621 [1,1,0,0,0,0|0,0,2]=4 1545 B9R1.8 CCCC1=CC=CC=C1 P104624 [1,1,0,0,0,0|0,0,2]=4 1546 B9R1.8 CCCC1=CC=CC=C1 P104625 [1,1,0,0,0,0|0,0,2]=4 1547 B9R1.8 CCCC1=CC=CC=C1 P104626 [1,1,0,0,0,0|0,0,2]=4 1548 B9R1.8 CCCC1=CC=CC=C1 P128158 [1,1,0,0,0,0|0,0,2]=4 1549 B9R1.8 CCNC1=CC=CC=C1 E103974 [1,1,0,0,0,0|0,0,2]=4 1550 B9R1.8 CCOC1=CC=CC=C1 E108654 [1,1,0,0,0,0|0,0,2]=4 1551 B9R1.8 CCOC1=CC=CC=C1 E108655 [1,1,0,0,0,0|0,0,2]=4 1552 B9R1.8 CCSC1=CC=CC=C1 E101809 [1,1,0,0,0,0|0,0,2]=4 1553 B9R1.8 CNCC1=CC=CC=C1 B106919 [1,1,0,0,0,0|0,0,2]=4 1554 B9R1.8 COCC1=CC=CC=C1 B103161 [1,1,0,0,0,0|0,0,2]=4 1555 B9R1.8 COCC1=CC=CC=C1 B591251 [1,1,0,0,0,0|0,0,2]=4 1556 B9R1.8 CSCC1=CC=CC=C1 B152510 [1,1,0,0,0,0|0,0,2]=4 1557 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B153177 [1,1,0,0,0,0|0,0,2]=4 1558 B9R1.15 C#CC1=CC=CC=C1Br B405186 [1,1,0,0,0,0|0,0,2]=4 1559 B9R1.15 C#CC1=CC=CC=C1Cl W134592 [1,1,0,0,0,0|0,0,2]=4 1560 B9R1.15 C#CC1=CC=CC=C1F E135295 [1,1,0,0,0,0|0,0,2]=4 1561 B9R1.15 C#CC1=CC=CC=C1N E176686 [1,1,0,0,0,0|0,0,2]=4 1562 B9R1.15 C1=CC(=C(N=C1)Br)C=O B107726 [1,1,0,0,0,0|2,0,0]=4 1563 B9R1.15 C1=CC(=C(N=C1)C=O)Br B482551 [1,1,0,0,0,0|2,0,0]=4 1564 B9R1.15 C1=CC(=C(N=C1)C=O)Cl C182663 [1,1,0,0,0,0|2,0,0]=4 1565 B9R1.15 C1=CC(=C(N=C1)C=O)F F121803 [1,1,0,0,0,0|2,0,0]=4 1566 B9R1.15 C1=CC(=C(N=C1)C=O)O H175252 [1,1,0,0,0,0|2,0,0]=4 1567 B9R1.15 C1=CC(=C(N=C1)Cl)C=O C107725 [1,1,0,0,0,0|2,0,0]=4 1568 B9R1.15 C1=CC(=C(N=C1)Cl)C=O C639107 [1,1,0,0,0,0|2,0,0]=4 1569 B9R1.15 C1=CC(=C(N=C1)F)C=O F169927 [1,1,0,0,0,0|2,0,0]=4 1570 B9R1.15 C1=CC(=C(N=C1)N)C=O A115308 [1,1,0,0,0,0|2,0,0]=4 1571 B9R1.15 C1=CC=C(C(=C1)C#N)Br B113773 [1,1,0,0,0,0|1,0,1]=4 1572 B9R1.15 C1=CC=C(C(=C1)C#N)Cl C105958 [1,1,0,0,0,0|1,0,1]=4 1573 B9R1.15 C1=CC=C(C(=C1)C#N)F F120868 [1,1,0,0,0,0|1,0,1]=4 1574 B9R1.15 C1=CC=C(C(=C1)C#N)I I103576 [1,1,0,0,0,0|1,0,1]=4 1575 B9R1.15 C1=CC=C(C(=C1)C#N)I I130037 [1,1,0,0,0,0|1,0,1]=4 1576 B9R1.15 C1=CC=C(C(=C1)C#N)N A107481 [1,1,0,0,0,0|1,0,1]=4 1577 B9R1.15 C1=CC=C(C(=C1)C#N)O H103175 [1,1,0,0,0,0|1,0,1]=4 1578 B9R1.15 C1=CC=C(C(=C1)C=O)Br B109684 [1,1,0,0,0,0|1,0,0]=3 1579 B9R1.15 C1=CC=C(C(=C1)C=O)Cl C108294 [1,1,0,0,0,0|1,0,0]=3 1580 B9R1.15 C1=CC=C(C(=C1)C=O)Cl C108295 [1,1,0,0,0,0|1,0,0]=3 1581 B9R1.15 C1=CC=C(C(=C1)C=O)Cl C108296 [1,1,0,0,0,0|1,0,0]=3 1582 B9R1.15 C1=CC=C(C(=C1)C=O)F F107119 [1,1,0,0,0,0|1,0,0]=3 1583 B9R1.15 C1=CC=C(C(=C1)C=O)I I124157 [1,1,0,0,0,0|1,0,0]=3 1584 B9R1.15 C1=CC=C(C(=C1)C=O)N A100686 [1,1,0,0,0,0|1,0,0]=3 1585 B9R1.15 C1=CC=C(C(=C1)C=O)O S103742 [1,1,0,0,0,0|1,0,0]=3 1586 B9R1.15 C1=CC=C(C(=C1)C=O)O S103743 [1,1,0,0,0,0|1,0,0]=3 1587 B9R1.15 C1=CC=C(C(=C1)C=O)O S103745 [1,1,0,0,0,0|1,0,0]=3 1588 B9R1.15 C1=CC=C(C(=C1)C=O)O S103746 [1,1,0,0,0,0|1,0,0]=3 1589 B9R1.15 C1=CC=C(C(=C1)CBr)Br B124758 [1,1,0,0,0,0|1,0,1]=4 1590 B9R1.15 C1=CC=C(C(=C1)CBr)Cl C135217 [1,1,0,0,0,0|1,0,1]=4 1591 B9R1.15 C1=CC=C(C(=C1)CBr)F F107111 [1,1,0,0,0,0|1,0,1]=4 1592 B9R1.15 C1=CC=C(C(=C1)CBr)I I101707 [1,1,0,0,0,0|1,0,1]=4 1593 B9R1.15 C1=CC=C(C(=C1)CBr)I I131028 [1,1,0,0,0,0|1,0,1]=4 1594 B9R1.15 C1=CC=C(C(=C1)CCl)Cl C136424 [1,1,0,0,0,0|1,0,1]=4 1595 B9R1.15 C1=CC=C(C(=C1)CCl)F F104448 [1,1,0,0,0,0|1,0,1]=4 1596 B9R1.15 C1=CC=C(C(=C1)CCl)I I472524 [1,1,0,0,0,0|1,0,1]=4 1597 B9R1.15 C1=CC=C(C(=C1)CN)Br B136382 [1,1,0,0,0,0|1,0,1]=4 1598 B9R1.15 C1=CC=C(C(=C1)CN)Br B184269 [1,1,0,0,0,0|1,0,1]=4 1599 B9R1.15 C1=CC=C(C(=C1)CN)Cl C100661 [1,1,0,0,0,0|1,0,1]=4 1600 B9R1.15 C1=CC=C(C(=C1)CN)Cl C298505 [1,1,0,0,0,0|1,0,1]=4 1601 B9R1.15 C1=CC=C(C(=C1)CN)F F122768 [1,1,0,0,0,0|1,0,1]=4 1602 B9R1.15 C1=CC=C(C(=C1)CN)O A195905 [1,1,0,0,0,0|1,0,1]=4 1603 B9R1.15 C1=CC=C(C(=C1)CO)Br B135325 [1,1,0,0,0,0|1,0,1]=4 1604 B9R1.15 C1=CC=C(C(=C1)CO)Cl C101747 [1,1,0,0,0,0|1,0,1]=4 1605 B9R1.15 C1=CC=C(C(=C1)CO)F F156600 [1,1,0,0,0,0|1,0,1]=4 1606 B9R1.15 C1=CC=C(C(=C1)CO)I I157441 [1,1,0,0,0,0|1,0,1]=4 1607 B9R1.15 C1=CC=C(C(=C1)CO)N A151122 [1,1,0,0,0,0|1,0,1]=4 1608 B9R1.15 C1=CC=C(C(=C1)CO)O H106789 [1,1,0,0,0,0|1,0,1]=4 1609 B9R1.15 C1=CC=C(C(=C1)CO)O H426756 [1,1,0,0,0,0|1,0,1]=4 1610 B9R1.15 C1=CC=C(C(=C1)CS)Br B101794 [1,1,0,0,0,0|1,0,1]=4 1611 B9R1.15 C1=CC=C(C(=C1)CS)Cl C101788 [1,1,0,0,0,0|1,0,1]=4 1612 B9R1.15 C1=CC=C(C(=C1)NN)Br B101712 [1,1,0,0,0,0|2,0,0]=4 1613 B9R1.15 C1=CC=C(C(=C1)NN)Cl C106485 [1,1,0,0,0,0|2,0,0]=4 1614 B9R1.15 C1=CC=C(C(=C1)NN)F F101710 [1,1,0,0,0,0|2,0,0]=4 1615 B9R1.15 C1=CN=CC(=C1C=O)Br B120658 [1,1,0,0,0,0|2,0,0]=4 1616 B9R1.15 C1=CN=CC(=C1C=O)Cl C120657 [1,1,0,0,0,0|2,0,0]=4 1617 B9R1.15 C1=CN=CC(=C1C=O)F F120653 [1,1,0,0,0,0|2,0,0]=4 1618 B9R1.15 C1=CN=CC(=C1C=O)O H182294 [1,1,0,0,0,0|2,0,0]=4 1619 B9R1.15 C1=CN=CC(=C1Cl)C=O C172130 [1,1,0,0,0,0|2,0,0]=4 1620 B9R1.15 C1=CN=CC(=C1N)C=O A479063 [1,1,0,0,0,0|2,0,0]=4 1621 B9R1.15 C1=CNC(=O)C(=C1)C=O H169926 [1,1,0,0,0,0|2,0,0]=4 1622 B9R1.15 C=CC1=CC=CC=C1Br B102182 [1,1,0,0,0,0|0,0,0]=2 1623 B9R1.15 C=CC1=CC=CC=C1Br B140775 [1,1,0,0,0,0|0,0,0]=2 1624 B9R1.15 C=CC1=CC=CC=C1Cl C121721 [1,1,0,0,0,0|0,0,0]=2 1625 B9R1.15 C=CC1=CC=CC=C1Cl C492343 [1,1,0,0,0,0|0,0,0]=2 1626 B9R1.15 C=CC1=CC=CC=C1F F121723 [1,1,0,0,0,0|0,0,0]=2 1627 B9R1.15 C=CC1=CC=CC=C1F F398479 [1,1,0,0,0,0|0,0,0]=2 1628 B9R1.15 C=CC1=CC=CC=C1N V303619 [1,1,0,0,0,0|0,0,0]=2 1629 B9R1.15 CC1=C(C=CC=N1)C=O M176904 [1,1,0,0,0,0|2,0,0]=4 1630 B9R1.15 CC1=C(N=CC=C1)C=O M120655 [1,1,0,0,0,0|2,0,0]=4 1631 B9R1.15 CC1=CC=CC=C1C#C E117998 [1,1,0,0,0,0|0,0,2]=4 1632 B9R1.15 CC1=CC=CC=C1C#N T103037 [1,1,0,0,0,0|1,0,1]=4 1633 B9R1.15 CC1=CC=CC=C1C=C M100795 [1,1,0,0,0,0|0,0,0]=2 1634 B9R1.15 CC1=CC=CC=C1C=O O159892 [1,1,0,0,0,0|1,0,0]=3 1635 B9R1.15 CC1=CC=CC=C1CBr M139409 [1,1,0,0,0,0|1,0,1]=4 1636 B9R1.15 CC1=CC=CC=C1CCl M101671 [1,1,0,0,0,0|1,0,1]=4 1637 B9R1.15 CC1=CC=CC=C1CN M158667 [1,1,0,0,0,0|1,0,1]=4 1638 B9R1.15 CC1=CC=CC=C1CO M157901 [1,1,0,0,0,0|1,0,1]=4 1639 B9R1.15 CC1=CC=CC=C1CS M300495 [1,1,0,0,0,0|1,0,1]=4 1640 B9R1.15 CC1=CC=CC=C1NC N159021 [1,1,0,0,0,0|1,0,1]=4 1641 B9R1.15 CC1=CC=CC=C1NN T101278 [1,1,0,0,0,0|2,0,0]=4 1642 B9R1.15 CC1=CC=CC=C1OC M158113 [1,1,0,0,0,0|1,0,1]=4 1643 B9R1.15 CCC1=CC=CC=C1Br B138432 [1,1,0,0,0,0|0,0,2]=4 1644 B9R1.15 CCC1=CC=CC=C1C E140581 [1,1,0,0,0,0|0,0,2]=4 1645 B9R1.15 CCC1=CC=CC=C1I E189052 [1,1,0,0,0,0|0,0,2]=4 1646 B9R1.15 CCC1=CC=CC=C1N E106226 [1,1,0,0,0,0|0,0,2]=4 1647 B9R1.15 CCC1=CC=CC=C1O E156225 [1,1,0,0,0,0|0,0,2]=4 1648 B9R1.15 CCC1=CC=CC=C1S E101792 [1,1,0,0,0,0|0,0,2]=4 1649 B9R1.15 CNC1=CC=CC=C1Br B186004 [1,1,0,0,0,0|1,0,1]=4 1650 B9R1.15 CNC1=CC=CC=C1Cl C153908 [1,1,0,0,0,0|1,0,1]=4 1651 B9R1.15 CNC1=CC=CC=C1F F132815 [1,1,0,0,0,0|1,0,1]=4 1652 B9R1.15 CNC1=CC=CC=C1N I134172 [1,1,0,0,0,0|1,0,1]=4 1653 B9R1.15 CNC1=CC=CC=C1N M106013 [1,1,0,0,0,0|1,0,1]=4 1654 B9R1.15 CNC1=CC=CC=C1O M194184 [1,1,0,0,0,0|1,0,1]=4 1655 B9R1.15 COC1=CC=CC=C1Br B109257 [1,1,0,0,0,0|1,0,1]=4 1656 B9R1.15 COC1=CC=CC=C1Cl C110652 [1,1,0,0,0,0|1,0,1]=4 1657 B9R1.15 COC1=CC=CC=C1F F120586 [1,1,0,0,0,0|1,0,1]=4 1658 B9R1.15 COC1=CC=CC=C1I I101929 [1,1,0,0,0,0|1,0,1]=4 1659 B9R1.15 COC1=CC=CC=C1N A103995 [1,1,0,0,0,0|1,0,1]=4 1660 B9R1.15 COC1=CC=CC=C1N A103997 [1,1,0,0,0,0|1,0,1]=4 1661 B9R1.15 COC1=CC=CC=C1N A141230 [1,1,0,0,0,0|1,0,1]=4 1662 B9R1.15 COC1=CC=CC=C1N O160024 [1,1,0,0,0,0|1,0,1]=4 1663 B9R1.15 COC1=CC=CC=C1O G112735 [1,1,0,0,0,0|1,0,1]=4 1664 B9R1.15 COC1=CC=CC=C1O G426764 [1,1,0,0,0,0|1,0,1]=4 1665 B9R1.15 COC1=CC=CC=C1S M101778 [1,1,0,0,0,0|1,0,1]=4 1666 B9R1.15 CSC1=CC=CC=C1Br B101843 [1,1,0,0,0,0|1,0,1]=4 1667 B9R1.15 CSC1=CC=CC=C1Cl C101838 [1,1,0,0,0,0|1,0,1]=4 1668 B9R1.15 CSC1=CC=CC=C1F F101836 [1,1,0,0,0,0|1,0,1]=4 1669 B9R1.15 CSC1=CC=CC=C1N M158418 [1,1,0,0,0,0|1,0,1]=4 1670 B9R1.15 CSC1=CC=CC=C1O M101847 [1,1,0,0,0,0|1,0,1]=4 1671 B9R1.15 [C-]#[N+]C1=CC=CC=C1Cl C299739 [1,1,0,0,0,0|1,0,1]=4 1672 B9R1.69 C1=C(C(=CN=C1Cl)O)I C590475 [1,1,0,0,0,0|2,0,0]=4 1673 B9R1.69 C1=C(C=NC(=C1Cl)Cl)O D154411 [1,1,0,0,0,0|2,0,0]=4 1674 B9R1.69 C1=C(C=NC(=C1Cl)F)O C182709 [1,1,0,0,0,0|2,0,0]=4 1675 B9R1.69 C1=C(C=NC(=C1F)Cl)O C187277 [1,1,0,0,0,0|2,0,0]=4 1676 B9R1.69 C1=CC(=C(C=C1Br)Br)Cl D588618 [1,1,0,0,0,0|2,0,0]=4 1677 B9R1.69 C1=CC(=C(C=C1Br)Br)F D122667 [1,1,0,0,0,0|2,0,0]=4 1678 B9R1.69 C1=CC(=C(C=C1Br)Br)I D587922 [1,1,0,0,0,0|2,0,0]=4 1679 B9R1.69 C1=CC(=C(C=C1Br)Br)N D101877 [1,1,0,0,0,0|2,0,0]=4 1680 B9R1.69 C1=CC(=C(C=C1Br)Br)O D133947 [1,1,0,0,0,0|1,0,0]=3 1681 B9R1.69 C1=CC(=C(C=C1Br)Cl)Br D137190 [1,1,0,0,0,0|2,0,0]=4 1682 B9R1.69 C1=CC(=C(C=C1Br)Cl)Cl B102024 [1,1,0,0,0,0|2,0,0]=4 1683 B9R1.69 C1=CC(=C(C=C1Br)Cl)F B122630 [1,1,0,0,0,0|2,0,0]=4 1684 B9R1.69 C1=CC(=C(C=C1Br)Cl)I B136229 [1,1,0,0,0,0|2,0,0]=4 1685 B9R1.69 C1=CC(=C(C=C1Br)Cl)N B136301 [1,1,0,0,0,0|2,0,0]=4 1686 B9R1.69 C1=CC(=C(C=C1Br)Cl)O B138789 [1,1,0,0,0,0|1,0,0]=3 1687 B9R1.69 C1=CC(=C(C=C1Br)F)Br D121044 [1,1,0,0,0,0|2,0,0]=4 1688 B9R1.69 C1=CC(=C(C=C1Br)F)Cl B122632 [1,1,0,0,0,0|2,0,0]=4 1689 B9R1.69 C1=CC(=C(C=C1Br)F)F B136570 [1,1,0,0,0,0|2,0,0]=4 1690 B9R1.69 C1=CC(=C(C=C1Br)F)I F115512 [1,1,0,0,0,0|2,0,0]=4 1691 B9R1.69 C1=CC(=C(C=C1Br)F)N B115549 [1,1,0,0,0,0|2,0,0]=4 1692 B9R1.69 C1=CC(=C(C=C1Br)F)O B152993 [1,1,0,0,0,0|1,0,0]=3 1693 B9R1.69 C1=CC(=C(C=C1Br)I)Cl B590154 [1,1,0,0,0,0|2,0,0]=4 1694 B9R1.69 C1=CC(=C(C=C1Br)I)F B179765 [1,1,0,0,0,0|2,0,0]=4 1695 B9R1.69 C1=CC(=C(C=C1Br)I)I B405335 [1,1,0,0,0,0|2,0,0]=4 1696 B9R1.69 C1=CC(=C(C=C1Br)I)N B152057 [1,1,0,0,0,0|2,0,0]=4 1697 B9R1.69 C1=CC(=C(C=C1Br)I)O B152695 [1,1,0,0,0,0|1,0,0]=3 1698 B9R1.69 C1=CC(=C(C=C1Br)N)Br D138742 [1,1,0,0,0,0|2,0,0]=4 1699 B9R1.69 C1=CC(=C(C=C1Br)N)Cl B185533 [1,1,0,0,0,0|2,0,0]=4 1700 B9R1.69 C1=CC(=C(C=C1Br)N)F B122475 [1,1,0,0,0,0|2,0,0]=4 1701 B9R1.69 C1=CC(=C(C=C1Br)N)N B122633 [1,1,0,0,0,0|2,0,0]=4 1702 B9R1.69 C1=CC(=C(C=C1Br)N)O A123465 [1,1,0,0,0,0|1,0,0]=3 1703 B9R1.69 C1=CC(=C(C=C1Br)O)Br D183406 [1,1,0,0,0,0|2,0,0]=4 1704 B9R1.69 C1=CC(=C(C=C1Br)O)Cl B120837 [1,1,0,0,0,0|2,0,0]=4 1705 B9R1.69 C1=CC(=C(C=C1Br)O)F B120822 [1,1,0,0,0,0|2,0,0]=4 1706 B9R1.69 C1=CC(=C(C=C1Br)O)N A184169 [1,1,0,0,0,0|2,0,0]=4 1707 B9R1.69 C1=CC(=C(C=C1Br)O)O B123682 [1,1,0,0,0,0|1,0,0]=3 1708 B9R1.69 C1=CC(=C(C=C1Cl)Br)Cl B167285 [1,1,0,0,0,0|2,0,0]=4 1709 B9R1.69 C1=CC(=C(C=C1Cl)Br)F B132950 [1,1,0,0,0,0|2,0,0]=4 1710 B9R1.69 C1=CC(=C(C=C1Cl)Br)I B293765 [1,1,0,0,0,0|2,0,0]=4 1711 B9R1.69 C1=CC(=C(C=C1Cl)Br)N B134593 [1,1,0,0,0,0|2,0,0]=4 1712 B9R1.69 C1=CC(=C(C=C1Cl)Br)O B152691 [1,1,0,0,0,0|1,0,0]=3 1713 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Br B101631 [1,1,0,0,0,0|2,0,0]=4 1714 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Cl T103299 [1,1,0,0,0,0|2,0,0]=4 1715 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Cl T103300 [1,1,0,0,0,0|2,0,0]=4 1716 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Cl T103301 [1,1,0,0,0,0|2,0,0]=4 1717 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Cl T103302 [1,1,0,0,0,0|2,0,0]=4 1718 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Cl T103303 [1,1,0,0,0,0|2,0,0]=4 1719 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Cl T119674 [1,1,0,0,0,0|2,0,0]=4 1720 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F D107754 [1,1,0,0,0,0|2,0,0]=4 1721 B9R1.69 C1=CC(=C(C=C1Cl)Cl)I D169376 [1,1,0,0,0,0|2,0,0]=4 1722 B9R1.69 C1=CC(=C(C=C1Cl)Cl)N D103990 [1,1,0,0,0,0|2,0,0]=4 1723 B9R1.69 C1=CC(=C(C=C1Cl)Cl)O D104288 [1,1,0,0,0,0|1,0,0]=3 1724 B9R1.69 C1=CC(=C(C=C1Cl)Cl)O D104289 [1,1,0,0,0,0|1,0,0]=3 1725 B9R1.69 C1=CC(=C(C=C1Cl)Cl)O D117194 [1,1,0,0,0,0|1,0,0]=3 1726 B9R1.69 C1=CC(=C(C=C1Cl)Cl)O D472060 [1,1,0,0,0,0|1,0,0]=3 1727 B9R1.69 C1=CC(=C(C=C1Cl)Cl)S D101769 [1,1,0,0,0,0|1,1,0]=4 1728 B9R1.69 C1=CC(=C(C=C1Cl)F)Br B120582 [1,1,0,0,0,0|2,0,0]=4 1729 B9R1.69 C1=CC(=C(C=C1Cl)F)Cl D120589 [1,1,0,0,0,0|2,0,0]=4 1730 B9R1.69 C1=CC(=C(C=C1Cl)F)F C121041 [1,1,0,0,0,0|2,0,0]=4 1731 B9R1.69 C1=CC(=C(C=C1Cl)F)I C113580 [1,1,0,0,0,0|2,0,0]=4 1732 B9R1.69 C1=CC(=C(C=C1Cl)F)N C122487 [1,1,0,0,0,0|2,0,0]=4 1733 B9R1.69 C1=CC(=C(C=C1Cl)F)O C122587 [1,1,0,0,0,0|1,0,0]=3 1734 B9R1.69 C1=CC(=C(C=C1Cl)I)Br B181605 [1,1,0,0,0,0|2,0,0]=4 1735 B9R1.69 C1=CC(=C(C=C1Cl)I)Cl D135761 [1,1,0,0,0,0|2,0,0]=4 1736 B9R1.69 C1=CC(=C(C=C1Cl)I)N C124466 [1,1,0,0,0,0|2,0,0]=4 1737 B9R1.69 C1=CC(=C(C=C1Cl)I)O C153519 [1,1,0,0,0,0|1,0,0]=3 1738 B9R1.69 C1=CC(=C(C=C1Cl)N)Br B135902 [1,1,0,0,0,0|2,0,0]=4 1739 B9R1.69 C1=CC(=C(C=C1Cl)N)Cl D103985 [1,1,0,0,0,0|2,0,0]=4 1740 B9R1.69 C1=CC(=C(C=C1Cl)N)Cl D141227 [1,1,0,0,0,0|2,0,0]=4 1741 B9R1.69 C1=CC(=C(C=C1Cl)N)F C122488 [1,1,0,0,0,0|2,0,0]=4 1742 B9R1.69 C1=CC(=C(C=C1Cl)N)I C122523 [1,1,0,0,0,0|2,0,0]=4 1743 B9R1.69 C1=CC(=C(C=C1Cl)N)N C122655 [1,1,0,0,0,0|2,0,0]=4 1744 B9R1.69 C1=CC(=C(C=C1Cl)N)O A107175 [1,1,0,0,0,0|1,0,0]=3 1745 B9R1.69 C1=CC(=C(C=C1Cl)N)S A101758 [1,1,0,0,0,0|1,1,0]=4 1746 B9R1.69 C1=CC(=C(C=C1Cl)O)Br B181326 [1,1,0,0,0,0|2,0,0]=4 1747 B9R1.69 C1=CC(=C(C=C1Cl)O)Cl D106518 [1,1,0,0,0,0|2,0,0]=4 1748 B9R1.69 C1=CC(=C(C=C1Cl)O)Cl D106519 [1,1,0,0,0,0|2,0,0]=4 1749 B9R1.69 C1=CC(=C(C=C1Cl)O)F C182325 [1,1,0,0,0,0|2,0,0]=4 1750 B9R1.69 C1=CC(=C(C=C1Cl)O)N A169264 [1,1,0,0,0,0|2,0,0]=4 1751 B9R1.69 C1=CC(=C(C=C1Cl)O)O C153242 [1,1,0,0,0,0|1,0,0]=3 1752 B9R1.69 C1=CC(=C(C=C1Cl)S)Cl D101770 [1,1,0,0,0,0|2,0,0]=4 1753 B9R1.69 C1=CC(=C(C=C1Cl)S)N A183043 [1,1,0,0,0,0|2,0,0]=4 1754 B9R1.69 C1=CC(=C(C=C1F)Br)Br D155246 [1,1,0,0,0,0|2,0,0]=4 1755 B9R1.69 C1=CC(=C(C=C1F)Br)Cl B122629 [1,1,0,0,0,0|2,0,0]=4 1756 B9R1.69 C1=CC(=C(C=C1F)Br)F B152646 [1,1,0,0,0,0|2,0,0]=4 1757 B9R1.69 C1=CC(=C(C=C1F)Br)I B152643 [1,1,0,0,0,0|2,0,0]=4 1758 B9R1.69 C1=CC(=C(C=C1F)Br)N B124495 [1,1,0,0,0,0|2,0,0]=4 1759 B9R1.69 C1=CC(=C(C=C1F)Br)O B101654 [1,1,0,0,0,0|1,0,0]=3 1760 B9R1.69 C1=CC(=C(C=C1F)Cl)Br B152639 [1,1,0,0,0,0|2,0,0]=4 1761 B9R1.69 C1=CC(=C(C=C1F)Cl)Cl D120633 [1,1,0,0,0,0|2,0,0]=4 1762 B9R1.69 C1=CC(=C(C=C1F)Cl)F C133122 [1,1,0,0,0,0|2,0,0]=4 1763 B9R1.69 C1=CC(=C(C=C1F)Cl)N C124474 [1,1,0,0,0,0|2,0,0]=4 1764 B9R1.69 C1=CC(=C(C=C1F)Cl)O C124476 [1,1,0,0,0,0|1,0,0]=3 1765 B9R1.69 C1=CC(=C(C=C1F)F)Br B101610 [1,1,0,0,0,0|2,0,0]=4 1766 B9R1.69 C1=CC(=C(C=C1F)F)Cl C154104 [1,1,0,0,0,0|2,0,0]=4 1767 B9R1.69 C1=CC(=C(C=C1F)F)F T161823 [1,1,0,0,0,0|2,0,0]=4 1768 B9R1.69 C1=CC(=C(C=C1F)F)I D121034 [1,1,0,0,0,0|2,0,0]=4 1769 B9R1.69 C1=CC(=C(C=C1F)F)N D135481 [1,1,0,0,0,0|2,0,0]=4 1770 B9R1.69 C1=CC(=C(C=C1F)F)O D120804 [1,1,0,0,0,0|1,0,0]=3 1771 B9R1.69 C1=CC(=C(C=C1F)F)S D101762 [1,1,0,0,0,0|1,1,0]=4 1772 B9R1.69 C1=CC(=C(C=C1F)I)Br W132543 [1,1,0,0,0,0|2,0,0]=4 1773 B9R1.69 C1=CC(=C(C=C1F)I)Cl C480720 [1,1,0,0,0,0|2,0,0]=4 1774 B9R1.69 C1=CC(=C(C=C1F)I)F D155245 [1,1,0,0,0,0|2,0,0]=4 1775 B9R1.69 C1=CC(=C(C=C1F)I)N F156710 [1,1,0,0,0,0|2,0,0]=4 1776 B9R1.69 C1=CC(=C(C=C1F)I)O F192457 [1,1,0,0,0,0|1,0,0]=3 1777 B9R1.69 C1=CC(=C(C=C1F)N)Br B104223 [1,1,0,0,0,0|2,0,0]=4 1778 B9R1.69 C1=CC(=C(C=C1F)N)Cl C122485 [1,1,0,0,0,0|2,0,0]=4 1779 B9R1.69 C1=CC(=C(C=C1F)N)F D155252 [1,1,0,0,0,0|2,0,0]=4 1780 B9R1.69 C1=CC(=C(C=C1F)N)I F122495 [1,1,0,0,0,0|2,0,0]=4 1781 B9R1.69 C1=CC(=C(C=C1F)N)N F129142 [1,1,0,0,0,0|2,0,0]=4 1782 B9R1.69 C1=CC(=C(C=C1F)N)O A124264 [1,1,0,0,0,0|1,0,0]=3 1783 B9R1.69 C1=CC(=C(C=C1F)O)Br B120807 [1,1,0,0,0,0|2,0,0]=4 1784 B9R1.69 C1=CC(=C(C=C1F)O)F D122593 [1,1,0,0,0,0|2,0,0]=4 1785 B9R1.69 C1=CC(=C(C=C1F)O)N A122546 [1,1,0,0,0,0|2,0,0]=4 1786 B9R1.69 C1=CC(=C(C=C1I)Br)Br D404265 [1,1,0,0,0,0|2,0,0]=4 1787 B9R1.69 C1=CC(=C(C=C1I)Br)Cl B183644 [1,1,0,0,0,0|2,0,0]=4 1788 B9R1.69 C1=CC(=C(C=C1I)Br)F B186720 [1,1,0,0,0,0|2,0,0]=4 1789 B9R1.69 C1=CC(=C(C=C1I)Br)N B183496 [1,1,0,0,0,0|2,0,0]=4 1790 B9R1.69 C1=CC(=C(C=C1I)Cl)Br B185063 [1,1,0,0,0,0|2,0,0]=4 1791 B9R1.69 C1=CC(=C(C=C1I)Cl)Cl D122906 [1,1,0,0,0,0|2,0,0]=4 1792 B9R1.69 C1=CC(=C(C=C1I)Cl)F W132261 [1,1,0,0,0,0|2,0,0]=4 1793 B9R1.69 C1=CC(=C(C=C1I)Cl)N C153882 [1,1,0,0,0,0|2,0,0]=4 1794 B9R1.69 C1=CC(=C(C=C1I)Cl)O C573565 [1,1,0,0,0,0|1,0,0]=3 1795 B9R1.69 C1=CC(=C(C=C1I)F)Br B115513 [1,1,0,0,0,0|2,0,0]=4 1796 B9R1.69 C1=CC(=C(C=C1I)F)Cl C191932 [1,1,0,0,0,0|2,0,0]=4 1797 B9R1.69 C1=CC(=C(C=C1I)F)F D115538 [1,1,0,0,0,0|2,0,0]=4 1798 B9R1.69 C1=CC(=C(C=C1I)F)I F587320 [1,1,0,0,0,0|2,0,0]=4 1799 B9R1.69 C1=CC(=C(C=C1I)F)N F103156 [1,1,0,0,0,0|2,0,0]=4 1800 B9R1.69 C1=CC(=C(C=C1I)F)O F588508 [1,1,0,0,0,0|1,0,0]=3 1801 B9R1.69 C1=CC(=C(C=C1I)O)Br B590757 [1,1,0,0,0,0|2,0,0]=4 1802 B9R1.69 C1=CC(=C(C=C1I)O)Cl C183453 [1,1,0,0,0,0|2,0,0]=4 1803 B9R1.69 C1=CC(=C(C=C1N)Br)Cl B124252 [1,1,0,0,0,0|2,0,0]=4 1804 B9R1.69 C1=CC(=C(C=C1N)Br)F B122474 [1,1,0,0,0,0|2,0,0]=4 1805 B9R1.69 C1=CC(=C(C=C1N)Br)I B187197 [1,1,0,0,0,0|2,0,0]=4 1806 B9R1.69 C1=CC(=C(C=C1N)Br)N B586996 [1,1,0,0,0,0|2,0,0]=4 1807 B9R1.69 C1=CC(=C(C=C1N)Br)O A124279 [1,1,0,0,0,0|1,0,0]=3 1808 B9R1.69 C1=CC(=C(C=C1N)Cl)Br B122508 [1,1,0,0,0,0|2,0,0]=4 1809 B9R1.69 C1=CC(=C(C=C1N)Cl)Br B122509 [1,1,0,0,0,0|2,0,0]=4 1810 B9R1.69 C1=CC(=C(C=C1N)Cl)Cl D113551 [1,1,0,0,0,0|2,0,0]=4 1811 B9R1.69 C1=CC(=C(C=C1N)Cl)Cl D113552 [1,1,0,0,0,0|2,0,0]=4 1812 B9R1.69 C1=CC(=C(C=C1N)Cl)F C106553 [1,1,0,0,0,0|2,0,0]=4 1813 B9R1.69 C1=CC(=C(C=C1N)Cl)F C106554 [1,1,0,0,0,0|2,0,0]=4 1814 B9R1.69 C1=CC(=C(C=C1N)Cl)I C138172 [1,1,0,0,0,0|2,0,0]=4 1815 B9R1.69 C1=CC(=C(C=C1N)Cl)N C134388 [1,1,0,0,0,0|2,0,0]=4 1816 B9R1.69 C1=CC(=C(C=C1N)Cl)N C153793 [1,1,0,0,0,0|2,0,0]=4 1817 B9R1.69 C1=CC(=C(C=C1N)Cl)O A151243 [1,1,0,0,0,0|1,0,0]=3 1818 B9R1.69 C1=CC(=C(C=C1N)Cl)O A406730 [1,1,0,0,0,0|1,0,0]=3 1819 B9R1.69 C1=CC(=C(C=C1N)F)Br B124324 [1,1,0,0,0,0|2,0,0]=4 1820 B9R1.69 C1=CC(=C(C=C1N)F)Cl C120498 [1,1,0,0,0,0|2,0,0]=4 1821 B9R1.69 C1=CC(=C(C=C1N)F)F D155253 [1,1,0,0,0,0|2,0,0]=4 1822 B9R1.69 C1=CC(=C(C=C1N)F)N F167391 [1,1,0,0,0,0|2,0,0]=4 1823 B9R1.69 C1=CC(=C(C=C1N)I)Cl C194015 [1,1,0,0,0,0|2,0,0]=4 1824 B9R1.69 C1=CC(=C(C=C1N)I)O A464039 [1,1,0,0,0,0|1,0,0]=3 1825 B9R1.69 C1=CC(=C(C=C1N)N)Cl C134670 [1,1,0,0,0,0|2,0,0]=4 1826 B9R1.69 C1=CC(=C(C=C1N)N)F F122661 [1,1,0,0,0,0|2,0,0]=4 1827 B9R1.69 C1=CC(=C(C=C1N)N)N T162209 [1,1,0,0,0,0|2,0,0]=4 1828 B9R1.69 C1=CC(=C(C=C1N)N)O A151245 [1,1,0,0,0,0|1,0,0]=3 1829 B9R1.69 C1=CC(=C(C=C1N)N)O A151538 [1,1,0,0,0,0|1,0,0]=3 1830 B9R1.69 C1=CC(=C(C=C1N)N)O D154509 [1,1,0,0,0,0|1,0,0]=3 1831 B9R1.69 C1=CC(=C(C=C1N)O)Cl A139126 [1,1,0,0,0,0|2,0,0]=4 1832 B9R1.69 C1=CC(=C(C=C1N)O)O A191179 [1,1,0,0,0,0|1,0,0]=3 1833 B9R1.69 C1=CC(=C(C=C1O)Br)Cl B181327 [1,1,0,0,0,0|1,0,0]=3 1834 B9R1.69 C1=CC(=C(C=C1O)Br)F B137152 [1,1,0,0,0,0|1,0,0]=3 1835 B9R1.69 C1=CC(=C(C=C1O)Br)I B573584 [1,1,0,0,0,0|1,0,0]=3 1836 B9R1.69 C1=CC(=C(C=C1O)Br)O B153212 [1,1,0,0,0,0|1,0,0]=3 1837 B9R1.69 C1=CC(=C(C=C1O)Cl)Br B123471 [1,1,0,0,0,0|1,0,0]=3 1838 B9R1.69 C1=CC(=C(C=C1O)Cl)Cl D106520 [1,1,0,0,0,0|1,0,0]=3 1839 B9R1.69 C1=CC(=C(C=C1O)Cl)Cl D106521 [1,1,0,0,0,0|1,0,0]=3 1840 B9R1.69 C1=CC(=C(C=C1O)Cl)F C120812 [1,1,0,0,0,0|1,0,0]=3 1841 B9R1.69 C1=CC(=C(C=C1O)Cl)N A121105 [1,1,0,0,0,0|1,0,0]=3 1842 B9R1.69 C1=CC(=C(C=C1O)Cl)N A191581 [1,1,0,0,0,0|1,0,0]=3 1843 B9R1.69 C1=CC(=C(C=C1O)Cl)O C133523 [1,1,0,0,0,0|1,0,0]=3 1844 B9R1.69 C1=CC(=C(C=C1O)F)Br B120805 [1,1,0,0,0,0|1,0,0]=3 1845 B9R1.69 C1=CC(=C(C=C1O)F)Cl C122588 [1,1,0,0,0,0|1,0,0]=3 1846 B9R1.69 C1=CC(=C(C=C1O)F)F D120810 [1,1,0,0,0,0|1,0,0]=3 1847 B9R1.69 C1=CC(=C(C=C1O)F)I F190218 [1,1,0,0,0,0|1,0,0]=3 1848 B9R1.69 C1=CC(=C(C=C1O)F)N A122547 [1,1,0,0,0,0|1,0,0]=3 1849 B9R1.69 C1=CC(=C(C=C1O)F)N F182266 [1,1,0,0,0,0|1,0,0]=3 1850 B9R1.69 C1=CC(=C(C=C1O)N)Br A178691 [1,1,0,0,0,0|1,0,0]=3 1851 B9R1.69 C1=CC(=C(C=C1O)N)Cl W132659 [1,1,0,0,0,0|1,0,0]=3 1852 B9R1.69 C1=CC(=C(C=C1O)N)F A137308 [1,1,0,0,0,0|1,0,0]=3 1853 B9R1.69 C1=CC(=C(C=C1O)O)Br B133544 [1,1,0,0,0,0|1,0,0]=3 1854 B9R1.69 C1=CC(=C(C=C1O)O)Cl C128535 [1,1,0,0,0,0|1,0,0]=3 1855 B9R1.69 C1=CC(=C(C=C1O)O)F F131375 [1,1,0,0,0,0|1,0,0]=3 1856 B9R1.69 C1=CC(=C(C=C1O)O)O B107437 [1,1,0,0,0,0|1,0,0]=3 1857 B9R1.69 C1=CC(=C(C=C1S)Cl)Cl D155420 [1,1,0,0,0,0|1,1,0]=4 1858 B9R1.69 C1=CC(=C(C=C1S)F)F D101763 [1,1,0,0,0,0|1,1,0]=4 1859 B9R1.69 C1=CC(=NC(=C1O)Br)Br D404198 [1,1,0,0,0,0|2,0,0]=4 1860 B9R1.69 C1=CC(=NC(=C1O)Br)I B166870 [1,1,0,0,0,0|2,0,0]=4 1861 B9R1.69 C1=CC(=NC(=C1O)Cl)I C168119 [1,1,0,0,0,0|2,0,0]=4 1862 B9R1.69 C1=CC(=NC(=C1O)F)Cl C195520 [1,1,0,0,0,0|2,0,0]=4 1863 B9R1.69 C1=CC(=NC(=C1O)I)Cl C153942 [1,1,0,0,0,0|2,0,0]=4 1864 B9R1.69 C1=CC(=O)C(=CC1=O)Cl C112976 [1,1,0,0,0,0|1,0,1]=4 1865 B9R1.69 CC1=C(C=C(C=C1)Br)Br D123561 [1,1,0,0,0,0|1,0,1]=4 1866 B9R1.69 CC1=C(C=C(C=C1)Br)C B101675 [1,1,0,0,0,0|1,0,1]=4 1867 B9R1.69 CC1=C(C=C(C=C1)Br)C B101676 [1,1,0,0,0,0|1,0,1]=4 1868 B9R1.69 CC1=C(C=C(C=C1)Br)Cl B304851 [1,1,0,0,0,0|1,0,1]=4 1869 B9R1.69 CC1=C(C=C(C=C1)Br)F B120745 [1,1,0,0,0,0|1,0,1]=4 1870 B9R1.69 CC1=C(C=C(C=C1)Br)I B588468 [1,1,0,0,0,0|1,0,1]=4 1871 B9R1.69 CC1=C(C=C(C=C1)Br)N B122515 [1,1,0,0,0,0|1,0,1]=4 1872 B9R1.69 CC1=C(C=C(C=C1)Br)O B124288 [1,1,0,0,0,0|1,0,1]=4 1873 B9R1.69 CC1=C(C=C(C=C1)Cl)Br B405162 [1,1,0,0,0,0|1,0,1]=4 1874 B9R1.69 CC1=C(C=C(C=C1)Cl)C C113569 [1,1,0,0,0,0|1,0,1]=4 1875 B9R1.69 CC1=C(C=C(C=C1)Cl)Cl D104648 [1,1,0,0,0,0|1,0,1]=4 1876 B9R1.69 CC1=C(C=C(C=C1)Cl)Cl D104649 [1,1,0,0,0,0|1,0,1]=4 1877 B9R1.69 CC1=C(C=C(C=C1)Cl)F C120759 [1,1,0,0,0,0|1,0,1]=4 1878 B9R1.69 CC1=C(C=C(C=C1)Cl)I C588753 [1,1,0,0,0,0|1,0,1]=4 1879 B9R1.69 CC1=C(C=C(C=C1)Cl)N C106532 [1,1,0,0,0,0|1,0,1]=4 1880 B9R1.69 CC1=C(C=C(C=C1)Cl)N C153903 [1,1,0,0,0,0|1,0,1]=4 1881 B9R1.69 CC1=C(C=C(C=C1)Cl)O C135000 [1,1,0,0,0,0|1,0,1]=4 1882 B9R1.69 CC1=C(C=C(C=C1)F)Br B120722 [1,1,0,0,0,0|1,0,1]=4 1883 B9R1.69 CC1=C(C=C(C=C1)F)C F124479 [1,1,0,0,0,0|1,0,1]=4 1884 B9R1.69 CC1=C(C=C(C=C1)F)Cl C120753 [1,1,0,0,0,0|1,0,1]=4 1885 B9R1.69 CC1=C(C=C(C=C1)F)F D120697 [1,1,0,0,0,0|1,0,1]=4 1886 B9R1.69 CC1=C(C=C(C=C1)F)I F122782 [1,1,0,0,0,0|1,0,1]=4 1887 B9R1.69 CC1=C(C=C(C=C1)F)N F120718 [1,1,0,0,0,0|1,0,1]=4 1888 B9R1.69 CC1=C(C=C(C=C1)F)O F124289 [1,1,0,0,0,0|1,0,1]=4 1889 B9R1.69 CC1=C(C=C(C=C1)I)C D123657 [1,1,0,0,0,0|1,0,1]=4 1890 B9R1.69 CC1=C(C=C(C=C1)I)Cl C186838 [1,1,0,0,0,0|1,0,1]=4 1891 B9R1.69 CC1=C(C=C(C=C1)I)F F122778 [1,1,0,0,0,0|1,0,1]=4 1892 B9R1.69 CC1=C(C=C(C=C1)I)N I113818 [1,1,0,0,0,0|1,0,1]=4 1893 B9R1.69 CC1=C(C=C(C=C1)N)Br B122480 [1,1,0,0,0,0|1,0,1]=4 1894 B9R1.69 CC1=C(C=C(C=C1)N)C D113394 [1,1,0,0,0,0|1,0,1]=4 1895 B9R1.69 CC1=C(C=C(C=C1)N)Cl C106530 [1,1,0,0,0,0|1,0,1]=4 1896 B9R1.69 CC1=C(C=C(C=C1)N)Cl C106531 [1,1,0,0,0,0|1,0,1]=4 1897 B9R1.69 CC1=C(C=C(C=C1)N)F F122497 [1,1,0,0,0,0|1,0,1]=4 1898 B9R1.69 CC1=C(C=C(C=C1)N)I I157695 [1,1,0,0,0,0|1,0,1]=4 1899 B9R1.69 CC1=C(C=C(C=C1)N)N D103648 [1,1,0,0,0,0|1,0,1]=4 1900 B9R1.69 CC1=C(C=C(C=C1)N)N D103649 [1,1,0,0,0,0|1,0,1]=4 1901 B9R1.69 CC1=C(C=C(C=C1)N)N D103650 [1,1,0,0,0,0|1,0,1]=4 1902 B9R1.69 CC1=C(C=C(C=C1)N)N D141204 [1,1,0,0,0,0|1,0,1]=4 1903 B9R1.69 CC1=C(C=C(C=C1)N)O A115492 [1,1,0,0,0,0|1,0,1]=4 1904 B9R1.69 CC1=C(C=C(C=C1)O)Br B185524 [1,1,0,0,0,0|0,0,1]=3 1905 B9R1.69 CC1=C(C=C(C=C1)O)C D104347 [1,1,0,0,0,0|0,0,1]=3 1906 B9R1.69 CC1=C(C=C(C=C1)O)C D117389 [1,1,0,0,0,0|0,0,1]=3 1907 B9R1.69 CC1=C(C=C(C=C1)O)Cl W136428 [1,1,0,0,0,0|0,0,1]=3 1908 B9R1.69 CC1=C(C=C(C=C1)O)F F124276 [1,1,0,0,0,0|0,0,1]=3 1909 B9R1.69 CC1=C(C=C(C=C1)O)N A183421 [1,1,0,0,0,0|0,0,1]=3 1910 B9R1.69 CC1=C(C=CC(=C1)Br)Br D123558 [1,1,0,0,0,0|2,0,0]=4 1911 B9R1.69 CC1=C(C=CC(=C1)Br)Cl B100861 [1,1,0,0,0,0|2,0,0]=4 1912 B9R1.69 CC1=C(C=CC(=C1)Br)F B120752 [1,1,0,0,0,0|2,0,0]=4 1913 B9R1.69 CC1=C(C=CC(=C1)Br)I B138065 [1,1,0,0,0,0|2,0,0]=4 1914 B9R1.69 CC1=C(C=CC(=C1)Br)N B100843 [1,1,0,0,0,0|2,0,0]=4 1915 B9R1.69 CC1=C(C=CC(=C1)Br)O B122703 [1,1,0,0,0,0|1,0,0]=3 1916 B9R1.69 CC1=C(C=CC(=C1)Cl)Br B131978 [1,1,0,0,0,0|2,0,0]=4 1917 B9R1.69 CC1=C(C=CC(=C1)Cl)Cl D113532 [1,1,0,0,0,0|2,0,0]=4 1918 B9R1.69 CC1=C(C=CC(=C1)Cl)Cl D113533 [1,1,0,0,0,0|2,0,0]=4 1919 B9R1.69 CC1=C(C=CC(=C1)Cl)F C120762 [1,1,0,0,0,0|2,0,0]=4 1920 B9R1.69 CC1=C(C=CC(=C1)Cl)I C136132 [1,1,0,0,0,0|2,0,0]=4 1921 B9R1.69 CC1=C(C=CC(=C1)Cl)N C111298 [1,1,0,0,0,0|2,0,0]=4 1922 B9R1.69 CC1=C(C=CC(=C1)Cl)N C111299 [1,1,0,0,0,0|2,0,0]=4 1923 B9R1.69 CC1=C(C=CC(=C1)Cl)N C153905 [1,1,0,0,0,0|2,0,0]=4 1924 B9R1.69 CC1=C(C=CC(=C1)Cl)O C153523 [1,1,0,0,0,0|1,0,0]=3 1925 B9R1.69 CC1=C(C=CC(=C1)F)Br B120723 [1,1,0,0,0,0|2,0,0]=4 1926 B9R1.69 CC1=C(C=CC(=C1)F)Cl C133805 [1,1,0,0,0,0|2,0,0]=4 1927 B9R1.69 CC1=C(C=CC(=C1)F)F D120698 [1,1,0,0,0,0|2,0,0]=4 1928 B9R1.69 CC1=C(C=CC(=C1)F)I F185888 [1,1,0,0,0,0|2,0,0]=4 1929 B9R1.69 CC1=C(C=CC(=C1)F)N F120709 [1,1,0,0,0,0|2,0,0]=4 1930 B9R1.69 CC1=C(C=CC(=C1)F)O F120816 [1,1,0,0,0,0|1,0,0]=3 1931 B9R1.69 CC1=C(C=CC(=C1)I)Br B132710 [1,1,0,0,0,0|2,0,0]=4 1932 B9R1.69 CC1=C(C=CC(=C1)I)Cl C166182 [1,1,0,0,0,0|2,0,0]=4 1933 B9R1.69 CC1=C(C=CC(=C1)I)F F122779 [1,1,0,0,0,0|2,0,0]=4 1934 B9R1.69 CC1=C(C=CC(=C1)I)N I111882 [1,1,0,0,0,0|2,0,0]=4 1935 B9R1.69 CC1=C(C=CC(=C1)I)O I343177 [1,1,0,0,0,0|1,0,0]=3 1936 B9R1.69 CC1=C(C=CC(=C1)N)Br B134726 [1,1,0,0,0,0|2,0,0]=4 1937 B9R1.69 CC1=C(C=CC(=C1)N)Cl C133999 [1,1,0,0,0,0|2,0,0]=4 1938 B9R1.69 CC1=C(C=CC(=C1)N)F F120715 [1,1,0,0,0,0|2,0,0]=4 1939 B9R1.69 CC1=C(C=CC(=C1)N)I I590928 [1,1,0,0,0,0|2,0,0]=4 1940 B9R1.69 CC1=C(C=CC(=C1)N)N D121697 [1,1,0,0,0,0|2,0,0]=4 1941 B9R1.69 CC1=C(C=CC(=C1)N)N D154484 [1,1,0,0,0,0|2,0,0]=4 1942 B9R1.69 CC1=C(C=CC(=C1)O)Br B124282 [1,1,0,0,0,0|1,0,0]=3 1943 B9R1.69 CC1=C(C=CC(=C1)O)Cl C103588 [1,1,0,0,0,0|1,0,0]=3 1944 B9R1.69 CC1=C(C=CC(=C1)O)Cl C103589 [1,1,0,0,0,0|1,0,0]=3 1945 B9R1.69 CC1=C(C=CC(=C1)O)Cl C128189 [1,1,0,0,0,0|1,0,0]=3 1946 B9R1.69 CC1=C(C=CC(=C1)O)F F120819 [1,1,0,0,0,0|1,0,0]=3 1947 B9R1.69 CC1=C(C=CC(=C1)O)I I181231 [1,1,0,0,0,0|1,0,0]=3 1948 B9R1.69 CC1=C(C=CC(=C1)O)N A121773 [1,1,0,0,0,0|1,0,0]=3 1949 B9R1.69 CC1=C(C=CC(=C1)O)O M109541 [1,1,0,0,0,0|1,0,0]=3 1950 B9R1.69 CC1=C(C=CC(=N1)Br)O B189928 [1,1,0,0,0,0|2,0,0]=4 1951 B9R1.69 CC1=C(C=CC(=N1)Cl)O C588169 [1,1,0,0,0,0|2,0,0]=4 1952 B9R1.69 CC1=CC(=C(C=C1)Br)Br D123553 [1,1,0,0,0,0|1,0,1]=4 1953 B9R1.69 CC1=CC(=C(C=C1)Br)C B101634 [1,1,0,0,0,0|1,0,1]=4 1954 B9R1.69 CC1=CC(=C(C=C1)Br)Cl B185889 [1,1,0,0,0,0|1,0,1]=4 1955 B9R1.69 CC1=CC(=C(C=C1)Br)F B120751 [1,1,0,0,0,0|1,0,1]=4 1956 B9R1.69 CC1=CC(=C(C=C1)Br)I B195363 [1,1,0,0,0,0|1,0,1]=4 1957 B9R1.69 CC1=CC(=C(C=C1)Br)N W136366 [1,1,0,0,0,0|1,0,1]=4 1958 B9R1.69 CC1=CC(=C(C=C1)Br)O D302938 [1,1,0,0,0,0|1,0,1]=4 1959 B9R1.69 CC1=CC(=C(C=C1)C)Br D107975 [1,1,0,0,0,0|1,0,1]=4 1960 B9R1.69 CC1=CC(=C(C=C1)C)C T110885 [1,1,0,0,0,0|1,0,1]=4 1961 B9R1.69 CC1=CC(=C(C=C1)C)C T110887 [1,1,0,0,0,0|1,0,1]=4 1962 B9R1.69 CC1=CC(=C(C=C1)C)C T110888 [1,1,0,0,0,0|1,0,1]=4 1963 B9R1.69 CC1=CC(=C(C=C1)C)C T128160 [1,1,0,0,0,0|1,0,1]=4 1964 B9R1.69 CC1=CC(=C(C=C1)C)Cl C122701 [1,1,0,0,0,0|1,0,1]=4 1965 B9R1.69 CC1=CC(=C(C=C1)C)F F186090 [1,1,0,0,0,0|1,0,1]=4 1966 B9R1.69 CC1=CC(=C(C=C1)C)N D106348 [1,1,0,0,0,0|1,0,1]=4 1967 B9R1.69 CC1=CC(=C(C=C1)C)O D104331 [1,1,0,0,0,0|1,0,1]=4 1968 B9R1.69 CC1=CC(=C(C=C1)C)O D104332 [1,1,0,0,0,0|1,0,1]=4 1969 B9R1.69 CC1=CC(=C(C=C1)C)O D117388 [1,1,0,0,0,0|1,0,1]=4 1970 B9R1.69 CC1=CC(=C(C=C1)C)S D101775 [1,1,0,0,0,0|1,0,1]=4 1971 B9R1.69 CC1=CC(=C(C=C1)Cl)Br B185302 [1,1,0,0,0,0|1,0,1]=4 1972 B9R1.69 CC1=CC(=C(C=C1)Cl)C C405487 [1,1,0,0,0,0|1,0,1]=4 1973 B9R1.69 CC1=CC(=C(C=C1)Cl)Cl D100626 [1,1,0,0,0,0|1,0,1]=4 1974 B9R1.69 CC1=CC(=C(C=C1)Cl)Cl D100627 [1,1,0,0,0,0|1,0,1]=4 1975 B9R1.69 CC1=CC(=C(C=C1)Cl)F C121012 [1,1,0,0,0,0|1,0,1]=4 1976 B9R1.69 CC1=CC(=C(C=C1)Cl)N C153907 [1,1,0,0,0,0|1,0,1]=4 1977 B9R1.69 CC1=CC(=C(C=C1)Cl)O C153524 [1,1,0,0,0,0|1,0,1]=4 1978 B9R1.69 CC1=CC(=C(C=C1)F)Br B120742 [1,1,0,0,0,0|1,0,1]=4 1979 B9R1.69 CC1=CC(=C(C=C1)F)Cl C181666 [1,1,0,0,0,0|1,0,1]=4 1980 B9R1.69 CC1=CC(=C(C=C1)F)F D120699 [1,1,0,0,0,0|1,0,1]=4 1981 B9R1.69 CC1=CC(=C(C=C1)F)I F122783 [1,1,0,0,0,0|1,0,1]=4 1982 B9R1.69 CC1=CC(=C(C=C1)F)N F113848 [1,1,0,0,0,0|1,0,1]=4 1983 B9R1.69 CC1=CC(=C(C=C1)F)O F124272 [1,1,0,0,0,0|1,0,1]=4 1984 B9R1.69 CC1=CC(=C(C=C1)I)Br B186225 [1,1,0,0,0,0|1,0,1]=4 1985 B9R1.69 CC1=CC(=C(C=C1)I)C I157574 [1,1,0,0,0,0|1,0,1]=4 1986 B9R1.69 CC1=CC(=C(C=C1)I)F W134166 [1,1,0,0,0,0|1,0,1]=4 1987 B9R1.69 CC1=CC(=C(C=C1)I)N I181158 [1,1,0,0,0,0|1,0,1]=4 1988 B9R1.69 CC1=CC(=C(C=C1)N)Br B139034 [1,1,0,0,0,0|1,0,1]=4 1989 B9R1.69 CC1=CC(=C(C=C1)N)C D105631 [1,1,0,0,0,0|1,0,1]=4 1990 B9R1.69 CC1=CC(=C(C=C1)N)C D105632 [1,1,0,0,0,0|1,0,1]=4 1991 B9R1.69 CC1=CC(=C(C=C1)N)C D154317 [1,1,0,0,0,0|1,0,1]=4 1992 B9R1.69 CC1=CC(=C(C=C1)N)Cl C133948 [1,1,0,0,0,0|1,0,1]=4 1993 B9R1.69 CC1=CC(=C(C=C1)N)F F120702 [1,1,0,0,0,0|1,0,1]=4 1994 B9R1.69 CC1=CC(=C(C=C1)N)I I183480 [1,1,0,0,0,0|1,0,1]=4 1995 B9R1.69 CC1=CC(=C(C=C1)N)N D106442 [1,1,0,0,0,0|1,0,1]=4 1996 B9R1.69 CC1=CC(=C(C=C1)N)N D106444 [1,1,0,0,0,0|1,0,1]=4 1997 B9R1.69 CC1=CC(=C(C=C1)N)O A121774 [1,1,0,0,0,0|1,0,1]=4 1998 B9R1.69 CC1=CC(=C(C=C1)O)Br B124659 [1,1,0,0,0,0|0,0,1]=3 1999 B9R1.69 CC1=CC(=C(C=C1)O)Br B141113 [1,1,0,0,0,0|0,0,1]=3 2000 B9R1.69 CC1=CC(=C(C=C1)O)C D112715 [1,1,0,0,0,0|0,0,1]=3 2001 B9R1.69 CC1=CC(=C(C=C1)O)C D117387 [1,1,0,0,0,0|0,0,1]=3 2002 B9R1.69 CC1=CC(=C(C=C1)O)C D472061 [1,1,0,0,0,0|0,0,1]=3 2003 B9R1.69 CC1=CC(=C(C=C1)O)Cl C134527 [1,1,0,0,0,0|0,0,1]=3 2004 B9R1.69 CC1=CC(=C(C=C1)O)F F133446 [1,1,0,0,0,0|0,0,1]=3 2005 B9R1.69 CC1=CC(=C(C=C1)O)I I305091 [1,1,0,0,0,0|0,0,1]=3 2006 B9R1.69 CC1=CC(=C(C=C1)O)N A107257 [1,1,0,0,0,0|0,0,1]=3 2007 B9R1.69 CC1=CC(=C(C=C1)O)O M108038 [1,1,0,0,0,0|0,0,1]=3 2008 B9R1.69 CC1=CC(=C(C=C1)S)C D101774 [1,1,0,0,0,0|0,1,1]=4 2009 B9R1.69 CC1=CC(=C(C=C1)S)S T113451 [1,1,0,0,0,0|0,1,1]=4 2010 B9R1.69 CC1=CC(=C(C=N1)O)Br B586814 [1,1,0,0,0,0|1,0,1]=4 2011 B9R1.69 CC1=CC(=CN=C1Br)O B178697 [1,1,0,0,0,0|2,0,0]=4 2012 B9R1.69 CC1=CC(=CN=C1Cl)O C193845 [1,1,0,0,0,0|2,0,0]=4 2013 B9R1.69 CC1=CC(=CN=C1F)O F587834 [1,1,0,0,0,0|2,0,0]=4 2014 B9R1.69 CC1=CC(=O)C=CC1=O I135188 [1,1,0,0,0,0|1,0,1]=4 2015 B9R1.69 CC1=NC(=C(C=C1)O)Br B183008 [1,1,0,0,0,0|1,0,1]=4 2016 B9R1.69 CC1=NC(=C(C=C1)O)I H121812 [1,1,0,0,0,0|1,0,1]=4 2017 B9R1.69 CC1=NC(=C(C=C1)O)N A191936 [1,1,0,0,0,0|1,0,1]=4 2018 B9R1.69 Clc1ccc(Cl)c(Cl)c1 T117379 [1,1,0,0,0,0|2,0,0]=4 2019 B9R1.69 Clc1ccc(Cl)c(Cl)c1 T117380 [1,1,0,0,0,0|2,0,0]=4 2020 B9R1.69 Clc1ccc(Cl)c(Cl)c1 T128176 [1,1,0,0,0,0|2,0,0]=4 2021 B9R1.69 Oc1ccc(Cl)cc1Cl D104291 [1,1,0,0,0,0|1,0,0]=3 2022 B9R1.21 C1=C(OC(=C1)C=O)CO H106322 [0,1,0,0,1,0|2,0,0]=4 2023 B9R1.21 C1=C(OC(=C1)C=O)CO H106323 [0,1,0,0,1,0|2,0,0]=4 2024 B9R1.21 C1=C(OC(=C1)C=O)CO H106324 [0,1,0,0,1,0|2,0,0]=4 2025 B9R1.21 C1=C(OC(=C1)C=O)CO H301743 [0,1,0,0,1,0|2,0,0]=4 2026 B9R1.21 C1=C(OC(=C1)C=O)CO H344404 [0,1,0,0,1,0|2,0,0]=4 2027 B9R1.21 C1=C(OC(=C1)C=O)CO H425395 [0,1,0,0,1,0|2,0,0]=4 2028 B9R1.21 COC1=CC=C(S1)C=O M588828 [0,1,0,0,1,0|2,0,0]=4 2029 B11R1.1 C1=CC(=CC=C1C=CC=O)Br T102188 [0,2,0,0,0,0|1,0,0]=3 2030 B11R1.1 C1=CC(=CC=C1C=CC=O)Cl E193580 [0,2,0,0,0,0|1,0,0]=3 2031 B11R1.1 C1=CC(=CC=C1C=CC=O)F F156576 [0,2,0,0,0,0|1,0,0]=3 2032 B11R1.1 C1=CC(=CC=C1CCCO)O W132591 [0,2,0,0,0,0|0,0,2]=4 2033 B11R1.1 CC1=CC=C(C=C1)C=CC=O E589502 [0,2,0,0,0,0|1,0,0]=3 2034 B11R1.1 CC1=CC=C(C=C1)OCC=C A151094 [0,2,0,0,0,0|1,0,0]=3 2035 B11R1.1 CCCCC1=CC=C(C=C1)O B152848 [0,2,0,0,0,0|0,0,2]=4 2036 B11R1.1 CCCOC1=CC=C(C=C1)O P132532 [0,2,0,0,0,0|0,0,2]=4 2037 B11R1.1 CCOCC1=CC=C(C=C1)O E194029 [0,2,0,0,0,0|0,0,2]=4 2038 B11R1.1 COCCC1=CC=C(C=C1)O M136398 [0,2,0,0,0,0|0,0,2]=4 2039 B11R1.20 C1=CC(=CC=C1C=C(Br)Br)Br B587080 [0,2,0,0,0,0|1,0,0]=3 2040 B11R1.20 C1=CC(=CC=C1CC(=O)Cl)Cl C153891 [0,2,0,0,0,0|1,0,1]=4 2041 B11R1.20 C1=CC(=CC=C1CC(=O)Cl)F F469238 [0,2,0,0,0,0|1,0,1]=4 2042 B11R1.20 C1=CC(=CC=C1CC(=O)N)O H117443 [0,2,0,0,0,0|0,0,1]=3 2043 B11R1.20 C1=CC(=CC=C1CC(=O)O)Br B101317 [0,2,0,0,0,0|1,0,1]=4 2044 B11R1.20 C1=CC(=CC=C1CC(=O)O)Cl C103600 [0,2,0,0,0,0|1,0,1]=4 2045 B11R1.20 C1=CC(=CC=C1CC(=O)O)F F115807 [0,2,0,0,0,0|1,0,1]=4 2046 B11R1.20 C1=CC(=CC=C1CC(=O)O)I I132292 [0,2,0,0,0,0|1,0,1]=4 2047 B11R1.20 C1=CC(=CC=C1CC(=O)O)N A110093 [0,2,0,0,0,0|1,0,1]=4 2048 B11R1.20 C1=CC(=CC=C1CC(=O)O)O H103972 [0,2,0,0,0,0|0,0,1]=3 2049 B11R1.20 C1=CC(=CC=C1CC(=O)O)O H421869 [0,2,0,0,0,0|0,0,1]=3 2050 B11R1.20 C1=CC(=CC=C1CC(=O)O)S M471020 [0,2,0,0,0,0|0,1,1]=4 2051 B11R1.20 C1=CC(=CC=C1N=C(N)N)Cl C287739 [0,2,0,0,0,0|2,0,0]=4 2052 B11R1.20 C1=CC(=CC=C1NC(=O)N)Br B152706 [0,2,0,0,0,0|2,0,0]=4 2053 B11R1.20 C1=CC(=CC=C1NC(=O)N)Cl C167191 [0,2,0,0,0,0|2,0,0]=4 2054 B11R1.20 C1=CC(=CC=C1NC(=O)N)F F156722 [0,2,0,0,0,0|2,0,0]=4 2055 B11R1.20 C1=CC(=CC=C1NC(=S)N)Br B152322 [0,2,0,0,0,0|2,0,0]=4 2056 B11R1.20 C1=CC(=CC=C1NC(=S)N)Cl C153740 [0,2,0,0,0,0|2,0,0]=4 2057 B11R1.20 C1=CC(=CC=C1NC(=S)N)F F101904 [0,2,0,0,0,0|2,0,0]=4 2058 B11R1.20 C1=CC(=CC=C1OC(=O)Cl)Cl C139256 [0,2,0,0,0,0|2,0,0]=4 2059 B11R1.20 C1=CC(=CC=C1OC(=O)Cl)F F193118 [0,2,0,0,0,0|2,0,0]=4 2060 B11R1.20 C1=CC(=CC=C1OC(=S)Cl)Cl C405485 [0,2,0,0,0,0|2,0,0]=4 2061 B11R1.20 C1=CC(=CC=C1OC(=S)Cl)F F140421 [0,2,0,0,0,0|2,0,0]=4 2062 B11R1.20 CC(=O)CC1=CC=C(C=C1)Br B133524 [0,2,0,0,0,0|1,0,1]=4 2063 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl C136193 [0,2,0,0,0,0|1,0,1]=4 2064 B11R1.20 CC(=O)CC1=CC=C(C=C1)F F123996 [0,2,0,0,0,0|1,0,1]=4 2065 B11R1.20 CC(=O)NC1=CC=C(C=C1)Br B152718 [0,2,0,0,0,0|1,0,1]=4 2066 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl C105638 [0,2,0,0,0,0|1,0,1]=4 2067 B11R1.20 CC(=O)NC1=CC=C(C=C1)F F124470 [0,2,0,0,0,0|1,0,1]=4 2068 B11R1.20 CC(=O)NC1=CC=C(C=C1)F F579463 [0,2,0,0,0,0|1,0,1]=4 2069 B11R1.20 CC(=O)NC1=CC=C(C=C1)I I135865 [0,2,0,0,0,0|1,0,1]=4 2070 B11R1.20 CC(=O)NC1=CC=C(C=C1)N A100947 [0,2,0,0,0,0|1,0,1]=4 2071 B11R1.20 CC(=O)NC1=CC=C(C=C1)O A105807 [0,2,0,0,0,0|0,0,1]=3 2072 B11R1.20 CC(=O)NC1=CC=C(C=C1)O A105808 [0,2,0,0,0,0|0,0,1]=3 2073 B11R1.20 CC(=O)NC1=CC=C(C=C1)O A105809 [0,2,0,0,0,0|0,0,1]=3 2074 B11R1.20 CC(=O)NC1=CC=C(C=C1)O A135872 [0,2,0,0,0,0|0,0,1]=3 2075 B11R1.20 CC(=O)NC1=CC=C(C=C1)O A136987 [0,2,0,0,0,0|0,0,1]=3 2076 B11R1.20 CC(=O)NC1=CC=C(C=C1)O A305928 [0,2,0,0,0,0|0,0,1]=3 2077 B11R1.20 CC(=O)NC1=CC=C(C=C1)S A100956 [0,2,0,0,0,0|0,1,1]=4 2078 B11R1.20 CC(=O)OC1=CC=C(C=C1)F A124503 [0,2,0,0,0,0|1,0,1]=4 2079 B11R1.20 CC(=O)OC1=CC=C(C=C1)O A588726 [0,2,0,0,0,0|0,0,1]=3 2080 B11R1.20 CC1=CC=C(C=C1)CC(=O)O T100785 [0,2,0,0,0,0|1,0,1]=4 2081 B11R1.20 CC1=CC=C(C=C1)NC(=O)C P160549 [0,2,0,0,0,0|1,0,1]=4 2082 B11R1.20 CC1=CC=C(C=C1)NC(=S)N P160446 [0,2,0,0,0,0|2,0,0]=4 2083 B11R1.20 CC1=CC=C(C=C1)OC(=O)C P160555 [0,2,0,0,0,0|1,0,1]=4 2084 B11R1.20 CC1=CC=C(C=C1)OC(=O)Cl P343127 [0,2,0,0,0,0|2,0,0]=4 2085 B11R1.22 C1=CC(=CC=C1C(=NO)N)Br E182421 [0,2,0,0,0,0|2,0,0]=4 2086 B11R1.22 C1=CC(=CC=C1C(=NO)N)Cl C589284 [0,2,0,0,0,0|2,0,0]=4 2087 B11R1.22 C1=CC(=CC=C1C(=NO)N)F F472588 [0,2,0,0,0,0|2,0,0]=4 2088 B11R1.22 C1=CC(=CC=C1C(=NO)N)N A169216 [0,2,0,0,0,0|2,0,0]=4 2089 B11R1.22 C1=CC(=CC=C1C(=O)C=O)Br B187187 [0,2,0,0,0,0|1,0,0]=3 2090 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Br D113568 [0,2,0,0,0,0|1,0,1]=4 2091 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Br D128625 [0,2,0,0,0,0|1,0,1]=4 2092 B11R1.22 C1=CC(=CC=C1C(=O)CBr)Cl B135176 [0,2,0,0,0,0|1,0,1]=4 2093 B11R1.22 C1=CC(=CC=C1C(=O)CBr)F B123244 [0,2,0,0,0,0|1,0,1]=4 2094 B11R1.22 C1=CC(=CC=C1C(=O)CBr)O B151940 [0,2,0,0,0,0|0,0,1]=3 2095 B11R1.22 C1=CC(=CC=C1C(=O)CCl)Br B122004 [0,2,0,0,0,0|1,0,1]=4 2096 B11R1.22 C1=CC(=CC=C1C(=O)CCl)F C138866 [0,2,0,0,0,0|1,0,1]=4 2097 B11R1.22 C1=CC(=CC=C1C(=O)CCl)O C123253 [0,2,0,0,0,0|0,0,1]=3 2098 B11R1.22 C1=CC(=CC=C1C(=O)CN)Br A136664 [0,2,0,0,0,0|1,0,1]=4 2099 B11R1.22 C1=CC(=CC=C1C(=O)CN)F A184615 [0,2,0,0,0,0|1,0,1]=4 2100 B11R1.22 C1=CC(=CC=C1C(=O)NN)Br B152172 [0,2,0,0,0,0|2,0,0]=4 2101 B11R1.22 C1=CC(=CC=C1C(=O)NN)Cl C153811 [0,2,0,0,0,0|2,0,0]=4 2102 B11R1.22 C1=CC(=CC=C1C(=O)NN)F F156619 [0,2,0,0,0,0|2,0,0]=4 2103 B11R1.22 C1=CC(=CC=C1C(=O)NN)N A151536 [0,2,0,0,0,0|2,0,0]=4 2104 B11R1.22 C1=CC(=CC=C1C(=O)NN)O H106356 [0,2,0,0,0,0|1,0,0]=3 2105 B11R1.22 C1=CC(=CC=C1C(CN)O)O O101521 [0,2,0,0,0,0|0,0,2]=4 2106 B11R1.22 CC(=NO)C1=CC=C(C=C1)O H157119 [0,2,0,0,0,0|0,0,1]=3 2107 B11R1.22 CC1=CC=C(C=C1)C(=NO)N M168234 [0,2,0,0,0,0|2,0,0]=4 2108 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr M113665 [0,2,0,0,0,0|1,0,1]=4 2109 B11R1.22 CC1=CC=C(C=C1)C(=O)NN M158580 [0,2,0,0,0,0|2,0,0]=4 2110 B11R1.22 CC1=CC=C(C=C1)C(=O)OC M110633 [0,2,0,0,0,0|1,0,1]=4 2111 B11R1.22 CC1=CC=C(C=C1)N(C)C=O N159308 [0,2,0,0,0,0|2,0,0]=4 2112 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br B137954 [0,2,0,0,0,0|1,0,1]=4 2113 B11R1.22 CCC(=O)C1=CC=C(C=C1)C M102232 [0,2,0,0,0,0|1,0,1]=4 2114 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl C109480 [0,2,0,0,0,0|1,0,1]=4 2115 B11R1.22 CCC(=O)C1=CC=C(C=C1)F F156638 [0,2,0,0,0,0|1,0,1]=4 2116 B11R1.22 CCC(=O)C1=CC=C(C=C1)N A419382 [0,2,0,0,0,0|1,0,1]=4 2117 B11R1.22 CCC(=O)C1=CC=C(C=C1)O H107590 [0,2,0,0,0,0|0,0,1]=3 2118 B11R1.22 CCC(C)C1=CC=C(C=C1)O S161081 [0,2,0,0,0,0|0,0,2]=4 2119 B11R1.22 CN(C=O)C1=CC=C(C=C1)Cl C153737 [0,2,0,0,0,0|2,0,0]=4 2120 B11R1.22 CNC(=O)C1=CC=C(C=C1)Br N183369 [0,2,0,0,0,0|1,0,1]=4 2121 B11R1.22 CNC(=O)C1=CC=C(C=C1)N A151421 [0,2,0,0,0,0|1,0,1]=4 2122 B11R1.22 COC(=N)C1=CC=C(C=C1)O B301321 [0,2,0,0,0,0|0,0,1]=3 2123 B11R1.22 COC(=O)C1=CC=C(C=C1)Br M157997 [0,2,0,0,0,0|1,0,1]=4 2124 B11R1.22 COC(=O)C1=CC=C(C=C1)Cl M158002 [0,2,0,0,0,0|1,0,1]=4 2125 B11R1.22 COC(=O)C1=CC=C(C=C1)F F108020 [0,2,0,0,0,0|1,0,1]=4 2126 B11R1.22 COC(=O)C1=CC=C(C=C1)I I101961 [0,2,0,0,0,0|1,0,1]=4 2127 B11R1.22 COC(=O)C1=CC=C(C=C1)N M111661 [0,2,0,0,0,0|1,0,1]=4 2128 B11R1.22 COC(=O)C1=CC=C(C=C1)O M108620 [0,2,0,0,0,0|0,0,1]=3 2129 B11R1.22 COC(=O)C1=CC=C(C=C1)O M108621 [0,2,0,0,0,0|0,0,1]=3 2130 B11R1.22 COC(=O)C1=CC=C(C=C1)O M108622 [0,2,0,0,0,0|0,0,1]=3 2131 B11R1.22 COC(=O)C1=CC=C(C=C1)O M111496 [0,2,0,0,0,0|0,0,1]=3 2132 B11R1.22 COC(=O)C1=CC=C(C=C1)O M427229 [0,2,0,0,0,0|0,0,1]=3 2133 B11R1.22 COC(=O)C1=CC=C(C=C1)[O-] M102796 [0,2,0,0,0,0|0,0,2]=4 2134 B11R1.22 COC(=O)C1=CC=C(C=C1)[O-] M102797 [0,2,0,0,0,0|0,0,2]=4 2135 B11R1.22 COC(=O)C1=CC=C(C=C1)[O-] M140627 [0,2,0,0,0,0|0,0,2]=4 2136 B11R1.22 COC(=O)C1=NC=C(C=C1)O M176070 [0,2,0,0,0,0|1,0,1]=4 2137 B11R1.22 NCC(O)C1=CC=C(O)C=C1 O408184 [0,2,0,0,0,0|0,0,2]=4 2138 B11R1.83 C1=CC(=CC=C1CCO)C#N H134819 [0,2,0,0,0,0|1,0,1]=4 2139 B11R1.83 C=CC1=CC=C(C=C1)N=C=S P352677 [0,2,0,0,0,0|0,1,0]=3 2140 B11R1.83 CC=CC1=CC=C(C=C1)OC A111314 [0,2,0,0,0,0|0,0,0]=2 2141 B11R1.83 CC=CC1=CC=C(C=C1)OC A119294 [0,2,0,0,0,0|0,0,0]=2 2142 B11R1.83 CC=CC1=CC=C(C=C1)OC P136392 [0,2,0,0,0,0|0,0,0]=2 2143 B11R1.83 CC=CC1=CC=C(C=C1)OC T423891 [0,2,0,0,0,0|0,0,0]=2 2144 B11R1.83 CCC1=CC=C(C=C1)OCC E156094 [0,2,0,0,0,0|0,0,2]=4 2145 B11R1.83 CCCC1=CC=C(C=C1)C=O P135756 [0,2,0,0,0,0|2,0,0]=4 2146 B11R1.83 CCCC1=CC=C(C=C1)OC M586236 [0,2,0,0,0,0|0,0,2]=4 2147 B11R1.83 CCOC1=CC=C(C=C1)C#C E156344 [0,2,0,0,0,0|0,0,2]=4 2148 B11R1.83 CCOC1=CC=C(C=C1)C#N E156327 [0,2,0,0,0,0|1,0,1]=4 2149 B11R1.83 CCOC1=CC=C(C=C1)C=C E477029 [0,2,0,0,0,0|0,0,0]=2 2150 B11R1.83 CCOC1=CC=C(C=C1)C=O E137923 [0,2,0,0,0,0|1,0,0]=3 2151 B11R1.83 CCOC1=CC=C(C=C1)CCl C194480 [0,2,0,0,0,0|1,0,1]=4 2152 B11R1.83 CCOC1=CC=C(C=C1)CO E156108 [0,2,0,0,0,0|0,0,2]=4 2153 B11R1.83 CNCC1=CC=C(C=C1)OC M121878 [0,2,0,0,0,0|0,0,2]=4 2154 B11R1.83 CNCC1=CC=C(C=C1)OC M187530 [0,2,0,0,0,0|0,0,2]=4 2155 B11R1.83 COC1=CC=C(C=C1)CC#N M124732 [0,2,0,0,0,0|0,0,2]=4 2156 B11R1.83 COC1=CC=C(C=C1)CC=C A151340 [0,2,0,0,0,0|0,0,0]=2 2157 B11R1.83 COC1=CC=C(C=C1)CC=C A421524 [0,2,0,0,0,0|0,0,0]=2 2158 B11R1.83 COC1=CC=C(C=C1)CC=O M193998 [0,2,0,0,0,0|0,0,1]=3 2159 B11R1.83 COC1=CC=C(C=C1)CCBr M353698 [0,2,0,0,0,0|0,0,2]=4 2160 B11R1.83 COC1=CC=C(C=C1)CCN M106422 [0,2,0,0,0,0|0,0,2]=4 2161 B11R1.83 COC1=CC=C(C=C1)CCO M124605 [0,2,0,0,0,0|0,0,2]=4 2162 B11R1.83 COC1=CC=C(C=C1)CCO M493169 [0,2,0,0,0,0|0,0,2]=4 2163 B11R1.83 COC1=CC=C(C=C1)CNN M175563 [0,2,0,0,0,0|1,0,1]=4 2164 B11R1.83 COC1=CC=C(C=C1)CON A479616 [0,2,0,0,0,0|1,0,1]=4 2165 B11R1.83 COC1=CC=C(C=C1)N=C=O M157830 [0,2,0,0,0,0|1,0,1]=4 2166 B11R1.83 COC1=CC=C(C=C1)N=C=S M140587 [0,2,0,0,0,0|1,0,1]=4 2167 B11R1.83 COC1=CC=C(C=C1)N=C=S M473065 [0,2,0,0,0,0|1,0,1]=4 2168 B11R1.83 COC1=CC=C(C=C1)NC=O M158339 [0,2,0,0,0,0|1,0,0]=3 2169 B11R1.83 COC1=CC=C(C=C1)OC#N M300697 [0,2,0,0,0,0|1,0,1]=4 2170 B11R1.83 COCC1=CC=C(C=C1)OC M158116 [0,2,0,0,0,0|0,0,2]=4 2171 B11R1.192 C1=CC(=C(C=C1CCN)O)O A303863 [0,2,0,0,0,0|0,0,2]=4 2172 B11R1.192 C1=CC(=C(C=C1CCN)O)O A303864 [0,2,0,0,0,0|0,0,2]=4 2173 B11R1.192 C1=CC(=C(C=C1CCN)O)O D103111 [0,2,0,0,0,0|0,0,2]=4 2174 B11R1.192 C1=CC(=C(C=C1CCN)O)O D121757 [0,2,0,0,0,0|0,0,2]=4 2175 B11R1.192 C1=CC(=C(C=C1CCN)O)O H350369 [0,2,0,0,0,0|0,0,2]=4 2176 B11R1.192 C1=CC(=C(C=C1CCO)O)O H107675 [0,2,0,0,0,0|0,0,2]=4 2177 B11R1.192 C1=CC(=C(C=C1CCO)O)O H306005 [0,2,0,0,0,0|0,0,2]=4 2178 B11R1.192 C1=CC(=C(C=C1CCO)O)O H420486 [0,2,0,0,0,0|0,0,2]=4 2179 B11R1.192 C=CCC1=CC(=C(C=C1)O)O A151341 [0,2,0,0,0,0|0,0,0]=2 2180 B11R1.192 CC1=C(C=CC(=C1)SC#N)O T338473 [0,2,0,0,0,0|1,0,1]=4 2181 B11R1.192 CCCC1=CC(=C(C=C1)O)O P588420 [0,2,0,0,0,0|0,0,2]=4 2182 B11R1.192 NCCC1=CC(=C(O)C=C1)O D408026 [0,2,0,0,0,0|0,0,2]=4 2183 B11R1.3 B(C1=CC=C(C=C1)C#N)(O)O C106584 [0,2,0,0,0,0|1,0,1]=4 2184 B11R1.3 B(C1=CC=C(C=C1)C=C)(O)O V102338 [0,2,0,0,0,0|0,0,0]=2 2185 B11R1.3 B(C1=CC=C(C=C1)C=O)(O)O F106771 [0,2,0,0,0,0|1,0,0]=3 2186 B11R1.3 B(C1=CC=C(C=C1)CBr)(O)O B120033 [0,2,0,0,0,0|1,0,1]=4 2187 B11R1.3 B(C1=CC=C(C=C1)CBr)(O)O B165281 [0,2,0,0,0,0|1,0,1]=4 2188 B11R1.3 B(C1=CC=C(C=C1)CC)(O)O E103180 [0,2,0,0,0,0|0,0,2]=4 2189 B11R1.3 B(C1=CC=C(C=C1)CN)(O)O A335898 [0,2,0,0,0,0|1,0,1]=4 2190 B11R1.3 B(C1=CC=C(C=C1)CO)(O)O H107742 [0,2,0,0,0,0|1,0,1]=4 2191 B11R1.3 B(C1=CC=C(C=C1)OC)(O)O M109431 [0,2,0,0,0,0|1,0,1]=4 2192 B11R1.3 B(C1=CC=C(C=C1)SC)(O)O M103215 [0,2,0,0,0,0|1,0,1]=4 2193 B11R1.3 C#CC1=CC=C(C=C1)C(=O)O E137978 [0,2,0,0,0,0|0,0,2]=4 2194 B11R1.3 C#CC1=CC=C(C=C1)C(=O)[O-] S299909 [0,2,0,0,0,0|2,0,0]=4 2195 B11R1.3 C1=CC(=CC=C1C#N)C(=O)Cl C153684 [0,2,0,0,0,0|2,0,0]=4 2196 B11R1.3 C1=CC(=CC=C1C#N)C(=O)N C153736 [0,2,0,0,0,0|2,0,0]=4 2197 B11R1.3 C1=CC(=CC=C1C#N)C(=O)O C108511 [0,2,0,0,0,0|1,0,1]=4 2198 B11R1.3 C1=CC(=CC=C1C(=O)O)NN H101716 [0,2,0,0,0,0|2,0,0]=4 2199 B11R1.3 C1=CC(=CC=C1C(=O)O)NN H106992 [0,2,0,0,0,0|2,0,0]=4 2200 B11R1.3 C1=CC(=CC=C1C=O)C(=O)O F109559 [0,2,0,0,0,0|1,0,0]=3 2201 B11R1.3 C1=CC(=CC=C1C=O)[N+](=O)[O-] N104181 [0,2,0,0,0,0|1,0,1]=4 2202 B11R1.3 C1=CC(=CC=C1CBr)C(=O)O B152291 [0,2,0,0,0,0|1,0,1]=4 2203 B11R1.3 C1=CC(=CC=C1CBr)C(=O)O B471433 [0,2,0,0,0,0|1,0,1]=4 2204 B11R1.3 C1=CC(=CC=C1CCl)C(=O)Cl C103225 [0,2,0,0,0,0|2,0,0]=4 2205 B11R1.3 C1=CC(=CC=C1CCl)C(=O)N C186877 [0,2,0,0,0,0|2,0,0]=4 2206 B11R1.3 C1=CC(=CC=C1CCl)C(=O)O C137487 [0,2,0,0,0,0|1,0,1]=4 2207 B11R1.3 C1=CC(=CC=C1CN)C(=O)O A111957 [0,2,0,0,0,0|1,0,1]=4 2208 B11R1.3 C1=CC(=CC=C1CO)C(=O)O H117675 [0,2,0,0,0,0|1,0,0]=3 2209 B11R1.3 C1=CC(=CC=C1CO)[N+](=O)[O-] N110318 [0,2,0,0,0,0|2,0,0]=4 2210 B11R1.3 C=CC1=CC=C(C=C1)C(=O)O V117230 [0,2,0,0,0,0|0,0,0]=2 2211 B11R1.3 C=CC1=CC=C(C=C1)[N+](=O)[O-] N404780 [0,2,0,0,0,0|0,0,1]=3 2212 B11R1.3 CC(=C)C1=CC=C(C=C1)OC M587638 [0,2,0,0,0,0|0,0,0]=2 2213 B11R1.3 CC(=O)C1=CC=C(C=C1)C#N C153682 [0,2,0,0,0,0|1,0,1]=4 2214 B11R1.3 CC(=O)C1=CC=C(C=C1)C=O A169740 [0,2,0,0,0,0|0,0,2]=4 2215 B11R1.3 CC(=O)C1=CC=C(C=C1)NC A196189 [0,2,0,0,0,0|1,0,1]=4 2216 B11R1.3 CC(=O)C1=CC=C(C=C1)OC M103875 [0,2,0,0,0,0|0,0,1]=3 2217 B11R1.3 CC(=O)C1=CC=C(C=C1)SC M101852 [0,2,0,0,0,0|0,1,1]=4 2218 B11R1.3 CC(=O)C1=CN=C(C=C1)OC A115779 [0,2,0,0,0,0|1,0,1]=4 2219 B11R1.3 CC(C)C1=CC=C(C=C1)C=O C117706 [0,2,0,0,0,0|2,0,0]=4 2220 B11R1.3 CC(C)C1=CC=C(C=C1)CO I107533 [0,2,0,0,0,0|0,0,2]=4 2221 B11R1.3 CC(C)C1=CC=C(C=C1)OC I157470 [0,2,0,0,0,0|0,0,2]=4 2222 B11R1.3 CC(C1=CC=C(C=C1)OC)N M100571 [0,2,0,0,0,0|0,0,2]=4 2223 B11R1.3 CC(C1=CC=C(C=C1)OC)N M106421 [0,2,0,0,0,0|0,0,2]=4 2224 B11R1.3 CC(C1=CC=C(C=C1)OC)N M185667 [0,2,0,0,0,0|0,0,2]=4 2225 B11R1.3 CC(C1=CC=C(C=C1)OC)O M169629 [0,2,0,0,0,0|0,0,2]=4 2226 B11R1.3 CCC1=CC=C(C=C1)C(=O)C E156360 [0,2,0,0,0,0|1,0,1]=4 2227 B11R1.3 CCC1=CC=C(C=C1)C(=O)Cl E103224 [0,2,0,0,0,0|2,0,0]=4 2228 B11R1.3 CCC1=CC=C(C=C1)C(=O)O E156333 [0,2,0,0,0,0|0,0,2]=4 2229 B11R1.3 CN(C)C1=CC=C(C=C1)C=C N588011 [0,2,0,0,0,0|1,0,0]=3 2230 B11R1.3 CN(C)C1=CC=C(C=C1)C=O D109640 [0,2,0,0,0,0|2,0,0]=4 2231 B11R1.3 CN(C)C1=CC=C(C=C1)C=O D109644 [0,2,0,0,0,0|2,0,0]=4 2232 B11R1.3 CN(C)C1=CC=C(C=C1)C=O D278973 [0,2,0,0,0,0|2,0,0]=4 2233 B11R1.3 CN(C)C1=CC=C(C=C1)CO D155714 [0,2,0,0,0,0|1,0,1]=4 2234 B11R1.3 CN(C)C1=CC=C(C=C1)CO D489122 [0,2,0,0,0,0|1,0,1]=4 2235 B11R1.3 CN(C)C1=CC=C(C=C1)OC M194673 [0,2,0,0,0,0|1,0,1]=4 2236 B11R1.3 CNC1=CC=C(C=C1)C(=O)O M158381 [0,2,0,0,0,0|1,0,1]=4 2237 B11R1.3 COC1=CC=C(C=C1)C(=N)N M158469 [0,2,0,0,0,0|1,0,0]=3 2238 B11R1.3 COC1=CC=C(C=C1)C(=O)Cl M100611 [0,2,0,0,0,0|1,0,0]=3 2239 B11R1.3 COC1=CC=C(C=C1)C(=O)N M158329 [0,2,0,0,0,0|1,0,0]=3 2240 B11R1.3 COC1=CC=C(C=C1)C(=O)O M104368 [0,2,0,0,0,0|1,0,0]=3 2241 B11R1.3 COC1=CC=C(C=C1)C(=O)O M119543 [0,2,0,0,0,0|1,0,0]=3 2242 B11R1.3 COC1=CC=C(C=C1)C(=S)N M101893 [0,2,0,0,0,0|1,0,0]=3 2243 B11R1.3 COC1=CC=C(C=C1)[N+](=O)[O-] N105584 [0,2,0,0,0,0|2,0,0]=4 2244 B11R1.3 COC1=CN=C(C=C1)C(=N)N M586506 [0,2,0,0,0,0|2,0,0]=4 2245 B11R1.3 COC1=NC=C(C=C1)C(=O)N J413630 [0,2,0,0,0,0|2,0,0]=4 2246 B11R1.3 COC1=NC=C(C=C1)C(=O)O M185906 [0,2,0,0,0,0|2,0,0]=4 2247 B11R1.3 CSC1=CC=C(C=C1)C(=O)O M158295 [0,2,0,0,0,0|1,0,1]=4 2248 B11R1.279 C1=CC(=C(C=C1C#N)Br)CO B195716 [0,2,0,0,0,0|1,0,1]=4 2249 B11R1.279 C1=CC(=C(C=C1C#N)F)C=O C179065 [0,2,0,0,0,0|2,0,0]=4 2250 B11R1.279 C1=CC(=C(C=C1C#N)F)CO F468959 [0,2,0,0,0,0|1,0,1]=4 2251 B11R1.279 C1=CC(=C(C=C1C#N)O)C=O F590287 [0,2,0,0,0,0|2,0,0]=4 2252 B11R1.279 C1=CC(=C(C=C1C=O)F)C#N F156617 [0,2,0,0,0,0|2,0,0]=4 2253 B11R1.279 C1=CC(=C(C=C1C=O)O)C=O H304508 [0,2,0,0,0,0|1,0,1]=4 2254 B11R1.279 CC1=C(C=CC(=C1)C#N)C=O F588526 [0,2,0,0,0,0|2,0,0]=4 2255 B11R1.279 CC1=C(C=CC(=C1)C=O)OC M133647 [0,2,0,0,0,0|1,0,0]=3 2256 B11R1.279 CC1=C(C=CC(=C1)CCl)OC C194161 [0,2,0,0,0,0|1,0,1]=4 2257 B11R1.279 CC1=C(C=CC(=C1)OC)C=O M124189 [0,2,0,0,0,0|1,0,0]=3 2258 B11R1.279 CC1=C(C=CC(=C1)OC)OC D155374 [0,2,0,0,0,0|1,0,1]=4 2259 B11R1.279 COC1=C(C=C(C=C1)C#N)Br B152144 [0,2,0,0,0,0|1,0,1]=4 2260 B11R1.279 COC1=C(C=C(C=C1)C#N)Cl W137412 [0,2,0,0,0,0|1,0,1]=4 2261 B11R1.279 COC1=C(C=C(C=C1)C#N)F F133310 [0,2,0,0,0,0|1,0,1]=4 2262 B11R1.279 COC1=C(C=C(C=C1)C#N)O H184992 [0,2,0,0,0,0|1,0,1]=4 2263 B11R1.279 COC1=C(C=C(C=C1)C=O)Br B133393 [0,2,0,0,0,0|1,0,0]=3 2264 B11R1.279 COC1=C(C=C(C=C1)C=O)Cl C153252 [0,2,0,0,0,0|1,0,0]=3 2265 B11R1.279 COC1=C(C=C(C=C1)C=O)F F122618 [0,2,0,0,0,0|1,0,0]=3 2266 B11R1.279 COC1=C(C=C(C=C1)C=O)I I168830 [0,2,0,0,0,0|1,0,0]=3 2267 B11R1.279 COC1=C(C=C(C=C1)C=O)O I113433 [0,2,0,0,0,0|1,0,0]=3 2268 B11R1.279 COC1=C(C=C(C=C1)CCl)F F404466 [0,2,0,0,0,0|1,0,1]=4 2269 B11R1.279 COC1=C(C=C(C=C1)CN)Cl C405721 [0,2,0,0,0,0|1,0,1]=4 2270 B11R1.279 COC1=C(C=C(C=C1)CN)Cl W133337 [0,2,0,0,0,0|1,0,1]=4 2271 B11R1.279 COC1=C(C=C(C=C1)CN)O H170289 [0,2,0,0,0,0|1,0,1]=4 2272 B11R1.279 COC1=C(C=C(C=C1)CO)Cl C167323 [0,2,0,0,0,0|1,0,1]=4 2273 B11R1.279 COC1=C(C=C(C=C1)CO)I I170835 [0,2,0,0,0,0|1,0,1]=4 2274 B11R1.279 COC1=C(C=C(C=C1)CO)N A586429 [0,2,0,0,0,0|1,0,1]=4 2275 B11R1.279 COC1=C(C=C(C=C1)CO)O I157468 [0,2,0,0,0,0|1,0,1]=4 2276 B11R1.279 COC1=CC(=C(C=C1)C#N)Br B181430 [0,2,0,0,0,0|1,0,1]=4 2277 B11R1.279 COC1=CC(=C(C=C1)C#N)Cl C180973 [0,2,0,0,0,0|1,0,1]=4 2278 B11R1.279 COC1=CC(=C(C=C1)C#N)F F122746 [0,2,0,0,0,0|1,0,1]=4 2279 B11R1.279 COC1=CC(=C(C=C1)C#N)N A184197 [0,2,0,0,0,0|1,0,1]=4 2280 B11R1.279 COC1=CC(=C(C=C1)C=O)Br B134162 [0,2,0,0,0,0|1,0,0]=3 2281 B11R1.279 COC1=CC(=C(C=C1)C=O)Cl C589430 [0,2,0,0,0,0|1,0,0]=3 2282 B11R1.279 COC1=CC(=C(C=C1)C=O)F F120910 [0,2,0,0,0,0|1,0,0]=3 2283 B11R1.279 COC1=CC(=C(C=C1)C=O)O H106333 [0,2,0,0,0,0|1,0,0]=3 2284 B11R1.279 COC1=CC(=C(C=C1)C=O)O H425389 [0,2,0,0,0,0|1,0,0]=3 2285 B11R1.279 COC1=CC(=C(C=C1)N=O)O N159106 [0,2,0,0,0,0|2,0,0]=4 2286 B11R1.279 COC1=CC(=C(C=C1)OC)Br B101643 [0,2,0,0,0,0|1,0,1]=4 2287 B11R1.279 COC1=CC(=C(C=C1)OC)Cl C132830 [0,2,0,0,0,0|1,0,1]=4 2288 B11R1.279 COC1=CC(=C(C=C1)OC)F D123994 [0,2,0,0,0,0|1,0,1]=4 2289 B11R1.279 COC1=CC(=C(C=C1)OC)N D111647 [0,2,0,0,0,0|1,0,1]=4 2290 B11R1.279 COC1=CC(=C(C=C1)OC)O D191676 [0,2,0,0,0,0|1,0,1]=4 2291 B11R1.279 COC1=CC(=C(C=C1)OC)S D101795 [0,2,0,0,0,0|1,0,1]=4 2292 B11R1.19 C1=CC(=CC=C1C(F)(F)F)O T106656 [0,2,0,0,0,0|1,0,1]=4 2293 B11R1.19 C1=CC(=CC=C1O)P(=O)(O)O H157413 [0,2,0,0,0,0|2,0,0]=4 2294 B11R1.19 C1=CC(=CC=C1O)S(=O)(=O)N H138312 [0,2,0,0,0,0|2,0,0]=4 2295 B11R1.19 C1=CC(=CC=C1O)S(=O)(=O)O H111204 [0,2,0,0,0,0|2,0,0]=4 2296 B11R1.19 C1=CC(=CC=C1O)S(=O)(=O)[O-] P136738 [0,2,0,0,0,0|2,0,0]=4 2297 B11R1.19 C1=CC(=CC=C1O)S(=O)(=O)[O-] S161115 [0,2,0,0,0,0|2,0,0]=4 2298 B11R1.19 C1=CC(=CC=C1O)[As](=O)(O)O H157169 [0,2,0,0,0,0|2,0,0]=4 2299 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O B110664 [0,2,0,0,0,0|0,0,2]=4 2300 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O B110665 [0,2,0,0,0,0|0,0,2]=4 2301 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O B110666 [0,2,0,0,0,0|0,0,2]=4 2302 B11R1.19 CS(=O)(=O)C1=CC=C(C=C1)O H157189 [0,2,0,0,0,0|1,0,1]=4 2303 B11R1.19 [B-](C1=CC=C(C=C1)O)(F)(F)F P165418 [0,2,0,0,0,0|2,0,0]=4 2304 B11R1.21 B(C1=CC(=C(C=C1)O)Cl)(O)O C182258 [0,2,0,0,0,0|2,0,0]=4 2305 B11R1.21 B(C1=CC(=C(C=C1)O)F)(O)O F138397 [0,2,0,0,0,0|2,0,0]=4 2306 B11R1.21 C1=CC(=C(C=C1C(=N)N)F)F D179284 [0,2,0,0,0,0|2,0,0]=4 2307 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)Br)F B185940 [0,2,0,0,0,0|2,0,0]=4 2308 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)Cl)Cl D103220 [0,2,0,0,0,0|2,0,0]=4 2309 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)Cl)F C153869 [0,2,0,0,0,0|2,0,0]=4 2310 B11R1.21 C1=CC(=C(C=C1C(=O)Cl)F)F D134018 [0,2,0,0,0,0|2,0,0]=4 2311 B11R1.21 C1=CC(=C(C=C1C(=O)N)Br)F B133447 [0,2,0,0,0,0|2,0,0]=4 2312 B11R1.21 C1=CC(=C(C=C1C(=O)N)Cl)Cl D154878 [0,2,0,0,0,0|2,0,0]=4 2313 B11R1.21 C1=CC(=C(C=C1C(=O)N)Cl)F C420053 [0,2,0,0,0,0|2,0,0]=4 2314 B11R1.21 C1=CC(=C(C=C1C(=O)N)F)F D155096 [0,2,0,0,0,0|2,0,0]=4 2315 B11R1.21 C1=CC(=C(C=C1C(=O)N)N)F A479835 [0,2,0,0,0,0|2,0,0]=4 2316 B11R1.21 C1=CC(=C(C=C1C(=O)O)Br)Br D194226 [0,2,0,0,0,0|2,0,0]=4 2317 B11R1.21 C1=CC(=C(C=C1C(=O)O)Br)Cl B152312 [0,2,0,0,0,0|2,0,0]=4 2318 B11R1.21 C1=CC(=C(C=C1C(=O)O)Br)F B152970 [0,2,0,0,0,0|2,0,0]=4 2319 B11R1.21 C1=CC(=C(C=C1C(=O)O)Br)I B183133 [0,2,0,0,0,0|2,0,0]=4 2320 B11R1.21 C1=CC(=C(C=C1C(=O)O)Br)N A134517 [0,2,0,0,0,0|2,0,0]=4 2321 B11R1.21 C1=CC(=C(C=C1C(=O)O)Br)O B152311 [0,2,0,0,0,0|1,0,0]=3 2322 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)Br B134378 [0,2,0,0,0,0|2,0,0]=4 2323 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)Cl D110134 [0,2,0,0,0,0|2,0,0]=4 2324 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)F C153391 [0,2,0,0,0,0|2,0,0]=4 2325 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)I C194046 [0,2,0,0,0,0|2,0,0]=4 2326 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)N A123912 [0,2,0,0,0,0|2,0,0]=4 2327 B11R1.21 C1=CC(=C(C=C1C(=O)O)Cl)O C153755 [0,2,0,0,0,0|1,0,0]=3 2328 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)Br B123999 [0,2,0,0,0,0|2,0,0]=4 2329 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)Cl C120453 [0,2,0,0,0,0|2,0,0]=4 2330 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)F D120459 [0,2,0,0,0,0|2,0,0]=4 2331 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)I F136784 [0,2,0,0,0,0|2,0,0]=4 2332 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)N A120972 [0,2,0,0,0,0|2,0,0]=4 2333 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)O F124307 [0,2,0,0,0,0|1,0,0]=3 2334 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)Cl C135910 [0,2,0,0,0,0|2,0,0]=4 2335 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)F F136315 [0,2,0,0,0,0|2,0,0]=4 2336 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)N A123913 [0,2,0,0,0,0|2,0,0]=4 2337 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)O H330656 [0,2,0,0,0,0|1,0,0]=3 2338 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)Br A133302 [0,2,0,0,0,0|2,0,0]=4 2339 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)Cl A151457 [0,2,0,0,0,0|2,0,0]=4 2340 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)F A133076 [0,2,0,0,0,0|2,0,0]=4 2341 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)N D139094 [0,2,0,0,0,0|2,0,0]=4 2342 B11R1.21 C1=CC(=C(C=C1C(=O)O)N)O A107186 [0,2,0,0,0,0|1,0,0]=3 2343 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)Br B302871 [0,2,0,0,0,0|2,0,0]=4 2344 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)Cl C183834 [0,2,0,0,0,0|2,0,0]=4 2345 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)F F123927 [0,2,0,0,0,0|2,0,0]=4 2346 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)I H122561 [0,2,0,0,0,0|2,0,0]=4 2347 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)N A109730 [0,2,0,0,0,0|2,0,0]=4 2348 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)O P104382 [0,2,0,0,0,0|1,0,0]=3 2349 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)O P104383 [0,2,0,0,0,0|1,0,0]=3 2350 B11R1.21 C1=CC(=C(C=C1C(=O)O)O)O P427224 [0,2,0,0,0,0|1,0,0]=3 2351 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])Br)O W134694 [0,2,0,0,0,0|2,0,0]=4 2352 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])Cl)O C104236 [0,2,0,0,0,0|2,0,0]=4 2353 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])F)O F156739 [0,2,0,0,0,0|2,0,0]=4 2354 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])I)O I349633 [0,2,0,0,0,0|2,0,0]=4 2355 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])N)O A107508 [0,2,0,0,0,0|2,0,0]=4 2356 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])O)O D138939 [0,2,0,0,0,0|2,0,0]=4 2357 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)F F183554 [0,2,0,0,0,0|1,0,1]=4 2358 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)N A469136 [0,2,0,0,0,0|1,0,1]=4 2359 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Cl D106502 [0,2,0,0,0,0|1,0,1]=4 2360 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)F C122007 [0,2,0,0,0,0|1,0,1]=4 2361 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)N A405620 [0,2,0,0,0,0|1,0,1]=4 2362 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Br B122006 [0,2,0,0,0,0|1,0,1]=4 2363 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Cl C121995 [0,2,0,0,0,0|1,0,1]=4 2364 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)F D137207 [0,2,0,0,0,0|1,0,1]=4 2365 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)N A132063 [0,2,0,0,0,0|1,0,1]=4 2366 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Br B151944 [0,2,0,0,0,0|0,0,1]=3 2367 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Cl C134912 [0,2,0,0,0,0|0,0,1]=3 2368 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)F F156639 [0,2,0,0,0,0|0,0,1]=3 2369 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)N A405624 [0,2,0,0,0,0|0,0,1]=3 2370 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)O D138090 [0,2,0,0,0,0|0,0,1]=3 2371 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)Br B151853 [0,2,0,0,0,0|1,0,1]=4 2372 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)C D106331 [0,2,0,0,0,0|1,0,1]=4 2373 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)F F353287 [0,2,0,0,0,0|1,0,1]=4 2374 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)N A151422 [0,2,0,0,0,0|2,0,0]=4 2375 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Br B136776 [0,2,0,0,0,0|2,0,0]=4 2376 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)C D134702 [0,2,0,0,0,0|2,0,0]=4 2377 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Cl C153816 [0,2,0,0,0,0|2,0,0]=4 2378 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F F120584 [0,2,0,0,0,0|2,0,0]=4 2379 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I I157659 [0,2,0,0,0,0|2,0,0]=4 2380 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)N A107448 [0,2,0,0,0,0|2,0,0]=4 2381 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)O H123413 [0,2,0,0,0,0|2,0,0]=4 2382 B11R1.21 CC1=C(C=CC(=C1)C(=O)C)Cl C100653 [0,2,0,0,0,0|1,0,1]=4 2383 B11R1.21 CC1=C(C=CC(=C1)C(=O)C)Cl C470980 [0,2,0,0,0,0|1,0,1]=4 2384 B11R1.21 CC1=C(C=CC(=C1)C(=O)C)F F136285 [0,2,0,0,0,0|1,0,1]=4 2385 B11R1.21 CC1=C(C=CC(=C1)C(=O)C)O H101899 [0,2,0,0,0,0|0,0,1]=3 2386 B11R1.21 CC1=C(C=CC(=C1)C(=O)Cl)F W135914 [0,2,0,0,0,0|2,0,0]=4 2387 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)F F183254 [0,2,0,0,0,0|2,0,0]=4 2388 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Br B120923 [0,2,0,0,0,0|2,0,0]=4 2389 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Cl C133589 [0,2,0,0,0,0|2,0,0]=4 2390 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)F F120591 [0,2,0,0,0,0|2,0,0]=4 2391 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)N A113937 [0,2,0,0,0,0|2,0,0]=4 2392 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)O H157027 [0,2,0,0,0,0|1,0,0]=3 2393 B11R1.21 CC1=C(C=CC(=C1)[N+](=O)[O-])O M124369 [0,2,0,0,0,0|2,0,0]=4 2394 B11R1.166 B(C1=C(C=C(C=C1)O)C)(O)O B335825 [0,2,0,0,0,0|2,0,0]=4 2395 B11R1.166 B(C1=C(C=C(C=C1)O)Cl)(O)O C590126 [0,2,0,0,0,0|2,0,0]=4 2396 B11R1.166 B(C1=C(C=C(C=C1)O)F)(O)O F587102 [0,2,0,0,0,0|2,0,0]=4 2397 B11R1.166 C1=CC(=C(C=C1Br)Br)C(=O)O D123768 [0,2,0,0,0,0|2,0,0]=4 2398 B11R1.166 C1=CC(=C(C=C1Br)Br)C(=O)O D154849 [0,2,0,0,0,0|2,0,0]=4 2399 B11R1.166 C1=CC(=C(C=C1Br)Cl)C(=O)O B152314 [0,2,0,0,0,0|2,0,0]=4 2400 B11R1.166 C1=CC(=C(C=C1Br)F)C(=O)Cl B132257 [0,2,0,0,0,0|2,0,0]=4 2401 B11R1.166 C1=CC(=C(C=C1Br)F)C(=O)O B152368 [0,2,0,0,0,0|2,0,0]=4 2402 B11R1.166 C1=CC(=C(C=C1Br)I)C(=O)O B586421 [0,2,0,0,0,0|2,0,0]=4 2403 B11R1.166 C1=CC(=C(C=C1Br)N)C(=O)O A120954 [0,2,0,0,0,0|2,0,0]=4 2404 B11R1.166 C1=CC(=C(C=C1Br)O)C(=O)O B111419 [0,2,0,0,0,0|2,0,0]=4 2405 B11R1.166 C1=CC(=C(C=C1Cl)Br)C(=O)O B139463 [0,2,0,0,0,0|2,0,0]=4 2406 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)Cl D100633 [0,2,0,0,0,0|2,0,0]=4 2407 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)N D154877 [0,2,0,0,0,0|2,0,0]=4 2408 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)O D104404 [0,2,0,0,0,0|2,0,0]=4 2409 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=O)O D104405 [0,2,0,0,0,0|2,0,0]=4 2410 B11R1.166 C1=CC(=C(C=C1Cl)Cl)C(=S)N B301192 [0,2,0,0,0,0|2,0,0]=4 2411 B11R1.166 C1=CC(=C(C=C1Cl)F)C(=O)O C120446 [0,2,0,0,0,0|2,0,0]=4 2412 B11R1.166 C1=CC(=C(C=C1Cl)I)C(=O)O C123922 [0,2,0,0,0,0|2,0,0]=4 2413 B11R1.166 C1=CC(=C(C=C1Cl)N)C(=O)N A185419 [0,2,0,0,0,0|2,0,0]=4 2414 B11R1.166 C1=CC(=C(C=C1Cl)N)C(=O)O A101215 [0,2,0,0,0,0|2,0,0]=4 2415 B11R1.166 C1=CC(=C(C=C1Cl)O)C(=O)O C123920 [0,2,0,0,0,0|2,0,0]=4 2416 B11R1.166 C1=CC(=C(C=C1F)Br)C(=O)O B120666 [0,2,0,0,0,0|2,0,0]=4 2417 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)Cl W135364 [0,2,0,0,0,0|2,0,0]=4 2418 B11R1.166 C1=CC(=C(C=C1F)Cl)C(=O)O C120960 [0,2,0,0,0,0|2,0,0]=4 2419 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)Cl D134834 [0,2,0,0,0,0|2,0,0]=4 2420 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)N W137074 [0,2,0,0,0,0|2,0,0]=4 2421 B11R1.166 C1=CC(=C(C=C1F)F)C(=O)O D124500 [0,2,0,0,0,0|2,0,0]=4 2422 B11R1.166 C1=CC(=C(C=C1F)I)C(=O)O F120989 [0,2,0,0,0,0|2,0,0]=4 2423 B11R1.166 C1=CC(=C(C=C1F)N)C(=O)O F156606 [0,2,0,0,0,0|2,0,0]=4 2424 B11R1.166 C1=CC(=C(C=C1F)O)C(=O)O F133808 [0,2,0,0,0,0|2,0,0]=4 2425 B11R1.166 C1=CC(=C(C=C1I)Br)C(=O)O B491580 [0,2,0,0,0,0|2,0,0]=4 2426 B11R1.166 C1=CC(=C(C=C1I)Cl)C(=O)O C153752 [0,2,0,0,0,0|2,0,0]=4 2427 B11R1.166 C1=CC(=C(C=C1I)O)C(=O)O H167820 [0,2,0,0,0,0|2,0,0]=4 2428 B11R1.166 C1=CC(=C(C=C1N)Cl)C(=O)N A168543 [0,2,0,0,0,0|2,0,0]=4 2429 B11R1.166 C1=CC(=C(C=C1N)Cl)C(=O)O A123909 [0,2,0,0,0,0|2,0,0]=4 2430 B11R1.166 C1=CC(=C(C=C1N)F)C(=O)O A120664 [0,2,0,0,0,0|2,0,0]=4 2431 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O A105007 [0,2,0,0,0,0|2,0,0]=4 2432 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O P337788 [0,2,0,0,0,0|2,0,0]=4 2433 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O P422509 [0,2,0,0,0,0|2,0,0]=4 2434 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)[O-] S115316 [0,2,0,0,0,0|2,0,0]=4 2435 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)[O-] S302405 [0,2,0,0,0,0|2,0,0]=4 2436 B11R1.166 C1=CC(=C(C=C1O)Br)C(=O)O B588568 [0,2,0,0,0,0|1,0,0]=3 2437 B11R1.166 C1=CC(=C(C=C1O)Br)[N+](=O)[O-] B193871 [0,2,0,0,0,0|2,0,0]=4 2438 B11R1.166 C1=CC(=C(C=C1O)Cl)C(=O)O C123874 [0,2,0,0,0,0|1,0,0]=3 2439 B11R1.166 C1=CC(=C(C=C1O)F)C(=O)O F123925 [0,2,0,0,0,0|1,0,0]=3 2440 B11R1.166 C1=CC(=C(C=C1O)F)[N+](=O)[O-] F101739 [0,2,0,0,0,0|2,0,0]=4 2441 B11R1.166 C1=CC(=C(C=C1O)F)[N+](=O)[O-] F397347 [0,2,0,0,0,0|2,0,0]=4 2442 B11R1.166 C1=CC(=C(C=C1O)O)C(=O)N D155337 [0,2,0,0,0,0|1,0,0]=3 2443 B11R1.166 C1=CC(=C(C=C1O)O)C(=O)O D104371 [0,2,0,0,0,0|1,0,0]=3 2444 B11R1.166 C1=CC(=C(C=C1O)O)[N+](=O)[O-] N303420 [0,2,0,0,0,0|2,0,0]=4 2445 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)Br D136552 [0,2,0,0,0,0|1,0,1]=4 2446 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)Cl B192317 [0,2,0,0,0,0|1,0,1]=4 2447 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)F B171235 [0,2,0,0,0,0|1,0,1]=4 2448 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)N A190249 [0,2,0,0,0,0|1,0,1]=4 2449 B11R1.166 CC(=O)C1=C(C=C(C=C1)Br)O B135067 [0,2,0,0,0,0|1,0,1]=4 2450 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Br B186775 [0,2,0,0,0,0|1,0,1]=4 2451 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)Cl D132842 [0,2,0,0,0,0|1,0,1]=4 2452 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)F C182148 [0,2,0,0,0,0|1,0,1]=4 2453 B11R1.166 CC(=O)C1=C(C=C(C=C1)Cl)O C153948 [0,2,0,0,0,0|1,0,1]=4 2454 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Br B123248 [0,2,0,0,0,0|1,0,1]=4 2455 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)Cl C133992 [0,2,0,0,0,0|1,0,1]=4 2456 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)F D123991 [0,2,0,0,0,0|1,0,1]=4 2457 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)O F123259 [0,2,0,0,0,0|1,0,1]=4 2458 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)Cl A590000 [0,2,0,0,0,0|1,0,1]=4 2459 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)O A183120 [0,2,0,0,0,0|1,0,1]=4 2460 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)Br B194221 [0,2,0,0,0,0|0,0,1]=3 2461 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)F F124233 [0,2,0,0,0,0|0,0,1]=3 2462 B11R1.166 CC(=O)C1=C(C=C(C=C1)O)O D103149 [0,2,0,0,0,0|0,0,1]=3 2463 B11R1.166 CC(C)C1=C(C=C(C=C1)O)O I588310 [0,2,0,0,0,0|0,0,2]=4 2464 B11R1.166 CC1=C(C=CC(=C1)Br)C(=O)O B152290 [0,2,0,0,0,0|2,0,0]=4 2465 B11R1.166 CC1=C(C=CC(=C1)Cl)C(=O)C C588908 [0,2,0,0,0,0|1,0,1]=4 2466 B11R1.166 CC1=C(C=CC(=C1)Cl)C(=O)O C123923 [0,2,0,0,0,0|2,0,0]=4 2467 B11R1.166 CC1=C(C=CC(=C1)F)C(=O)C F336011 [0,2,0,0,0,0|1,0,1]=4 2468 B11R1.166 CC1=C(C=CC(=C1)F)C(=O)Cl F337879 [0,2,0,0,0,0|2,0,0]=4 2469 B11R1.166 CC1=C(C=CC(=C1)F)C(=O)O F156728 [0,2,0,0,0,0|2,0,0]=4 2470 B11R1.166 CC1=C(C=CC(=C1)I)C(=O)O L573533 [0,2,0,0,0,0|2,0,0]=4 2471 B11R1.166 CC1=C(C=CC(=C1)N)C(=O)O A133080 [0,2,0,0,0,0|2,0,0]=4 2472 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)C H124612 [0,2,0,0,0,0|0,0,1]=3 2473 B11R1.166 CC1=C(C=CC(=C1)O)C(=O)O H139023 [0,2,0,0,0,0|1,0,0]=3 2474 B11R1.166 CC1=C(C=CC(=C1)O)C(C)C I157507 [0,2,0,0,0,0|0,0,2]=4 2475 B11R1.166 CC1=C(C=CC(=C1)O)[N+](=O)[O-] N159535 [0,2,0,0,0,0|2,0,0]=4 2476 B11R1.166 CC1=CC(=C(C=C1)C(=O)C)C D108574 [0,2,0,0,0,0|1,0,1]=4 2477 B11R1.166 CC1=CC(=C(C=C1)C(=O)C)O H156900 [0,2,0,0,0,0|1,0,1]=4 2478 B11R1.166 CC1=CC(=C(C=C1)C(=O)Cl)C D301998 [0,2,0,0,0,0|2,0,0]=4 2479 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)Br B123862 [0,2,0,0,0,0|2,0,0]=4 2480 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)C D101977 [0,2,0,0,0,0|2,0,0]=4 2481 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)Cl C186521 [0,2,0,0,0,0|2,0,0]=4 2482 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)F F120565 [0,2,0,0,0,0|2,0,0]=4 2483 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)N A151592 [0,2,0,0,0,0|2,0,0]=4 2484 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O M111847 [0,2,0,0,0,0|2,0,0]=4 2485 B11R1.166 C[S+](C)C1=C(C=C(C=C1)O)O D349670 [0,2,0,0,0,0|1,0,1]=4 2486 B11R1.166 NC1=CC(=C(C=C1)C([O-])=O)O S408715 [0,2,0,0,0,0|2,0,0]=4 2487 B11R1.37 C1=CC(=C(C=C1O)C#N)C#N H156977 [0,2,0,0,0,0|1,0,1]=4 2488 B11R1.37 CC1=CC(=C(C=C1)C=O)OC M589533 [0,2,0,0,0,0|2,0,0]=4 2489 B11R1.37 COC1=C(C=C(C=C1)O)C=O H192950 [0,2,0,0,0,0|1,0,1]=4 2490 B11R1.37 COC1=C(C=C(C=C1)O)OC D107922 [0,2,0,0,0,0|1,0,1]=4 2491 B11R1.37 COC1=C(C=CC(=C1)Br)C=O B124176 [0,2,0,0,0,0|2,0,0]=4 2492 B11R1.37 COC1=C(C=CC(=C1)Cl)C=O C193805 [0,2,0,0,0,0|2,0,0]=4 2493 B11R1.37 COC1=C(C=CC(=C1)F)C=O F124184 [0,2,0,0,0,0|2,0,0]=4 2494 B11R1.37 COC1=C(C=CC(=C1)O)C=O H132034 [0,2,0,0,0,0|1,0,0]=3 2495 B11R1.277 C1=C(C(=CC(=C1Cl)Br)F)C=O B587482 [0,2,0,0,0,0|2,0,0]=4 2496 B11R1.277 C1=C(C(=CC(=C1Cl)O)O)C=O C302355 [0,2,0,0,0,0|1,0,0]=3 2497 B11R1.277 C1=C(C(=CC(=C1F)Br)Cl)C=O C578596 [0,2,0,0,0,0|2,0,0]=4 2498 B11R1.277 C1=C(C(=CC(=C1F)Br)F)C=O B183997 [0,2,0,0,0,0|2,0,0]=4 2499 B11R1.277 C1=C(C(=CC(=C1F)Cl)F)C=O C187567 [0,2,0,0,0,0|2,0,0]=4 2500 B11R1.277 C1=C(C(=CC(=C1F)F)Br)C=O B184679 [0,2,0,0,0,0|2,0,0]=4 2501 B11R1.277 C1=C(C(=CC(=C1F)F)F)C=O T161511 [0,2,0,0,0,0|2,0,0]=4 2502 B11R1.277 C1=C(C(=CC(=C1F)F)O)C=O B131832 [0,2,0,0,0,0|2,0,0]=4 2503 B11R1.277 C1=C(C(=CC(=C1F)O)F)C=O D124138 [0,2,0,0,0,0|1,0,0]=3 2504 B11R1.277 CC1=CC(=C(C=C1C)C=O)C T162651 [0,2,0,0,0,0|2,0,0]=4 2505 B11R1.278 C1=CC(=C(C(=C1C#N)F)F)O D122741 [0,2,0,0,0,0|1,0,1]=4 2506 B11R1.278 C1=CC(=C(C(=C1C=O)F)Cl)Cl D578619 [0,2,0,0,0,0|2,0,0]=4 2507 B11R1.278 C1=CC(=C(C(=C1C=O)F)F)Br B194378 [0,2,0,0,0,0|2,0,0]=4 2508 B11R1.278 C1=CC(=C(C(=C1C=O)F)F)F T161510 [0,2,0,0,0,0|2,0,0]=4 2509 B11R1.278 C1=CC(=C(C(=C1C=O)O)O)O T107278 [0,2,0,0,0,0|1,0,0]=3 2510 B11R1.278 CC1=C(C(=C(C=C1)C=O)F)F D183110 [0,2,0,0,0,0|2,0,0]=4 2511 B11R1.278 CC1=C(C=CC(=C1O)C=O)O D194257 [0,2,0,0,0,0|1,0,0]=3 2512 B11R1.278 COC1=C(C(=C(C=C1)O)F)F D124115 [0,2,0,0,0,0|1,0,1]=4 2513 B11R1.464 C1=C(C=C(C(=C1Cl)C=O)Cl)Br B586388 [0,2,0,0,0,0|2,0,0]=4 2514 B11R1.464 C1=C(C=C(C(=C1Cl)C=O)Cl)Cl T192274 [0,2,0,0,0,0|2,0,0]=4 2515 B11R1.464 C1=C(C=C(C(=C1Cl)C=O)Cl)O D330755 [0,2,0,0,0,0|1,0,0]=3 2516 B11R1.464 C1=C(C=C(C(=C1Cl)CO)Cl)O H400308 [0,2,0,0,0,0|1,0,1]=4 2517 B11R1.464 C1=C(C=C(C(=C1F)C#N)F)O D101742 [0,2,0,0,0,0|1,0,1]=4 2518 B11R1.464 C1=C(C=C(C(=C1F)C=O)Br)Br D182650 [0,2,0,0,0,0|2,0,0]=4 2519 B11R1.464 C1=C(C=C(C(=C1F)C=O)F)Br B122611 [0,2,0,0,0,0|2,0,0]=4 2520 B11R1.464 C1=C(C=C(C(=C1F)C=O)F)Cl C169037 [0,2,0,0,0,0|2,0,0]=4 2521 B11R1.464 C1=C(C=C(C(=C1F)C=O)F)F T124135 [0,2,0,0,0,0|2,0,0]=4 2522 B11R1.464 C1=C(C=C(C(=C1F)C=O)F)O D124140 [0,2,0,0,0,0|1,0,0]=3 2523 B11R1.464 C1=C(C=C(C(=C1F)CO)F)O D184544 [0,2,0,0,0,0|1,0,1]=4 2524 B11R1.464 C1=C(C=C(C(=C1O)C=O)Cl)Cl D134853 [0,2,0,0,0,0|2,0,0]=4 2525 B11R1.464 C1=C(C=C(C(=C1O)C=O)O)O T161492 [0,2,0,0,0,0|1,0,0]=3 2526 B11R1.464 CC1=CC(=C(C(=C1)C)C=C)C T161978 [0,2,0,0,0,0|1,0,0]=3 2527 B11R1.464 CC1=CC(=C(C(=C1)C)C=O)C M109959 [0,2,0,0,0,0|2,0,0]=4 2528 B11R1.464 CC1=CC(=CC(=C1C=O)C)Br B589541 [0,2,0,0,0,0|2,0,0]=4 2529 B11R1.464 CC1=CC(=CC(=C1C=O)C)O D189189 [0,2,0,0,0,0|1,0,0]=3 2530 B11R1.464 CC1=CC(=CC(=C1C=O)O)O D589243 [0,2,0,0,0,0|1,0,0]=3 2531 B11R1.464 CC1=CC(=CC(=C1OC)C)O D299390 [0,2,0,0,0,0|1,0,1]=4 2532 B11R1.14 C1=C(C=C(C(=C1Br)O)Br)C#N B135561 [0,2,0,0,0,0|1,0,1]=4 2533 B11R1.14 C1=C(C=C(C(=C1Br)O)Br)C#N B141237 [0,2,0,0,0,0|1,0,1]=4 2534 B11R1.14 C1=C(C=C(C(=C1Br)O)Br)C#N B141452 [0,2,0,0,0,0|1,0,1]=4 2535 B11R1.14 C1=C(C=C(C(=C1Br)O)Br)C=O D117854 [0,2,0,0,0,0|1,0,0]=3 2536 B11R1.14 C1=C(C=C(C(=C1Cl)O)Br)C=O B191730 [0,2,0,0,0,0|1,0,0]=3 2537 B11R1.14 C1=C(C=C(C(=C1F)Cl)Cl)C=O D576829 [0,2,0,0,0,0|2,0,0]=4 2538 B11R1.14 C1=C(C=C(C(=C1F)F)F)C=O T124161 [0,2,0,0,0,0|2,0,0]=4 2539 B11R1.14 C1=C(C=C(C(=C1F)O)F)C#N D192591 [0,2,0,0,0,0|1,0,1]=4 2540 B11R1.14 C1=C(C=C(C(=C1F)O)F)C=O D124163 [0,2,0,0,0,0|1,0,0]=3 2541 B11R1.14 C1=C(C=C(C(=C1F)O)F)C=O D492705 [0,2,0,0,0,0|1,0,0]=3 2542 B11R1.14 C1=C(C=C(C(=C1I)O)I)C=O H156881 [0,2,0,0,0,0|1,0,0]=3 2543 B11R1.14 C1=C(C=C(C(=C1O)O)O)C=O T168487 [0,2,0,0,0,0|1,0,0]=3 2544 B11R1.14 C1=C(C=C(C(=C1O)O)O)C=O T190718 [0,2,0,0,0,0|1,0,0]=3 2545 B11R1.14 CC1=C(C=C(C=C1I)C=O)I D195377 [0,2,0,0,0,0|2,0,0]=4 2546 B11R1.14 CC1=CC(=CC(=C1Br)C)C=O B193229 [0,2,0,0,0,0|2,0,0]=4 2547 B11R1.14 CC1=CC(=CC(=C1O)C)C#N H136322 [0,2,0,0,0,0|1,0,1]=4 2548 B11R1.14 CC1=CC(=CC(=C1O)C)C=O H135703 [0,2,0,0,0,0|1,0,0]=3 2549 B11R1.14 COC1=CC(=C(C(=C1)Br)O)N A405658 [0,2,0,0,0,0|1,0,1]=4 2550 B11R1.14 COC1=CC(=C(C(=C1)F)O)F D187750 [0,2,0,0,0,0|1,0,1]=4 2551 B11R1.280 C1=CC(=C(C=C1C=O)C#N)F F124171 [0,2,0,0,0,0|2,0,0]=4 2552 B11R1.280 C1=CC(=C(C=C1C=O)C=O)O H157418 [0,2,0,0,0,0|1,0,0]=3 2553 B11R1.280 C1=CC(=C(C=C1CCl)C=O)O C346082 [0,2,0,0,0,0|1,0,1]=4 2554 B11R1.280 CCC1=CC(=C(C=C1)O)C=O E344459 [0,2,0,0,0,0|0,0,2]=4 2555 B11R1.280 CCC1=CC(=C(C=C1)O)OC E111257 [0,2,0,0,0,0|0,0,2]=4 2556 B11R1.280 COC1=C(C=CC(=C1)C#N)O H156992 [0,2,0,0,0,0|1,0,1]=4 2557 B11R1.280 COC1=C(C=CC(=C1)C=C)O M137776 [0,2,0,0,0,0|0,0,0]=2 2558 B11R1.280 COC1=C(C=CC(=C1)C=O)Br B184522 [0,2,0,0,0,0|2,0,0]=4 2559 B11R1.280 COC1=C(C=CC(=C1)C=O)Cl C190733 [0,2,0,0,0,0|2,0,0]=4 2560 B11R1.280 COC1=C(C=CC(=C1)C=O)F F108788 [0,2,0,0,0,0|2,0,0]=4 2561 B11R1.280 COC1=C(C=CC(=C1)C=O)O V100115 [0,2,0,0,0,0|1,0,0]=3 2562 B11R1.280 COC1=C(C=CC(=C1)C=O)O V128320 [0,2,0,0,0,0|1,0,0]=3 2563 B11R1.280 COC1=C(C=CC(=C1)C=O)O V141281 [0,2,0,0,0,0|1,0,0]=3 2564 B11R1.280 COC1=C(C=CC(=C1)C=O)O V420926 [0,2,0,0,0,0|1,0,0]=3 2565 B11R1.280 COC1=C(C=CC(=C1)C=O)O V431597 [0,2,0,0,0,0|1,0,0]=3 2566 B11R1.280 COC1=C(C=CC(=C1)CN)O A586553 [0,2,0,0,0,0|1,0,1]=4 2567 B11R1.280 COC1=C(C=CC(=C1)CN)O V103080 [0,2,0,0,0,0|1,0,1]=4 2568 B11R1.280 COC1=C(C=CC(=C1)CO)O H103777 [0,2,0,0,0,0|1,0,1]=4 2569 B11R1.280 COC1=CC(=C(C=C1)O)C#N H588994 [0,2,0,0,0,0|1,0,1]=4 2570 B11R1.280 COC1=CC(=C(C=C1)O)C=O H113429 [0,2,0,0,0,0|1,0,1]=4 2571 B11R1.280 COC1=CC(=C(C=C1)O)OC D190590 [0,2,0,0,0,0|1,0,1]=4 2572 B9R1.3 C1=CC(=C(C(=C1)Br)Br)O D346206 [0,0,1,1,0,0|2,0,0]=4 2573 B9R1.3 C1=CC(=C(C(=C1)Br)Cl)O B195395 [0,0,1,1,0,0|2,0,0]=4 2574 B9R1.3 C1=CC(=C(C(=C1)Br)F)O B181777 [0,0,1,1,0,0|2,0,0]=4 2575 B9R1.3 C1=CC(=C(C(=C1)Br)I)O B187151 [0,0,1,1,0,0|2,0,0]=4 2576 B9R1.3 C1=CC(=C(C(=C1)Br)N)O A166175 [0,0,1,1,0,0|2,0,0]=4 2577 B9R1.3 C1=CC(=C(C(=C1)Br)O)O B152693 [0,0,1,1,0,0|2,0,0]=4 2578 B9R1.3 C1=CC(=C(C(=C1)Cl)Br)O B187152 [0,0,1,1,0,0|2,0,0]=4 2579 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)O D106516 [0,0,1,1,0,0|2,0,0]=4 2580 B9R1.3 C1=CC(=C(C(=C1)Cl)Cl)O D106517 [0,0,1,1,0,0|2,0,0]=4 2581 B9R1.3 C1=CC(=C(C(=C1)Cl)F)O C122586 [0,0,1,1,0,0|2,0,0]=4 2582 B9R1.3 C1=CC(=C(C(=C1)Cl)N)O A193993 [0,0,1,1,0,0|2,0,0]=4 2583 B9R1.3 C1=CC(=C(C(=C1)Cl)O)O C153516 [0,0,1,1,0,0|2,0,0]=4 2584 B9R1.3 C1=CC(=C(C(=C1)F)Br)O B184569 [0,0,1,1,0,0|2,0,0]=4 2585 B9R1.3 C1=CC(=C(C(=C1)F)Cl)O C177721 [0,0,1,1,0,0|2,0,0]=4 2586 B9R1.3 C1=CC(=C(C(=C1)F)F)O D123506 [0,0,1,1,0,0|2,0,0]=4 2587 B9R1.3 C1=CC(=C(C(=C1)F)O)O F122610 [0,0,1,1,0,0|2,0,0]=4 2588 B9R1.3 C1=CC(=C(C(=C1)O)Br)N A171600 [0,0,1,1,0,0|2,0,0]=4 2589 B9R1.3 C1=CC(=C(C(=C1)O)Br)O B139168 [0,0,1,1,0,0|2,0,0]=4 2590 B9R1.3 C1=CC(=C(C(=C1)O)Cl)O C171213 [0,0,1,1,0,0|2,0,0]=4 2591 B9R1.3 C1=CC(=C(C(=C1)O)I)O I157530 [0,0,1,1,0,0|2,0,0]=4 2592 B9R1.3 C1=CC(=C(C(=C1)O)N)N D171126 [0,0,1,1,0,0|2,0,0]=4 2593 B9R1.3 C1=CC(=C(C(=C1)O)N)O A192687 [0,0,1,1,0,0|2,0,0]=4 2594 B9R1.3 C1=CC(=C(C(=C1)O)O)O P104234 [0,0,1,1,0,0|2,0,0]=4 2595 B9R1.3 C1=CC(=C(C(=C1)O)O)O P104235 [0,0,1,1,0,0|2,0,0]=4 2596 B9R1.3 C1=CC(=C(C(=C1)O)O)O P426622 [0,0,1,1,0,0|2,0,0]=4 2597 B9R1.3 CC1=C(C(=CC=C1)O)Br B182885 [0,0,1,1,0,0|1,0,1]=4 2598 B9R1.3 CC1=C(C(=CC=C1)O)C D104325 [0,0,1,1,0,0|0,0,2]=4 2599 B9R1.3 CC1=C(C(=CC=C1)O)C D104326 [0,0,1,1,0,0|0,0,2]=4 2600 B9R1.3 CC1=C(C(=CC=C1)O)C D117386 [0,0,1,1,0,0|0,0,2]=4 2601 B9R1.3 CC1=C(C(=CC=C1)O)F F358560 [0,0,1,1,0,0|1,0,1]=4 2602 B9R1.3 CC1=C(C(=CC=C1)O)N A151257 [0,0,1,1,0,0|1,0,1]=4 2603 B9R1.3 CC1=C(C(=CC=C1)O)O M124478 [0,0,1,1,0,0|1,0,1]=4 2604 B9R1.3 CC1=C(C=CC=C1Br)O B186587 [0,0,1,1,0,0|1,0,1]=4 2605 B9R1.3 CC1=C(C=CC=C1Cl)O C192741 [0,0,1,1,0,0|1,0,1]=4 2606 B9R1.3 CC1=C(C=CC=C1F)O F589138 [0,0,1,1,0,0|1,0,1]=4 2607 B9R1.3 CC1=C(C=CC=C1O)N A151256 [0,0,1,1,0,0|1,0,1]=4 2608 B9R1.3 CC1=C(C=CC=C1O)O M133940 [0,0,1,1,0,0|1,0,1]=4 2609 B9R1.3 CC1=C(C=CC=C1O)O M135030 [0,0,1,1,0,0|1,0,1]=4 2610 B9R1.5 C1=CC=C(C(=O)C=C1)Cl C131496 [0,0,1,1,0,0|1,0,1]=4 2611 B9R1.5 C1=CC=C(C(=O)C=C1)O T112998 [0,0,1,1,0,0|1,0,0]=3 2612 B9R1.12 C1=COC(=C1)C=CC=O F103082 [0,0,1,1,0,0|1,0,1]=4 2613 B9R2.50 C1CC2=CC=CC=C21 B107638 [1,0,0,1,0,0|0,0,2]=4 2614 B11R2.36 C1=CC(=CC2=C1C=CN2)Br B123498 [0,1,0,1,0,0|1,0,0]=3 2615 B11R2.36 C1=CC(=CC2=C1C=CN2)Cl C123500 [0,1,0,1,0,0|1,0,0]=3 2616 B11R2.36 C1=CC(=CC2=C1C=CN2)F F111471 [0,1,0,1,0,0|1,0,0]=3 2617 B11R2.36 C1=CC(=CC2=C1C=CN2)N A119320 [0,1,0,1,0,0|1,0,0]=3 2618 B11R2.36 C1=CC(=CC2=C1C=CN2)O H102255 [0,1,0,1,0,0|0,0,0]=2 2619 B11R2.36 C1=CC(=CC2=C1C=CO2)Br B173227 [0,1,0,1,0,0|1,0,0]=3 2620 B11R2.36 C1=CC(=CC2=C1C=CO2)N B586369 [0,1,0,1,0,0|1,0,0]=3 2621 B11R2.36 C1=CC(=CC2=C1C=CS2)Br B133149 [0,1,0,1,0,0|1,0,0]=3 2622 B11R2.36 C1=CC(=NC2=C1C=CN2)Br B181491 [0,1,0,1,0,0|2,0,0]=4 2623 B11R2.36 C1=CC(=NC2=C1C=CN2)Cl C176770 [0,1,0,1,0,0|2,0,0]=4 2624 B11R2.36 C1=CC(=NC2=C1C=CN2)F F195689 [0,1,0,1,0,0|2,0,0]=4 2625 B11R2.36 C1=CC(=NC2=C1NC=C2)Cl C124823 [0,1,0,1,0,0|2,0,0]=4 2626 B11R2.36 C1=CC(=NC2=C1NC=C2)F F195603 [0,1,0,1,0,0|2,0,0]=4 2627 B11R2.36 C1=CC(=NC2=C1SC=C2)Cl C177088 [0,1,0,1,0,0|2,0,0]=4 2628 B11R2.36 C1=CC(=O)NC2=C1C=CN2 H589458 [0,1,0,1,0,0|1,0,1]=4 2629 B11R2.36 C1=CC2=C(C=C1Br)C=NN2 B122429 [0,1,0,1,0,0|2,0,0]=4 2630 B11R2.36 C1=CC2=C(C=C1Br)C=NN2 B589198 [0,1,0,1,0,0|2,0,0]=4 2631 B11R2.36 C1=CC2=C(C=C1Br)N=CO2 B166962 [0,1,0,1,0,0|2,0,0]=4 2632 B11R2.36 C1=CC2=C(C=C1Br)N=CS2 B186512 [0,1,0,1,0,0|2,0,0]=4 2633 B11R2.36 C1=CC2=C(C=C1Br)NC=N2 B137245 [0,1,0,1,0,0|2,0,0]=4 2634 B11R2.36 C1=CC2=C(C=C1Br)NN=C2 B152362 [0,1,0,1,0,0|2,0,0]=4 2635 B11R2.36 C1=CC2=C(C=C1Br)OC=N2 B184114 [0,1,0,1,0,0|2,0,0]=4 2636 B11R2.36 C1=CC2=C(C=C1Br)SC=N2 B135001 [0,1,0,1,0,0|2,0,0]=4 2637 B11R2.36 C1=CC2=C(C=C1Cl)C=NN2 C186101 [0,1,0,1,0,0|2,0,0]=4 2638 B11R2.36 C1=CC2=C(C=C1Cl)N=CO2 C167876 [0,1,0,1,0,0|2,0,0]=4 2639 B11R2.36 C1=CC2=C(C=C1Cl)N=CS2 C192496 [0,1,0,1,0,0|2,0,0]=4 2640 B11R2.36 C1=CC2=C(C=C1Cl)NC=N2 C153428 [0,1,0,1,0,0|2,0,0]=4 2641 B11R2.36 C1=CC2=C(C=C1Cl)NN=C2 C177222 [0,1,0,1,0,0|2,0,0]=4 2642 B11R2.36 C1=CC2=C(C=C1Cl)OC=N2 C182978 [0,1,0,1,0,0|2,0,0]=4 2643 B11R2.36 C1=CC2=C(C=C1F)C=NN2 F169766 [0,1,0,1,0,0|2,0,0]=4 2644 B11R2.36 C1=CC2=C(C=C1F)NC=N2 F191875 [0,1,0,1,0,0|2,0,0]=4 2645 B11R2.36 C1=CC2=C(C=C1I)NC=N2 I195064 [0,1,0,1,0,0|2,0,0]=4 2646 B11R2.36 C1=CC2=C(C=C1I)NN=C2 I157583 [0,1,0,1,0,0|2,0,0]=4 2647 B11R2.36 C1=CC2=C(C=C1N)C=NN2 A113923 [0,1,0,1,0,0|2,0,0]=4 2648 B11R2.36 C1=CC2=C(C=C1N)N=CS2 A138033 [0,1,0,1,0,0|2,0,0]=4 2649 B11R2.36 C1=CC2=C(C=C1N)NC=N2 A151159 [0,1,0,1,0,0|2,0,0]=4 2650 B11R2.36 C1=CC2=C(C=C1N)NC=N2 H332116 [0,1,0,1,0,0|2,0,0]=4 2651 B11R2.36 C1=CC2=C(C=C1N)NN=C2 A110323 [0,1,0,1,0,0|2,0,0]=4 2652 B11R2.36 C1=CC2=C(C=C1N)SC=N2 A113931 [0,1,0,1,0,0|2,0,0]=4 2653 B11R2.36 C1=CC2=C(C=C1O)C=NN2 H122402 [0,1,0,1,0,0|1,0,0]=3 2654 B11R2.36 C1=CC2=C(C=C1O)NN=C2 H157135 [0,1,0,1,0,0|1,0,0]=3 2655 B11R2.36 C1=CC2=C(C=C1O)SC=N2 H157270 [0,1,0,1,0,0|1,0,0]=3 2656 B11R2.36 C1=CC2=C(C=CN2)C=C1Br B111473 [0,1,0,1,0,0|1,0,0]=3 2657 B11R2.36 C1=CC2=C(C=CN2)C=C1Cl C119122 [0,1,0,1,0,0|1,0,0]=3 2658 B11R2.36 C1=CC2=C(C=CN2)C=C1F F111474 [0,1,0,1,0,0|1,0,0]=3 2659 B11R2.36 C1=CC2=C(C=CN2)C=C1I I122983 [0,1,0,1,0,0|1,0,0]=3 2660 B11R2.36 C1=CC2=C(C=CN2)C=C1N A107386 [0,1,0,1,0,0|1,0,0]=3 2661 B11R2.36 C1=CC2=C(C=CN2)C=C1O H105520 [0,1,0,1,0,0|0,0,0]=2 2662 B11R2.36 C1=CC2=C(C=CO2)C=C1Br B168831 [0,1,0,1,0,0|1,0,0]=3 2663 B11R2.36 C1=CC2=C(C=CS2)C=C1Br B101866 [0,1,0,1,0,0|1,0,0]=3 2664 B11R2.36 C1=CC2=C(C=CS2)C=C1Cl C135346 [0,1,0,1,0,0|1,0,0]=3 2665 B11R2.36 C1=CC2=CSN=C2C=C1Br B343921 [0,1,0,1,0,0|2,0,0]=4 2666 B11R2.36 C1=CC2=NC=CN2C=C1Br B137301 [0,1,0,1,0,0|2,0,0]=4 2667 B11R2.36 C1=CC2=NC=CN2C=C1Cl C194225 [0,1,0,1,0,0|2,0,0]=4 2668 B11R2.36 C1=CC2=NC=CN2C=C1F F181399 [0,1,0,1,0,0|2,0,0]=4 2669 B11R2.36 C1=CC2=NC=CN2C=C1I I342463 [0,1,0,1,0,0|2,0,0]=4 2670 B11R2.36 C1=CN2C(=CC=N2)C=C1Br B171861 [0,1,0,1,0,0|2,0,0]=4 2671 B11R2.36 C1=CN2C(=CC=N2)C=C1N P172013 [0,1,0,1,0,0|2,0,0]=4 2672 B11R2.36 C1=CN2C=CN=C2C=C1Br W135900 [0,1,0,1,0,0|2,0,0]=4 2673 B11R2.36 C1=CN2C=CN=C2C=C1Cl C176512 [0,1,0,1,0,0|2,0,0]=4 2674 B11R2.36 C1=CN2C=CN=C2C=C1F F586844 [0,1,0,1,0,0|2,0,0]=4 2675 B11R2.36 C1=CNC2=C1N=CC(=C2)Br B139476 [0,1,0,1,0,0|2,0,0]=4 2676 B11R2.36 C1=CNC2=C1N=CC(=C2)Cl C586160 [0,1,0,1,0,0|2,0,0]=4 2677 B11R2.36 C1=CNC2=C1N=CC(=C2)I I165431 [0,1,0,1,0,0|2,0,0]=4 2678 B11R2.36 C1=CNC2=CN=C(C=C21)Br B166544 [0,1,0,1,0,0|2,0,0]=4 2679 B11R2.36 C1=CNC2=CN=C(C=C21)Cl C173298 [0,1,0,1,0,0|2,0,0]=4 2680 B11R2.36 C1=CNC2=NC=C(C=C21)Br B102309 [0,1,0,1,0,0|2,0,0]=4 2681 B11R2.36 C1=CNC2=NC=C(C=C21)Cl C122893 [0,1,0,1,0,0|2,0,0]=4 2682 B11R2.36 C1=CNC2=NC=C(C=C21)F F122930 [0,1,0,1,0,0|2,0,0]=4 2683 B11R2.36 C1=CNC2=NC=C(C=C21)I I178091 [0,1,0,1,0,0|2,0,0]=4 2684 B11R2.36 C1=CNC2=NC=C(C=C21)N H137408 [0,1,0,1,0,0|2,0,0]=4 2685 B11R2.36 C1=CNC2=NC=C(C=C21)O H178602 [0,1,0,1,0,0|1,0,0]=3 2686 B11R2.36 C1=COC2=NC=C(C=C21)Br B182894 [0,1,0,1,0,0|2,0,0]=4 2687 B11R2.36 C1CC2=C(C1)C=C(C=C2)O H157229 [0,1,0,1,0,0|0,0,2]=4 2688 B11R2.36 C1OC2=C(O1)C=C(C=C2)O S106853 [0,1,0,1,0,0|1,0,1]=4 2689 B11R2.36 CC1=CC2=C(C=C1)C=CN2 M107953 [0,1,0,1,0,0|1,0,0]=3 2690 B11R2.36 CC1=CC2=C(C=C1)N=CN2 M158013 [0,1,0,1,0,0|2,0,0]=4 2691 B11R2.36 CC1=CC2=C(C=C1)N=CS2 M588612 [0,1,0,1,0,0|2,0,0]=4 2692 B11R2.36 CC1=CC2=C(C=C1)NC=C2 M113638 [0,1,0,1,0,0|1,0,0]=3 2693 B11R2.36 CC1=CC2=C(C=C1)NN=C2 M121870 [0,1,0,1,0,0|2,0,0]=4 2694 B11R2.36 CC1=CC2=C(C=C1)OC=N2 M158471 [0,1,0,1,0,0|2,0,0]=4 2695 B11R2.36 CC1=CC2=C(C=C1)SC=C2 M158051 [0,1,0,1,0,0|1,0,0]=3 2696 B11R2.36 CC1=CC2=C(NC=C2)N=C1 M134033 [0,1,0,1,0,0|2,0,0]=4 2697 B11R2.36 CC1=CC2=NC=CN2C=C1 M187496 [0,1,0,1,0,0|2,0,0]=4 2698 B11R2.36 CC1=NC2=C(C=C1)C=CN2 M195188 [0,1,0,1,0,0|2,0,0]=4 2699 B11R2.190 C=CC1=CC2=C(CC2)C=C1 V196176 [0,1,0,1,0,0|1,0,0]=3 2700 B7R1.1 C1=CNC(=C1)C=O P123130 [1,0,0,0,1,0|2,0,0]=4 2701 B7R1.1 C1=COC(=C1)C=O F100546 [1,0,0,0,1,0|2,0,0]=4 2702 B7R1.1 C1=COC(=C1)C=O F100547 [1,0,0,0,1,0|2,0,0]=4 2703 B7R1.1 C1=COC(=C1)C=O F100548 [1,0,0,0,1,0|2,0,0]=4 2704 B7R1.1 C1=COC(=C1)C=O F336820 [1,0,0,0,1,0|2,0,0]=4 2705 B7R1.1 C1=COC=C1C=O F122652 [1,0,0,0,1,0|2,0,0]=4 2706 B7R1.1 C1=CSC(=C1)C=O T107122 [1,0,0,0,1,0|2,0,0]=4 2707 B7R1.1 C1=CSC=C1C=O T115194 [1,0,0,0,1,0|2,0,0]=4 2708 B7R1.1 C=CC1=CC=CS1 V305289 [1,0,0,0,1,0|1,0,0]=3 2709 B7R1.1 C=CN1C=CN=C1 V109377 [1,0,0,0,1,0|2,0,0]=4