0 B9R1.1 C#CC1=CC=C(C=C1)Br B100857 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.1 C#CC1=CC=C(C=C1)Cl C115544 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.1 C#CC1=CC=C(C=C1)F E115545 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.1 C#CC1=CC=C(C=C1)N E156336 [0,0,0,0,0,0|2,0,2]=4 4 B9R1.1 C#CC1=CN=C(C=C1)F E590351 [0,0,0,0,0,0|1,0,2]=3 5 B9R1.1 C1=C(C=NC(=N1)Cl)CO C171812 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.1 C1=C(C=NC(=N1)N)C#N A182142 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.1 C1=C(C=NC(=N1)N)C=O A123166 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.1 C1=C(C=NC(=N1)N)CO A172565 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.1 C1=C(N=CC(=N1)Cl)CO C177296 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.1 C1=CC(=CC=C1C#N)Br B152383 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.1 C1=CC(=CC=C1C#N)Cl C105375 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.1 C1=CC(=CC=C1C#N)F F120871 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.1 C1=CC(=CC=C1C#N)I I103578 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.1 C1=CC(=CC=C1C#N)N A107274 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.1 C1=CC(=CC=C1C#N)O H115122 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.1 C1=CC(=CC=C1C#N)O H115123 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.1 C1=CC(=CC=C1C#N)S M184058 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.1 C1=CC(=CC=C1C=O)Br B109177 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.1 C1=CC(=CC=C1C=O)Br B419287 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.1 C1=CC(=CC=C1C=O)Cl C104155 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.1 C1=CC(=CC=C1C=O)F F109178 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.1 C1=CC(=CC=C1C=O)I I138274 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.1 C1=CC(=CC=C1C=O)N A303975 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.1 C1=CC(=CC=C1C=O)N A405596 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.1 C1=CC(=CC=C1C=O)O H100420 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.1 C1=CC(=CC=C1C=O)O H100421 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.1 C1=CC(=CC=C1C=O)O H431620 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.1 C1=CC(=CC=C1CBr)Br B171105 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.1 C1=CC(=CC=C1CBr)Cl C135867 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.1 C1=CC(=CC=C1CBr)F F120595 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.1 C1=CC(=CC=C1CBr)I I122909 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.1 C1=CC(=CC=C1CCl)Br B113785 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.1 C1=CC(=CC=C1CCl)Cl C106513 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.1 C1=CC(=CC=C1CCl)F F100905 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.1 C1=CC(=CC=C1CN)Br B133133 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.1 C1=CC(=CC=C1CN)Br B136595 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.1 C1=CC(=CC=C1CN)Cl C117222 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.1 C1=CC(=CC=C1CN)Cl C493514 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.1 C1=CC(=CC=C1CN)F F111212 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.1 C1=CC(=CC=C1CN)F F292633 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.1 C1=CC(=CC=C1CN)F F292646 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.1 C1=CC(=CC=C1CN)F F404486 [0,0,0,0,0,0|3,0,0]=3 43 B9R1.1 C1=CC(=CC=C1CN)I I171122 [0,0,0,0,0,0|3,0,0]=3 44 B9R1.1 C1=CC(=CC=C1CN)N A151636 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.1 C1=CC(=CC=C1CN)N A193875 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.1 C1=CC(=CC=C1CN)O A139192 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.1 C1=CC(=CC=C1CN)O A187992 [0,0,0,0,0,0|3,0,0]=3 48 B9R1.1 C1=CC(=CC=C1CO)Br B139372 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.1 C1=CC(=CC=C1CO)Cl C109479 [0,0,0,0,0,0|3,0,0]=3 50 B9R1.1 C1=CC(=CC=C1CO)F F156598 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.1 C1=CC(=CC=C1CO)I I138398 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.1 C1=CC(=CC=C1CO)N A107272 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.1 C1=CC(=CC=C1CO)O H107912 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.1 C1=CC(=CC=C1CS)Br B101799 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.1 C1=CC(=CC=C1CS)Cl C101789 [0,0,0,0,0,0|3,0,0]=3 56 B9R1.1 C1=CC(=CC=C1CS)F F101796 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.1 C1=CC(=CC=C1N=O)O N159523 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.1 C1=CC(=CC=C1NN)Br B109685 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.1 C1=CC(=CC=C1NN)Br B141295 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.1 C1=CC(=CC=C1NN)Br B185411 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.1 C1=CC(=CC=C1NN)Br B193346 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.1 C1=CC(=CC=C1NN)Cl C110269 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.1 C1=CC(=CC=C1NN)Cl C153656 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.1 C1=CC(=CC=C1NN)F F110267 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.1 C1=CC(=CC=C1NN)I I166921 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.1 C1=CC(=CC=C1NN)I I194278 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.1 C1=CC(=CC=C1[N+]#N)Br B152895 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.1 C1=CC(=NC=C1Br)CN B182096 [0,0,0,0,0,0|4,0,0]=4 69 B9R1.1 C1=CC(=NC=C1Br)CO B121986 [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|2,0,1]=3 71 B9R1.1 C1=CC(=NC=C1C#N)Cl C123447 [0,0,0,0,0,0|2,0,1]=3 72 B9R1.1 C1=CC(=NC=C1C#N)F F176363 [0,0,0,0,0,0|2,0,1]=3 73 B9R1.1 C1=CC(=NC=C1C#N)N A151661 [0,0,0,0,0,0|2,0,1]=3 74 B9R1.1 C1=CC(=NC=C1C=O)Br B115763 [0,0,0,0,0,0|2,0,1]=3 75 B9R1.1 C1=CC(=NC=C1C=O)Cl C122666 [0,0,0,0,0,0|2,0,1]=3 76 B9R1.1 C1=CC(=NC=C1C=O)F F185975 [0,0,0,0,0,0|2,0,1]=3 77 B9R1.1 C1=CC(=NC=C1C=O)N A177224 [0,0,0,0,0,0|2,0,1]=3 78 B9R1.1 C1=CC(=NC=C1CBr)Cl B182268 [0,0,0,0,0,0|2,0,0]=2 79 B9R1.1 C1=CC(=NC=C1CCl)Cl C106558 [0,0,0,0,0,0|2,0,0]=2 80 B9R1.1 C1=CC(=NC=C1CN)Cl A113916 [0,0,0,0,0,0|2,0,0]=2 81 B9R1.1 C1=CC(=NC=C1CO)Br B123090 [0,0,0,0,0,0|2,0,0]=2 82 B9R1.1 C1=CC(=NC=C1CO)Cl C154056 [0,0,0,0,0,0|2,0,0]=2 83 B9R1.1 C1=CC(=NC=C1CO)F F184294 [0,0,0,0,0,0|2,0,0]=2 84 B9R1.1 C1=CC(=NC=C1CO)N A136079 [0,0,0,0,0,0|2,0,0]=2 85 B9R1.1 C1=CC(=NC=C1F)CN A589490 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.1 C1=CC(=NC=C1F)CO F177498 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.1 C1=CC(=NN=C1C#N)Cl C176250 [0,0,0,0,0,0|3,0,1]=4 88 B9R1.1 C1=CC(=NN=C1NN)Cl W132179 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.1 C1=CC(=O)NC=C1C=O H179130 [0,0,0,0,0,0|2,0,2]=4 90 B9R1.1 C1=C[N+](=CC=C1CO)[O-] P168730 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.1 C=CC1=CC=C(C=C1)Br B102167 [0,0,0,0,0,0|2,0,2]=4 92 B9R1.1 C=CC1=CC=C(C=C1)Cl C121719 [0,0,0,0,0,0|2,0,2]=4 93 B9R1.1 C=CC1=CC=C(C=C1)F F107117 [0,0,0,0,0,0|2,0,2]=4 94 B9R1.1 C=CC1=CC=C(C=C1)F F407667 [0,0,0,0,0,0|2,0,2]=4 95 B9R1.1 C=CC1=CC=C(C=C1)N A151485 [0,0,0,0,0,0|2,0,2]=4 96 B9R1.1 C=CC1=CC=C(C=C1)O H189096 [0,0,0,0,0,0|2,0,2]=4 97 B9R1.1 CC1=CC=C(C=C1)C#C E106375 [0,0,0,0,0,0|1,0,2]=3 98 B9R1.1 CC1=CC=C(C=C1)C#N P160229 [0,0,0,0,0,0|2,0,1]=3 99 B9R1.1 CC1=CC=C(C=C1)C=C M158348 [0,0,0,0,0,0|1,0,2]=3 100 B9R1.1 CC1=CC=C(C=C1)C=O M105910 [0,0,0,0,0,0|2,0,1]=3 101 B9R1.1 CC1=CC=C(C=C1)CBr M109534 [0,0,0,0,0,0|2,0,0]=2 102 B9R1.1 CC1=CC=C(C=C1)CCl A101683 [0,0,0,0,0,0|2,0,0]=2 103 B9R1.1 CC1=CC=C(C=C1)CCl A164460 [0,0,0,0,0,0|2,0,0]=2 104 B9R1.1 CC1=CC=C(C=C1)CN M158669 [0,0,0,0,0,0|2,0,0]=2 105 B9R1.1 CC1=CC=C(C=C1)CO M113648 [0,0,0,0,0,0|2,0,0]=2 106 B9R1.1 CC1=CC=C(C=C1)CS M113646 [0,0,0,0,0,0|2,0,0]=2 107 B9R1.1 CC1=CC=C(C=C1)NC N159024 [0,0,0,0,0,0|2,0,0]=2 108 B9R1.1 CC1=CC=C(C=C1)NN T109603 [0,0,0,0,0,0|3,0,0]=3 109 B9R1.1 CC1=CC=C(C=C1)OC M106728 [0,0,0,0,0,0|2,0,0]=2 110 B9R1.1 CC1=CC=C(C=C1)SC M101848 [0,0,0,0,0,0|2,0,0]=2 111 B9R1.1 CC1=CN=C(C=C1)C#N C132411 [0,0,0,0,0,0|3,0,1]=4 112 B9R1.1 CC1=CN=C(C=C1)C=O M170606 [0,0,0,0,0,0|3,0,1]=4 113 B9R1.1 CC1=CN=C(C=C1)CN M589171 [0,0,0,0,0,0|3,0,0]=3 114 B9R1.1 CC1=CN=C(C=C1)OC M181247 [0,0,0,0,0,0|3,0,0]=3 115 B9R1.1 CC1=CN=C(C=N1)C=O M176646 [0,0,0,0,0,0|2,0,1]=3 116 B9R1.1 CC1=CN=C(C=N1)CN A151407 [0,0,0,0,0,0|2,0,0]=2 117 B9R1.1 CC1=NC=C(C=C1)C#N C140251 [0,0,0,0,0,0|1,0,1]=2 118 B9R1.1 CC1=NC=C(C=C1)C=O W134999 [0,0,0,0,0,0|1,0,1]=2 119 B9R1.1 CC1=NC=C(C=C1)CO W136158 [0,0,0,0,0,0|1,0,0]=1 120 B9R1.1 CC1=NN=C(C=C1)NN H193151 [0,0,0,0,0,0|3,0,0]=3 121 B9R1.1 CC1=NN=C(C=C1)OC M587689 [0,0,0,0,0,0|2,0,0]=2 122 B9R1.1 CCC1=CC=C(C=C1)Br B101890 [0,0,0,0,0,0|2,0,0]=2 123 B9R1.1 CCC1=CC=C(C=C1)Br B141181 [0,0,0,0,0,0|2,0,0]=2 124 B9R1.1 CCC1=CC=C(C=C1)C E123489 [0,0,0,0,0,0|1,0,0]=1 125 B9R1.1 CCC1=CC=C(C=C1)Cl C171229 [0,0,0,0,0,0|2,0,0]=2 126 B9R1.1 CCC1=CC=C(C=C1)I E189089 [0,0,0,0,0,0|2,0,0]=2 127 B9R1.1 CCC1=CC=C(C=C1)N E102230 [0,0,0,0,0,0|2,0,0]=2 128 B9R1.1 CCC1=CC=C(C=C1)O E115497 [0,0,0,0,0,0|2,0,0]=2 129 B9R1.1 CCC1=CC=C(C=C1)S E156190 [0,0,0,0,0,0|2,0,0]=2 130 B9R1.1 CCC1=CN=C(C=C1)C E101695 [0,0,0,0,0,0|0,0,0]=0 131 B9R1.1 CCC1=CN=C(C=C1)N E587963 [0,0,0,0,0,0|1,0,0]=1 132 B9R1.1 CCC1=CN=C(N=C1)Cl C124060 [0,0,0,0,0,0|2,0,0]=2 133 B9R1.1 CCC1=NC=C(N=C1)C E302421 [0,0,0,0,0,0|1,0,0]=1 134 B9R1.1 CC[N+]1=CC=C(C=C1)C E303436 [0,0,0,0,0,0|2,0,0]=2 135 B9R1.1 CNC1=CC=C(C=C1)Br B304406 [0,0,0,0,0,0|3,0,0]=3 136 B9R1.1 CNC1=CC=C(C=C1)Cl C139458 [0,0,0,0,0,0|3,0,0]=3 137 B9R1.1 CNC1=CC=C(C=C1)F F170454 [0,0,0,0,0,0|3,0,0]=3 138 B9R1.1 CNC1=CC=C(C=C1)N N589686 [0,0,0,0,0,0|3,0,0]=3 139 B9R1.1 CNC1=CN=C(C=C1)Br B586167 [0,0,0,0,0,0|2,0,0]=2 140 B9R1.1 COC1=CC=C(C=C1)Br B108656 [0,0,0,0,0,0|3,0,0]=3 141 B9R1.1 COC1=CC=C(C=C1)Cl C113571 [0,0,0,0,0,0|3,0,0]=3 142 B9R1.1 COC1=CC=C(C=C1)F F123675 [0,0,0,0,0,0|3,0,0]=3 143 B9R1.1 COC1=CC=C(C=C1)I I107035 [0,0,0,0,0,0|3,0,0]=3 144 B9R1.1 COC1=CC=C(C=C1)I L359048 [0,0,0,0,0,0|3,0,0]=3 145 B9R1.1 COC1=CC=C(C=C1)N A106071 [0,0,0,0,0,0|3,0,0]=3 146 B9R1.1 COC1=CC=C(C=C1)N A615348 [0,0,0,0,0,0|3,0,0]=3 147 B9R1.1 COC1=CC=C(C=C1)N P160121 [0,0,0,0,0,0|3,0,0]=3 148 B9R1.1 COC1=CC=C(C=C1)O M104222 [0,0,0,0,0,0|3,0,0]=3 149 B9R1.1 COC1=CC=C(C=C1)S M101780 [0,0,0,0,0,0|3,0,0]=3 150 B9R1.1 COC1=CC=C(O)C=C1 M408201 [0,0,0,0,0,0|3,0,0]=3 151 B9R1.1 COC1=CC=[N+](C=C1)[O-] M119964 [0,0,0,0,0,0|4,0,0]=4 152 B9R1.1 COC1=CC=[N+](C=C1)[O-] M168481 [0,0,0,0,0,0|4,0,0]=4 153 B9R1.1 COC1=CN=C(C=C1)Br B179025 [0,0,0,0,0,0|2,0,0]=2 154 B9R1.1 COC1=CN=C(C=C1)Cl C190823 [0,0,0,0,0,0|2,0,0]=2 155 B9R1.1 COC1=CN=C(C=C1)F F190725 [0,0,0,0,0,0|2,0,0]=2 156 B9R1.1 COC1=CN=C(C=C1)N M171668 [0,0,0,0,0,0|2,0,0]=2 157 B9R1.1 COC1=CN=C(N=C1)Cl C123459 [0,0,0,0,0,0|3,0,0]=3 158 B9R1.1 COC1=CN=C(N=C1)N M173441 [0,0,0,0,0,0|3,0,0]=3 159 B9R1.1 COC1=NC=C(C=C1)Br B115758 [0,0,0,0,0,0|4,0,0]=4 160 B9R1.1 COC1=NC=C(C=C1)Cl C120716 [0,0,0,0,0,0|4,0,0]=4 161 B9R1.1 COC1=NC=C(C=C1)F F120714 [0,0,0,0,0,0|4,0,0]=4 162 B9R1.1 COC1=NC=C(C=C1)I I132230 [0,0,0,0,0,0|4,0,0]=4 163 B9R1.1 COC1=NC=C(C=C1)N A151664 [0,0,0,0,0,0|4,0,0]=4 164 B9R1.1 COC1=NC=C(C=C1)N A400674 [0,0,0,0,0,0|4,0,0]=4 165 B9R1.1 COC1=NC=C(C=C1)O H184927 [0,0,0,0,0,0|4,0,0]=4 166 B9R1.1 COC1=NN=C(C=C1)Br B182084 [0,0,0,0,0,0|3,0,0]=3 167 B9R1.1 COC1=NN=C(C=C1)Cl C154051 [0,0,0,0,0,0|3,0,0]=3 168 B9R1.1 COC1=NN=C(C=C1)I I191532 [0,0,0,0,0,0|3,0,0]=3 169 B9R1.1 COC1=NN=C(C=C1)N A337871 [0,0,0,0,0,0|3,0,0]=3 170 B9R1.1 CSC1=CC=C(C=C1)Br B101844 [0,0,0,0,0,0|3,0,0]=3 171 B9R1.1 CSC1=CC=C(C=C1)Cl C101840 [0,0,0,0,0,0|3,0,0]=3 172 B9R1.1 CSC1=CC=C(C=C1)F F101837 [0,0,0,0,0,0|3,0,0]=3 173 B9R1.1 CSC1=CC=C(C=C1)N M101835 [0,0,0,0,0,0|3,0,0]=3 174 B9R1.1 CSC1=CC=C(C=C1)O M100813 [0,0,0,0,0,0|3,0,0]=3 175 B9R1.1 CSC1=CC=C(C=C1)S M101782 [0,0,0,0,0,0|3,0,0]=3 176 B9R1.1 CSC1=NC=C(C=C1)Br B122969 [0,0,0,0,0,0|4,0,0]=4 177 B9R1.1 [C-]#[N+]C1=CC=C(C=C1)Br B303469 [0,0,0,0,0,0|3,0,1]=4 178 B9R1.1 [C-]#[N+]C1=CC=C(C=C1)F F300626 [0,0,0,0,0,0|3,0,1]=4 179 B8R1.2 C#CC1=CC=CC=C1 P107030 [1,0,0,0,0,0|1,0,2]=4 180 B8R1.2 C#CC1=CC=CC=C1 P332820 [1,0,0,0,0,0|1,0,2]=4 181 B8R1.2 C#CC1=CN=CC=C1 E101379 [1,0,0,0,0,0|0,0,2]=3 182 B8R1.2 C#CC1=CN=CN=C1 E167509 [1,0,0,0,0,0|1,0,2]=4 183 B8R1.2 C1=C(C=NC=N1)C#N P176425 [1,0,0,0,0,0|2,0,1]=4 184 B8R1.2 C1=C(C=NC=N1)C=O P123455 [1,0,0,0,0,0|2,0,1]=4 185 B8R1.2 C1=CC(=CN=C1)C#N N104919 [1,0,0,0,0,0|1,0,1]=3 186 B8R1.2 C1=CC(=CN=C1)C=O P106877 [1,0,0,0,0,0|1,0,1]=3 187 B8R1.2 C1=CC(=CN=C1)CBr B137612 [1,0,0,0,0,0|1,0,0]=2 188 B8R1.2 C1=CC(=CN=C1)CCl P135883 [1,0,0,0,0,0|1,0,0]=2 189 B8R1.2 C1=CC(=CN=C1)CN P160053 [1,0,0,0,0,0|1,0,0]=2 190 B8R1.2 C1=CC(=CN=C1)CO P106580 [1,0,0,0,0,0|1,0,0]=2 191 B8R1.2 C1=CC(=NN=C1)C#N P170871 [1,0,0,0,0,0|2,0,1]=4 192 B8R1.2 C1=CC=C(C=C1)C#N B104457 [1,0,0,0,0,0|2,0,1]=4 193 B8R1.2 C1=CC=C(C=C1)C#N B104458 [1,0,0,0,0,0|2,0,1]=4 194 B8R1.2 C1=CC=C(C=C1)C#N B110114 [1,0,0,0,0,0|2,0,1]=4 195 B8R1.2 C1=CC=C(C=C1)C#N B113726 [1,0,0,0,0,0|2,0,1]=4 196 B8R1.2 C1=CC=C(C=C1)C#N B119686 [1,0,0,0,0,0|2,0,1]=4 197 B8R1.2 C1=CC=C(C=C1)C#N B121683 [1,0,0,0,0,0|2,0,1]=4 198 B8R1.2 C1=CC=C(C=C1)C=O B110459 [1,0,0,0,0,0|2,0,1]=4 199 B8R1.2 C1=CC=C(C=C1)C=O B110460 [1,0,0,0,0,0|2,0,1]=4 200 B8R1.2 C1=CC=C(C=C1)C=O B110463 [1,0,0,0,0,0|2,0,1]=4 201 B8R1.2 C1=CC=C(C=C1)C=O B110464 [1,0,0,0,0,0|2,0,1]=4 202 B8R1.2 C1=CC=C(C=C1)C=O B266083 [1,0,0,0,0,0|2,0,1]=4 203 B8R1.2 C1=CC=C(C=C1)C=O B420281 [1,0,0,0,0,0|2,0,1]=4 204 B8R1.2 C1=CC=C(C=C1)C=O B472001 [1,0,0,0,0,0|2,0,1]=4 205 B8R1.2 C1=CC=C(C=C1)CBr B108549 [1,0,0,0,0,0|2,0,0]=3 206 B8R1.2 C1=CC=C(C=C1)CBr B471999 [1,0,0,0,0,0|2,0,0]=3 207 B8R1.2 C1=CC=C(C=C1)CBr B472021 [1,0,0,0,0,0|2,0,0]=3 208 B8R1.2 C1=CC=C(C=C1)CCl B110580 [1,0,0,0,0,0|2,0,0]=3 209 B8R1.2 C1=CC=C(C=C1)CCl B110581 [1,0,0,0,0,0|2,0,0]=3 210 B8R1.2 C1=CC=C(C=C1)CCl B110582 [1,0,0,0,0,0|2,0,0]=3 211 B8R1.2 C1=CC=C(C=C1)CCl B141153 [1,0,0,0,0,0|2,0,0]=3 212 B8R1.2 C1=CC=C(C=C1)CCl B431204 [1,0,0,0,0,0|2,0,0]=3 213 B8R1.2 C1=CC=C(C=C1)CCl B472028 [1,0,0,0,0,0|2,0,0]=3 214 B8R1.2 C1=CC=C(C=C1)CCl B472041 [1,0,0,0,0,0|2,0,0]=3 215 B8R1.2 C1=CC=C(C=C1)CN A348464 [1,0,0,0,0,0|2,0,0]=3 216 B8R1.2 C1=CC=C(C=C1)CN B108477 [1,0,0,0,0,0|2,0,0]=3 217 B8R1.2 C1=CC=C(C=C1)CN B152179 [1,0,0,0,0,0|2,0,0]=3 218 B8R1.2 C1=CC=C(C=C1)CN B152887 [1,0,0,0,0,0|2,0,0]=3 219 B8R1.2 C1=CC=C(C=C1)CN B152949 [1,0,0,0,0,0|2,0,0]=3 220 B8R1.2 C1=CC=C(C=C1)CN B304428 [1,0,0,0,0,0|2,0,0]=3 221 B8R1.2 C1=CC=C(C=C1)CN B485378 [1,0,0,0,0,0|2,0,0]=3 222 B8R1.2 C1=CC=C(C=C1)CN P493007 [1,0,0,0,0,0|2,0,0]=3 223 B8R1.2 C1=CC=C(C=C1)CN P493016 [1,0,0,0,0,0|2,0,0]=3 224 B8R1.2 C1=CC=C(C=C1)CN P493100 [1,0,0,0,0,0|2,0,0]=3 225 B8R1.2 C1=CC=C(C=C1)CO B108199 [1,0,0,0,0,0|2,0,0]=3 226 B8R1.2 C1=CC=C(C=C1)CO B108202 [1,0,0,0,0,0|2,0,0]=3 227 B8R1.2 C1=CC=C(C=C1)CO B108203 [1,0,0,0,0,0|2,0,0]=3 228 B8R1.2 C1=CC=C(C=C1)CO B108204 [1,0,0,0,0,0|2,0,0]=3 229 B8R1.2 C1=CC=C(C=C1)CO B108205 [1,0,0,0,0,0|2,0,0]=3 230 B8R1.2 C1=CC=C(C=C1)CO B163018 [1,0,0,0,0,0|2,0,0]=3 231 B8R1.2 C1=CC=C(C=C1)CO B346959 [1,0,0,0,0,0|2,0,0]=3 232 B8R1.2 C1=CC=C(C=C1)CO B420278 [1,0,0,0,0,0|2,0,0]=3 233 B8R1.2 C1=CC=C(C=C1)CO B472101 [1,0,0,0,0,0|2,0,0]=3 234 B8R1.2 C1=CC=C(C=C1)CS B109256 [1,0,0,0,0,0|2,0,0]=3 235 B8R1.2 C1=CC=C(C=C1)I=O I157626 [1,0,0,0,0,0|3,0,0]=4 236 B8R1.2 C1=CC=C(C=C1)N=O N159156 [1,0,0,0,0,0|3,0,0]=4 237 B8R1.2 C1=CC=C(C=C1)NN P104684 [1,0,0,0,0,0|3,0,0]=4 238 B8R1.2 C1=CC=C(C=C1)NN P108563 [1,0,0,0,0,0|3,0,0]=4 239 B8R1.2 C1=CC=C(C=C1)NN P112739 [1,0,0,0,0,0|3,0,0]=4 240 B8R1.2 C1=CC=C(C=C1)NN P579459 [1,0,0,0,0,0|3,0,0]=4 241 B8R1.2 C1=CC=C(C=C1)NO N131374 [1,0,0,0,0,0|3,0,0]=4 242 B8R1.2 C1=CC=C(C=C1)ON O464484 [1,0,0,0,0,0|3,0,0]=4 243 B8R1.2 C1=CC=C(C=C1)[As]=O P336440 [1,0,0,0,0,0|3,0,0]=4 244 B8R1.2 C1=CC=C(C=C1)[Hg]Cl P598721 [1,0,0,0,0,0|3,0,0]=4 245 B8R1.2 C1=CC=C(C=C1)[Se]Cl P160704 [1,0,0,0,0,0|3,0,0]=4 246 B8R1.2 C1=CC=NC(=C1)CBr B169474 [1,0,0,0,0,0|3,0,0]=4 247 B8R1.2 C1=CC=NC(=C1)CCl C117226 [1,0,0,0,0,0|3,0,0]=4 248 B8R1.2 C1=CC=NC(=C1)CN P107146 [1,0,0,0,0,0|3,0,0]=4 249 B8R1.2 C1=CC=NC(=C1)CO P106578 [1,0,0,0,0,0|3,0,0]=4 250 B8R1.2 C1=CN=C(C=N1)C#N P121629 [1,0,0,0,0,0|2,0,1]=4 251 B8R1.2 C1=CN=C(C=N1)C=O P176847 [1,0,0,0,0,0|2,0,1]=4 252 B8R1.2 C1=CN=C(C=N1)CN P175485 [1,0,0,0,0,0|2,0,0]=3 253 B8R1.2 C1=CN=C(C=N1)NN H176751 [1,0,0,0,0,0|3,0,0]=4 254 B8R1.2 C1=CN=CC=C1CBr B135280 [1,0,0,0,0,0|3,0,0]=4 255 B8R1.2 C1=CN=CC=C1CCl C107154 [1,0,0,0,0,0|3,0,0]=4 256 B8R1.2 C1=CN=CC=C1CN A107215 [1,0,0,0,0,0|3,0,0]=4 257 B8R1.2 C1=CN=CC=C1CN P194376 [1,0,0,0,0,0|3,0,0]=4 258 B8R1.2 C1=CN=CC=C1CO P107414 [1,0,0,0,0,0|3,0,0]=4 259 B8R1.2 C=CC1=CC=CC=C1 A304890 [1,0,0,0,0,0|1,0,2]=4 260 B8R1.2 C=CC1=CC=CC=C1 P107084 [1,0,0,0,0,0|1,0,2]=4 261 B8R1.2 C=CC1=CC=CC=C1 P107085 [1,0,0,0,0,0|1,0,2]=4 262 B8R1.2 C=CC1=CC=CC=C1 P107086 [1,0,0,0,0,0|1,0,2]=4 263 B8R1.2 C=CC1=CC=CC=C1 P107087 [1,0,0,0,0,0|1,0,2]=4 264 B8R1.2 C=CC1=CC=CC=C1 P107088 [1,0,0,0,0,0|1,0,2]=4 265 B8R1.2 C=CC1=CC=CC=C1 P107089 [1,0,0,0,0,0|1,0,2]=4 266 B8R1.2 C=CC1=CC=CC=C1 P107090 [1,0,0,0,0,0|1,0,2]=4 267 B8R1.2 C=CC1=CC=CC=C1 P107091 [1,0,0,0,0,0|1,0,2]=4 268 B8R1.2 C=CC1=CC=CC=C1 P107772 [1,0,0,0,0,0|1,0,2]=4 269 B8R1.2 C=CC1=CC=CC=C1 P107773 [1,0,0,0,0,0|1,0,2]=4 270 B8R1.2 C=CC1=CC=CC=C1 P107774 [1,0,0,0,0,0|1,0,2]=4 271 B8R1.2 C=CC1=CC=CC=C1 P107775 [1,0,0,0,0,0|1,0,2]=4 272 B8R1.2 C=CC1=CC=CC=C1 P107776 [1,0,0,0,0,0|1,0,2]=4 273 B8R1.2 C=CC1=CC=CC=C1 P107777 [1,0,0,0,0,0|1,0,2]=4 274 B8R1.2 C=CC1=CC=CC=C1 P107778 [1,0,0,0,0,0|1,0,2]=4 275 B8R1.2 C=CC1=CC=CC=C1 P107779 [1,0,0,0,0,0|1,0,2]=4 276 B8R1.2 C=CC1=CC=CC=C1 P107780 [1,0,0,0,0,0|1,0,2]=4 277 B8R1.2 C=CC1=CC=CC=C1 P107782 [1,0,0,0,0,0|1,0,2]=4 278 B8R1.2 C=CC1=CC=CC=C1 P107783 [1,0,0,0,0,0|1,0,2]=4 279 B8R1.2 C=CC1=CC=CC=C1 P107784 [1,0,0,0,0,0|1,0,2]=4 280 B8R1.2 C=CC1=CC=CC=C1 P107786 [1,0,0,0,0,0|1,0,2]=4 281 B8R1.2 C=CC1=CC=CC=C1 P107787 [1,0,0,0,0,0|1,0,2]=4 282 B8R1.2 C=CC1=CC=CC=C1 P107789 [1,0,0,0,0,0|1,0,2]=4 283 B8R1.2 C=CC1=CC=CC=C1 P107790 [1,0,0,0,0,0|1,0,2]=4 284 B8R1.2 C=CC1=CC=CC=C1 P107791 [1,0,0,0,0,0|1,0,2]=4 285 B8R1.2 C=CC1=CC=CC=C1 P107792 [1,0,0,0,0,0|1,0,2]=4 286 B8R1.2 C=CC1=CC=CC=C1 P107793 [1,0,0,0,0,0|1,0,2]=4 287 B8R1.2 C=CC1=CC=CC=C1 P107794 [1,0,0,0,0,0|1,0,2]=4 288 B8R1.2 C=CC1=CC=CC=C1 P107795 [1,0,0,0,0,0|1,0,2]=4 289 B8R1.2 C=CC1=CC=CC=C1 P107796 [1,0,0,0,0,0|1,0,2]=4 290 B8R1.2 C=CC1=CC=CC=C1 P107797 [1,0,0,0,0,0|1,0,2]=4 291 B8R1.2 C=CC1=CC=CC=C1 P107798 [1,0,0,0,0,0|1,0,2]=4 292 B8R1.2 C=CC1=CC=CC=C1 P107801 [1,0,0,0,0,0|1,0,2]=4 293 B8R1.2 C=CC1=CC=CC=C1 P107802 [1,0,0,0,0,0|1,0,2]=4 294 B8R1.2 C=CC1=CC=CC=C1 P107803 [1,0,0,0,0,0|1,0,2]=4 295 B8R1.2 C=CC1=CC=CC=C1 P107804 [1,0,0,0,0,0|1,0,2]=4 296 B8R1.2 C=CC1=CC=CC=C1 P107805 [1,0,0,0,0,0|1,0,2]=4 297 B8R1.2 C=CC1=CC=CC=C1 P107806 [1,0,0,0,0,0|1,0,2]=4 298 B8R1.2 C=CC1=CC=CC=C1 P107807 [1,0,0,0,0,0|1,0,2]=4 299 B8R1.2 C=CC1=CC=CC=C1 P107808 [1,0,0,0,0,0|1,0,2]=4 300 B8R1.2 C=CC1=CC=CC=C1 P107809 [1,0,0,0,0,0|1,0,2]=4 301 B8R1.2 C=CC1=CC=CC=C1 P107810 [1,0,0,0,0,0|1,0,2]=4 302 B8R1.2 C=CC1=CC=CC=C1 P107811 [1,0,0,0,0,0|1,0,2]=4 303 B8R1.2 C=CC1=CC=CC=C1 P107812 [1,0,0,0,0,0|1,0,2]=4 304 B8R1.2 C=CC1=CC=CC=C1 P107813 [1,0,0,0,0,0|1,0,2]=4 305 B8R1.2 C=CC1=CC=CC=C1 P107814 [1,0,0,0,0,0|1,0,2]=4 306 B8R1.2 C=CC1=CC=CC=C1 P119494 [1,0,0,0,0,0|1,0,2]=4 307 B8R1.2 C=CC1=CC=CC=C1 P119495 [1,0,0,0,0,0|1,0,2]=4 308 B8R1.2 C=CC1=CC=CC=C1 P119496 [1,0,0,0,0,0|1,0,2]=4 309 B8R1.2 C=CC1=CC=CC=C1 P119498 [1,0,0,0,0,0|1,0,2]=4 310 B8R1.2 C=CC1=CC=CC=C1 P119572 [1,0,0,0,0,0|1,0,2]=4 311 B8R1.2 C=CC1=CC=CC=C1 P304886 [1,0,0,0,0,0|1,0,2]=4 312 B8R1.2 C=CC1=CC=CC=C1 P304889 [1,0,0,0,0,0|1,0,2]=4 313 B8R1.2 C=CC1=CC=CC=C1 P434446 [1,0,0,0,0,0|1,0,2]=4 314 B8R1.2 C=CC1=CC=CC=C1 P434450 [1,0,0,0,0,0|1,0,2]=4 315 B8R1.2 C=CC1=CC=CC=C1 P434455 [1,0,0,0,0,0|1,0,2]=4 316 B8R1.2 C=CC1=CC=CC=C1 P476626 [1,0,0,0,0,0|1,0,2]=4 317 B8R1.2 C=CC1=CC=CC=C1 P490073 [1,0,0,0,0,0|1,0,2]=4 318 B8R1.2 C=CC1=CC=CC=C1 P638578 [1,0,0,0,0,0|1,0,2]=4 319 B8R1.2 C=CC1=CC=CC=C1 S110374 [1,0,0,0,0,0|1,0,2]=4 320 B8R1.2 C=CC1=CC=CC=C1 S110375 [1,0,0,0,0,0|1,0,2]=4 321 B8R1.2 C=CC1=CC=CC=C1 S110376 [1,0,0,0,0,0|1,0,2]=4 322 B8R1.2 C=CC1=CC=CC=C1 S110377 [1,0,0,0,0,0|1,0,2]=4 323 B8R1.2 C=CC1=CC=CC=C1 S110378 [1,0,0,0,0,0|1,0,2]=4 324 B8R1.2 C=CC1=CC=CC=C1 S121282 [1,0,0,0,0,0|1,0,2]=4 325 B8R1.2 C=CC1=CN=CC=C1 V138030 [1,0,0,0,0,0|0,0,2]=3 326 B8R1.2 CCC1=CC=CC=C1 E108144 [1,0,0,0,0,0|1,0,0]=2 327 B8R1.2 CCC1=CC=CC=C1 E108145 [1,0,0,0,0,0|1,0,0]=2 328 B8R1.2 CCC1=CC=CC=C1 E108146 [1,0,0,0,0,0|1,0,0]=2 329 B8R1.2 CCC1=CC=CC=C1 E108148 [1,0,0,0,0,0|1,0,0]=2 330 B8R1.2 CCC1=CC=CC=C1 E108149 [1,0,0,0,0,0|1,0,0]=2 331 B8R1.2 CCC1=CC=CC=C1 E117364 [1,0,0,0,0,0|1,0,0]=2 332 B8R1.2 CCC1=CC=CC=N1 E156565 [1,0,0,0,0,0|2,0,0]=3 333 B8R1.2 CCC1=CC=NC=C1 E106225 [1,0,0,0,0,0|2,0,0]=3 334 B8R1.2 CCC1=CN=CC=C1 E156048 [1,0,0,0,0,0|0,0,0]=1 335 B8R1.2 CCC1=NC=CN=C1 E156371 [1,0,0,0,0,0|1,0,0]=2 336 B8R1.2 CC[N+]1=CC=CC=C1 E102660 [1,0,0,0,0,0|2,0,0]=3 337 B8R1.2 CC[N+]1=CC=CC=C1 E102661 [1,0,0,0,0,0|2,0,0]=3 338 B8R1.2 CNC1=CC=CC=C1 M109539 [1,0,0,0,0,0|2,0,0]=3 339 B8R1.2 CNC1=CC=CC=C1 M109540 [1,0,0,0,0,0|2,0,0]=3 340 B8R1.2 CNC1=CC=CC=N1 M158828 [1,0,0,0,0,0|3,0,0]=4 341 B8R1.2 CNC1=CC=NC=C1 M119978 [1,0,0,0,0,0|3,0,0]=4 342 B8R1.2 CNC1=CN=CC=C1 M158833 [1,0,0,0,0,0|1,0,0]=2 343 B8R1.2 COC1=CC=CC=C1 A103680 [1,0,0,0,0,0|2,0,0]=3 344 B8R1.2 COC1=CC=CC=C1 A103683 [1,0,0,0,0,0|2,0,0]=3 345 B8R1.2 COC1=CC=CC=C1 A103684 [1,0,0,0,0,0|2,0,0]=3 346 B8R1.2 COC1=CC=CC=C1 A105952 [1,0,0,0,0,0|2,0,0]=3 347 B8R1.2 COC1=CC=CC=C1 A472026 [1,0,0,0,0,0|2,0,0]=3 348 B8R1.2 COC1=CC=CC=N1 M120557 [1,0,0,0,0,0|3,0,0]=4 349 B8R1.2 COC1=CC=NC=C1 M120571 [1,0,0,0,0,0|3,0,0]=4 350 B8R1.2 COC1=CN=CC=C1 M134006 [1,0,0,0,0,0|1,0,0]=2 351 B8R1.2 COC1=CN=CN=C1 M303416 [1,0,0,0,0,0|2,0,0]=3 352 B8R1.2 COC1=NC=CN=C1 M136222 [1,0,0,0,0,0|2,0,0]=3 353 B8R1.2 COC1=NN=CC=C1 M157842 [1,0,0,0,0,0|2,0,0]=3 354 B8R1.2 CSC1=CC=CC=C1 T107511 [1,0,0,0,0,0|2,0,0]=3 355 B8R1.2 CSC1=CC=CC=N1 M132299 [1,0,0,0,0,0|3,0,0]=4 356 B8R1.2 CSC1=NC=CN=C1 M132836 [1,0,0,0,0,0|2,0,0]=3 357 B8R1.2 CSC1=NC=CN=N1 M169273 [1,0,0,0,0,0|3,0,0]=4 358 B8R1.2 C[Si]C1=CC=CC=C1 M338232 [1,0,0,0,0,0|1,1,0]=3 359 B8R1.2 [C-]#CC1=CC=CC=C1 C282525 [1,0,0,0,0,0|1,0,2]=4 360 B8R1.2 [C-]#CC1=CC=CC=C1 P331408 [1,0,0,0,0,0|1,0,2]=4 361 B8R1.3 C1=C(C=NC(=N1)Br)Br D121632 [1,0,0,0,0,0|3,0,0]=4 362 B8R1.3 C1=C(C=NC(=N1)Br)F B178446 [1,0,0,0,0,0|3,0,0]=4 363 B8R1.3 C1=C(C=NC(=N1)Br)N A185256 [1,0,0,0,0,0|3,0,0]=4 364 B8R1.3 C1=C(C=NC(=N1)Br)O B172861 [1,0,0,0,0,0|3,0,0]=4 365 B8R1.3 C1=C(C=NC(=N1)Cl)Br B113805 [1,0,0,0,0,0|3,0,0]=4 366 B8R1.3 C1=C(C=NC(=N1)Cl)Cl D123559 [1,0,0,0,0,0|3,0,0]=4 367 B8R1.3 C1=C(C=NC(=N1)Cl)F C102638 [1,0,0,0,0,0|3,0,0]=4 368 B8R1.3 C1=C(C=NC(=N1)Cl)I C153606 [1,0,0,0,0,0|3,0,0]=4 369 B8R1.3 C1=C(C=NC(=N1)Cl)N A481967 [1,0,0,0,0,0|3,0,0]=4 370 B8R1.3 C1=C(C=NC(=N1)Cl)O C176622 [1,0,0,0,0,0|3,0,0]=4 371 B8R1.3 C1=C(C=NC(=N1)F)Br B123109 [1,0,0,0,0,0|3,0,0]=4 372 B8R1.3 C1=C(C=NC(=N1)I)Br W131810 [1,0,0,0,0,0|3,0,0]=4 373 B8R1.3 C1=C(C=NC(=N1)N)Br A123409 [1,0,0,0,0,0|3,0,0]=4 374 B8R1.3 C1=C(C=NC(=N1)N)Cl A113872 [1,0,0,0,0,0|3,0,0]=4 375 B8R1.3 C1=C(C=NC(=N1)N)F A181981 [1,0,0,0,0,0|3,0,0]=4 376 B8R1.3 C1=C(C=NC(=N1)N)I A167314 [1,0,0,0,0,0|3,0,0]=4 377 B8R1.3 C1=C(C=NC(=O)N1)Br B120278 [1,0,0,0,0,0|3,0,0]=4 378 B8R1.3 C1=C(C=NC(=O)N1)F W136119 [1,0,0,0,0,0|3,0,0]=4 379 B8R1.3 C1=C(N=CC(=N1)Br)Br D154926 [1,0,0,0,0,0|3,0,0]=4 380 B8R1.3 C1=C(N=CC(=N1)Br)N A115828 [1,0,0,0,0,0|3,0,0]=4 381 B8R1.3 C1=C(N=CC(=N1)Cl)Cl D175458 [1,0,0,0,0,0|3,0,0]=4 382 B8R1.3 C1=C(N=CC(=N1)Cl)N A122400 [1,0,0,0,0,0|3,0,0]=4 383 B8R1.3 C1=C(N=CC(=N1)I)Br B176964 [1,0,0,0,0,0|3,0,0]=4 384 B8R1.3 C1=C(N=CC(=N1)I)Cl C179057 [1,0,0,0,0,0|3,0,0]=4 385 B8R1.3 C1=C(N=CC(=O)N1)Br B115827 [1,0,0,0,0,0|3,0,0]=4 386 B8R1.3 C1=CC(=CC=C1Br)Br D104691 [1,0,0,0,0,0|3,0,0]=4 387 B8R1.3 C1=CC(=CC=C1Br)Br D104693 [1,0,0,0,0,0|3,0,0]=4 388 B8R1.3 C1=CC(=CC=C1Br)Br D121273 [1,0,0,0,0,0|3,0,0]=4 389 B8R1.3 C1=CC(=CC=C1Br)I B107004 [1,0,0,0,0,0|3,0,0]=4 390 B8R1.3 C1=CC(=CC=C1Cl)Br B106076 [1,0,0,0,0,0|3,0,0]=4 391 B8R1.3 C1=CC(=CC=C1Cl)Br B106077 [1,0,0,0,0,0|3,0,0]=4 392 B8R1.3 C1=CC(=CC=C1Cl)Cl D104666 [1,0,0,0,0,0|3,0,0]=4 393 B8R1.3 C1=CC(=CC=C1Cl)Cl D104668 [1,0,0,0,0,0|3,0,0]=4 394 B8R1.3 C1=CC(=CC=C1Cl)Cl D104670 [1,0,0,0,0,0|3,0,0]=4 395 B8R1.3 C1=CC(=CC=C1Cl)Cl D104676 [1,0,0,0,0,0|3,0,0]=4 396 B8R1.3 C1=CC(=CC=C1Cl)Cl D115108 [1,0,0,0,0,0|3,0,0]=4 397 B8R1.3 C1=CC(=CC=C1Cl)Cl D123306 [1,0,0,0,0,0|3,0,0]=4 398 B8R1.3 C1=CC(=CC=C1Cl)I C101940 [1,0,0,0,0,0|3,0,0]=4 399 B8R1.3 C1=CC(=CC=C1F)Br B107758 [1,0,0,0,0,0|3,0,0]=4 400 B8R1.3 C1=CC(=CC=C1F)Cl C122649 [1,0,0,0,0,0|3,0,0]=4 401 B8R1.3 C1=CC(=CC=C1F)F D113734 [1,0,0,0,0,0|3,0,0]=4 402 B8R1.3 C1=CC(=CC=C1F)I F100907 [1,0,0,0,0,0|3,0,0]=4 403 B8R1.3 C1=CC(=CC=C1F)S F101761 [1,0,0,0,0,0|3,0,0]=4 404 B8R1.3 C1=CC(=CC=C1I)I D111116 [1,0,0,0,0,0|3,0,0]=4 405 B8R1.3 C1=CC(=CC=C1N)Br B103946 [1,0,0,0,0,0|3,0,0]=4 406 B8R1.3 C1=CC(=CC=C1N)Cl C103934 [1,0,0,0,0,0|3,0,0]=4 407 B8R1.3 C1=CC(=CC=C1N)Cl C103935 [1,0,0,0,0,0|3,0,0]=4 408 B8R1.3 C1=CC(=CC=C1N)Cl C103936 [1,0,0,0,0,0|3,0,0]=4 409 B8R1.3 C1=CC(=CC=C1N)Cl C103945 [1,0,0,0,0,0|3,0,0]=4 410 B8R1.3 C1=CC(=CC=C1N)Cl C141217 [1,0,0,0,0,0|3,0,0]=4 411 B8R1.3 C1=CC(=CC=C1N)F F103204 [1,0,0,0,0,0|3,0,0]=4 412 B8R1.3 C1=CC(=CC=C1N)F F404104 [1,0,0,0,0,0|3,0,0]=4 413 B8R1.3 C1=CC(=CC=C1N)F F404490 [1,0,0,0,0,0|3,0,0]=4 414 B8R1.3 C1=CC(=CC=C1N)I I107029 [1,0,0,0,0,0|3,0,0]=4 415 B8R1.3 C1=CC(=CC=C1N)N D117081 [1,0,0,0,0,0|3,0,0]=4 416 B8R1.3 C1=CC(=CC=C1N)N P108424 [1,0,0,0,0,0|3,0,0]=4 417 B8R1.3 C1=CC(=CC=C1N)N P108425 [1,0,0,0,0,0|3,0,0]=4 418 B8R1.3 C1=CC(=CC=C1N)N P108426 [1,0,0,0,0,0|3,0,0]=4 419 B8R1.3 C1=CC(=CC=C1N)N P128784 [1,0,0,0,0,0|3,0,0]=4 420 B8R1.3 C1=CC(=CC=C1N)N P292856 [1,0,0,0,0,0|3,0,0]=4 421 B8R1.3 C1=CC(=CC=C1N)N P302258 [1,0,0,0,0,0|3,0,0]=4 422 B8R1.3 C1=CC(=CC=C1N)N p115806 [1,0,0,0,0,0|3,0,0]=4 423 B8R1.3 C1=CC(=CC=C1N)O A100496 [1,0,0,0,0,0|3,0,0]=4 424 B8R1.3 C1=CC(=CC=C1N)O A110564 [1,0,0,0,0,0|3,0,0]=4 425 B8R1.3 C1=CC(=CC=C1N)O A110566 [1,0,0,0,0,0|3,0,0]=4 426 B8R1.3 C1=CC(=CC=C1N)S A107494 [1,0,0,0,0,0|3,0,0]=4 427 B8R1.3 C1=CC(=CC=C1N)S A163041 [1,0,0,0,0,0|3,0,0]=4 428 B8R1.3 C1=CC(=CC=C1O)Br B100691 [1,0,0,0,0,0|3,0,0]=4 429 B8R1.3 C1=CC(=CC=C1O)Br B100692 [1,0,0,0,0,0|3,0,0]=4 430 B8R1.3 C1=CC(=CC=C1O)Cl C108253 [1,0,0,0,0,0|3,0,0]=4 431 B8R1.3 C1=CC(=CC=C1O)Cl C108254 [1,0,0,0,0,0|3,0,0]=4 432 B8R1.3 C1=CC(=CC=C1O)Cl C108255 [1,0,0,0,0,0|3,0,0]=4 433 B8R1.3 C1=CC(=CC=C1O)Cl C108256 [1,0,0,0,0,0|3,0,0]=4 434 B8R1.3 C1=CC(=CC=C1O)F F107127 [1,0,0,0,0,0|3,0,0]=4 435 B8R1.3 C1=CC(=CC=C1O)I I107037 [1,0,0,0,0,0|3,0,0]=4 436 B8R1.3 C1=CC(=CC=C1O)O H108945 [1,0,0,0,0,0|3,0,0]=4 437 B8R1.3 C1=CC(=CC=C1O)O H108946 [1,0,0,0,0,0|3,0,0]=4 438 B8R1.3 C1=CC(=CC=C1O)O H108947 [1,0,0,0,0,0|3,0,0]=4 439 B8R1.3 C1=CC(=CC=C1O)O H431621 [1,0,0,0,0,0|3,0,0]=4 440 B8R1.3 C1=CC(=CC=C1O)S M101786 [1,0,0,0,0,0|3,0,0]=4 441 B8R1.3 C1=CC(=CC=C1S)Br B101773 [1,0,0,0,0,0|3,0,0]=4 442 B8R1.3 C1=CC(=CC=C1S)Cl C101766 [1,0,0,0,0,0|3,0,0]=4 443 B8R1.3 C1=CC(=CC=C1S)S B151928 [1,0,0,0,0,0|3,0,0]=4 444 B8R1.3 C1=CC(=NC=C1Br)Br D101561 [1,0,0,0,0,0|2,0,0]=3 445 B8R1.3 C1=CC(=NC=C1Br)Cl B123411 [1,0,0,0,0,0|2,0,0]=3 446 B8R1.3 C1=CC(=NC=C1Br)F B110259 [1,0,0,0,0,0|2,0,0]=3 447 B8R1.3 C1=CC(=NC=C1Br)I B120792 [1,0,0,0,0,0|2,0,0]=3 448 B8R1.3 C1=CC(=NC=C1Br)N A101197 [1,0,0,0,0,0|2,0,0]=3 449 B8R1.3 C1=CC(=NC=C1Cl)Br B102594 [1,0,0,0,0,0|2,0,0]=3 450 B8R1.3 C1=CC(=NC=C1Cl)Cl D120567 [1,0,0,0,0,0|2,0,0]=3 451 B8R1.3 C1=CC(=NC=C1Cl)F C110260 [1,0,0,0,0,0|2,0,0]=3 452 B8R1.3 C1=CC(=NC=C1Cl)I C168964 [1,0,0,0,0,0|2,0,0]=3 453 B8R1.3 C1=CC(=NC=C1Cl)N A107183 [1,0,0,0,0,0|2,0,0]=3 454 B8R1.3 C1=CC(=NC=C1F)Br B111195 [1,0,0,0,0,0|2,0,0]=3 455 B8R1.3 C1=CC(=NC=C1F)Cl C102598 [1,0,0,0,0,0|2,0,0]=3 456 B8R1.3 C1=CC(=NC=C1F)F D124342 [1,0,0,0,0,0|2,0,0]=3 457 B8R1.3 C1=CC(=NC=C1F)I F181837 [1,0,0,0,0,0|2,0,0]=3 458 B8R1.3 C1=CC(=NC=C1F)N A101607 [1,0,0,0,0,0|2,0,0]=3 459 B8R1.3 C1=CC(=NC=C1I)Br B122970 [1,0,0,0,0,0|2,0,0]=3 460 B8R1.3 C1=CC(=NC=C1I)Cl C119410 [1,0,0,0,0,0|2,0,0]=3 461 B8R1.3 C1=CC(=NC=C1I)F F119657 [1,0,0,0,0,0|2,0,0]=3 462 B8R1.3 C1=CC(=NC=C1I)I D166168 [1,0,0,0,0,0|2,0,0]=3 463 B8R1.3 C1=CC(=NC=C1I)N A129106 [1,0,0,0,0,0|2,0,0]=3 464 B8R1.3 C1=CC(=NC=C1N)Br A101199 [1,0,0,0,0,0|2,0,0]=3 465 B8R1.3 C1=CC(=NC=C1N)Cl A124240 [1,0,0,0,0,0|2,0,0]=3 466 B8R1.3 C1=CC(=NC=C1N)F A119632 [1,0,0,0,0,0|2,0,0]=3 467 B8R1.3 C1=CC(=NC=C1N)I A588630 [1,0,0,0,0,0|2,0,0]=3 468 B8R1.3 C1=CC(=NC=C1N)N D134973 [1,0,0,0,0,0|2,0,0]=3 469 B8R1.3 C1=CC(=NC=C1N)N D135606 [1,0,0,0,0,0|2,0,0]=3 470 B8R1.3 C1=CC(=NC=C1O)Br B102604 [1,0,0,0,0,0|2,0,0]=3 471 B8R1.3 C1=CC(=NC=C1O)Br B399634 [1,0,0,0,0,0|2,0,0]=3 472 B8R1.3 C1=CC(=NC=C1O)Cl C102603 [1,0,0,0,0,0|2,0,0]=3 473 B8R1.3 C1=CC(=NC=C1O)F F102601 [1,0,0,0,0,0|2,0,0]=3 474 B8R1.3 C1=CC(=NC=C1O)N A185200 [1,0,0,0,0,0|2,0,0]=3 475 B8R1.3 C1=CC(=NN=C1Br)Br D123209 [1,0,0,0,0,0|3,0,0]=4 476 B8R1.3 C1=CC(=NN=C1Cl)Br B187829 [1,0,0,0,0,0|3,0,0]=4 477 B8R1.3 C1=CC(=NN=C1Cl)Cl D154248 [1,0,0,0,0,0|3,0,0]=4 478 B8R1.3 C1=CC(=NN=C1Cl)I C167062 [1,0,0,0,0,0|3,0,0]=4 479 B8R1.3 C1=CC(=NN=C1F)Br B587053 [1,0,0,0,0,0|3,0,0]=4 480 B8R1.3 C1=CC(=NN=C1I)I D191979 [1,0,0,0,0,0|3,0,0]=4 481 B8R1.3 C1=CC(=NN=C1N)Br B177923 [1,0,0,0,0,0|3,0,0]=4 482 B8R1.3 C1=CC(=NN=C1N)Cl C113874 [1,0,0,0,0,0|3,0,0]=4 483 B8R1.3 C1=CC(=NNC1=O)Br B193678 [1,0,0,0,0,0|3,0,0]=4 484 B8R1.3 C1=CC(=NNC1=O)Cl C132941 [1,0,0,0,0,0|3,0,0]=4 485 B8R1.3 C1=CC(=NNC1=S)Cl C349932 [1,0,0,0,0,0|3,0,0]=4 486 B8R1.3 C1=CC(=O)C=CC1=O B108670 [1,0,0,0,0,0|3,0,0]=4 487 B8R1.3 C1=CC(=O)C=CC1=O B108671 [1,0,0,0,0,0|3,0,0]=4 488 B8R1.3 C1=CC(=O)C=CC1=O B108672 [1,0,0,0,0,0|3,0,0]=4 489 B8R1.3 C1=CC(=O)C=CC1=O Q104677 [1,0,0,0,0,0|3,0,0]=4 490 B8R1.3 C1=CC(=O)NC=C1Br B152104 [1,0,0,0,0,0|2,0,1]=4 491 B8R1.3 C1=CC(=O)NC=C1Cl C136324 [1,0,0,0,0,0|2,0,1]=4 492 B8R1.3 C1=CC(=O)NC=C1F F102599 [1,0,0,0,0,0|2,0,1]=4 493 B8R1.3 C1=CC(=O)NC=C1I W131730 [1,0,0,0,0,0|2,0,1]=4 494 B8R1.3 C1=CC(=O)NC=C1N A120454 [1,0,0,0,0,0|2,0,1]=4 495 B8R1.3 CC1=CC=C(C=C1)Br B108900 [1,0,0,0,0,0|2,0,0]=3 496 B8R1.3 CC1=CC=C(C=C1)C X103333 [1,0,0,0,0,0|1,0,0]=2 497 B8R1.3 CC1=CC=C(C=C1)C X103334 [1,0,0,0,0,0|1,0,0]=2 498 B8R1.3 CC1=CC=C(C=C1)C X103336 [1,0,0,0,0,0|1,0,0]=2 499 B8R1.3 CC1=CC=C(C=C1)C X103338 [1,0,0,0,0,0|1,0,0]=2 500 B8R1.3 CC1=CC=C(C=C1)C X103339 [1,0,0,0,0,0|1,0,0]=2 501 B8R1.3 CC1=CC=C(C=C1)C X103342 [1,0,0,0,0,0|1,0,0]=2 502 B8R1.3 CC1=CC=C(C=C1)C X119715 [1,0,0,0,0,0|1,0,0]=2 503 B8R1.3 CC1=CC=C(C=C1)C X128149 [1,0,0,0,0,0|1,0,0]=2 504 B8R1.3 CC1=CC=C(C=C1)Cl C104628 [1,0,0,0,0,0|2,0,0]=3 505 B8R1.3 CC1=CC=C(C=C1)Cl C104629 [1,0,0,0,0,0|2,0,0]=3 506 B8R1.3 CC1=CC=C(C=C1)Cl C113011 [1,0,0,0,0,0|2,0,0]=3 507 B8R1.3 CC1=CC=C(C=C1)Cl C113012 [1,0,0,0,0,0|2,0,0]=3 508 B8R1.3 CC1=CC=C(C=C1)Cl C128161 [1,0,0,0,0,0|2,0,0]=3 509 B8R1.3 CC1=CC=C(C=C1)F F107110 [1,0,0,0,0,0|2,0,0]=3 510 B8R1.3 CC1=CC=C(C=C1)I I118363 [1,0,0,0,0,0|2,0,0]=3 511 B8R1.3 CC1=CC=C(C=C1)N T108450 [1,0,0,0,0,0|2,0,0]=3 512 B8R1.3 CC1=CC=C(C=C1)N T108451 [1,0,0,0,0,0|2,0,0]=3 513 B8R1.3 CC1=CC=C(C=C1)N T111232 [1,0,0,0,0,0|2,0,0]=3 514 B8R1.3 CC1=CC=C(C=C1)O C108248 [1,0,0,0,0,0|2,0,0]=3 515 B8R1.3 CC1=CC=C(C=C1)O C108249 [1,0,0,0,0,0|2,0,0]=3 516 B8R1.3 CC1=CC=C(C=C1)O C108250 [1,0,0,0,0,0|2,0,0]=3 517 B8R1.3 CC1=CC=C(C=C1)O C108251 [1,0,0,0,0,0|2,0,0]=3 518 B8R1.3 CC1=CC=C(C=C1)O C108252 [1,0,0,0,0,0|2,0,0]=3 519 B8R1.3 CC1=CC=C(C=C1)O C108640 [1,0,0,0,0,0|2,0,0]=3 520 B8R1.3 CC1=CC=C(C=C1)O C108641 [1,0,0,0,0,0|2,0,0]=3 521 B8R1.3 CC1=CC=C(C=C1)O C128202 [1,0,0,0,0,0|2,0,0]=3 522 B8R1.3 CC1=CC=C(C=C1)S T109389 [1,0,0,0,0,0|2,0,0]=3 523 B8R1.3 CC1=CC=[N+](C=C1)C D588274 [1,0,0,0,0,0|2,0,0]=3 524 B8R1.3 CC1=CC=[N+](C=C1)[O-] M158852 [1,0,0,0,0,0|3,0,0]=4 525 B8R1.3 CC1=CN=C(C=C1)Br B120720 [1,0,0,0,0,0|1,0,0]=2 526 B8R1.3 CC1=CN=C(C=C1)C L111803 [1,0,0,0,0,0|0,0,0]=1 527 B8R1.3 CC1=CN=C(C=C1)Cl C122971 [1,0,0,0,0,0|1,0,0]=2 528 B8R1.3 CC1=CN=C(C=C1)F F120713 [1,0,0,0,0,0|1,0,0]=2 529 B8R1.3 CC1=CN=C(C=C1)N A107505 [1,0,0,0,0,0|1,0,0]=2 530 B8R1.3 CC1=CN=C(C=N1)C D106345 [1,0,0,0,0,0|1,0,0]=2 531 B8R1.3 CC1=CN=C(C=N1)Cl C110233 [1,0,0,0,0,0|2,0,0]=3 532 B8R1.3 CC1=CN=C(C=N1)N M133886 [1,0,0,0,0,0|2,0,0]=3 533 B8R1.3 CC1=CN=C(N=C1)Cl C153537 [1,0,0,0,0,0|2,0,0]=3 534 B8R1.3 CC1=CNC(=O)C=C1 H107715 [1,0,0,0,0,0|1,0,1]=3 535 B8R1.3 CC1=CNC(=O)C=N1 M191984 [1,0,0,0,0,0|2,0,0]=3 536 B8R1.3 CC1=CNC(=S)C=C1 M405751 [1,0,0,0,0,0|1,0,1]=3 537 B8R1.3 CC1=NC=C(C=C1)Br B123445 [1,0,0,0,0,0|1,0,0]=2 538 B8R1.3 CC1=NC=C(C=C1)Cl C186235 [1,0,0,0,0,0|1,0,0]=2 539 B8R1.3 CC1=NC=C(C=C1)F F489688 [1,0,0,0,0,0|1,0,0]=2 540 B8R1.3 CC1=NC=C(C=C1)N A103049 [1,0,0,0,0,0|1,0,0]=2 541 B8R1.3 CC1=NC=C(C=C1)O H156935 [1,0,0,0,0,0|1,0,0]=2 542 B8R1.3 CC1=NC=C(C=N1)Br B152665 [1,0,0,0,0,0|2,0,0]=3 543 B8R1.3 CC1=NC=C(C=N1)N M176382 [1,0,0,0,0,0|2,0,0]=3 544 B8R1.3 CC1=NC=C(C=N1)O M588838 [1,0,0,0,0,0|2,0,0]=3 545 B8R1.3 CC1=NN=C(C=C1)Br B177071 [1,0,0,0,0,0|2,0,0]=3 546 B8R1.3 CC1=NN=C(C=C1)C D587537 [1,0,0,0,0,0|1,0,0]=2 547 B8R1.3 CC1=NN=C(C=C1)Cl C122392 [1,0,0,0,0,0|2,0,0]=3 548 B8R1.3 CC1=NN=C(N=N1)C D404324 [1,0,0,0,0,0|3,0,0]=4 549 B8R1.3 CC1=NNC(=O)C=C1 M157846 [1,0,0,0,0,0|2,0,0]=3 550 B8R1.3 CC1=[C-]C=C(C=C1)F F579402 [1,0,0,0,0,0|2,0,0]=3 551 B10R1.1 C1=CC(=CC=C1CC#N)Br B100849 [0,1,0,0,0,0|2,0,1]=4 552 B10R1.1 C1=CC(=CC=C1CC#N)Cl C124714 [0,1,0,0,0,0|2,0,1]=4 553 B10R1.1 C1=CC(=CC=C1CC#N)F F156616 [0,1,0,0,0,0|2,0,1]=4 554 B10R1.1 C1=CC(=CC=C1CC#N)I I170725 [0,1,0,0,0,0|2,0,1]=4 555 B10R1.1 C1=CC(=CC=C1CC#N)N A107271 [0,1,0,0,0,0|2,0,1]=4 556 B10R1.1 C1=CC(=CC=C1CC#N)O H121848 [0,1,0,0,0,0|2,0,1]=4 557 B10R1.1 C1=CC(=CC=C1CCBr)Br B167924 [0,1,0,0,0,0|2,0,0]=3 558 B10R1.1 C1=CC(=CC=C1CCBr)Cl C121844 [0,1,0,0,0,0|2,0,0]=3 559 B10R1.1 C1=CC(=CC=C1CCBr)F F121611 [0,1,0,0,0,0|2,0,0]=3 560 B10R1.1 C1=CC(=CC=C1CCBr)O H167212 [0,1,0,0,0,0|2,0,0]=3 561 B10R1.1 C1=CC(=CC=C1CCCl)F F156671 [0,1,0,0,0,0|2,0,0]=3 562 B10R1.1 C1=CC(=CC=C1CCN)Br B101709 [0,1,0,0,0,0|2,0,0]=3 563 B10R1.1 C1=CC(=CC=C1CCN)Br B494194 [0,1,0,0,0,0|2,0,0]=3 564 B10R1.1 C1=CC(=CC=C1CCN)Br B494196 [0,1,0,0,0,0|2,0,0]=3 565 B10R1.1 C1=CC(=CC=C1CCN)Cl C153968 [0,1,0,0,0,0|2,0,0]=3 566 B10R1.1 C1=CC(=CC=C1CCN)Cl C493551 [0,1,0,0,0,0|2,0,0]=3 567 B10R1.1 C1=CC(=CC=C1CCN)F F131906 [0,1,0,0,0,0|2,0,0]=3 568 B10R1.1 C1=CC(=CC=C1CCN)F F292669 [0,1,0,0,0,0|2,0,0]=3 569 B10R1.1 C1=CC(=CC=C1CCN)F F302836 [0,1,0,0,0,0|2,0,0]=3 570 B10R1.1 C1=CC(=CC=C1CCN)F F493198 [0,1,0,0,0,0|2,0,0]=3 571 B10R1.1 C1=CC(=CC=C1CCN)N A151503 [0,1,0,0,0,0|2,0,0]=3 572 B10R1.1 C1=CC(=CC=C1CCN)O T105543 [0,1,0,0,0,0|2,0,0]=3 573 B10R1.1 C1=CC(=CC=C1CCN)O T107153 [0,1,0,0,0,0|2,0,0]=3 574 B10R1.1 C1=CC(=CC=C1CCN)O T424437 [0,1,0,0,0,0|2,0,0]=3 575 B10R1.1 C1=CC(=CC=C1CCO)Br B153115 [0,1,0,0,0,0|2,0,0]=3 576 B10R1.1 C1=CC(=CC=C1CCO)Cl C121856 [0,1,0,0,0,0|2,0,0]=3 577 B10R1.1 C1=CC(=CC=C1CCO)F F136730 [0,1,0,0,0,0|2,0,0]=3 578 B10R1.1 C1=CC(=CC=C1CCO)N A151120 [0,1,0,0,0,0|2,0,0]=3 579 B10R1.1 C1=CC(=CC=C1CCO)O H106325 [0,1,0,0,0,0|2,0,0]=3 580 B10R1.1 C1=CC(=CC=C1CCO)O H118576 [0,1,0,0,0,0|2,0,0]=3 581 B10R1.1 C1=CC(=CC=C1CCO)O H424324 [0,1,0,0,0,0|2,0,0]=3 582 B10R1.1 C1=CC(=CC=C1CON)F A184897 [0,1,0,0,0,0|3,0,0]=4 583 B10R1.1 C1=CC(=NC=C1CC#N)Br B587268 [0,1,0,0,0,0|1,0,1]=3 584 B10R1.1 C1=CC(=NC=C1CC#N)Cl C138793 [0,1,0,0,0,0|1,0,1]=3 585 B10R1.1 C=CCC1=CC=C(C=C1)O A589273 [0,1,0,0,0,0|2,0,1]=4 586 B10R1.1 CC1=CC=C(C=C1)CC#N P160068 [0,1,0,0,0,0|1,0,1]=3 587 B10R1.1 CC1=CC=C(C=C1)CC=C A169644 [0,1,0,0,0,0|1,0,1]=3 588 B10R1.1 CC1=CC=C(C=C1)CC=O P586228 [0,1,0,0,0,0|1,0,1]=3 589 B10R1.1 CC1=CC=C(C=C1)CCBr M469504 [0,1,0,0,0,0|1,0,0]=2 590 B10R1.1 CC1=CC=C(C=C1)CCN M493506 [0,1,0,0,0,0|1,0,0]=2 591 B10R1.1 CC1=CC=C(C=C1)CCN P101999 [0,1,0,0,0,0|1,0,0]=2 592 B10R1.1 CC1=CC=C(C=C1)CCO I135268 [0,1,0,0,0,0|1,0,0]=2 593 B10R1.1 CC1=CC=C(C=C1)CNC N300479 [0,1,0,0,0,0|1,0,0]=2 594 B10R1.1 CC1=CC=C(C=C1)N=C=O T106835 [0,1,0,0,0,0|2,0,1]=4 595 B10R1.1 CC1=CC=C(C=C1)N=C=S P160464 [0,1,0,0,0,0|2,0,1]=4 596 B10R1.1 CC1=CC=C(C=C1)NC=O M158337 [0,1,0,0,0,0|2,0,1]=4 597 B10R1.1 CCCC1=CC=C(C=C1)Br B101884 [0,1,0,0,0,0|2,0,0]=3 598 B10R1.1 CCCC1=CC=C(C=C1)C P160392 [0,1,0,0,0,0|1,0,0]=2 599 B10R1.1 CCCC1=CC=C(C=C1)Cl C303901 [0,1,0,0,0,0|2,0,0]=3 600 B10R1.1 CCCC1=CC=C(C=C1)N P136525 [0,1,0,0,0,0|2,0,0]=3 601 B10R1.1 CCCC1=CC=C(C=C1)O P136692 [0,1,0,0,0,0|2,0,0]=3 602 B10R1.1 CCNC1=CC=C(C=C1)C N158982 [0,1,0,0,0,0|1,0,0]=2 603 B10R1.1 CCNC1=NN=C(C=C1)Cl C349279 [0,1,0,0,0,0|2,0,0]=3 604 B10R1.1 CCOC1=CC=C(C=C1)Br B113334 [0,1,0,0,0,0|2,0,0]=3 605 B10R1.1 CCOC1=CC=C(C=C1)Cl C304178 [0,1,0,0,0,0|2,0,0]=3 606 B10R1.1 CCOC1=CC=C(C=C1)F F156673 [0,1,0,0,0,0|2,0,0]=3 607 B10R1.1 CCOC1=CC=C(C=C1)I I111883 [0,1,0,0,0,0|2,0,0]=3 608 B10R1.1 CCOC1=CC=C(C=C1)N E108459 [0,1,0,0,0,0|2,0,0]=3 609 B10R1.1 CCOC1=CC=C(C=C1)N P160470 [0,1,0,0,0,0|2,0,0]=3 610 B10R1.1 CCOC1=CC=C(C=C1)O E124314 [0,1,0,0,0,0|2,0,0]=3 611 B10R1.1 CCOC1=NC=C(C=C1)Br B122972 [0,1,0,0,0,0|3,0,0]=4 612 B10R1.1 CCOC1=NC=C(C=C1)Cl C588198 [0,1,0,0,0,0|3,0,0]=4 613 B10R1.1 CCOC1=NN=C(C=C1)N E184272 [0,1,0,0,0,0|2,0,0]=3 614 B10R1.1 CNCC1=CC=C(C=C1)Br B186104 [0,1,0,0,0,0|2,0,0]=3 615 B10R1.1 CNCC1=CC=C(C=C1)Cl C153967 [0,1,0,0,0,0|2,0,0]=3 616 B10R1.1 CNCC1=CC=C(C=C1)F F156709 [0,1,0,0,0,0|2,0,0]=3 617 B10R1.1 COCC1=CC=C(C=C1)Br B181671 [0,1,0,0,0,0|2,0,0]=3 618 B10R1.1 COCC1=CC=C(C=C1)O M170858 [0,1,0,0,0,0|2,0,0]=3 619 B10R1.3 C#CC1=CC=C(C=C1)CCl C586270 [0,1,0,0,0,0|1,0,2]=4 620 B10R1.3 C#CC1=CC=C(C=C1)CO E302152 [0,1,0,0,0,0|1,0,2]=4 621 B10R1.3 C#CC1=CN=C(C=C1)C#C D404161 [0,1,0,0,0,0|0,0,3]=4 622 B10R1.3 C1=CC(=CC=C1CBr)C#N C153839 [0,1,0,0,0,0|2,0,1]=4 623 B10R1.3 C1=CC(=CC=C1CBr)C=O B184885 [0,1,0,0,0,0|2,0,1]=4 624 B10R1.3 C1=CC(=CC=C1CBr)CBr D100654 [0,1,0,0,0,0|2,0,0]=3 625 B10R1.3 C1=CC(=CC=C1CCl)C#N C101656 [0,1,0,0,0,0|2,0,1]=4 626 B10R1.3 C1=CC(=CC=C1CCl)C=O C194802 [0,1,0,0,0,0|2,0,1]=4 627 B10R1.3 C1=CC(=CC=C1CCl)CCl D104515 [0,1,0,0,0,0|2,0,0]=3 628 B10R1.3 C1=CC(=CC=C1CN)C#N A132657 [0,1,0,0,0,0|2,0,1]=4 629 B10R1.3 C1=CC(=CC=C1CN)CN P292859 [0,1,0,0,0,0|2,0,0]=3 630 B10R1.3 C1=CC(=CC=C1CN)CN X113802 [0,1,0,0,0,0|2,0,0]=3 631 B10R1.3 C1=CC(=CC=C1CN)CO A184295 [0,1,0,0,0,0|2,0,0]=3 632 B10R1.3 C1=CC(=CC=C1CO)C#N H124046 [0,1,0,0,0,0|2,0,1]=4 633 B10R1.3 C1=CC(=CC=C1CO)C=O H193722 [0,1,0,0,0,0|2,0,1]=4 634 B10R1.3 C1=CC(=CC=C1CO)CCl W131919 [0,1,0,0,0,0|2,0,0]=3 635 B10R1.3 C1=CC(=CC=C1CO)CO B107001 [0,1,0,0,0,0|2,0,0]=3 636 B10R1.3 C1=CC(=CC=C1CS)CS B101791 [0,1,0,0,0,0|2,0,0]=3 637 B10R1.3 C1=CC(=NC=C1C#N)C#N P588046 [0,1,0,0,0,0|1,0,2]=4 638 B10R1.3 C1=CC(=NC=C1C#N)CBr B587456 [0,1,0,0,0,0|1,0,1]=3 639 B10R1.3 C1=CC(=NC=C1C=O)C#N F181154 [0,1,0,0,0,0|1,0,2]=4 640 B10R1.3 C1=CC(=NC=C1CBr)C#N B588663 [0,1,0,0,0,0|1,0,1]=3 641 B10R1.3 C=CC1=CC=C(C=C1)CCl V141224 [0,1,0,0,0,0|1,0,2]=4 642 B10R1.3 C=CC1=CC=C(C=C1)CCl V592268 [0,1,0,0,0,0|1,0,2]=4 643 B10R1.3 C=CC1=CC=C(C=C1)CN V123986 [0,1,0,0,0,0|1,0,2]=4 644 B10R1.3 CCC1=CC=C(C=C1)C#C E115541 [0,1,0,0,0,0|1,0,1]=3 645 B10R1.3 CCC1=CC=C(C=C1)C#N E169049 [0,1,0,0,0,0|1,0,1]=3 646 B10R1.3 CCC1=CC=C(C=C1)C=O E102795 [0,1,0,0,0,0|1,0,1]=3 647 B10R1.3 CCC1=CC=C(C=C1)CC D107652 [0,1,0,0,0,0|1,0,0]=2 648 B10R1.3 CCC1=CC=C(C=C1)CC D107653 [0,1,0,0,0,0|1,0,0]=2 649 B10R1.3 CCC1=CC=C(C=C1)CCl E299918 [0,1,0,0,0,0|1,0,0]=2 650 B10R1.3 CCC1=CC=C(C=C1)CCl E399766 [0,1,0,0,0,0|1,0,0]=2 651 B10R1.3 CCC1=CC=C(C=C1)CO E156110 [0,1,0,0,0,0|1,0,0]=2 652 B10R1.3 CCC1=CC=C(C=C1)NN E185066 [0,1,0,0,0,0|2,0,0]=3 653 B10R1.3 CCC1=CC=C(C=C1)OC E137475 [0,1,0,0,0,0|1,0,0]=2 654 B10R1.3 CNC1=CC=C(C=C1)C#N M184657 [0,1,0,0,0,0|2,0,1]=4 655 B10R1.3 CNC1=CC=C(C=C1)OC I133933 [0,1,0,0,0,0|2,0,0]=3 656 B10R1.3 COC1=CC=C(C=C1)C#C M111332 [0,1,0,0,0,0|1,0,2]=4 657 B10R1.3 COC1=CC=C(C=C1)C#N M111093 [0,1,0,0,0,0|2,0,1]=4 658 B10R1.3 COC1=CC=C(C=C1)C=C M103131 [0,1,0,0,0,0|1,0,2]=4 659 B10R1.3 COC1=CC=C(C=C1)C=O A108955 [0,1,0,0,0,0|2,0,1]=4 660 B10R1.3 COC1=CC=C(C=C1)C=O A108956 [0,1,0,0,0,0|2,0,1]=4 661 B10R1.3 COC1=CC=C(C=C1)C=O A108957 [0,1,0,0,0,0|2,0,1]=4 662 B10R1.3 COC1=CC=C(C=C1)C=O A108958 [0,1,0,0,0,0|2,0,1]=4 663 B10R1.3 COC1=CC=C(C=C1)C=O P421001 [0,1,0,0,0,0|2,0,1]=4 664 B10R1.3 COC1=CC=C(C=C1)CCl M491599 [0,1,0,0,0,0|2,0,0]=3 665 B10R1.3 COC1=CC=C(C=C1)CN M123767 [0,1,0,0,0,0|2,0,0]=3 666 B10R1.3 COC1=CC=C(C=C1)CO M107568 [0,1,0,0,0,0|2,0,0]=3 667 B10R1.3 COC1=CC=C(C=C1)CS M101790 [0,1,0,0,0,0|2,0,0]=3 668 B10R1.3 COC1=CC=C(C=C1)CS M414622 [0,1,0,0,0,0|2,0,0]=3 669 B10R1.3 COC1=CC=C(C=C1)OC D104711 [0,1,0,0,0,0|2,0,0]=3 670 B10R1.3 COC1=CC=C(C=C1)OC D137778 [0,1,0,0,0,0|2,0,0]=3 671 B10R1.3 COC1=CC=C(C=C1)SC M101846 [0,1,0,0,0,0|2,0,0]=3 672 B10R1.3 COC1=CC=C(C=C1)[N+]#N M123217 [0,1,0,0,0,0|3,0,0]=4 673 B10R1.3 COC1=CC=C(C=C1)[N+]#[C-] M165558 [0,1,0,0,0,0|2,0,1]=4 674 B10R1.3 COC1=CN=C(C=C1)C#N M178084 [0,1,0,0,0,0|1,0,1]=3 675 B10R1.3 COC1=CN=C(C=C1)C=O M182921 [0,1,0,0,0,0|1,0,1]=3 676 B10R1.3 COC1=CN=C(C=C1)CO M190450 [0,1,0,0,0,0|1,0,0]=2 677 B10R1.3 COC1=NC=C(C=C1)C#N M167622 [0,1,0,0,0,0|1,0,1]=3 678 B10R1.3 COC1=NC=C(C=C1)C=O M115769 [0,1,0,0,0,0|1,0,1]=3 679 B10R1.3 COC1=NC=C(C=C1)CN M177670 [0,1,0,0,0,0|1,0,0]=2 680 B10R1.3 COC1=NC=C(C=C1)CO M176865 [0,1,0,0,0,0|1,0,0]=2 681 B10R1.3 COC1=NC=C(C=N1)C=O F337248 [0,1,0,0,0,0|2,0,1]=4 682 B10R1.3 COC1=NN=C(C=C1)OC D303761 [0,1,0,0,0,0|2,0,0]=3 683 B10R1.3 CSC1=CC=C(C=C1)C#N M101849 [0,1,0,0,0,0|2,0,1]=4 684 B10R1.3 CSC1=CC=C(C=C1)C=O P133663 [0,1,0,0,0,0|2,0,1]=4 685 B10R1.3 CSC1=CC=C(C=C1)CCl M101851 [0,1,0,0,0,0|2,0,0]=3 686 B10R1.3 CSC1=CC=C(C=C1)CO M101850 [0,1,0,0,0,0|2,0,0]=3 687 B10R1.3 CSC1=NC=C(C=N1)C=O M178139 [0,1,0,0,0,0|2,0,1]=4 688 B10R1.13 B(C1=CC=C(C=C1)C)(O)O P290670 [0,1,0,0,0,0|3,0,0]=4 689 B10R1.13 B(C1=CC=C(C=C1)C)(O)O P396101 [0,1,0,0,0,0|3,0,0]=4 690 B10R1.13 B(C1=CC=C(C=C1)C)(O)O T111324 [0,1,0,0,0,0|3,0,0]=4 691 B10R1.13 B(C1=CN=C(C=C1)Br)(O)O B102580 [0,1,0,0,0,0|3,0,0]=4 692 B10R1.13 B(C1=CN=C(C=C1)C)(O)O M334495 [0,1,0,0,0,0|2,0,0]=3 693 B10R1.13 B(C1=CN=C(C=C1)C)(O)O P189181 [0,1,0,0,0,0|2,0,0]=3 694 B10R1.13 B(C1=CN=C(C=C1)Cl)(O)O C102579 [0,1,0,0,0,0|3,0,0]=4 695 B10R1.13 B(C1=CN=C(C=C1)F)(O)O F102578 [0,1,0,0,0,0|3,0,0]=4 696 B10R1.13 B(C1=CN=C(C=C1)N)(O)O A177646 [0,1,0,0,0,0|3,0,0]=4 697 B10R1.13 B(C1=CN=C(N=C1)C)(O)O M171767 [0,1,0,0,0,0|3,0,0]=4 698 B10R1.13 C1=CC(=CC=C1C(Cl)Cl)F F156706 [0,1,0,0,0,0|3,0,0]=4 699 B10R1.13 C1=CC(=CC=C1C(F)F)Br B184912 [0,1,0,0,0,0|3,0,0]=4 700 B10R1.13 C1=CC(=NC=C1C(=O)Cl)Cl C113581 [0,1,0,0,0,0|2,0,1]=4 701 B10R1.13 C1=CC(=NC=C1C(=O)N)Br B187814 [0,1,0,0,0,0|2,0,1]=4 702 B10R1.13 C1=CC(=NC=C1C(=O)N)Cl C154058 [0,1,0,0,0,0|2,0,1]=4 703 B10R1.13 C1=CC(=NC=C1C(=O)N)N A112600 [0,1,0,0,0,0|2,0,1]=4 704 B10R1.13 C1=CC(=NC=C1C(=O)O)Br B151851 [0,1,0,0,0,0|2,0,1]=4 705 B10R1.13 C1=CC(=NC=C1C(=O)O)Cl C128115 [0,1,0,0,0,0|2,0,1]=4 706 B10R1.13 C1=CC(=NC=C1C(=O)O)F F170170 [0,1,0,0,0,0|2,0,1]=4 707 B10R1.13 C1=CC(=NC=C1C(=O)O)N A113866 [0,1,0,0,0,0|2,0,1]=4 708 B10R1.13 C1=CC(=NC=C1C(F)F)Br B166565 [0,1,0,0,0,0|2,0,0]=3 709 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Br B107718 [0,1,0,0,0,0|3,0,0]=4 710 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Cl C106559 [0,1,0,0,0,0|3,0,0]=4 711 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])F F140137 [0,1,0,0,0,0|3,0,0]=4 712 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])I I157682 [0,1,0,0,0,0|3,0,0]=4 713 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])N A124302 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.13 CC(=C)C1=CC=C(C=C1)F F156644 [0,1,0,0,0,0|2,0,1]=4 715 B10R1.13 CC(=C)C1=CC=C(C=C1)O P193379 [0,1,0,0,0,0|2,0,1]=4 716 B10R1.13 CC(=O)C1=CC=C(C=C1)Br B106981 [0,1,0,0,0,0|2,0,1]=4 717 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl C103870 [0,1,0,0,0,0|2,0,1]=4 718 B10R1.13 CC(=O)C1=CC=C(C=C1)F F101384 [0,1,0,0,0,0|2,0,1]=4 719 B10R1.13 CC(=O)C1=CC=C(C=C1)I I107027 [0,1,0,0,0,0|2,0,1]=4 720 B10R1.13 CC(=O)C1=CC=C(C=C1)N A110613 [0,1,0,0,0,0|2,0,1]=4 721 B10R1.13 CC(=O)C1=CC=C(C=C1)N A110614 [0,1,0,0,0,0|2,0,1]=4 722 B10R1.13 CC(=O)C1=CC=C(C=C1)N A151685 [0,1,0,0,0,0|2,0,1]=4 723 B10R1.13 CC(=O)C1=CC=C(C=C1)O H102969 [0,1,0,0,0,0|2,0,1]=4 724 B10R1.13 CC(=O)C1=CC=C(C=C1)S M407301 [0,1,0,0,0,0|2,0,1]=4 725 B10R1.13 CC(=O)C1=CN=C(C=C1)Br B115765 [0,1,0,0,0,0|1,0,1]=3 726 B10R1.13 CC(=O)C1=CN=C(C=C1)Cl A151743 [0,1,0,0,0,0|1,0,1]=3 727 B10R1.13 CC(=O)C1=CN=C(C=C1)F F186855 [0,1,0,0,0,0|1,0,1]=3 728 B10R1.13 CC(C)C1=CC=C(C=C1)Br B102079 [0,1,0,0,0,0|2,0,0]=3 729 B10R1.13 CC(C)C1=CC=C(C=C1)I I587659 [0,1,0,0,0,0|2,0,0]=3 730 B10R1.13 CC(C)C1=CC=C(C=C1)N I101369 [0,1,0,0,0,0|2,0,0]=3 731 B10R1.13 CC(C)C1=CC=C(C=C1)N I106863 [0,1,0,0,0,0|2,0,0]=3 732 B10R1.13 CC(C)C1=CC=C(C=C1)O I101756 [0,1,0,0,0,0|2,0,0]=3 733 B10R1.13 CC(C)C1=CC=C(C=C1)S I101777 [0,1,0,0,0,0|2,0,0]=3 734 B10R1.13 CC(C)C1=NC=C(C=C1)Br B586459 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.13 CC(C)C1=NC=C(C=C1)N P176415 [0,1,0,0,0,0|3,0,0]=4 736 B10R1.13 CC(C1=CC=C(C=C1)Br)N B113790 [0,1,0,0,0,0|2,0,0]=3 737 B10R1.13 CC(C1=CC=C(C=C1)Br)N B151926 [0,1,0,0,0,0|2,0,0]=3 738 B10R1.13 CC(C1=CC=C(C=C1)Br)N R138868 [0,1,0,0,0,0|2,0,0]=3 739 B10R1.13 CC(C1=CC=C(C=C1)Br)N R409459 [0,1,0,0,0,0|2,0,0]=3 740 B10R1.13 CC(C1=CC=C(C=C1)Br)O B153117 [0,1,0,0,0,0|2,0,0]=3 741 B10R1.13 CC(C1=CC=C(C=C1)Br)O I131837 [0,1,0,0,0,0|2,0,0]=3 742 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C111118 [0,1,0,0,0,0|2,0,0]=3 743 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C171312 [0,1,0,0,0,0|2,0,0]=3 744 B10R1.13 CC(C1=CC=C(C=C1)Cl)N C185668 [0,1,0,0,0,0|2,0,0]=3 745 B10R1.13 CC(C1=CC=C(C=C1)Cl)N R588512 [0,1,0,0,0,0|2,0,0]=3 746 B10R1.13 CC(C1=CC=C(C=C1)Cl)O C153305 [0,1,0,0,0,0|2,0,0]=3 747 B10R1.13 CC(C1=CC=C(C=C1)Cl)O S196166 [0,1,0,0,0,0|2,0,0]=3 748 B10R1.13 CC(C1=CC=C(C=C1)F)N F122770 [0,1,0,0,0,0|2,0,0]=3 749 B10R1.13 CC(C1=CC=C(C=C1)F)N R303591 [0,1,0,0,0,0|2,0,0]=3 750 B10R1.13 CC(C1=CC=C(C=C1)F)O F156599 [0,1,0,0,0,0|2,0,0]=3 751 B10R1.13 CC(C1=CC=C(C=C1)I)N I195715 [0,1,0,0,0,0|2,0,0]=3 752 B10R1.13 CC(C1=CC=C(C=C1)I)N L489513 [0,1,0,0,0,0|2,0,0]=3 753 B10R1.13 CC(C1=CC=C(C=C1)I)N R489522 [0,1,0,0,0,0|2,0,0]=3 754 B10R1.13 CC(C1=CC=C(C=C1)I)N S489515 [0,1,0,0,0,0|2,0,0]=3 755 B10R1.13 CC(C1=CC=C(C=C1)N)O H167342 [0,1,0,0,0,0|2,0,0]=3 756 B10R1.13 CC(C1=CC=C(C=C1)O)O H192225 [0,1,0,0,0,0|2,0,0]=3 757 B10R1.13 CC(C1=CN=C(C=C1)Cl)N C489471 [0,1,0,0,0,0|1,0,0]=2 758 B10R1.13 CC(C1=NC=C(C=C1)Br)N B489562 [0,1,0,0,0,0|3,0,0]=4 759 B10R1.13 CC(C1=NC=C(C=C1)Br)N R489263 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.13 CC(C1=NC=C(C=C1)Br)N S489604 [0,1,0,0,0,0|3,0,0]=4 761 B10R1.13 CC1=CC=C(C=C1)C(=C)C I157628 [0,1,0,0,0,0|1,0,1]=3 762 B10R1.13 CC1=CC=C(C=C1)C(=N)N M135239 [0,1,0,0,0,0|2,0,1]=4 763 B10R1.13 CC1=CC=C(C=C1)C(=O)C M106726 [0,1,0,0,0,0|1,0,1]=3 764 B10R1.13 CC1=CC=C(C=C1)C(=O)C M140798 [0,1,0,0,0,0|1,0,1]=3 765 B10R1.13 CC1=CC=C(C=C1)C(=O)Cl T106376 [0,1,0,0,0,0|2,0,1]=4 766 B10R1.13 CC1=CC=C(C=C1)C(=O)N P160467 [0,1,0,0,0,0|2,0,1]=4 767 B10R1.13 CC1=CC=C(C=C1)C(=O)O T104320 [0,1,0,0,0,0|2,0,1]=4 768 B10R1.13 CC1=CC=C(C=C1)C(=O)O T119535 [0,1,0,0,0,0|2,0,1]=4 769 B10R1.13 CC1=CC=C(C=C1)C(=O)O T305431 [0,1,0,0,0,0|2,0,1]=4 770 B10R1.13 CC1=CC=C(C=C1)C(=S)N M140148 [0,1,0,0,0,0|2,0,1]=4 771 B10R1.13 CC1=CC=C(C=C1)C(C)C D102667 [0,1,0,0,0,0|1,0,0]=2 772 B10R1.13 CC1=CC=C(C=C1)C(C)C D118512 [0,1,0,0,0,0|1,0,0]=2 773 B10R1.13 CC1=CC=C(C=C1)C(C)C I105448 [0,1,0,0,0,0|1,0,0]=2 774 B10R1.13 CC1=CC=C(C=C1)C(C)C I105449 [0,1,0,0,0,0|1,0,0]=2 775 B10R1.13 CC1=CC=C(C=C1)C(C)C I105451 [0,1,0,0,0,0|1,0,0]=2 776 B10R1.13 CC1=CC=C(C=C1)C(C)N D113666 [0,1,0,0,0,0|1,0,0]=2 777 B10R1.13 CC1=CC=C(C=C1)C(C)N P160184 [0,1,0,0,0,0|1,0,0]=2 778 B10R1.13 CC1=CC=C(C=C1)C(C)N R160847 [0,1,0,0,0,0|1,0,0]=2 779 B10R1.13 CC1=CC=C(C=C1)C(C)O P160711 [0,1,0,0,0,0|1,0,0]=2 780 B10R1.13 CC1=CC=C(C=C1)N(C)C N158974 [0,1,0,0,0,0|2,0,0]=3 781 B10R1.13 CC1=CC=C(C=C1)S(=O)C M304998 [0,1,0,0,0,0|2,0,0]=3 782 B10R1.13 CC1=CC=C(C=C1)S(=O)N I168991 [0,1,0,0,0,0|3,0,0]=4 783 B10R1.13 CC1=CC=C(C=C1)S(=O)N S161364 [0,1,0,0,0,0|3,0,0]=4 784 B10R1.13 CC1=CC=C(C=C1)S(=O)[O-] L348763 [0,1,0,0,0,0|3,0,0]=4 785 B10R1.13 CC1=CC=C(C=C1)S(=O)[O-] S100400 [0,1,0,0,0,0|3,0,0]=4 786 B10R1.13 CC1=CC=C(C=C1)S(=O)[O-] S100401 [0,1,0,0,0,0|3,0,0]=4 787 B10R1.13 CC1=CC=C(C=C1)S(=O)[O-] S161159 [0,1,0,0,0,0|3,0,0]=4 788 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] N104645 [0,1,0,0,0,0|3,0,0]=4 789 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] N104647 [0,1,0,0,0,0|3,0,0]=4 790 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] N118455 [0,1,0,0,0,0|3,0,0]=4 791 B10R1.13 CC1=CC=C(C=C1)[N+](=O)[O-] N119545 [0,1,0,0,0,0|3,0,0]=4 792 B10R1.13 CC1=CC=C(CC1)C(C)C A151162 [0,1,0,0,0,0|1,0,1]=3 793 B10R1.13 CC1=CCC(=CC1)C(C)C G156812 [0,1,0,0,0,0|1,0,1]=3 794 B10R1.13 CC1=CCC(C=C1)C(C)C A151161 [0,1,0,0,0,0|1,0,2]=4 795 B10R1.13 CC1=CN=C(C=C1)C(=O)C A185017 [0,1,0,0,0,0|2,0,1]=4 796 B10R1.13 CC1=CN=C(C=N1)C(=O)O M106709 [0,1,0,0,0,0|2,0,1]=4 797 B10R1.13 CC1=NC=C(C=C1)C(=O)C A123439 [0,1,0,0,0,0|0,0,1]=2 798 B10R1.13 CC1=NC=C(C=C1)C(=O)N M139191 [0,1,0,0,0,0|1,0,1]=3 799 B10R1.13 CC1=NC=C(C=C1)C(=O)O M128104 [0,1,0,0,0,0|1,0,1]=3 800 B10R1.13 CC1=NC=C(C=C1)[N+](=O)[O-] M120570 [0,1,0,0,0,0|2,0,0]=3 801 B10R1.13 CC1=NC=C(C=N1)C(=O)O M120447 [0,1,0,0,0,0|2,0,1]=4 802 B10R1.13 CN(C)C1=CC=C(C=C1)Br B120305 [0,1,0,0,0,0|3,0,0]=4 803 B10R1.13 CN(C)C1=CC=C(C=C1)F F156712 [0,1,0,0,0,0|3,0,0]=4 804 B10R1.13 CN(C)C1=CC=C(C=C1)N D100438 [0,1,0,0,0,0|3,0,0]=4 805 B10R1.13 CN(C)C1=CC=C(C=C1)N D105596 [0,1,0,0,0,0|3,0,0]=4 806 B10R1.13 CN(C)C1=CC=C(C=C1)N D106285 [0,1,0,0,0,0|3,0,0]=4 807 B10R1.13 CN(C)C1=CC=C(C=C1)N D110992 [0,1,0,0,0,0|3,0,0]=4 808 B10R1.13 CN(C)C1=CC=C(C=C1)N D110993 [0,1,0,0,0,0|3,0,0]=4 809 B10R1.13 CN(C)C1=CC=C(C=C1)N I168425 [0,1,0,0,0,0|3,0,0]=4 810 B10R1.13 CN(C)C1=CC=C(C=C1)O D194230 [0,1,0,0,0,0|3,0,0]=4 811 B10R1.13 CN(C)C1=CC=C(C=C1)S D155401 [0,1,0,0,0,0|3,0,0]=4 812 B10R1.13 CN(C)C1=CN=C(C=C1)Br B588991 [0,1,0,0,0,0|2,0,0]=3 813 B10R1.13 CS(=O)C1=CC=C(C=C1)Br B188392 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.13 C[S+](C)C1=CC=C(C=C1)O H156984 [0,1,0,0,0,0|3,0,0]=4 815 B10R1.25 C1=C(C(=CN=C1Cl)C#N)Cl D181949 [0,1,0,0,0,0|2,0,1]=4 816 B10R1.25 C1=C(C(=CN=C1Cl)C=O)Cl D586277 [0,1,0,0,0,0|2,0,1]=4 817 B10R1.25 C1=C(C(=CN=C1Cl)C=O)N A586085 [0,1,0,0,0,0|2,0,1]=4 818 B10R1.25 C1=C(C(=CN=C1Cl)CCl)Cl D194829 [0,1,0,0,0,0|2,0,0]=3 819 B10R1.25 C1=CC(=C(C=C1Br)Br)CO D154156 [0,1,0,0,0,0|3,0,0]=4 820 B10R1.25 C1=CC(=C(C=C1Br)Cl)CO B182302 [0,1,0,0,0,0|3,0,0]=4 821 B10R1.25 C1=CC(=C(C=C1Br)F)CBr B120594 [0,1,0,0,0,0|3,0,0]=4 822 B10R1.25 C1=CC(=C(C=C1Br)F)CCl B152645 [0,1,0,0,0,0|3,0,0]=4 823 B10R1.25 C1=CC(=C(C=C1Br)F)CO B168173 [0,1,0,0,0,0|3,0,0]=4 824 B10R1.25 C1=CC(=C(C=C1Br)N)CO A188537 [0,1,0,0,0,0|3,0,0]=4 825 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CBr B191953 [0,1,0,0,0,0|3,0,0]=4 826 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CCl D405586 [0,1,0,0,0,0|3,0,0]=4 827 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CN D154480 [0,1,0,0,0,0|3,0,0]=4 828 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CO D154151 [0,1,0,0,0,0|3,0,0]=4 829 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CO D422163 [0,1,0,0,0,0|3,0,0]=4 830 B10R1.25 C1=CC(=C(C=C1Cl)Cl)CS D155416 [0,1,0,0,0,0|3,0,0]=4 831 B10R1.25 C1=CC(=C(C=C1Cl)F)CBr C153563 [0,1,0,0,0,0|3,0,0]=4 832 B10R1.25 C1=CC(=C(C=C1Cl)F)CO C185242 [0,1,0,0,0,0|3,0,0]=4 833 B10R1.25 C1=CC(=C(C=C1Cl)N)CO A169996 [0,1,0,0,0,0|3,0,0]=4 834 B10R1.25 C1=CC(=C(C=C1F)Br)CO B133187 [0,1,0,0,0,0|3,0,0]=4 835 B10R1.25 C1=CC(=C(C=C1F)Cl)CBr C123478 [0,1,0,0,0,0|3,0,0]=4 836 B10R1.25 C1=CC(=C(C=C1F)Cl)CCl C153561 [0,1,0,0,0,0|3,0,0]=4 837 B10R1.25 C1=CC(=C(C=C1F)Cl)CN C124426 [0,1,0,0,0,0|3,0,0]=4 838 B10R1.25 C1=CC(=C(C=C1F)Cl)CO C133066 [0,1,0,0,0,0|3,0,0]=4 839 B10R1.25 C1=CC(=C(C=C1F)F)CBr D120599 [0,1,0,0,0,0|3,0,0]=4 840 B10R1.25 C1=CC(=C(C=C1F)F)CCl D122811 [0,1,0,0,0,0|3,0,0]=4 841 B10R1.25 C1=CC(=C(C=C1F)F)CN D122767 [0,1,0,0,0,0|3,0,0]=4 842 B10R1.25 C1=CC(=C(C=C1F)F)CO D154518 [0,1,0,0,0,0|3,0,0]=4 843 B10R1.25 C1=CC(=NC(=C1C#N)Cl)Cl D124087 [0,1,0,0,0,0|2,0,1]=4 844 B10R1.25 C1=CC(=NC(=C1C=O)Cl)Br B165963 [0,1,0,0,0,0|2,0,1]=4 845 B10R1.25 C1=CC(=NC(=C1C=O)Cl)Cl D154201 [0,1,0,0,0,0|2,0,1]=4 846 B10R1.25 C1=CC(=NC(=C1C=O)F)F D181754 [0,1,0,0,0,0|2,0,1]=4 847 B10R1.25 C1=CC(=NC(=C1CBr)Cl)F B586690 [0,1,0,0,0,0|2,0,0]=3 848 B10R1.25 C1=NC(=O)NC(=C1CO)N H302221 [0,1,0,0,0,0|3,0,0]=4 849 B10R1.25 CC1=C(C=CC(=C1)Br)CN B193071 [0,1,0,0,0,0|3,0,0]=4 850 B10R1.25 CC1=C(C=CC(=C1)Br)CN M491375 [0,1,0,0,0,0|3,0,0]=4 851 B10R1.25 CC1=C(C=CC(=C1)Br)CO B153118 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.25 CC1=C(C=CC(=C1)Br)OC B122705 [0,1,0,0,0,0|3,0,0]=4 853 B10R1.25 CC1=C(C=CC(=C1)Cl)CO C153314 [0,1,0,0,0,0|3,0,0]=4 854 B10R1.25 CC1=C(C=CC(=C1)Cl)OC C153447 [0,1,0,0,0,0|3,0,0]=4 855 B10R1.25 CC1=C(C=CC(=C1)F)CBr F137397 [0,1,0,0,0,0|3,0,0]=4 856 B10R1.25 CC1=C(C=CC(=C1)N)OC M140237 [0,1,0,0,0,0|3,0,0]=4 857 B10R1.25 CC1=C(C=CC(=C1)O)SC M158095 [0,1,0,0,0,0|3,0,0]=4 858 B10R1.25 CC1=C(C=CC(=N1)Cl)C=O C187655 [0,1,0,0,0,0|2,0,1]=4 859 B10R1.25 CC1=C(C=CC(=N1)N)C#N A168088 [0,1,0,0,0,0|2,0,1]=4 860 B10R1.25 CC1=CC(=C(C=C1)C#N)Br W135911 [0,1,0,0,0,0|2,0,1]=4 861 B10R1.25 CC1=CC(=C(C=C1)C#N)C D154445 [0,1,0,0,0,0|2,0,1]=4 862 B10R1.25 CC1=CC(=C(C=C1)C#N)Cl C182776 [0,1,0,0,0,0|2,0,1]=4 863 B10R1.25 CC1=CC(=C(C=C1)C#N)F F120481 [0,1,0,0,0,0|2,0,1]=4 864 B10R1.25 CC1=CC(=C(C=C1)C#N)N A123969 [0,1,0,0,0,0|2,0,1]=4 865 B10R1.25 CC1=CC(=C(C=C1)C#N)O H182292 [0,1,0,0,0,0|2,0,1]=4 866 B10R1.25 CC1=CC(=C(C=C1)C=O)Br B186774 [0,1,0,0,0,0|2,0,1]=4 867 B10R1.25 CC1=CC(=C(C=C1)C=O)C D103125 [0,1,0,0,0,0|2,0,1]=4 868 B10R1.25 CC1=CC(=C(C=C1)C=O)Cl C135937 [0,1,0,0,0,0|2,0,1]=4 869 B10R1.25 CC1=CC(=C(C=C1)C=O)F F120634 [0,1,0,0,0,0|2,0,1]=4 870 B10R1.25 CC1=CC(=C(C=C1)C=O)O H124155 [0,1,0,0,0,0|2,0,1]=4 871 B10R1.25 CC1=CC(=C(C=C1)CCl)C D304725 [0,1,0,0,0,0|2,0,0]=3 872 B10R1.25 CC1=CC(=C(C=C1)CO)C D155716 [0,1,0,0,0,0|2,0,0]=3 873 B10R1.25 CC1=CC(=C(C=C1)CO)Cl C588985 [0,1,0,0,0,0|2,0,0]=3 874 B10R1.25 CC1=CC(=C(C=C1)NN)C D102567 [0,1,0,0,0,0|3,0,0]=4 875 B10R1.25 CC1=CC(=C(C=C1)OC)Br B135797 [0,1,0,0,0,0|2,0,0]=3 876 B10R1.25 CC1=CC(=C(C=C1)OC)N M114090 [0,1,0,0,0,0|2,0,0]=3 877 B10R1.25 CC1=CC(=C(C=C1)OC)N M131613 [0,1,0,0,0,0|2,0,0]=3 878 B10R1.25 CC1=CC(=C(C=C1)OC)O M124273 [0,1,0,0,0,0|2,0,0]=3 879 B10R1.25 CC1=CC(=C(N=C1)CCl)C C590035 [0,1,0,0,0,0|3,0,0]=4 880 B10R1.25 CC1=CC(=C(N=C1)OC)Br B186222 [0,1,0,0,0,0|3,0,0]=4 881 B10R1.25 CC1=CC(=NC=C1C=O)Cl C187656 [0,1,0,0,0,0|2,0,1]=4 882 B10R1.25 CC1=CC=C(C(=O)N1)C#N C123051 [0,1,0,0,0,0|1,0,2]=4 883 B10R1.25 CC1=NC(=C(C=C1)C#N)Cl C123053 [0,1,0,0,0,0|1,0,1]=3 884 B10R1.25 CC1=NC=C(C(=N1)N)C#N A137005 [0,1,0,0,0,0|2,0,1]=4 885 B10R1.25 CC1=NC=C(C(=N1)N)CN A188569 [0,1,0,0,0,0|2,0,0]=3 886 B10R1.25 CC1=NC=C(C(=N1)N)CO A151329 [0,1,0,0,0,0|2,0,0]=3 887 B10R1.25 CCC1=C(C=C(C=C1)C)C E156304 [0,1,0,0,0,0|1,0,0]=2 888 B10R1.25 CCC1=C(C=C(C=C1)O)O E100551 [0,1,0,0,0,0|2,0,0]=3 889 B10R1.25 CCC1=CNC(=O)NC1=O E135137 [0,1,0,0,0,0|2,0,1]=4 890 B10R1.25 CCC1=NC=C(N=C1C)C E103761 [0,1,0,0,0,0|1,0,0]=2 891 B10R1.25 CCC1=NC=C(N=C1C)C E133774 [0,1,0,0,0,0|1,0,0]=2 892 B10R1.25 CNC1=C(C=C(C=C1)Br)Br D469616 [0,1,0,0,0,0|3,0,0]=4 893 B10R1.25 CNC1=C(C=C(C=C1)Cl)Cl D169801 [0,1,0,0,0,0|3,0,0]=4 894 B10R1.25 CNC1=C(C=C(C=C1)Cl)N C194119 [0,1,0,0,0,0|3,0,0]=4 895 B10R1.25 COC1=C(C=C(C=C1)Br)Br D132966 [0,1,0,0,0,0|3,0,0]=4 896 B10R1.25 COC1=C(C=C(C=C1)Br)Cl B357163 [0,1,0,0,0,0|3,0,0]=4 897 B10R1.25 COC1=C(C=C(C=C1)Br)F B101646 [0,1,0,0,0,0|3,0,0]=4 898 B10R1.25 COC1=C(C=C(C=C1)Br)N B134097 [0,1,0,0,0,0|3,0,0]=4 899 B10R1.25 COC1=C(C=C(C=C1)Br)O B137212 [0,1,0,0,0,0|3,0,0]=4 900 B10R1.25 COC1=C(C=C(C=C1)Cl)Br B101886 [0,1,0,0,0,0|3,0,0]=4 901 B10R1.25 COC1=C(C=C(C=C1)Cl)Cl D155538 [0,1,0,0,0,0|3,0,0]=4 902 B10R1.25 COC1=C(C=C(C=C1)Cl)F C332053 [0,1,0,0,0,0|3,0,0]=4 903 B10R1.25 COC1=C(C=C(C=C1)Cl)I C189153 [0,1,0,0,0,0|3,0,0]=4 904 B10R1.25 COC1=C(C=C(C=C1)Cl)N C153904 [0,1,0,0,0,0|3,0,0]=4 905 B10R1.25 COC1=C(C=C(C=C1)Cl)O C193052 [0,1,0,0,0,0|3,0,0]=4 906 B10R1.25 COC1=C(C=C(C=C1)F)Br B120999 [0,1,0,0,0,0|3,0,0]=4 907 B10R1.25 COC1=C(C=C(C=C1)F)Cl C122583 [0,1,0,0,0,0|3,0,0]=4 908 B10R1.25 COC1=C(C=C(C=C1)F)F D122592 [0,1,0,0,0,0|3,0,0]=4 909 B10R1.25 COC1=C(C=C(C=C1)F)N F122496 [0,1,0,0,0,0|3,0,0]=4 910 B10R1.25 COC1=C(C=C(C=C1)F)N F598725 [0,1,0,0,0,0|3,0,0]=4 911 B10R1.25 COC1=C(C=C(C=C1)F)O F186288 [0,1,0,0,0,0|3,0,0]=4 912 B10R1.25 COC1=C(C=C(C=C1)I)F F193110 [0,1,0,0,0,0|3,0,0]=4 913 B10R1.25 COC1=C(C=C(C=C1)I)N I136035 [0,1,0,0,0,0|3,0,0]=4 914 B10R1.25 COC1=C(C=C(C=C1)N)Br B135326 [0,1,0,0,0,0|3,0,0]=4 915 B10R1.25 COC1=C(C=C(C=C1)N)Cl C124254 [0,1,0,0,0,0|3,0,0]=4 916 B10R1.25 COC1=C(C=C(C=C1)N)F F120575 [0,1,0,0,0,0|3,0,0]=4 917 B10R1.25 COC1=C(C=C(C=C1)N)I I139236 [0,1,0,0,0,0|3,0,0]=4 918 B10R1.25 COC1=C(C=C(C=C1)N)N D154686 [0,1,0,0,0,0|3,0,0]=4 919 B10R1.25 COC1=C(C=C(C=C1)N)N D573312 [0,1,0,0,0,0|3,0,0]=4 920 B10R1.25 COC1=C(C=C(C=C1)N)N M114086 [0,1,0,0,0,0|3,0,0]=4 921 B10R1.25 COC1=C(C=C(C=C1)N)O H157240 [0,1,0,0,0,0|3,0,0]=4 922 B10R1.25 COC1=C(C=C(C=C1)O)Br B182087 [0,1,0,0,0,0|3,0,0]=4 923 B10R1.25 COC1=C(C=C(C=C1)O)F F193465 [0,1,0,0,0,0|3,0,0]=4 924 B10R1.25 COC1=C(C=C(C=C1)O)O M304130 [0,1,0,0,0,0|3,0,0]=4 925 B10R1.25 COC1=C(N=C(C=C1)Br)Br D590202 [0,1,0,0,0,0|2,0,0]=3 926 B10R1.25 COC1=C(N=C(C=C1)I)Br B169549 [0,1,0,0,0,0|2,0,0]=3 927 B10R1.25 COC1=C(N=C(C=C1)I)I D170361 [0,1,0,0,0,0|2,0,0]=3 928 B10R1.25 COC1=CN=C(N=C1Cl)Cl D119148 [0,1,0,0,0,0|3,0,0]=4 929 B10R1.176 C1=C(C=NC(=C1Br)Br)C#N D586636 [0,1,0,0,0,0|2,0,1]=4 930 B10R1.176 C1=C(C=NC(=C1Br)Cl)C#N B177268 [0,1,0,0,0,0|2,0,1]=4 931 B10R1.176 C1=C(C=NC(=C1Br)N)C#N A184685 [0,1,0,0,0,0|2,0,1]=4 932 B10R1.176 C1=C(C=NC(=C1Cl)Cl)CO D135968 [0,1,0,0,0,0|2,0,0]=3 933 B10R1.176 C1=C(C=NC(=C1F)Br)C=O B586695 [0,1,0,0,0,0|2,0,1]=4 934 B10R1.176 C1=C(C=NC(=C1F)Cl)C#N C178819 [0,1,0,0,0,0|2,0,1]=4 935 B10R1.176 C1=CC(=C(C=C1CBr)Br)F B134543 [0,1,0,0,0,0|3,0,0]=4 936 B10R1.176 C1=CC(=C(C=C1CBr)Cl)Cl D182371 [0,1,0,0,0,0|3,0,0]=4 937 B10R1.176 C1=CC(=C(C=C1CBr)Cl)F C122802 [0,1,0,0,0,0|3,0,0]=4 938 B10R1.176 C1=CC(=C(C=C1CBr)F)Br B132624 [0,1,0,0,0,0|3,0,0]=4 939 B10R1.176 C1=CC(=C(C=C1CBr)F)Cl C122818 [0,1,0,0,0,0|3,0,0]=4 940 B10R1.176 C1=CC(=C(C=C1CBr)F)F D120602 [0,1,0,0,0,0|3,0,0]=4 941 B10R1.176 C1=CC(=C(C=C1CCl)Cl)Cl D165515 [0,1,0,0,0,0|3,0,0]=4 942 B10R1.176 C1=CC(=C(C=C1CCl)F)F D120478 [0,1,0,0,0,0|3,0,0]=4 943 B10R1.176 C1=CC(=C(C=C1CN)Cl)Cl D122964 [0,1,0,0,0,0|3,0,0]=4 944 B10R1.176 C1=CC(=C(C=C1CN)Cl)F C113579 [0,1,0,0,0,0|3,0,0]=4 945 B10R1.176 C1=CC(=C(C=C1CN)F)Br B589556 [0,1,0,0,0,0|3,0,0]=4 946 B10R1.176 C1=CC(=C(C=C1CN)F)Cl C194761 [0,1,0,0,0,0|3,0,0]=4 947 B10R1.176 C1=CC(=C(C=C1CN)F)F D155250 [0,1,0,0,0,0|3,0,0]=4 948 B10R1.176 C1=CC(=C(C=C1CN)O)O D167718 [0,1,0,0,0,0|3,0,0]=4 949 B10R1.176 C1=CC(=C(C=C1CO)Br)Cl B183729 [0,1,0,0,0,0|3,0,0]=4 950 B10R1.176 C1=CC(=C(C=C1CO)Br)F B122794 [0,1,0,0,0,0|3,0,0]=4 951 B10R1.176 C1=CC(=C(C=C1CO)Br)O B133783 [0,1,0,0,0,0|3,0,0]=4 952 B10R1.176 C1=CC(=C(C=C1CO)Cl)Cl D154150 [0,1,0,0,0,0|3,0,0]=4 953 B10R1.176 C1=CC(=C(C=C1CO)Cl)F C137482 [0,1,0,0,0,0|3,0,0]=4 954 B10R1.176 C1=CC(=C(C=C1CO)F)Br B135371 [0,1,0,0,0,0|3,0,0]=4 955 B10R1.176 C1=CC(=C(C=C1CO)F)Cl C182593 [0,1,0,0,0,0|3,0,0]=4 956 B10R1.176 C1=CC(=C(C=C1CO)F)F D122815 [0,1,0,0,0,0|3,0,0]=4 957 B10R1.176 C1=CC(=C(C=C1CO)O)O D155345 [0,1,0,0,0,0|3,0,0]=4 958 B10R1.176 CC1=C(C=C(C=C1)C#N)Br B120889 [0,1,0,0,0,0|2,0,1]=4 959 B10R1.176 CC1=C(C=C(C=C1)C#N)C D168795 [0,1,0,0,0,0|2,0,1]=4 960 B10R1.176 CC1=C(C=C(C=C1)C#N)Cl W136125 [0,1,0,0,0,0|2,0,1]=4 961 B10R1.176 CC1=C(C=C(C=C1)C#N)F F120484 [0,1,0,0,0,0|2,0,1]=4 962 B10R1.176 CC1=C(C=C(C=C1)C#N)I I170326 [0,1,0,0,0,0|2,0,1]=4 963 B10R1.176 CC1=C(C=C(C=C1)C#N)N A185526 [0,1,0,0,0,0|2,0,1]=4 964 B10R1.176 CC1=C(C=C(C=C1)C#N)O H184166 [0,1,0,0,0,0|2,0,1]=4 965 B10R1.176 CC1=C(C=C(C=C1)C=O)Br B153186 [0,1,0,0,0,0|2,0,1]=4 966 B10R1.176 CC1=C(C=C(C=C1)C=O)C D123177 [0,1,0,0,0,0|2,0,1]=4 967 B10R1.176 CC1=C(C=C(C=C1)C=O)Cl C124170 [0,1,0,0,0,0|2,0,1]=4 968 B10R1.176 CC1=C(C=C(C=C1)C=O)F F124173 [0,1,0,0,0,0|2,0,1]=4 969 B10R1.176 CC1=C(C=C(C=C1)CCl)C C189378 [0,1,0,0,0,0|2,0,0]=3 970 B10R1.176 CC1=C(C=C(C=C1)CN)C D132092 [0,1,0,0,0,0|2,0,0]=3 971 B10R1.176 CC1=C(C=C(C=C1)CO)C D331591 [0,1,0,0,0,0|2,0,0]=3 972 B10R1.176 CC1=C(C=C(C=C1)CO)N A151061 [0,1,0,0,0,0|2,0,0]=3 973 B10R1.176 CC1=C(C=C(C=C1)NN)C D101717 [0,1,0,0,0,0|3,0,0]=4 974 B10R1.176 CC1=C(C=C(C=C1)NN)Cl C134208 [0,1,0,0,0,0|3,0,0]=4 975 B10R1.176 CC1=C(C=C(C=C1)OC)Br B193028 [0,1,0,0,0,0|2,0,0]=3 976 B10R1.176 CC1=C(C=C(C=C1)OC)C D170479 [0,1,0,0,0,0|2,0,0]=3 977 B10R1.176 CC1=C(C=C(C=C1)OC)Cl C405497 [0,1,0,0,0,0|2,0,0]=3 978 B10R1.176 CC1=C(C=C(C=C1)OC)F F193262 [0,1,0,0,0,0|2,0,0]=3 979 B10R1.176 CC1=C(C=C(C=C1)OC)N W134180 [0,1,0,0,0,0|2,0,0]=3 980 B10R1.176 CC1=C(C=CC(=C1)CBr)F F129140 [0,1,0,0,0,0|3,0,0]=4 981 B10R1.176 CC1=C(C=CC(=C1)CN)F F122788 [0,1,0,0,0,0|3,0,0]=4 982 B10R1.176 CC1=C(C=CC(=C1)CO)Br B181609 [0,1,0,0,0,0|3,0,0]=4 983 B10R1.176 CC1=C(C=CC(=C1)CO)F F183255 [0,1,0,0,0,0|3,0,0]=4 984 B10R1.176 CC1=C(C=CC(=C1)OC)Br B115843 [0,1,0,0,0,0|3,0,0]=4 985 B10R1.176 CC1=C(C=CC(=C1)OC)F W137121 [0,1,0,0,0,0|3,0,0]=4 986 B10R1.176 CC1=C(C=CC(=C1)OC)N M124249 [0,1,0,0,0,0|3,0,0]=4 987 B10R1.176 CC1=C(C=CC(=C1)OC)O H193776 [0,1,0,0,0,0|3,0,0]=4 988 B10R1.176 CC1=CC(=CN=C1Br)C#N B184105 [0,1,0,0,0,0|2,0,1]=4 989 B10R1.176 CCC1=CC(=C(C=C1)O)Br B589769 [0,1,0,0,0,0|2,0,0]=3 990 B10R1.176 CCC1=CC(=C(C=C1)O)O E165960 [0,1,0,0,0,0|2,0,0]=3 991 B10R1.176 CCC1=CN=C(C(=N1)C)C E156377 [0,1,0,0,0,0|1,0,0]=2 992 B10R1.176 CNC1=CC(=C(C=C1)Cl)Cl D589045 [0,1,0,0,0,0|3,0,0]=4 993 B10R1.176 COC1=CC(=C(C=C1)Br)Cl B184846 [0,1,0,0,0,0|3,0,0]=4 994 B10R1.176 COC1=CC(=C(C=C1)Br)F B115514 [0,1,0,0,0,0|3,0,0]=4 995 B10R1.176 COC1=CC(=C(C=C1)Br)I B589246 [0,1,0,0,0,0|3,0,0]=4 996 B10R1.176 COC1=CC(=C(C=C1)Br)N B185457 [0,1,0,0,0,0|3,0,0]=4 997 B10R1.176 COC1=CC(=C(C=C1)Br)O B185723 [0,1,0,0,0,0|3,0,0]=4 998 B10R1.176 COC1=CC(=C(C=C1)Cl)Br B120329 [0,1,0,0,0,0|3,0,0]=4 999 B10R1.176 COC1=CC(=C(C=C1)Cl)F C133728 [0,1,0,0,0,0|3,0,0]=4 1000 B10R1.176 COC1=CC(=C(C=C1)Cl)N C122489 [0,1,0,0,0,0|3,0,0]=4 1001 B10R1.176 COC1=CC(=C(C=C1)Cl)N C134554 [0,1,0,0,0,0|3,0,0]=4 1002 B10R1.176 COC1=CC(=C(C=C1)F)Br B576831 [0,1,0,0,0,0|3,0,0]=4 1003 B10R1.176 COC1=CC(=C(C=C1)F)Cl C132066 [0,1,0,0,0,0|3,0,0]=4 1004 B10R1.176 COC1=CC(=C(C=C1)F)F D155764 [0,1,0,0,0,0|3,0,0]=4 1005 B10R1.176 COC1=CC(=C(C=C1)I)Br B184649 [0,1,0,0,0,0|3,0,0]=4 1006 B10R1.176 COC1=CC(=C(C=C1)I)O I170223 [0,1,0,0,0,0|3,0,0]=4 1007 B10R1.176 COC1=CC(=C(C=C1)N)Cl C192569 [0,1,0,0,0,0|3,0,0]=4 1008 B10R1.176 COC1=CC(=C(C=C1)N)F F124247 [0,1,0,0,0,0|3,0,0]=4 1009 B10R1.176 COC1=CC(=C(C=C1)N)I I175362 [0,1,0,0,0,0|3,0,0]=4 1010 B10R1.176 COC1=CC(=C(C=C1)N)N D178847 [0,1,0,0,0,0|3,0,0]=4 1011 B10R1.176 COC1=CC(=C(C=C1)N)N M299127 [0,1,0,0,0,0|3,0,0]=4 1012 B10R1.176 COC1=CC(=C(C=C1)N)O H157084 [0,1,0,0,0,0|3,0,0]=4 1013 B10R1.176 COC1=CC(=C(C=C1)O)Br B122555 [0,1,0,0,0,0|3,0,0]=4 1014 B10R1.176 COC1=CC(=C(C=C1)O)Br B152684 [0,1,0,0,0,0|3,0,0]=4 1015 B10R1.176 COC1=CC(=C(C=C1)O)Cl C124268 [0,1,0,0,0,0|3,0,0]=4 1016 B10R1.176 COC1=CC(=C(C=C1)O)F F156740 [0,1,0,0,0,0|3,0,0]=4 1017 B10R1.176 COC1=CC(=C(C=C1)O)N A299108 [0,1,0,0,0,0|3,0,0]=4 1018 B8R0.9 CC(=O)C=CC(=O)OC M157976 [0,0,1,0,0,0|3,0,0]=4 1019 B8R0.9 CC(=O)C=CC(=O)OC M464501 [0,0,1,0,0,0|3,0,0]=4 1020 B8R0.11 CCCC=C(CC)C=O E156033 [0,0,1,0,0,0|1,0,2]=4 1021 B10R2.31 C1CC2=C1C=CC(=C2)Br B132442 [0,0,0,1,0,0|2,0,0]=3 1022 B8R1.1 C1=C(N=C(S1)Br)CO B170760 [0,0,0,0,1,0|3,0,0]=4 1023 B8R1.1 C1=C(SC(=C1)Br)CN B171578 [0,0,0,0,1,0|3,0,0]=4 1024 B8R1.1 C1=C(SC(=C1)Cl)CN A489444 [0,0,0,0,1,0|3,0,0]=4 1025 B8R1.1 C1=C(SC(=C1)Cl)CN C176759 [0,0,0,0,1,0|3,0,0]=4 1026 B8R1.1 C1=C(SC(=C1)Cl)CO C177325 [0,0,0,0,1,0|3,0,0]=4 1027 B8R1.1 C1=C(SC(=N1)Br)CO B186024 [0,0,0,0,1,0|3,0,0]=4 1028 B8R1.1 C1=C(SC=C1Br)CN B193540 [0,0,0,0,1,0|3,0,0]=4 1029 B8R1.1 C1=C(SC=C1Br)CO B186670 [0,0,0,0,1,0|3,0,0]=4 1030 B8R1.1 CC1=CC(=NN1)CO M588591 [0,0,0,0,1,0|2,0,1]=4 1031 B8R1.1 CC1=CC(=NO1)CO M136270 [0,0,0,0,1,0|3,0,0]=4 1032 B8R1.1 CC1=CC=C(N1)C=O M586541 [0,0,0,0,1,0|1,0,2]=4 1033 B8R1.1 CC1=CC=C(O1)C=O M102952 [0,0,0,0,1,0|2,0,1]=4 1034 B8R1.1 CC1=CC=C(O1)C=O M425132 [0,0,0,0,1,0|2,0,1]=4 1035 B8R1.1 CC1=CC=C(O1)CN M158539 [0,0,0,0,1,0|2,0,0]=3 1036 B8R1.1 CC1=CC=C(O1)CO M189133 [0,0,0,0,1,0|2,0,0]=3 1037 B8R1.1 CC1=CC=C(O1)SC M133227 [0,0,0,0,1,0|2,0,0]=3 1038 B8R1.1 CC1=CC=C(S1)C#N M177298 [0,0,0,0,1,0|2,0,1]=4 1039 B8R1.1 CC1=CC=C(S1)C=O M157937 [0,0,0,0,1,0|2,0,1]=4 1040 B8R1.1 CC1=CSC(=C1)C=O M171140 [0,0,0,0,1,0|2,0,1]=4 1041 B8R1.1 CC1=CSC(=N1)C=O W131880 [0,0,0,0,1,0|2,0,1]=4 1042 B8R1.1 CC1=NC(=CO1)C=O W132350 [0,0,0,0,1,0|2,0,1]=4 1043 B8R1.1 CC1=NC(=CS1)C=O W133174 [0,0,0,0,1,0|2,0,1]=4 1044 B8R1.1 CC1=NC=C(S1)C=O M586094 [0,0,0,0,1,0|2,0,1]=4 1045 B8R1.1 CC1=NOC(=N1)CCl D302540 [0,0,0,0,1,0|3,0,0]=4 1046 B8R1.1 CCC1=CC(=NN1)N A587870 [0,0,0,0,1,0|2,0,0]=3 1047 B8R1.1 CCC1=NC(=CS1)C E124072 [0,0,0,0,1,0|1,0,0]=2 1048 B8R1.1 CCC1=NC(=NN1)N E168786 [0,0,0,0,1,0|3,0,0]=4 1049 B8R1.1 CCC1=NC=C(N1)C E104846 [0,0,0,0,1,0|1,0,1]=3 1050 B8R1.1 CCC1=NN=C(S1)N A468731 [0,0,0,0,1,0|3,0,0]=4 1051 B8R1.1 CCN1C=C(C=N1)Br B186185 [0,0,0,0,1,0|3,0,0]=4 1052 B8R1.1 CCN1C=C[N+](=C1)C E101503 [0,0,0,0,1,0|2,0,0]=3 1053 B8R1.1 CCN1C=C[N+](=C1)C E101504 [0,0,0,0,1,0|2,0,0]=3 1054 B8R1.1 CCN1C=C[N+](=C1)C E101508 [0,0,0,0,1,0|2,0,0]=3 1055 B8R1.1 CCN1C=C[N+](=C1)C E106224 [0,0,0,0,1,0|2,0,0]=3 1056 B8R1.1 CCN1C=C[N+](=C1)C E120488 [0,0,0,0,1,0|2,0,0]=3 1057 B8R1.1 CCN1C=C[N+](=C1)C E120491 [0,0,0,0,1,0|2,0,0]=3 1058 B8R1.1 CCN1C=C[N+](=C1)C E120492 [0,0,0,0,1,0|2,0,0]=3 1059 B8R1.1 CCN1C=C[N+](=C1)C E120493 [0,0,0,0,1,0|2,0,0]=3 1060 B8R1.1 CCN1C=C[N+](=C1)C E121210 [0,0,0,0,1,0|2,0,0]=3 1061 B8R1.1 CCN1C=C[N+](=C1)C E121211 [0,0,0,0,1,0|2,0,0]=3 1062 B8R1.1 CCN1C=C[N+](=C1)C E121213 [0,0,0,0,1,0|2,0,0]=3 1063 B8R1.1 CCN1C=C[N+](=C1)C E121229 [0,0,0,0,1,0|2,0,0]=3 1064 B8R1.1 CCN1C=C[N+](=C1)C E156361 [0,0,0,0,1,0|2,0,0]=3 1065 B8R1.1 CCN1C=C[N+](=C1)C E170730 [0,0,0,0,1,0|2,0,0]=3 1066 B8R1.1 CCN1C=C[N+](=C1)C E299084 [0,0,0,0,1,0|2,0,0]=3 1067 B8R1.1 CCN1C=C[N+](=C1)C E304331 [0,0,0,0,1,0|2,0,0]=3 1068 B8R1.1 CCN1C=C[N+](=C1)C E304343 [0,0,0,0,1,0|2,0,0]=3 1069 B8R1.1 CCN1C=C[N+](=C1)C E305185 [0,0,0,0,1,0|2,0,0]=3 1070 B8R1.1 CCN1C=C[N+](=C1)C E342179 [0,0,0,0,1,0|2,0,0]=3 1071 B8R1.1 CCN1C=C[N+](=C1)C E342742 [0,0,0,0,1,0|2,0,0]=3 1072 B8R1.1 CCN1C=C[N+](=C1)C E342745 [0,0,0,0,1,0|2,0,0]=3 1073 B8R1.1 CCN1C=C[N+](=C1)C M299085 [0,0,0,0,1,0|2,0,0]=3 1074 B8R1.1 CCN1C=C[N+](=C1)C W131887 [0,0,0,0,1,0|2,0,0]=3 1075 B8R1.1 CCN1C=C[N+](=C1)C W136549 [0,0,0,0,1,0|2,0,0]=3 1076 B8R1.1 CN1C=C(C=N1)C#C E170134 [0,0,0,0,1,0|1,0,2]=4 1077 B8R1.1 CN1C=C(C=N1)C#N M177097 [0,0,0,0,1,0|2,0,1]=4 1078 B8R1.1 CN1C=C(C=N1)C=O M137134 [0,0,0,0,1,0|2,0,1]=4 1079 B8R1.1 CN1C=C(C=N1)CN M172031 [0,0,0,0,1,0|2,0,0]=3 1080 B8R1.1 CN1C=C(C=N1)CN M589007 [0,0,0,0,1,0|2,0,0]=3 1081 B8R1.1 CN1C=C(C=N1)CO M172072 [0,0,0,0,1,0|2,0,0]=3 1082 B8R1.1 CN1C=C(N=C1)CO M305172 [0,0,0,0,1,0|3,0,0]=4 1083 B8R1.1 CN1C=CC(=N1)CN M589648 [0,0,0,0,1,0|2,0,0]=3 1084 B8R1.1 CN1C=CC(=N1)CO M177588 [0,0,0,0,1,0|2,0,0]=3 1085 B8R1.1 CN1C=NC(=N1)CO M406986 [0,0,0,0,1,0|3,0,0]=4 1086 B8R1.1 COC1=NC(=CS1)Br B168930 [0,0,0,0,1,0|3,0,0]=4 1087 B8R1.1 CSC1=NC(=CS1)Br B182627 [0,0,0,0,1,0|3,0,0]=4 1088 B7R0.1 CCC=CC=CC=O H102914 [1,0,1,0,0,0|2,0,0]=4 1089 B7R0.4 CC=CC=CC(=O)C H156931 [1,0,1,0,0,0|1,0,1]=4 1090 B7R0.4 CCCC=CC(=O)C H156932 [1,0,1,0,0,0|1,0,1]=4 1091 B7R0.6 CC(=C)CCC(=C)C D155280 [1,0,1,0,0,0|1,0,1]=4 1092 B7R0.6 CC(=CC=C(C)C)C D103154 [1,0,1,0,0,0|1,0,1]=4 1093 B7R1.3 Brc1ccccc1 B128157 [2,0,0,0,0,0|2,0,0]=4 1094 B7R1.3 C1=C(C=NC=N1)Br B107005 [2,0,0,0,0,0|2,0,0]=4 1095 B7R1.3 C1=C(C=NC=N1)N A122551 [2,0,0,0,0,0|2,0,0]=4 1096 B7R1.3 C1=C(C=NC=N1)O P175938 [2,0,0,0,0,0|2,0,0]=4 1097 B7R1.3 C1=CC(=CN=C1)Br B106977 [2,0,0,0,0,0|1,0,0]=3 1098 B7R1.3 C1=CC(=CN=C1)Cl C106490 [2,0,0,0,0,0|1,0,0]=3 1099 B7R1.3 C1=CC(=CN=C1)F F119663 [2,0,0,0,0,0|1,0,0]=3 1100 B7R1.3 C1=CC(=CN=C1)I I101566 [2,0,0,0,0,0|1,0,0]=3 1101 B7R1.3 C1=CC(=CN=C1)N A107134 [2,0,0,0,0,0|1,0,0]=3 1102 B7R1.3 C1=CC(=CN=C1)N A107135 [2,0,0,0,0,0|1,0,0]=3 1103 B7R1.3 C1=CC(=CN=C1)O H106342 [2,0,0,0,0,0|1,0,0]=3 1104 B7R1.3 C1=CC(=CN=C1)O H434905 [2,0,0,0,0,0|1,0,0]=3 1105 B7R1.3 C1=CC(=NN=C1)Br B590520 [2,0,0,0,0,0|2,0,0]=4 1106 B7R1.3 C1=CC(=NN=C1)Cl C177666 [2,0,0,0,0,0|2,0,0]=4 1107 B7R1.3 C1=CC(=NN=C1)N A123467 [2,0,0,0,0,0|2,0,0]=4 1108 B7R1.3 C1=CC(=O)NC=C1 H108693 [2,0,0,0,0,0|1,0,1]=4 1109 B7R1.3 C1=CC(=O)NC=C1 H421556 [2,0,0,0,0,0|1,0,1]=4 1110 B7R1.3 C1=CC(=O)NN=C1 P119352 [2,0,0,0,0,0|2,0,0]=4 1111 B7R1.3 C1=CC(=O)OC=C1 A136345 [2,0,0,0,0,0|2,0,0]=4 1112 B7R1.3 C1=CC(=S)NC=C1 M101871 [2,0,0,0,0,0|1,0,1]=4 1113 B7R1.3 C1=CC=C(C=C1)Br B103388 [2,0,0,0,0,0|2,0,0]=4 1114 B7R1.3 C1=CC=C(C=C1)Br B103389 [2,0,0,0,0,0|2,0,0]=4 1115 B7R1.3 C1=CC=C(C=C1)Br B103390 [2,0,0,0,0,0|2,0,0]=4 1116 B7R1.3 C1=CC=C(C=C1)Br B121294 [2,0,0,0,0,0|2,0,0]=4 1117 B7R1.3 C1=CC=C(C=C1)Br B473807 [2,0,0,0,0,0|2,0,0]=4 1118 B7R1.3 C1=CC=C(C=C1)Cl C105081 [2,0,0,0,0,0|2,0,0]=4 1119 B7R1.3 C1=CC=C(C=C1)Cl C105082 [2,0,0,0,0,0|2,0,0]=4 1120 B7R1.3 C1=CC=C(C=C1)Cl C105083 [2,0,0,0,0,0|2,0,0]=4 1121 B7R1.3 C1=CC=C(C=C1)Cl C105084 [2,0,0,0,0,0|2,0,0]=4 1122 B7R1.3 C1=CC=C(C=C1)Cl C119461 [2,0,0,0,0,0|2,0,0]=4 1123 B7R1.3 C1=CC=C(C=C1)Cl C342726 [2,0,0,0,0,0|2,0,0]=4 1124 B7R1.3 C1=CC=C(C=C1)Cl C431386 [2,0,0,0,0,0|2,0,0]=4 1125 B7R1.3 C1=CC=C(C=C1)Cl C639739 [2,0,0,0,0,0|2,0,0]=4 1126 B7R1.3 C1=CC=C(C=C1)F F107096 [2,0,0,0,0,0|2,0,0]=4 1127 B7R1.3 C1=CC=C(C=C1)F F107098 [2,0,0,0,0,0|2,0,0]=4 1128 B7R1.3 C1=CC=C(C=C1)F F107099 [2,0,0,0,0,0|2,0,0]=4 1129 B7R1.3 C1=CC=C(C=C1)F F107100 [2,0,0,0,0,0|2,0,0]=4 1130 B7R1.3 C1=CC=C(C=C1)F F128178 [2,0,0,0,0,0|2,0,0]=4 1131 B7R1.3 C1=CC=C(C=C1)F F128179 [2,0,0,0,0,0|2,0,0]=4 1132 B7R1.3 C1=CC=C(C=C1)I I104581 [2,0,0,0,0,0|2,0,0]=4 1133 B7R1.3 C1=CC=C(C=C1)I I104582 [2,0,0,0,0,0|2,0,0]=4 1134 B7R1.3 C1=CC=C(C=C1)N A108448 [2,0,0,0,0,0|2,0,0]=4 1135 B7R1.3 C1=CC=C(C=C1)N A111640 [2,0,0,0,0,0|2,0,0]=4 1136 B7R1.3 C1=CC=C(C=C1)N A112119 [2,0,0,0,0,0|2,0,0]=4 1137 B7R1.3 C1=CC=C(C=C1)N A112120 [2,0,0,0,0,0|2,0,0]=4 1138 B7R1.3 C1=CC=C(C=C1)N A112122 [2,0,0,0,0,0|2,0,0]=4 1139 B7R1.3 C1=CC=C(C=C1)N A112123 [2,0,0,0,0,0|2,0,0]=4 1140 B7R1.3 C1=CC=C(C=C1)N A112124 [2,0,0,0,0,0|2,0,0]=4 1141 B7R1.3 C1=CC=C(C=C1)N A112125 [2,0,0,0,0,0|2,0,0]=4 1142 B7R1.3 C1=CC=C(C=C1)N A117353 [2,0,0,0,0,0|2,0,0]=4 1143 B7R1.3 C1=CC=C(C=C1)N A117354 [2,0,0,0,0,0|2,0,0]=4 1144 B7R1.3 C1=CC=C(C=C1)N A117355 [2,0,0,0,0,0|2,0,0]=4 1145 B7R1.3 C1=CC=C(C=C1)N A121681 [2,0,0,0,0,0|2,0,0]=4 1146 B7R1.3 C1=CC=C(C=C1)N A133014 [2,0,0,0,0,0|2,0,0]=4 1147 B7R1.3 C1=CC=C(C=C1)N A135834 [2,0,0,0,0,0|2,0,0]=4 1148 B7R1.3 C1=CC=C(C=C1)N A151130 [2,0,0,0,0,0|2,0,0]=4 1149 B7R1.3 C1=CC=C(C=C1)N A151150 [2,0,0,0,0,0|2,0,0]=4 1150 B7R1.3 C1=CC=C(C=C1)N A283803 [2,0,0,0,0,0|2,0,0]=4 1151 B7R1.3 C1=CC=C(C=C1)N A344406 [2,0,0,0,0,0|2,0,0]=4 1152 B7R1.3 C1=CC=C(C=C1)N P492994 [2,0,0,0,0,0|2,0,0]=4 1153 B7R1.3 C1=CC=C(C=C1)N P492999 [2,0,0,0,0,0|2,0,0]=4 1154 B7R1.3 C1=CC=C(C=C1)O P100761 [2,0,0,0,0,0|2,0,0]=4 1155 B7R1.3 C1=CC=C(C=C1)O P100762 [2,0,0,0,0,0|2,0,0]=4 1156 B7R1.3 C1=CC=C(C=C1)O P100765 [2,0,0,0,0,0|2,0,0]=4 1157 B7R1.3 C1=CC=C(C=C1)O P100767 [2,0,0,0,0,0|2,0,0]=4 1158 B7R1.3 C1=CC=C(C=C1)O P100769 [2,0,0,0,0,0|2,0,0]=4 1159 B7R1.3 C1=CC=C(C=C1)O P100770 [2,0,0,0,0,0|2,0,0]=4 1160 B7R1.3 C1=CC=C(C=C1)O P121281 [2,0,0,0,0,0|2,0,0]=4 1161 B7R1.3 C1=CC=C(C=C1)O P128316 [2,0,0,0,0,0|2,0,0]=4 1162 B7R1.3 C1=CC=C(C=C1)O P397150 [2,0,0,0,0,0|2,0,0]=4 1163 B7R1.3 C1=CC=C(C=C1)O P472012 [2,0,0,0,0,0|2,0,0]=4 1164 B7R1.3 C1=CC=C(C=C1)[O-] P171611 [2,0,0,0,0,0|2,0,0]=4 1165 B7R1.3 C1=CC=C(C=C1)[O-] S110499 [2,0,0,0,0,0|2,0,0]=4 1166 B7R1.3 C1=CC=C(C=C1)[O-] S190796 [2,0,0,0,0,0|2,0,0]=4 1167 B7R1.3 C1=CC=C(C=C1)[S-] C355238 [2,0,0,0,0,0|2,0,0]=4 1168 B7R1.3 C1=CC=C(C=C1)[S-] S195897 [2,0,0,0,0,0|2,0,0]=4 1169 B7R1.3 C1=CC=C(C=C1)[Se] B121193 [2,0,0,0,0,0|2,0,0]=4 1170 B7R1.3 C1=CC=C(C=C1)[Si] P160608 [2,0,0,0,0,0|1,1,0]=4 1171 B7R1.3 C1=CC=NC(=C1)Br B109679 [2,0,0,0,0,0|1,0,0]=3 1172 B7R1.3 C1=CC=NC(=C1)Cl C104870 [2,0,0,0,0,0|1,0,0]=3 1173 B7R1.3 C1=CC=NC(=C1)F F120342 [2,0,0,0,0,0|1,0,0]=3 1174 B7R1.3 C1=CC=NC(=C1)I I111393 [2,0,0,0,0,0|1,0,0]=3 1175 B7R1.3 C1=CC=NC(=C1)N A105221 [2,0,0,0,0,0|1,0,0]=3 1176 B7R1.3 C1=CC=NC(=C1)N A105222 [2,0,0,0,0,0|1,0,0]=3 1177 B7R1.3 C1=CN=C(C=N1)Br B135014 [2,0,0,0,0,0|2,0,0]=4 1178 B7R1.3 C1=CN=C(C=N1)Cl C124227 [2,0,0,0,0,0|2,0,0]=4 1179 B7R1.3 C1=CN=C(C=N1)F F119252 [2,0,0,0,0,0|2,0,0]=4 1180 B7R1.3 C1=CN=C(C=N1)I I157423 [2,0,0,0,0,0|2,0,0]=4 1181 B7R1.3 C1=CN=C(C=N1)N A111242 [2,0,0,0,0,0|2,0,0]=4 1182 B7R1.3 C1=CN=C(N=C1)Br B120301 [2,0,0,0,0,0|2,0,0]=4 1183 B7R1.3 C1=CN=C(N=C1)Cl C132282 [2,0,0,0,0,0|2,0,0]=4 1184 B7R1.3 C1=CN=C(N=C1)I I404595 [2,0,0,0,0,0|2,0,0]=4 1185 B7R1.3 C1=CN=C(N=C1)N A109732 [2,0,0,0,0,0|2,0,0]=4 1186 B7R1.3 C1=CN=CC(=O)N1 H134514 [2,0,0,0,0,0|2,0,0]=4 1187 B7R1.3 C1=CN=CC(=O)N1 P586771 [2,0,0,0,0,0|2,0,0]=4 1188 B7R1.3 C1=CN=CC(=S)N1 M170065 [2,0,0,0,0,0|2,0,0]=4 1189 B7R1.3 C1=CN=CN=C1N A151327 [2,0,0,0,0,0|2,0,0]=4 1190 B7R1.3 C1=CN=C[N+](=C1)[O-] P338543 [2,0,0,0,0,0|2,0,0]=4 1191 B7R1.3 C1=CN=NC=C1N P132827 [2,0,0,0,0,0|2,0,0]=4 1192 B7R1.3 C1=CNC(=O)N=C1 H111812 [2,0,0,0,0,0|2,0,0]=4 1193 B7R1.3 C1=CNC(=O)N=C1 P303873 [2,0,0,0,0,0|2,0,0]=4 1194 B7R1.3 C1=CNC(=S)N=C1 M158441 [2,0,0,0,0,0|2,0,0]=4 1195 B7R1.3 C1=CNN=CC1=O H191985 [2,0,0,0,0,0|2,0,0]=4 1196 B7R1.3 CC1=CC=CC=C1 T102274 [2,0,0,0,0,0|1,0,0]=3 1197 B7R1.3 CC1=CC=CC=C1 T102275 [2,0,0,0,0,0|1,0,0]=3 1198 B7R1.3 CC1=CC=CC=C1 T102276 [2,0,0,0,0,0|1,0,0]=3 1199 B7R1.3 CC1=CC=CC=C1 T399619 [2,0,0,0,0,0|1,0,0]=3 1200 B7R1.3 CC1=CC=CC=C1 T399633 [2,0,0,0,0,0|1,0,0]=3 1201 B7R1.3 CC1=CC=CC=C1 T399640 [2,0,0,0,0,0|1,0,0]=3 1202 B7R1.3 CC1=CC=CC=C1 T399643 [2,0,0,0,0,0|1,0,0]=3 1203 B7R1.3 CC1=CC=CC=C1 T399652 [2,0,0,0,0,0|1,0,0]=3 1204 B7R1.3 CC1=CC=CC=C1 T399677 [2,0,0,0,0,0|1,0,0]=3 1205 B7R1.3 CC1=CC=CC=C1 T399681 [2,0,0,0,0,0|1,0,0]=3 1206 B7R1.3 CC1=CC=CC=N1 M108694 [2,0,0,0,0,0|0,0,0]=2 1207 B7R1.3 CC1=CC=CC=N1 M108695 [2,0,0,0,0,0|0,0,0]=2 1208 B7R1.3 CC1=CC=CC=N1 P122349 [2,0,0,0,0,0|0,0,0]=2 1209 B7R1.3 CC1=CC=NC=C1 P105226 [2,0,0,0,0,0|2,0,0]=4 1210 B7R1.3 CC1=CCC=CC1 M113652 [2,0,0,0,0,0|1,0,1]=4 1211 B7R1.3 CC1=CN=CC=C1 P109209 [2,0,0,0,0,0|0,0,0]=2 1212 B7R1.3 CC1=CN=CC=C1 P109210 [2,0,0,0,0,0|0,0,0]=2 1213 B7R1.3 CC1=CN=CN=C1 M132067 [2,0,0,0,0,0|1,0,0]=3 1214 B7R1.3 CC1=CN=NC=C1 M157845 [2,0,0,0,0,0|1,0,0]=3 1215 B7R1.3 CC1=NC=CN=C1 M158369 [2,0,0,0,0,0|1,0,0]=3 1216 B7R1.3 CC1=NC=NC=C1 M134934 [2,0,0,0,0,0|1,0,0]=3 1217 B7R1.3 CC1=NN=CC=C1 M131781 [2,0,0,0,0,0|1,0,0]=3 1218 B7R1.3 C[N+]1=CC=CC=C1 M302265 [2,0,0,0,0,0|2,0,0]=4 1219 B7R1.3 Cc1ccccn1 M141144 [2,0,0,0,0,0|0,0,0]=2 1220 B7R1.3 Oc1ccccc1 BWY272999 [2,0,0,0,0,0|2,0,0]=4 1221 B7R1.3 Oc1ccccc1 BWY273026 [2,0,0,0,0,0|2,0,0]=4 1222 B7R1.3 Oc1ccccc1 P100768 [2,0,0,0,0,0|2,0,0]=4 1223 B7R1.3 Oc1ccccc1 P117348 [2,0,0,0,0,0|2,0,0]=4 1224 B7R1.3 [CH2-]C1=CC=CC=C1 B465975 [2,0,0,0,0,0|1,0,1]=4 1225 B9R1.2 C1=C(C=NC=C1Br)C#N B121801 [1,1,0,0,0,0|1,0,1]=4 1226 B9R1.2 C1=C(C=NC=C1Br)C=O B111394 [1,1,0,0,0,0|1,0,1]=4 1227 B9R1.2 C1=C(C=NC=C1Br)CO B124232 [1,1,0,0,0,0|1,0,0]=3 1228 B9R1.2 C1=C(C=NC=C1Br)CO B494555 [1,1,0,0,0,0|1,0,0]=3 1229 B9R1.2 C1=C(C=NC=C1Cl)C#N C193669 [1,1,0,0,0,0|1,0,1]=4 1230 B9R1.2 C1=C(C=NC=C1Cl)C=O C165987 [1,1,0,0,0,0|1,0,1]=4 1231 B9R1.2 C1=C(C=NC=C1Cl)CCl C177606 [1,1,0,0,0,0|1,0,0]=3 1232 B9R1.2 C1=C(C=NC=C1Cl)CO C168770 [1,1,0,0,0,0|1,0,0]=3 1233 B9R1.2 C1=C(C=NC=C1F)C=O F176383 [1,1,0,0,0,0|1,0,1]=4 1234 B9R1.2 C1=C(C=NC=C1I)C=O I340108 [1,1,0,0,0,0|1,0,1]=4 1235 B9R1.2 C1=C(C=NC=C1N)C#N A181298 [1,1,0,0,0,0|1,0,1]=4 1236 B9R1.2 C1=C(N=C(C=N1)Cl)CO C586741 [1,1,0,0,0,0|2,0,0]=4 1237 B9R1.2 C1=CC(=CC(=C1)Br)CBr B135903 [1,1,0,0,0,0|2,0,0]=4 1238 B9R1.2 C1=CC(=CC(=C1)Br)CCl B139457 [1,1,0,0,0,0|2,0,0]=4 1239 B9R1.2 C1=CC(=CC(=C1)Br)CN B131936 [1,1,0,0,0,0|2,0,0]=4 1240 B9R1.2 C1=CC(=CC(=C1)Br)CN B136310 [1,1,0,0,0,0|2,0,0]=4 1241 B9R1.2 C1=CC(=CC(=C1)Br)CO B103188 [1,1,0,0,0,0|2,0,0]=4 1242 B9R1.2 C1=CC(=CC(=C1)Cl)CBr C106489 [1,1,0,0,0,0|2,0,0]=4 1243 B9R1.2 C1=CC(=CC(=C1)Cl)CCl C189170 [1,1,0,0,0,0|2,0,0]=4 1244 B9R1.2 C1=CC(=CC(=C1)Cl)CN C135515 [1,1,0,0,0,0|2,0,0]=4 1245 B9R1.2 C1=CC(=CC(=C1)Cl)CO C106488 [1,1,0,0,0,0|2,0,0]=4 1246 B9R1.2 C1=CC(=CC(=C1)F)CBr F107112 [1,1,0,0,0,0|2,0,0]=4 1247 B9R1.2 C1=CC(=CC(=C1)F)CCl F123352 [1,1,0,0,0,0|2,0,0]=4 1248 B9R1.2 C1=CC(=CC(=C1)F)CN F107964 [1,1,0,0,0,0|2,0,0]=4 1249 B9R1.2 C1=CC(=CC(=C1)F)CO F156601 [1,1,0,0,0,0|2,0,0]=4 1250 B9R1.2 C1=CC(=CC(=C1)I)CBr I133459 [1,1,0,0,0,0|2,0,0]=4 1251 B9R1.2 C1=CC(=CC(=C1)I)CN I113819 [1,1,0,0,0,0|2,0,0]=4 1252 B9R1.2 C1=CC(=CC(=C1)I)CN I468184 [1,1,0,0,0,0|2,0,0]=4 1253 B9R1.2 C1=CC(=CC(=C1)I)CO I157442 [1,1,0,0,0,0|2,0,0]=4 1254 B9R1.2 C1=CC(=CC(=C1)N)CN A151635 [1,1,0,0,0,0|2,0,0]=4 1255 B9R1.2 C1=CC(=CC(=C1)N)CO A151125 [1,1,0,0,0,0|2,0,0]=4 1256 B9R1.2 C1=CC(=CC(=C1)O)CN H407384 [1,1,0,0,0,0|2,0,0]=4 1257 B9R1.2 C1=CC(=CC(=C1)O)CO H137304 [1,1,0,0,0,0|2,0,0]=4 1258 B9R1.2 C1=CC(=CC(=C1)O)CO H501150 [1,1,0,0,0,0|2,0,0]=4 1259 B9R1.2 C1=CC(=C[N+](=C1)[O-])CO M418531 [1,1,0,0,0,0|1,0,1]=4 1260 B9R1.2 CC1=CC(=CC=C1)CBr B405679 [1,1,0,0,0,0|2,0,0]=4 1261 B9R1.2 CC1=CC(=CC=C1)CCl M101677 [1,1,0,0,0,0|2,0,0]=4 1262 B9R1.2 CC1=CC(=CC=C1)CN M158668 [1,1,0,0,0,0|2,0,0]=4 1263 B9R1.2 CC1=CC(=CC=C1)CO M157904 [1,1,0,0,0,0|2,0,0]=4 1264 B9R1.2 CC1=CC(=CC=C1)CS M588442 [1,1,0,0,0,0|2,0,0]=4 1265 B9R1.2 CC1=CC(=CC=C1)NC M107962 [1,1,0,0,0,0|2,0,0]=4 1266 B9R1.2 CC1=CC(=CC=C1)OC M158111 [1,1,0,0,0,0|2,0,0]=4 1267 B9R1.2 CC1=CC(=CC=C1)SC M351262 [1,1,0,0,0,0|2,0,0]=4 1268 B9R1.2 CC1=CC(=CN=C1)C#N M170328 [1,1,0,0,0,0|1,0,1]=4 1269 B9R1.2 CC1=CC(=CN=C1)CCl C178714 [1,1,0,0,0,0|1,0,0]=3 1270 B9R1.2 CCC1=CC(=CC=C1)Br B101889 [1,1,0,0,0,0|1,0,0]=3 1271 B9R1.2 CCC1=CC(=CC=C1)Cl C589677 [1,1,0,0,0,0|1,0,0]=3 1272 B9R1.2 CCC1=CC(=CC=C1)I E587883 [1,1,0,0,0,0|1,0,0]=3 1273 B9R1.2 CCC1=CC(=CC=C1)N E101873 [1,1,0,0,0,0|1,0,0]=3 1274 B9R1.2 CCC1=CC(=CC=C1)O E156226 [1,1,0,0,0,0|1,0,0]=3 1275 B9R1.2 CCC1=CC(=NC=C1)N A123353 [1,1,0,0,0,0|2,0,0]=4 1276 B9R1.2 CCC1=CC=CC(=C1)C E113367 [1,1,0,0,0,0|1,0,0]=3 1277 B9R1.2 CC[N+]1=CC=CC(=C1)C E121235 [1,1,0,0,0,0|2,0,0]=4 1278 B9R1.2 CC[N+]1=CC=CC(=C1)O E472644 [1,1,0,0,0,0|2,0,0]=4 1279 B9R1.2 CNC1=CC(=CC=C1)Br B194483 [1,1,0,0,0,0|2,0,0]=4 1280 B9R1.2 CNC1=CC(=CC=C1)Cl C153906 [1,1,0,0,0,0|2,0,0]=4 1281 B9R1.2 CNC1=CC(=CC=C1)F F168315 [1,1,0,0,0,0|2,0,0]=4 1282 B9R1.2 CNC1=CC(=CC=C1)O M587311 [1,1,0,0,0,0|2,0,0]=4 1283 B9R1.2 COC1=CC(=CC=C1)Br B100846 [1,1,0,0,0,0|2,0,0]=4 1284 B9R1.2 COC1=CC(=CC=C1)Cl C106486 [1,1,0,0,0,0|2,0,0]=4 1285 B9R1.2 COC1=CC(=CC=C1)F F120587 [1,1,0,0,0,0|2,0,0]=4 1286 B9R1.2 COC1=CC(=CC=C1)I I123674 [1,1,0,0,0,0|2,0,0]=4 1287 B9R1.2 COC1=CC(=CC=C1)S M101779 [1,1,0,0,0,0|2,0,0]=4 1288 B9R1.2 COC1=CC(=CN=C1)Br B115755 [1,1,0,0,0,0|1,0,0]=3 1289 B9R1.2 COC1=CC(=CN=C1)Cl C479903 [1,1,0,0,0,0|1,0,0]=3 1290 B9R1.2 COC1=CC(=NN=C1)Cl C172842 [1,1,0,0,0,0|2,0,0]=4 1291 B9R1.2 COC1=CC=CC(=C1)N A107482 [1,1,0,0,0,0|2,0,0]=4 1292 B9R1.2 COC1=CC=CC(=C1)O M109432 [1,1,0,0,0,0|2,0,0]=4 1293 B9R1.2 COC1=CC=CC(=C1)[CH2-] M300737 [1,1,0,0,0,0|2,0,0]=4 1294 B9R1.2 COC1=CN=CC(=C1)O W132603 [1,1,0,0,0,0|1,0,0]=3 1295 B9R1.2 CSC1=CC(=CC=C1)Br B101842 [1,1,0,0,0,0|2,0,0]=4 1296 B9R1.2 CSC1=CC(=CC=C1)Cl C101839 [1,1,0,0,0,0|2,0,0]=4 1297 B9R1.2 CSC1=CC=CC(=C1)F F156685 [1,1,0,0,0,0|2,0,0]=4 1298 B9R1.2 CSC1=CC=CC(=C1)N M101834 [1,1,0,0,0,0|2,0,0]=4 1299 B9R1.6 B(C1=CN=CC=C1)(O)O P106882 [1,1,0,0,0,0|2,0,0]=4 1300 B9R1.6 B(C1=CN=CC=C1)(O)O P396303 [1,1,0,0,0,0|2,0,0]=4 1301 B9R1.6 C1=CC(=CN=C1)C(=N)N P160050 [1,1,0,0,0,0|1,0,1]=4 1302 B9R1.6 C1=CC(=CN=C1)C(=O)Cl N107157 [1,1,0,0,0,0|1,0,1]=4 1303 B9R1.6 C1=CC(=CN=C1)C(=O)N BWY396895 [1,1,0,0,0,0|1,0,1]=4 1304 B9R1.6 C1=CC(=CN=C1)C(=O)N BWY396901 [1,1,0,0,0,0|1,0,1]=4 1305 B9R1.6 C1=CC(=CN=C1)C(=O)N N105042 [1,1,0,0,0,0|1,0,1]=4 1306 B9R1.6 C1=CC(=CN=C1)C(=O)N N105043 [1,1,0,0,0,0|1,0,1]=4 1307 B9R1.6 C1=CC(=CN=C1)C(=O)N N108086 [1,1,0,0,0,0|1,0,1]=4 1308 B9R1.6 C1=CC(=CN=C1)C(=O)N N108087 [1,1,0,0,0,0|1,0,1]=4 1309 B9R1.6 C1=CC(=CN=C1)C(=O)N N434628 [1,1,0,0,0,0|1,0,1]=4 1310 B9R1.6 C1=CC(=CN=C1)C(=O)O N103652 [1,1,0,0,0,0|1,0,1]=4 1311 B9R1.6 C1=CC(=CN=C1)C(=O)O N103654 [1,1,0,0,0,0|1,0,1]=4 1312 B9R1.6 C1=CC(=CN=C1)C(=O)O N118655 [1,1,0,0,0,0|1,0,1]=4 1313 B9R1.6 C1=CC(=CN=C1)C(=O)O N118656 [1,1,0,0,0,0|1,0,1]=4 1314 B9R1.6 C1=CC(=CN=C1)C(=O)O N433033 [1,1,0,0,0,0|1,0,1]=4 1315 B9R1.6 C1=CC(=CN=C1)C(=O)[O-] S161385 [1,1,0,0,0,0|1,0,1]=4 1316 B9R1.6 C1=CC(=CN=C1)C(=S)N T161553 [1,1,0,0,0,0|1,0,1]=4 1317 B9R1.6 C1=CC(=CN=C1)S(=O)[O-] S586711 [1,1,0,0,0,0|2,0,0]=4 1318 B9R1.6 C1=CC=C(C=C1)C(Br)Br D300412 [1,1,0,0,0,0|2,0,0]=4 1319 B9R1.6 C1=CC=C(C=C1)C(F)F D404169 [1,1,0,0,0,0|2,0,0]=4 1320 B9R1.6 CC(=C)C1=CC=CC=C1 M104900 [1,1,0,0,0,0|1,0,1]=4 1321 B9R1.6 CC(=C)C1=CC=CC=C1 M104901 [1,1,0,0,0,0|1,0,1]=4 1322 B9R1.6 CC(=C)C1=CC=CC=C1 P347730 [1,1,0,0,0,0|1,0,1]=4 1323 B9R1.6 CC(=C)C1=CC=CC=C1 P491419 [1,1,0,0,0,0|1,0,1]=4 1324 B9R1.6 CC(=O)C1=CC=CC=C1 A103666 [1,1,0,0,0,0|1,0,1]=4 1325 B9R1.6 CC(=O)C1=CC=CC=C1 A103667 [1,1,0,0,0,0|1,0,1]=4 1326 B9R1.6 CC(=O)C1=CC=CC=C1 A103669 [1,1,0,0,0,0|1,0,1]=4 1327 B9R1.6 CC(=O)C1=CC=CC=C1 A427211 [1,1,0,0,0,0|1,0,1]=4 1328 B9R1.6 CC(=O)C1=CC=CC=C1 A471960 [1,1,0,0,0,0|1,0,1]=4 1329 B9R1.6 CC(=O)C1=CC=CC=C1 A474131 [1,1,0,0,0,0|1,0,1]=4 1330 B9R1.6 CC(=O)C1=CC=CC=C1 A474138 [1,1,0,0,0,0|1,0,1]=4 1331 B9R1.6 CC(=O)C1=CN=CC=C1 A106235 [1,1,0,0,0,0|0,0,1]=3 1332 B9R1.6 CC(=O)C1=CN=CC=C1 A106236 [1,1,0,0,0,0|0,0,1]=3 1333 B9R1.6 CC(=O)C1=CN=CN=C1 P171742 [1,1,0,0,0,0|1,0,1]=4 1334 B9R1.6 CC(=O)C1=CN=NC=C1 P176647 [1,1,0,0,0,0|1,0,1]=4 1335 B9R1.6 CC(=O)C1=NC=CN=C1 A100996 [1,1,0,0,0,0|1,0,1]=4 1336 B9R1.6 CC(C)C1=CC=CC=C1 I101049 [1,1,0,0,0,0|1,0,0]=3 1337 B9R1.6 CC(C)C1=CC=CC=C1 I101050 [1,1,0,0,0,0|1,0,0]=3 1338 B9R1.6 CC(C)C1=CC=CC=C1 I101052 [1,1,0,0,0,0|1,0,0]=3 1339 B9R1.6 CC(C)C1=CC=CC=N1 I177046 [1,1,0,0,0,0|2,0,0]=4 1340 B9R1.6 CC(C)C1=CC=NC=C1 I136834 [1,1,0,0,0,0|2,0,0]=4 1341 B9R1.6 CC(C1=CC=CC=C1)Br B104540 [1,1,0,0,0,0|1,0,0]=3 1342 B9R1.6 CC(C1=CC=CC=C1)Cl C107586 [1,1,0,0,0,0|1,0,0]=3 1343 B9R1.6 CC(C1=CC=CC=C1)N M105678 [1,1,0,0,0,0|1,0,0]=3 1344 B9R1.6 CC(C1=CC=CC=C1)N M105679 [1,1,0,0,0,0|1,0,0]=3 1345 B9R1.6 CC(C1=CC=CC=C1)N M106714 [1,1,0,0,0,0|1,0,0]=3 1346 B9R1.6 CC(C1=CC=CC=C1)N M141280 [1,1,0,0,0,0|1,0,0]=3 1347 B9R1.6 CC(C1=CC=CC=C1)N R432669 [1,1,0,0,0,0|1,0,0]=3 1348 B9R1.6 CC(C1=CC=CC=C1)N R432670 [1,1,0,0,0,0|1,0,0]=3 1349 B9R1.6 CC(C1=CC=CC=C1)N R432682 [1,1,0,0,0,0|1,0,0]=3 1350 B9R1.6 CC(C1=CC=CC=C1)N S135224 [1,1,0,0,0,0|1,0,0]=3 1351 B9R1.6 CC(C1=CC=CC=C1)N S432505 [1,1,0,0,0,0|1,0,0]=3 1352 B9R1.6 CC(C1=CC=CC=C1)O P100878 [1,1,0,0,0,0|1,0,0]=3 1353 B9R1.6 CC(C1=CC=CC=C1)O P103660 [1,1,0,0,0,0|1,0,0]=3 1354 B9R1.6 CC(C1=CC=CC=C1)O P113820 [1,1,0,0,0,0|1,0,0]=3 1355 B9R1.6 CC(C1=CC=CC=C1)O P165285 [1,1,0,0,0,0|1,0,0]=3 1356 B9R1.6 CC(C1=CC=CC=N1)N P589080 [1,1,0,0,0,0|2,0,0]=4 1357 B9R1.6 CC(C1=CC=CC=N1)O P191765 [1,1,0,0,0,0|2,0,0]=4 1358 B9R1.6 CC(C1=CC=CC=N1)O R404547 [1,1,0,0,0,0|2,0,0]=4 1359 B9R1.6 CC(C1=CC=CC=N1)O S161029 [1,1,0,0,0,0|2,0,0]=4 1360 B9R1.6 CC(C1=CC=NC=C1)N A467309 [1,1,0,0,0,0|2,0,0]=4 1361 B9R1.6 CC(C1=CC=NC=C1)O I170921 [1,1,0,0,0,0|2,0,0]=4 1362 B9R1.6 CC(C1=CC=NC=C1)O R192493 [1,1,0,0,0,0|2,0,0]=4 1363 B9R1.6 CC(C1=CN=CC=C1)N P193948 [1,1,0,0,0,0|0,0,0]=2 1364 B9R1.6 CN(C)C1=CC=CC=C1 D100060 [1,1,0,0,0,0|2,0,0]=4 1365 B9R1.6 CN(C)C1=CC=CC=C1 D100061 [1,1,0,0,0,0|2,0,0]=4 1366 B9R1.6 CN(C)C1=CC=CC=C1 D100063 [1,1,0,0,0,0|2,0,0]=4 1367 B9R1.6 CN(C1=CC=CC=C1)N M298692 [1,1,0,0,0,0|2,0,0]=4 1368 B9R1.6 CP(C)C1=CC=CC=C1 C118698 [1,1,0,0,0,0|2,0,0]=4 1369 B9R1.6 CP(C)C1=CC=CC=C1 D115603 [1,1,0,0,0,0|2,0,0]=4 1370 B9R1.6 CS(=O)C1=CC=CC=C1 M158079 [1,1,0,0,0,0|2,0,0]=4 1371 B9R1.6 CS(=O)C1=CC=CC=C1 M464276 [1,1,0,0,0,0|2,0,0]=4 1372 B9R1.6 C[Si](=O)C1=CC=CC=C1 P331251 [1,1,0,0,0,0|1,1,0]=4 1373 B9R1.6 C[Si](C)C1=CC=CC=C1 D111809 [1,1,0,0,0,0|1,1,0]=4 1374 B9R1.6 NC(=O)C1=CC=CN=C1 N407906 [1,1,0,0,0,0|1,0,1]=4 1375 B9R1.6 OC(=O)C1=CC=CN=C1 N407808 [1,1,0,0,0,0|1,0,1]=4 1376 B9R1.8 C1=CC(=CN=C1)C=NO P166345 [1,1,0,0,0,0|1,0,1]=4 1377 B9R1.8 C1=CC(=CN=C1)CC#N P137656 [1,1,0,0,0,0|0,0,1]=3 1378 B9R1.8 C1=CC(=CN=C1)CCN A151786 [1,1,0,0,0,0|0,0,0]=2 1379 B9R1.8 C1=CC(=CN=C1)CCN A169450 [1,1,0,0,0,0|0,0,0]=2 1380 B9R1.8 C1=CC(=CN=C1)N=C=S P140429 [1,1,0,0,0,0|1,0,1]=4 1381 B9R1.8 C1=CC=C(C=C1)CC=O P105078 [1,1,0,0,0,0|1,0,1]=4 1382 B9R1.8 C1=CC=C(C=C1)CC=O P105080 [1,1,0,0,0,0|1,0,1]=4 1383 B9R1.8 C1=CC=C(C=C1)CC=O P420978 [1,1,0,0,0,0|1,0,1]=4 1384 B9R1.8 C1=CC=C(C=C1)CCBr B106895 [1,1,0,0,0,0|1,0,0]=3 1385 B9R1.8 C1=CC=C(C=C1)CCCl C136679 [1,1,0,0,0,0|1,0,0]=3 1386 B9R1.8 C1=CC=C(C=C1)CCI I138375 [1,1,0,0,0,0|1,0,0]=3 1387 B9R1.8 C1=CC=C(C=C1)CCN P105641 [1,1,0,0,0,0|1,0,0]=3 1388 B9R1.8 C1=CC=C(C=C1)CCN P160641 [1,1,0,0,0,0|1,0,0]=3 1389 B9R1.8 C1=CC=C(C=C1)CCN P290339 [1,1,0,0,0,0|1,0,0]=3 1390 B9R1.8 C1=CC=C(C=C1)CCN P408003 [1,1,0,0,0,0|1,0,0]=3 1391 B9R1.8 C1=CC=C(C=C1)CCN P421867 [1,1,0,0,0,0|1,0,0]=3 1392 B9R1.8 C1=CC=C(C=C1)CCN P425250 [1,1,0,0,0,0|1,0,0]=3 1393 B9R1.8 C1=CC=C(C=C1)CCN P491880 [1,1,0,0,0,0|1,0,0]=3 1394 B9R1.8 C1=CC=C(C=C1)CCN P493037 [1,1,0,0,0,0|1,0,0]=3 1395 B9R1.8 C1=CC=C(C=C1)CCN P493125 [1,1,0,0,0,0|1,0,0]=3 1396 B9R1.8 C1=CC=C(C=C1)CCO P108195 [1,1,0,0,0,0|1,0,0]=3 1397 B9R1.8 C1=CC=C(C=C1)CCO P108197 [1,1,0,0,0,0|1,0,0]=3 1398 B9R1.8 C1=CC=C(C=C1)CCO P424995 [1,1,0,0,0,0|1,0,0]=3 1399 B9R1.8 C1=CC=C(C=C1)CCS P160530 [1,1,0,0,0,0|1,0,0]=3 1400 B9R1.8 C1=CC=C(C=C1)CNN B122576 [1,1,0,0,0,0|2,0,0]=4 1401 B9R1.8 C1=CC=C(C=C1)CNN B137990 [1,1,0,0,0,0|2,0,0]=4 1402 B9R1.8 C1=CC=C(C=C1)CNN B464175 [1,1,0,0,0,0|2,0,0]=4 1403 B9R1.8 C1=CC=C(C=C1)CNO I137166 [1,1,0,0,0,0|2,0,0]=4 1404 B9R1.8 C1=CC=C(C=C1)CON O159948 [1,1,0,0,0,0|2,0,0]=4 1405 B9R1.8 C1=CC=C(C=C1)CON O189173 [1,1,0,0,0,0|2,0,0]=4 1406 B9R1.8 C1=CC=C(C=C1)SCCl C101827 [1,1,0,0,0,0|2,0,0]=4 1407 B9R1.8 C1=CC=NC(=C1)CCBr B186289 [1,1,0,0,0,0|2,0,0]=4 1408 B9R1.8 C1=CC=NC(=C1)CCN A151790 [1,1,0,0,0,0|2,0,0]=4 1409 B9R1.8 C1=CC=NC(=C1)CCO P160791 [1,1,0,0,0,0|2,0,0]=4 1410 B9R1.8 C1=CN=C(C=N1)CCS M103122 [1,1,0,0,0,0|1,0,0]=3 1411 B9R1.8 C1=CN=CC=C1CCN A109738 [1,1,0,0,0,0|2,0,0]=4 1412 B9R1.8 C1=CN=CC=C1CCS P134707 [1,1,0,0,0,0|2,0,0]=4 1413 B9R1.8 C1=CN=CC=C1CCS P478833 [1,1,0,0,0,0|2,0,0]=4 1414 B9R1.8 C=CCC1=CC=CC=C1 A101037 [1,1,0,0,0,0|1,0,1]=4 1415 B9R1.8 CC#CC1=CC=CC=C1 P141240 [1,1,0,0,0,0|1,0,1]=4 1416 B9R1.8 CC=CC1=CC=CC=C1 C153576 [1,1,0,0,0,0|1,0,1]=4 1417 B9R1.8 CC=CC1=CC=CC=C1 M136687 [1,1,0,0,0,0|1,0,1]=4 1418 B9R1.8 CC=CC1=CC=CC=C1 T134052 [1,1,0,0,0,0|1,0,1]=4 1419 B9R1.8 CC=CC1=CC=CC=C1 T301941 [1,1,0,0,0,0|1,0,1]=4 1420 B9R1.8 CCCC1=CC=CC=C1 P104621 [1,1,0,0,0,0|1,0,0]=3 1421 B9R1.8 CCCC1=CC=CC=C1 P104624 [1,1,0,0,0,0|1,0,0]=3 1422 B9R1.8 CCCC1=CC=CC=C1 P104625 [1,1,0,0,0,0|1,0,0]=3 1423 B9R1.8 CCCC1=CC=CC=C1 P104626 [1,1,0,0,0,0|1,0,0]=3 1424 B9R1.8 CCCC1=CC=CC=C1 P128158 [1,1,0,0,0,0|1,0,0]=3 1425 B9R1.8 CCCC1=CC=CC=N1 P160637 [1,1,0,0,0,0|2,0,0]=4 1426 B9R1.8 CCCC1=CC=NC=C1 P160632 [1,1,0,0,0,0|2,0,0]=4 1427 B9R1.8 CCCC1=NC=CN=C1 P132679 [1,1,0,0,0,0|1,0,0]=3 1428 B9R1.8 CCC[N+]1=CC=CC=C1 P404861 [1,1,0,0,0,0|2,0,0]=4 1429 B9R1.8 CCNC1=CC=CC=C1 E103974 [1,1,0,0,0,0|1,0,0]=3 1430 B9R1.8 CCOC1=CC=CC=C1 E108654 [1,1,0,0,0,0|1,0,0]=3 1431 B9R1.8 CCOC1=CC=CC=C1 E108655 [1,1,0,0,0,0|1,0,0]=3 1432 B9R1.8 CCOC1=CC=CC=N1 E137467 [1,1,0,0,0,0|2,0,0]=4 1433 B9R1.8 CCOC1=NC=CN=C1 E136587 [1,1,0,0,0,0|1,0,0]=3 1434 B9R1.8 CCSC1=CC=CC=C1 E101809 [1,1,0,0,0,0|1,0,0]=3 1435 B9R1.8 CNCC1=CC=CC=C1 B106919 [1,1,0,0,0,0|1,0,0]=3 1436 B9R1.8 CNCC1=CC=CC=N1 M168526 [1,1,0,0,0,0|2,0,0]=4 1437 B9R1.8 CNCC1=CN=CC=C1 M138441 [1,1,0,0,0,0|0,0,0]=2 1438 B9R1.8 COCC1=CC=CC=C1 B103161 [1,1,0,0,0,0|1,0,0]=3 1439 B9R1.8 COCC1=CC=CC=C1 B591251 [1,1,0,0,0,0|1,0,0]=3 1440 B9R1.8 CSCC1=CC=CC=C1 B152510 [1,1,0,0,0,0|1,0,0]=3 1441 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B153177 [1,1,0,0,0,0|1,0,1]=4 1442 B9R1.15 C#CC1=C(N=CC=C1)N E194525 [1,1,0,0,0,0|0,0,2]=4 1443 B9R1.15 C1=CC(=C(N=C1)Br)C#N B182652 [1,1,0,0,0,0|1,0,1]=4 1444 B9R1.15 C1=CC(=C(N=C1)Br)C=O B107726 [1,1,0,0,0,0|1,0,1]=4 1445 B9R1.15 C1=CC(=C(N=C1)Br)CBr B123443 [1,1,0,0,0,0|1,0,0]=3 1446 B9R1.15 C1=CC(=C(N=C1)Br)CO B151848 [1,1,0,0,0,0|1,0,0]=3 1447 B9R1.15 C1=CC(=C(N=C1)Cl)C#N C119938 [1,1,0,0,0,0|1,0,1]=4 1448 B9R1.15 C1=CC(=C(N=C1)Cl)C=O C107725 [1,1,0,0,0,0|1,0,1]=4 1449 B9R1.15 C1=CC(=C(N=C1)Cl)C=O C639107 [1,1,0,0,0,0|1,0,1]=4 1450 B9R1.15 C1=CC(=C(N=C1)Cl)CO C154080 [1,1,0,0,0,0|1,0,0]=3 1451 B9R1.15 C1=CC(=C(N=C1)F)C#N C136305 [1,1,0,0,0,0|1,0,1]=4 1452 B9R1.15 C1=CC(=C(N=C1)F)C=O F169927 [1,1,0,0,0,0|1,0,1]=4 1453 B9R1.15 C1=CC(=C(N=C1)N)C#N A123148 [1,1,0,0,0,0|1,0,1]=4 1454 B9R1.15 C1=CC(=C(N=C1)N)C=O A115308 [1,1,0,0,0,0|1,0,1]=4 1455 B9R1.15 C1=CC(=C(N=C1)N)CO A119400 [1,1,0,0,0,0|1,0,0]=3 1456 B9R1.15 C1=CC=C(C(=C1)CBr)Br B124758 [1,1,0,0,0,0|2,0,0]=4 1457 B9R1.15 C1=CC=C(C(=C1)CBr)Cl C135217 [1,1,0,0,0,0|2,0,0]=4 1458 B9R1.15 C1=CC=C(C(=C1)CBr)F F107111 [1,1,0,0,0,0|2,0,0]=4 1459 B9R1.15 C1=CC=C(C(=C1)CBr)I I101707 [1,1,0,0,0,0|2,0,0]=4 1460 B9R1.15 C1=CC=C(C(=C1)CBr)I I131028 [1,1,0,0,0,0|2,0,0]=4 1461 B9R1.15 C1=CC=C(C(=C1)CCl)Cl C136424 [1,1,0,0,0,0|2,0,0]=4 1462 B9R1.15 C1=CC=C(C(=C1)CCl)F F104448 [1,1,0,0,0,0|2,0,0]=4 1463 B9R1.15 C1=CC=C(C(=C1)CCl)I I472524 [1,1,0,0,0,0|2,0,0]=4 1464 B9R1.15 C1=CC=C(C(=C1)CN)Br B136382 [1,1,0,0,0,0|2,0,0]=4 1465 B9R1.15 C1=CC=C(C(=C1)CN)Br B184269 [1,1,0,0,0,0|2,0,0]=4 1466 B9R1.15 C1=CC=C(C(=C1)CN)Cl C100661 [1,1,0,0,0,0|2,0,0]=4 1467 B9R1.15 C1=CC=C(C(=C1)CN)Cl C298505 [1,1,0,0,0,0|2,0,0]=4 1468 B9R1.15 C1=CC=C(C(=C1)CN)F F122768 [1,1,0,0,0,0|2,0,0]=4 1469 B9R1.15 C1=CC=C(C(=C1)CN)O A195905 [1,1,0,0,0,0|2,0,0]=4 1470 B9R1.15 C1=CC=C(C(=C1)CO)Br B135325 [1,1,0,0,0,0|2,0,0]=4 1471 B9R1.15 C1=CC=C(C(=C1)CO)Cl C101747 [1,1,0,0,0,0|2,0,0]=4 1472 B9R1.15 C1=CC=C(C(=C1)CO)F F156600 [1,1,0,0,0,0|2,0,0]=4 1473 B9R1.15 C1=CC=C(C(=C1)CO)I I157441 [1,1,0,0,0,0|2,0,0]=4 1474 B9R1.15 C1=CC=C(C(=C1)CO)N A151122 [1,1,0,0,0,0|2,0,0]=4 1475 B9R1.15 C1=CC=C(C(=C1)CO)O H106789 [1,1,0,0,0,0|2,0,0]=4 1476 B9R1.15 C1=CC=C(C(=C1)CO)O H426756 [1,1,0,0,0,0|2,0,0]=4 1477 B9R1.15 C1=CC=C(C(=C1)CS)Br B101794 [1,1,0,0,0,0|2,0,0]=4 1478 B9R1.15 C1=CC=C(C(=C1)CS)Cl C101788 [1,1,0,0,0,0|2,0,0]=4 1479 B9R1.15 C1=CN=CC(=C1Cl)C=O C172130 [1,1,0,0,0,0|1,0,1]=4 1480 B9R1.15 C1=CN=CC(=C1Cl)CO C587861 [1,1,0,0,0,0|1,0,0]=3 1481 B9R1.15 C1=CN=CC(=C1N)C=O A479063 [1,1,0,0,0,0|1,0,1]=4 1482 B9R1.15 C1=CN=CC(=C1N)CO A167140 [1,1,0,0,0,0|1,0,0]=3 1483 B9R1.15 C1=CNC(=O)C(=C1)CO H176459 [1,1,0,0,0,0|1,0,1]=4 1484 B9R1.15 CC1=C(C=CC=N1)C#N M174953 [1,1,0,0,0,0|1,0,1]=4 1485 B9R1.15 CC1=C(C=CC=N1)C=O M176904 [1,1,0,0,0,0|1,0,1]=4 1486 B9R1.15 CC1=C(C=CC=N1)CO W136400 [1,1,0,0,0,0|1,0,0]=3 1487 B9R1.15 CC1=C(C=NC=C1)C#N C135007 [1,1,0,0,0,0|1,0,1]=4 1488 B9R1.15 CC1=CC=CC=C1CBr M139409 [1,1,0,0,0,0|2,0,0]=4 1489 B9R1.15 CC1=CC=CC=C1CCl M101671 [1,1,0,0,0,0|2,0,0]=4 1490 B9R1.15 CC1=CC=CC=C1CN M158667 [1,1,0,0,0,0|2,0,0]=4 1491 B9R1.15 CC1=CC=CC=C1CO M157901 [1,1,0,0,0,0|2,0,0]=4 1492 B9R1.15 CC1=CC=CC=C1CS M300495 [1,1,0,0,0,0|2,0,0]=4 1493 B9R1.15 CC1=CC=CC=C1NC N159021 [1,1,0,0,0,0|2,0,0]=4 1494 B9R1.15 CC1=CC=CC=C1OC M158113 [1,1,0,0,0,0|2,0,0]=4 1495 B9R1.15 CC1=NC=CN=C1CO M174600 [1,1,0,0,0,0|2,0,0]=4 1496 B9R1.15 CC1=NC=CN=C1OC M102551 [1,1,0,0,0,0|2,0,0]=4 1497 B9R1.15 CC1=NC=CN=C1SC M102553 [1,1,0,0,0,0|2,0,0]=4 1498 B9R1.15 CCC1=CC=CC=C1Br B138432 [1,1,0,0,0,0|1,0,0]=3 1499 B9R1.15 CCC1=CC=CC=C1C E140581 [1,1,0,0,0,0|1,0,0]=3 1500 B9R1.15 CCC1=CC=CC=C1I E189052 [1,1,0,0,0,0|1,0,0]=3 1501 B9R1.15 CCC1=CC=CC=C1N E106226 [1,1,0,0,0,0|1,0,0]=3 1502 B9R1.15 CCC1=CC=CC=C1O E156225 [1,1,0,0,0,0|1,0,0]=3 1503 B9R1.15 CCC1=CC=CC=C1S E101792 [1,1,0,0,0,0|1,0,0]=3 1504 B9R1.15 CCC1=NC=CN=C1C E105685 [1,1,0,0,0,0|1,0,0]=3 1505 B9R1.15 CC[N+]1=CC=CC=C1C E303437 [1,1,0,0,0,0|2,0,0]=4 1506 B9R1.15 CNC1=CC=CC=C1Br B186004 [1,1,0,0,0,0|2,0,0]=4 1507 B9R1.15 CNC1=CC=CC=C1Cl C153908 [1,1,0,0,0,0|2,0,0]=4 1508 B9R1.15 CNC1=CC=CC=C1F F132815 [1,1,0,0,0,0|2,0,0]=4 1509 B9R1.15 CNC1=CC=CC=C1N I134172 [1,1,0,0,0,0|2,0,0]=4 1510 B9R1.15 CNC1=CC=CC=C1N M106013 [1,1,0,0,0,0|2,0,0]=4 1511 B9R1.15 CNC1=CC=CC=C1O M194184 [1,1,0,0,0,0|2,0,0]=4 1512 B9R1.15 COC1=C(N=CC=C1)Br B120786 [1,1,0,0,0,0|1,0,0]=3 1513 B9R1.15 COC1=C(N=CC=C1)Cl C135954 [1,1,0,0,0,0|1,0,0]=3 1514 B9R1.15 COC1=C(N=CC=C1)F F191342 [1,1,0,0,0,0|1,0,0]=3 1515 B9R1.15 COC1=C(N=CC=C1)N A165482 [1,1,0,0,0,0|1,0,0]=3 1516 B9R1.15 COC1=CC=CC=C1Br B109257 [1,1,0,0,0,0|2,0,0]=4 1517 B9R1.15 COC1=CC=CC=C1Cl C110652 [1,1,0,0,0,0|2,0,0]=4 1518 B9R1.15 COC1=CC=CC=C1F F120586 [1,1,0,0,0,0|2,0,0]=4 1519 B9R1.15 COC1=CC=CC=C1I I101929 [1,1,0,0,0,0|2,0,0]=4 1520 B9R1.15 COC1=CC=CC=C1N A103995 [1,1,0,0,0,0|2,0,0]=4 1521 B9R1.15 COC1=CC=CC=C1N A103997 [1,1,0,0,0,0|2,0,0]=4 1522 B9R1.15 COC1=CC=CC=C1N A141230 [1,1,0,0,0,0|2,0,0]=4 1523 B9R1.15 COC1=CC=CC=C1N O160024 [1,1,0,0,0,0|2,0,0]=4 1524 B9R1.15 COC1=CC=CC=C1O G112735 [1,1,0,0,0,0|2,0,0]=4 1525 B9R1.15 COC1=CC=CC=C1O G426764 [1,1,0,0,0,0|2,0,0]=4 1526 B9R1.15 COC1=CC=CC=C1S M101778 [1,1,0,0,0,0|2,0,0]=4 1527 B9R1.15 COC1=CC=CNC1=O M168513 [1,1,0,0,0,0|1,0,1]=4 1528 B9R1.15 COC1=NC=CN=C1Cl C193237 [1,1,0,0,0,0|2,0,0]=4 1529 B9R1.15 COC1=NC=CN=C1N M589216 [1,1,0,0,0,0|2,0,0]=4 1530 B9R1.15 CSC1=CC=CC=C1Br B101843 [1,1,0,0,0,0|2,0,0]=4 1531 B9R1.15 CSC1=CC=CC=C1Cl C101838 [1,1,0,0,0,0|2,0,0]=4 1532 B9R1.15 CSC1=CC=CC=C1F F101836 [1,1,0,0,0,0|2,0,0]=4 1533 B9R1.15 CSC1=CC=CC=C1N M158418 [1,1,0,0,0,0|2,0,0]=4 1534 B9R1.15 CSC1=CC=CC=C1O M101847 [1,1,0,0,0,0|2,0,0]=4 1535 B9R1.69 C1=C(C(=CN=C1Br)Cl)Cl B586208 [1,1,0,0,0,0|2,0,0]=4 1536 B9R1.69 C1=C(C(=CN=C1Br)F)I B586284 [1,1,0,0,0,0|2,0,0]=4 1537 B9R1.69 C1=C(C(=CN=C1Cl)Br)Cl B195297 [1,1,0,0,0,0|2,0,0]=4 1538 B9R1.69 C1=C(C(=CN=C1Cl)Br)I B184327 [1,1,0,0,0,0|2,0,0]=4 1539 B9R1.69 C1=C(C(=CN=C1Cl)Br)N B134047 [1,1,0,0,0,0|2,0,0]=4 1540 B9R1.69 C1=C(C(=CN=C1Cl)Cl)Cl T176794 [1,1,0,0,0,0|2,0,0]=4 1541 B9R1.69 C1=C(C(=CN=C1Cl)Cl)I D590206 [1,1,0,0,0,0|2,0,0]=4 1542 B9R1.69 C1=C(C(=CN=C1Cl)F)I C195528 [1,1,0,0,0,0|2,0,0]=4 1543 B9R1.69 C1=C(C(=CN=C1Cl)N)I C406435 [1,1,0,0,0,0|2,0,0]=4 1544 B9R1.69 C1=C(C(=CN=C1Cl)O)I C590475 [1,1,0,0,0,0|2,0,0]=4 1545 B9R1.69 C1=C(C(=CN=C1F)Br)Cl B586518 [1,1,0,0,0,0|2,0,0]=4 1546 B9R1.69 C1=C(C(=CN=C1F)Cl)F C587748 [1,1,0,0,0,0|2,0,0]=4 1547 B9R1.69 C1=C(C(=CN=C1F)Cl)I C589811 [1,1,0,0,0,0|2,0,0]=4 1548 B9R1.69 C1=C(C(=CN=C1F)F)Cl C590342 [1,1,0,0,0,0|2,0,0]=4 1549 B9R1.69 C1=C(C(=CN=C1F)F)I D178774 [1,1,0,0,0,0|2,0,0]=4 1550 B9R1.69 C1=C(C(=CN=C1N)Br)Cl B178386 [1,1,0,0,0,0|2,0,0]=4 1551 B9R1.69 C1=C(C(=CN=C1N)Cl)Br B179962 [1,1,0,0,0,0|2,0,0]=4 1552 B9R1.69 C1=C(C(=CN=C1N)Cl)Cl D175321 [1,1,0,0,0,0|2,0,0]=4 1553 B9R1.69 C1=C(C(=CN=C1N)I)Br B573563 [1,1,0,0,0,0|2,0,0]=4 1554 B9R1.69 C1=C(C(=CN=C1N)I)Cl C480400 [1,1,0,0,0,0|2,0,0]=4 1555 B9R1.69 C1=C(C(=CN=C1N)I)F F578857 [1,1,0,0,0,0|2,0,0]=4 1556 B9R1.69 C1=C(C=NC(=C1Br)Br)Br T161585 [1,1,0,0,0,0|2,0,0]=4 1557 B9R1.69 C1=C(C=NC(=C1Br)Br)Cl D131734 [1,1,0,0,0,0|2,0,0]=4 1558 B9R1.69 C1=C(C=NC(=C1Br)Br)F D187562 [1,1,0,0,0,0|2,0,0]=4 1559 B9R1.69 C1=C(C=NC(=C1Br)Cl)Br D138802 [1,1,0,0,0,0|2,0,0]=4 1560 B9R1.69 C1=C(C=NC(=C1Br)Cl)Cl B151965 [1,1,0,0,0,0|2,0,0]=4 1561 B9R1.69 C1=C(C=NC(=C1Br)Cl)F B187640 [1,1,0,0,0,0|2,0,0]=4 1562 B9R1.69 C1=C(C=NC(=C1Br)Cl)N A120067 [1,1,0,0,0,0|2,0,0]=4 1563 B9R1.69 C1=C(C=NC(=C1Br)F)F B180141 [1,1,0,0,0,0|2,0,0]=4 1564 B9R1.69 C1=C(C=NC(=C1Br)N)Br A151580 [1,1,0,0,0,0|2,0,0]=4 1565 B9R1.69 C1=C(C=NC(=C1Br)N)Cl A102589 [1,1,0,0,0,0|2,0,0]=4 1566 B9R1.69 C1=C(C=NC(=C1Br)N)F A102590 [1,1,0,0,0,0|2,0,0]=4 1567 B9R1.69 C1=C(C=NC(=C1Br)N)I P177213 [1,1,0,0,0,0|2,0,0]=4 1568 B9R1.69 C1=C(C=NC(=C1Br)N)N B469818 [1,1,0,0,0,0|2,0,0]=4 1569 B9R1.69 C1=C(C=NC(=C1Cl)Br)Br D174596 [1,1,0,0,0,0|2,0,0]=4 1570 B9R1.69 C1=C(C=NC(=C1Cl)Br)Cl B120787 [1,1,0,0,0,0|2,0,0]=4 1571 B9R1.69 C1=C(C=NC(=C1Cl)Br)F B586627 [1,1,0,0,0,0|2,0,0]=4 1572 B9R1.69 C1=C(C=NC(=C1Cl)Br)N A181062 [1,1,0,0,0,0|2,0,0]=4 1573 B9R1.69 C1=C(C=NC(=C1Cl)Cl)Br B188921 [1,1,0,0,0,0|2,0,0]=4 1574 B9R1.69 C1=C(C=NC(=C1Cl)Cl)Cl T110138 [1,1,0,0,0,0|2,0,0]=4 1575 B9R1.69 C1=C(C=NC(=C1Cl)Cl)F D191742 [1,1,0,0,0,0|2,0,0]=4 1576 B9R1.69 C1=C(C=NC(=C1Cl)Cl)N D122388 [1,1,0,0,0,0|2,0,0]=4 1577 B9R1.69 C1=C(C=NC(=C1Cl)Cl)O D154411 [1,1,0,0,0,0|2,0,0]=4 1578 B9R1.69 C1=C(C=NC(=C1Cl)F)Br B170037 [1,1,0,0,0,0|2,0,0]=4 1579 B9R1.69 C1=C(C=NC(=C1Cl)F)Cl D119654 [1,1,0,0,0,0|2,0,0]=4 1580 B9R1.69 C1=C(C=NC(=C1Cl)F)F C136907 [1,1,0,0,0,0|2,0,0]=4 1581 B9R1.69 C1=C(C=NC(=C1Cl)F)O C182709 [1,1,0,0,0,0|2,0,0]=4 1582 B9R1.69 C1=C(C=NC(=C1Cl)N)Br A184168 [1,1,0,0,0,0|2,0,0]=4 1583 B9R1.69 C1=C(C=NC(=C1Cl)N)Cl A151577 [1,1,0,0,0,0|2,0,0]=4 1584 B9R1.69 C1=C(C=NC(=C1Cl)N)F C190127 [1,1,0,0,0,0|2,0,0]=4 1585 B9R1.69 C1=C(C=NC(=C1F)Br)Br D132004 [1,1,0,0,0,0|2,0,0]=4 1586 B9R1.69 C1=C(C=NC(=C1F)Br)Cl B176664 [1,1,0,0,0,0|2,0,0]=4 1587 B9R1.69 C1=C(C=NC(=C1F)Br)F B177091 [1,1,0,0,0,0|2,0,0]=4 1588 B9R1.69 C1=C(C=NC(=C1F)Cl)Br B133607 [1,1,0,0,0,0|2,0,0]=4 1589 B9R1.69 C1=C(C=NC(=C1F)Cl)N C190328 [1,1,0,0,0,0|2,0,0]=4 1590 B9R1.69 C1=C(C=NC(=C1F)Cl)O C187277 [1,1,0,0,0,0|2,0,0]=4 1591 B9R1.69 C1=C(C=NC(=C1F)F)Cl D418844 [1,1,0,0,0,0|2,0,0]=4 1592 B9R1.69 C1=C(C=NC(=C1F)F)Cl D591134 [1,1,0,0,0,0|2,0,0]=4 1593 B9R1.69 C1=C(C=NC(=C1F)F)F T123106 [1,1,0,0,0,0|2,0,0]=4 1594 B9R1.69 C1=C(C=NC(=C1F)I)Br B586839 [1,1,0,0,0,0|2,0,0]=4 1595 B9R1.69 C1=C(C=NC(=C1F)N)Br B177355 [1,1,0,0,0,0|2,0,0]=4 1596 B9R1.69 C1=C(C=NC(=C1F)N)Cl W135722 [1,1,0,0,0,0|2,0,0]=4 1597 B9R1.69 C1=C(C=NC(=C1F)N)F A186304 [1,1,0,0,0,0|2,0,0]=4 1598 B9R1.69 C1=C(C=NC(=C1F)N)I F573535 [1,1,0,0,0,0|2,0,0]=4 1599 B9R1.69 C1=C(C=NC(=C1I)Cl)Cl D188491 [1,1,0,0,0,0|2,0,0]=4 1600 B9R1.69 C1=C(C=NC(=C1I)N)Br A151582 [1,1,0,0,0,0|2,0,0]=4 1601 B9R1.69 C1=C(C=NC(=C1I)N)Cl C132073 [1,1,0,0,0,0|2,0,0]=4 1602 B9R1.69 C1=C(C=NC(=C1I)N)F A186765 [1,1,0,0,0,0|2,0,0]=4 1603 B9R1.69 C1=C(C=NC(=C1I)N)I a168881 [1,1,0,0,0,0|2,0,0]=4 1604 B9R1.69 C1=C(C=NC(=C1N)Br)Br D178138 [1,1,0,0,0,0|2,0,0]=4 1605 B9R1.69 C1=C(C=NC(=C1N)Br)Cl A151585 [1,1,0,0,0,0|2,0,0]=4 1606 B9R1.69 C1=C(C=NC(=C1N)Br)F A119665 [1,1,0,0,0,0|2,0,0]=4 1607 B9R1.69 C1=C(C=NC(=C1N)Br)I B166039 [1,1,0,0,0,0|2,0,0]=4 1608 B9R1.69 C1=C(C=NC(=C1N)Cl)Br A102588 [1,1,0,0,0,0|2,0,0]=4 1609 B9R1.69 C1=C(C=NC(=C1N)Cl)Cl A136471 [1,1,0,0,0,0|2,0,0]=4 1610 B9R1.69 C1=C(C=NC(=C1N)N)Br D123444 [1,1,0,0,0,0|2,0,0]=4 1611 B9R1.69 C1=C(C=NC(=C1N)N)Cl D169084 [1,1,0,0,0,0|2,0,0]=4 1612 B9R1.69 C1=C(C=NC(=C1O)Br)Br D187173 [1,1,0,0,0,0|2,0,0]=4 1613 B9R1.69 C1=C(C=NC(=C1O)Cl)Br B137160 [1,1,0,0,0,0|2,0,0]=4 1614 B9R1.69 C1=C(C=NC(=C1O)Cl)Cl D170841 [1,1,0,0,0,0|2,0,0]=4 1615 B9R1.69 C1=C(C=NC(=C1O)I)Br B168169 [1,1,0,0,0,0|2,0,0]=4 1616 B9R1.69 C1=C(C=NC(=C1O)N)Br A151583 [1,1,0,0,0,0|2,0,0]=4 1617 B9R1.69 C1=C(C=NC(=C1O)N)Cl A184404 [1,1,0,0,0,0|2,0,0]=4 1618 B9R1.69 C1=CC(=NC(=C1Br)Cl)Cl B136053 [1,1,0,0,0,0|2,0,0]=4 1619 B9R1.69 C1=CC(=NC(=C1Br)Cl)N B192977 [1,1,0,0,0,0|2,0,0]=4 1620 B9R1.69 C1=CC(=NC(=C1Br)F)Cl B187705 [1,1,0,0,0,0|2,0,0]=4 1621 B9R1.69 C1=CC(=NC(=C1Br)F)N B590812 [1,1,0,0,0,0|2,0,0]=4 1622 B9R1.69 C1=CC(=NC(=C1Cl)Br)N P171605 [1,1,0,0,0,0|2,0,0]=4 1623 B9R1.69 C1=CC(=NC(=C1Cl)Cl)Cl T194406 [1,1,0,0,0,0|2,0,0]=4 1624 B9R1.69 C1=CC(=NC(=C1F)F)F T176223 [1,1,0,0,0,0|2,0,0]=4 1625 B9R1.69 C1=CC(=NC(=C1F)N)F D491332 [1,1,0,0,0,0|2,0,0]=4 1626 B9R1.69 C1=CC(=NC(=C1I)Cl)Br W132753 [1,1,0,0,0,0|2,0,0]=4 1627 B9R1.69 C1=CC(=NC(=C1I)Cl)Cl D132480 [1,1,0,0,0,0|2,0,0]=4 1628 B9R1.69 C1=CC(=NC(=C1I)Cl)N C180409 [1,1,0,0,0,0|2,0,0]=4 1629 B9R1.69 C1=CC(=NC(=C1I)F)F D186015 [1,1,0,0,0,0|2,0,0]=4 1630 B9R1.69 C1=CC(=NC(=C1I)F)N F578687 [1,1,0,0,0,0|2,0,0]=4 1631 B9R1.69 C1=CC(=NC(=C1N)Br)Br A121064 [1,1,0,0,0,0|2,0,0]=4 1632 B9R1.69 C1=CC(=NC(=C1N)Br)Br A638539 [1,1,0,0,0,0|2,0,0]=4 1633 B9R1.69 C1=CC(=NC(=C1N)Br)Cl A179021 [1,1,0,0,0,0|2,0,0]=4 1634 B9R1.69 C1=CC(=NC(=C1N)Br)F B189567 [1,1,0,0,0,0|2,0,0]=4 1635 B9R1.69 C1=CC(=NC(=C1N)Cl)Br W131925 [1,1,0,0,0,0|2,0,0]=4 1636 B9R1.69 C1=CC(=NC(=C1N)Cl)Cl A123903 [1,1,0,0,0,0|2,0,0]=4 1637 B9R1.69 C1=CC(=NC(=C1N)Cl)I C165545 [1,1,0,0,0,0|2,0,0]=4 1638 B9R1.69 C1=CC(=NC(=C1N)N)Br B181030 [1,1,0,0,0,0|2,0,0]=4 1639 B9R1.69 C1=CC(=NC(=C1N)N)Cl D138813 [1,1,0,0,0,0|2,0,0]=4 1640 B9R1.69 C1=CC(=NC(=C1O)Br)Br D404198 [1,1,0,0,0,0|2,0,0]=4 1641 B9R1.69 C1=CC(=NC(=C1O)Br)I B166870 [1,1,0,0,0,0|2,0,0]=4 1642 B9R1.69 C1=CC(=NC(=C1O)Cl)I C168119 [1,1,0,0,0,0|2,0,0]=4 1643 B9R1.69 C1=CC(=NC(=C1O)F)Cl C195520 [1,1,0,0,0,0|2,0,0]=4 1644 B9R1.69 C1=CC(=NC(=C1O)I)Cl C153942 [1,1,0,0,0,0|2,0,0]=4 1645 B9R1.69 CC1=C(C=C(C=C1)Br)Br D123561 [1,1,0,0,0,0|2,0,0]=4 1646 B9R1.69 CC1=C(C=C(C=C1)Br)C B101675 [1,1,0,0,0,0|2,0,0]=4 1647 B9R1.69 CC1=C(C=C(C=C1)Br)C B101676 [1,1,0,0,0,0|2,0,0]=4 1648 B9R1.69 CC1=C(C=C(C=C1)Br)Cl B304851 [1,1,0,0,0,0|2,0,0]=4 1649 B9R1.69 CC1=C(C=C(C=C1)Br)F B120745 [1,1,0,0,0,0|2,0,0]=4 1650 B9R1.69 CC1=C(C=C(C=C1)Br)I B588468 [1,1,0,0,0,0|2,0,0]=4 1651 B9R1.69 CC1=C(C=C(C=C1)Br)N B122515 [1,1,0,0,0,0|2,0,0]=4 1652 B9R1.69 CC1=C(C=C(C=C1)Br)O B124288 [1,1,0,0,0,0|2,0,0]=4 1653 B9R1.69 CC1=C(C=C(C=C1)Cl)Br B405162 [1,1,0,0,0,0|2,0,0]=4 1654 B9R1.69 CC1=C(C=C(C=C1)Cl)C C113569 [1,1,0,0,0,0|2,0,0]=4 1655 B9R1.69 CC1=C(C=C(C=C1)Cl)Cl D104648 [1,1,0,0,0,0|2,0,0]=4 1656 B9R1.69 CC1=C(C=C(C=C1)Cl)Cl D104649 [1,1,0,0,0,0|2,0,0]=4 1657 B9R1.69 CC1=C(C=C(C=C1)Cl)F C120759 [1,1,0,0,0,0|2,0,0]=4 1658 B9R1.69 CC1=C(C=C(C=C1)Cl)I C588753 [1,1,0,0,0,0|2,0,0]=4 1659 B9R1.69 CC1=C(C=C(C=C1)Cl)N C106532 [1,1,0,0,0,0|2,0,0]=4 1660 B9R1.69 CC1=C(C=C(C=C1)Cl)N C153903 [1,1,0,0,0,0|2,0,0]=4 1661 B9R1.69 CC1=C(C=C(C=C1)Cl)O C135000 [1,1,0,0,0,0|2,0,0]=4 1662 B9R1.69 CC1=C(C=C(C=C1)F)Br B120722 [1,1,0,0,0,0|2,0,0]=4 1663 B9R1.69 CC1=C(C=C(C=C1)F)C F124479 [1,1,0,0,0,0|2,0,0]=4 1664 B9R1.69 CC1=C(C=C(C=C1)F)Cl C120753 [1,1,0,0,0,0|2,0,0]=4 1665 B9R1.69 CC1=C(C=C(C=C1)F)F D120697 [1,1,0,0,0,0|2,0,0]=4 1666 B9R1.69 CC1=C(C=C(C=C1)F)I F122782 [1,1,0,0,0,0|2,0,0]=4 1667 B9R1.69 CC1=C(C=C(C=C1)F)N F120718 [1,1,0,0,0,0|2,0,0]=4 1668 B9R1.69 CC1=C(C=C(C=C1)F)O F124289 [1,1,0,0,0,0|2,0,0]=4 1669 B9R1.69 CC1=C(C=C(C=C1)I)C D123657 [1,1,0,0,0,0|2,0,0]=4 1670 B9R1.69 CC1=C(C=C(C=C1)I)Cl C186838 [1,1,0,0,0,0|2,0,0]=4 1671 B9R1.69 CC1=C(C=C(C=C1)I)F F122778 [1,1,0,0,0,0|2,0,0]=4 1672 B9R1.69 CC1=C(C=C(C=C1)I)N I113818 [1,1,0,0,0,0|2,0,0]=4 1673 B9R1.69 CC1=C(C=C(C=C1)N)Br B122480 [1,1,0,0,0,0|2,0,0]=4 1674 B9R1.69 CC1=C(C=C(C=C1)N)C D113394 [1,1,0,0,0,0|2,0,0]=4 1675 B9R1.69 CC1=C(C=C(C=C1)N)Cl C106530 [1,1,0,0,0,0|2,0,0]=4 1676 B9R1.69 CC1=C(C=C(C=C1)N)Cl C106531 [1,1,0,0,0,0|2,0,0]=4 1677 B9R1.69 CC1=C(C=C(C=C1)N)F F122497 [1,1,0,0,0,0|2,0,0]=4 1678 B9R1.69 CC1=C(C=C(C=C1)N)I I157695 [1,1,0,0,0,0|2,0,0]=4 1679 B9R1.69 CC1=C(C=C(C=C1)N)N D103648 [1,1,0,0,0,0|2,0,0]=4 1680 B9R1.69 CC1=C(C=C(C=C1)N)N D103649 [1,1,0,0,0,0|2,0,0]=4 1681 B9R1.69 CC1=C(C=C(C=C1)N)N D103650 [1,1,0,0,0,0|2,0,0]=4 1682 B9R1.69 CC1=C(C=C(C=C1)N)N D141204 [1,1,0,0,0,0|2,0,0]=4 1683 B9R1.69 CC1=C(C=C(C=C1)N)O A115492 [1,1,0,0,0,0|2,0,0]=4 1684 B9R1.69 CC1=C(C=C(C=C1)O)Br B185524 [1,1,0,0,0,0|2,0,0]=4 1685 B9R1.69 CC1=C(C=C(C=C1)O)C D104347 [1,1,0,0,0,0|2,0,0]=4 1686 B9R1.69 CC1=C(C=C(C=C1)O)C D117389 [1,1,0,0,0,0|2,0,0]=4 1687 B9R1.69 CC1=C(C=C(C=C1)O)Cl W136428 [1,1,0,0,0,0|2,0,0]=4 1688 B9R1.69 CC1=C(C=C(C=C1)O)F F124276 [1,1,0,0,0,0|2,0,0]=4 1689 B9R1.69 CC1=C(C=C(C=C1)O)N A183421 [1,1,0,0,0,0|2,0,0]=4 1690 B9R1.69 CC1=C(C=C(C=N1)Br)Cl B178179 [1,1,0,0,0,0|1,0,0]=3 1691 B9R1.69 CC1=C(C=C(C=N1)Br)N A139435 [1,1,0,0,0,0|1,0,0]=3 1692 B9R1.69 CC1=C(C=C(C=N1)F)Br B586615 [1,1,0,0,0,0|1,0,0]=3 1693 B9R1.69 CC1=C(C=C(C=N1)N)Br B175304 [1,1,0,0,0,0|1,0,0]=3 1694 B9R1.69 CC1=C(C=CC(=N1)Br)Br W134958 [1,1,0,0,0,0|2,0,0]=4 1695 B9R1.69 CC1=C(C=CC(=N1)Br)F B184106 [1,1,0,0,0,0|2,0,0]=4 1696 B9R1.69 CC1=C(C=CC(=N1)Br)N A151749 [1,1,0,0,0,0|2,0,0]=4 1697 B9R1.69 CC1=C(C=CC(=N1)Br)O B189928 [1,1,0,0,0,0|2,0,0]=4 1698 B9R1.69 CC1=C(C=CC(=N1)Cl)Br B151865 [1,1,0,0,0,0|2,0,0]=4 1699 B9R1.69 CC1=C(C=CC(=N1)Cl)F C187646 [1,1,0,0,0,0|2,0,0]=4 1700 B9R1.69 CC1=C(C=CC(=N1)Cl)N A137489 [1,1,0,0,0,0|2,0,0]=4 1701 B9R1.69 CC1=C(C=CC(=N1)Cl)O C588169 [1,1,0,0,0,0|2,0,0]=4 1702 B9R1.69 CC1=C(C=CC(=N1)F)Br B184112 [1,1,0,0,0,0|2,0,0]=4 1703 B9R1.69 CC1=C(C=CC(=N1)N)Br A101193 [1,1,0,0,0,0|2,0,0]=4 1704 B9R1.69 CC1=C(C=CC(=N1)N)Cl W134135 [1,1,0,0,0,0|2,0,0]=4 1705 B9R1.69 CC1=C(C=CC(=N1)N)I I139241 [1,1,0,0,0,0|2,0,0]=4 1706 B9R1.69 CC1=C(N=C(C=C1)Br)N B178057 [1,1,0,0,0,0|1,0,0]=3 1707 B9R1.69 CC1=C(N=C(C=C1)Cl)Cl D139037 [1,1,0,0,0,0|1,0,0]=3 1708 B9R1.69 CC1=C(N=C(C=C1)N)Br B178058 [1,1,0,0,0,0|1,0,0]=3 1709 B9R1.69 CC1=C(N=C(C=C1)N)C A406933 [1,1,0,0,0,0|1,0,0]=3 1710 B9R1.69 CC1=C(N=C(C=C1)N)Cl C184559 [1,1,0,0,0,0|1,0,0]=3 1711 B9R1.69 CC1=C(NC(=O)N=C1)N M133493 [1,1,0,0,0,0|2,0,0]=4 1712 B9R1.69 CC1=C(NC(=O)N=C1)N M158547 [1,1,0,0,0,0|2,0,0]=4 1713 B9R1.69 CC1=CC(=C(C=C1)Br)Br D123553 [1,1,0,0,0,0|2,0,0]=4 1714 B9R1.69 CC1=CC(=C(C=C1)Br)C B101634 [1,1,0,0,0,0|2,0,0]=4 1715 B9R1.69 CC1=CC(=C(C=C1)Br)Cl B185889 [1,1,0,0,0,0|2,0,0]=4 1716 B9R1.69 CC1=CC(=C(C=C1)Br)F B120751 [1,1,0,0,0,0|2,0,0]=4 1717 B9R1.69 CC1=CC(=C(C=C1)Br)I B195363 [1,1,0,0,0,0|2,0,0]=4 1718 B9R1.69 CC1=CC(=C(C=C1)Br)N W136366 [1,1,0,0,0,0|2,0,0]=4 1719 B9R1.69 CC1=CC(=C(C=C1)Br)O D302938 [1,1,0,0,0,0|2,0,0]=4 1720 B9R1.69 CC1=CC(=C(C=C1)C)Br D107975 [1,1,0,0,0,0|1,0,0]=3 1721 B9R1.69 CC1=CC(=C(C=C1)C)C T110885 [1,1,0,0,0,0|1,0,0]=3 1722 B9R1.69 CC1=CC(=C(C=C1)C)C T110887 [1,1,0,0,0,0|1,0,0]=3 1723 B9R1.69 CC1=CC(=C(C=C1)C)C T110888 [1,1,0,0,0,0|1,0,0]=3 1724 B9R1.69 CC1=CC(=C(C=C1)C)C T128160 [1,1,0,0,0,0|1,0,0]=3 1725 B9R1.69 CC1=CC(=C(C=C1)C)Cl C122701 [1,1,0,0,0,0|1,0,0]=3 1726 B9R1.69 CC1=CC(=C(C=C1)C)F F186090 [1,1,0,0,0,0|1,0,0]=3 1727 B9R1.69 CC1=CC(=C(C=C1)C)N D106348 [1,1,0,0,0,0|1,0,0]=3 1728 B9R1.69 CC1=CC(=C(C=C1)C)O D104331 [1,1,0,0,0,0|1,0,0]=3 1729 B9R1.69 CC1=CC(=C(C=C1)C)O D104332 [1,1,0,0,0,0|1,0,0]=3 1730 B9R1.69 CC1=CC(=C(C=C1)C)O D117388 [1,1,0,0,0,0|1,0,0]=3 1731 B9R1.69 CC1=CC(=C(C=C1)C)S D101775 [1,1,0,0,0,0|1,0,0]=3 1732 B9R1.69 CC1=CC(=C(C=C1)Cl)Br B185302 [1,1,0,0,0,0|2,0,0]=4 1733 B9R1.69 CC1=CC(=C(C=C1)Cl)C C405487 [1,1,0,0,0,0|2,0,0]=4 1734 B9R1.69 CC1=CC(=C(C=C1)Cl)Cl D100626 [1,1,0,0,0,0|2,0,0]=4 1735 B9R1.69 CC1=CC(=C(C=C1)Cl)Cl D100627 [1,1,0,0,0,0|2,0,0]=4 1736 B9R1.69 CC1=CC(=C(C=C1)Cl)F C121012 [1,1,0,0,0,0|2,0,0]=4 1737 B9R1.69 CC1=CC(=C(C=C1)Cl)N C153907 [1,1,0,0,0,0|2,0,0]=4 1738 B9R1.69 CC1=CC(=C(C=C1)Cl)O C153524 [1,1,0,0,0,0|2,0,0]=4 1739 B9R1.69 CC1=CC(=C(C=C1)F)Br B120742 [1,1,0,0,0,0|2,0,0]=4 1740 B9R1.69 CC1=CC(=C(C=C1)F)Cl C181666 [1,1,0,0,0,0|2,0,0]=4 1741 B9R1.69 CC1=CC(=C(C=C1)F)F D120699 [1,1,0,0,0,0|2,0,0]=4 1742 B9R1.69 CC1=CC(=C(C=C1)F)I F122783 [1,1,0,0,0,0|2,0,0]=4 1743 B9R1.69 CC1=CC(=C(C=C1)F)N F113848 [1,1,0,0,0,0|2,0,0]=4 1744 B9R1.69 CC1=CC(=C(C=C1)F)O F124272 [1,1,0,0,0,0|2,0,0]=4 1745 B9R1.69 CC1=CC(=C(C=C1)I)Br B186225 [1,1,0,0,0,0|2,0,0]=4 1746 B9R1.69 CC1=CC(=C(C=C1)I)C I157574 [1,1,0,0,0,0|2,0,0]=4 1747 B9R1.69 CC1=CC(=C(C=C1)I)F W134166 [1,1,0,0,0,0|2,0,0]=4 1748 B9R1.69 CC1=CC(=C(C=C1)I)N I181158 [1,1,0,0,0,0|2,0,0]=4 1749 B9R1.69 CC1=CC(=C(C=C1)N)Br B139034 [1,1,0,0,0,0|2,0,0]=4 1750 B9R1.69 CC1=CC(=C(C=C1)N)C D105631 [1,1,0,0,0,0|2,0,0]=4 1751 B9R1.69 CC1=CC(=C(C=C1)N)C D105632 [1,1,0,0,0,0|2,0,0]=4 1752 B9R1.69 CC1=CC(=C(C=C1)N)C D154317 [1,1,0,0,0,0|2,0,0]=4 1753 B9R1.69 CC1=CC(=C(C=C1)N)Cl C133948 [1,1,0,0,0,0|2,0,0]=4 1754 B9R1.69 CC1=CC(=C(C=C1)N)F F120702 [1,1,0,0,0,0|2,0,0]=4 1755 B9R1.69 CC1=CC(=C(C=C1)N)I I183480 [1,1,0,0,0,0|2,0,0]=4 1756 B9R1.69 CC1=CC(=C(C=C1)N)N D106442 [1,1,0,0,0,0|2,0,0]=4 1757 B9R1.69 CC1=CC(=C(C=C1)N)N D106444 [1,1,0,0,0,0|2,0,0]=4 1758 B9R1.69 CC1=CC(=C(C=C1)N)O A121774 [1,1,0,0,0,0|2,0,0]=4 1759 B9R1.69 CC1=CC(=C(C=C1)O)Br B124659 [1,1,0,0,0,0|2,0,0]=4 1760 B9R1.69 CC1=CC(=C(C=C1)O)Br B141113 [1,1,0,0,0,0|2,0,0]=4 1761 B9R1.69 CC1=CC(=C(C=C1)O)C D112715 [1,1,0,0,0,0|2,0,0]=4 1762 B9R1.69 CC1=CC(=C(C=C1)O)C D117387 [1,1,0,0,0,0|2,0,0]=4 1763 B9R1.69 CC1=CC(=C(C=C1)O)C D472061 [1,1,0,0,0,0|2,0,0]=4 1764 B9R1.69 CC1=CC(=C(C=C1)O)Cl C134527 [1,1,0,0,0,0|2,0,0]=4 1765 B9R1.69 CC1=CC(=C(C=C1)O)F F133446 [1,1,0,0,0,0|2,0,0]=4 1766 B9R1.69 CC1=CC(=C(C=C1)O)I I305091 [1,1,0,0,0,0|2,0,0]=4 1767 B9R1.69 CC1=CC(=C(C=C1)O)N A107257 [1,1,0,0,0,0|2,0,0]=4 1768 B9R1.69 CC1=CC(=C(C=C1)O)O M108038 [1,1,0,0,0,0|2,0,0]=4 1769 B9R1.69 CC1=CC(=C(C=C1)S)C D101774 [1,1,0,0,0,0|2,0,0]=4 1770 B9R1.69 CC1=CC(=C(C=C1)S)S T113451 [1,1,0,0,0,0|2,0,0]=4 1771 B9R1.69 CC1=CC(=C(C=N1)Br)N A586241 [1,1,0,0,0,0|1,0,0]=3 1772 B9R1.69 CC1=CC(=C(C=N1)Cl)Br B586612 [1,1,0,0,0,0|1,0,0]=3 1773 B9R1.69 CC1=CC(=C(C=N1)O)Br B586814 [1,1,0,0,0,0|1,0,0]=3 1774 B9R1.69 CC1=CC(=C(N=C1)Br)Br D121800 [1,1,0,0,0,0|1,0,0]=3 1775 B9R1.69 CC1=CC(=C(N=C1)Br)C B188354 [1,1,0,0,0,0|1,0,0]=3 1776 B9R1.69 CC1=CC(=C(N=C1)Br)N A183879 [1,1,0,0,0,0|1,0,0]=3 1777 B9R1.69 CC1=CC(=C(N=C1)C)C C109929 [1,1,0,0,0,0|0,0,0]=2 1778 B9R1.69 CC1=CC(=C(N=C1)Cl)Br B405195 [1,1,0,0,0,0|1,0,0]=3 1779 B9R1.69 CC1=CC(=C(N=C1)Cl)Cl D136951 [1,1,0,0,0,0|1,0,0]=3 1780 B9R1.69 CC1=CC(=C(N=C1)Cl)F C135824 [1,1,0,0,0,0|1,0,0]=3 1781 B9R1.69 CC1=CC(=C(N=C1)Cl)I C171129 [1,1,0,0,0,0|1,0,0]=3 1782 B9R1.69 CC1=CC(=C(N=C1)Cl)N A151741 [1,1,0,0,0,0|1,0,0]=3 1783 B9R1.69 CC1=CC(=C(N=C1)Cl)O C195775 [1,1,0,0,0,0|1,0,0]=3 1784 B9R1.69 CC1=CC(=C(N=C1)F)Br B129177 [1,1,0,0,0,0|1,0,0]=3 1785 B9R1.69 CC1=CC(=C(N=C1)F)I F119656 [1,1,0,0,0,0|1,0,0]=3 1786 B9R1.69 CC1=CC(=C(N=C1)N)Br A151670 [1,1,0,0,0,0|1,0,0]=3 1787 B9R1.69 CC1=CC(=C(N=C1)N)C D193349 [1,1,0,0,0,0|1,0,0]=3 1788 B9R1.69 CC1=CC(=C(N=C1)N)Cl A151674 [1,1,0,0,0,0|1,0,0]=3 1789 B9R1.69 CC1=CC(=C(N=C1)N)I I168541 [1,1,0,0,0,0|1,0,0]=3 1790 B9R1.69 CC1=CC(=CN=C1Br)Br D154210 [1,1,0,0,0,0|2,0,0]=4 1791 B9R1.69 CC1=CC(=CN=C1Br)Cl B185847 [1,1,0,0,0,0|2,0,0]=4 1792 B9R1.69 CC1=CC(=CN=C1Br)F B119669 [1,1,0,0,0,0|2,0,0]=4 1793 B9R1.69 CC1=CC(=CN=C1Br)I B151864 [1,1,0,0,0,0|2,0,0]=4 1794 B9R1.69 CC1=CC(=CN=C1Br)N A151752 [1,1,0,0,0,0|2,0,0]=4 1795 B9R1.69 CC1=CC(=CN=C1Br)O B178697 [1,1,0,0,0,0|2,0,0]=4 1796 B9R1.69 CC1=CC(=CN=C1C)N D589816 [1,1,0,0,0,0|1,0,0]=3 1797 B9R1.69 CC1=CC(=CN=C1Cl)Br B102593 [1,1,0,0,0,0|2,0,0]=4 1798 B9R1.69 CC1=CC(=CN=C1Cl)F C138770 [1,1,0,0,0,0|2,0,0]=4 1799 B9R1.69 CC1=CC(=CN=C1Cl)N A137214 [1,1,0,0,0,0|2,0,0]=4 1800 B9R1.69 CC1=CC(=CN=C1Cl)O C193845 [1,1,0,0,0,0|2,0,0]=4 1801 B9R1.69 CC1=CC(=CN=C1F)Br B121813 [1,1,0,0,0,0|2,0,0]=4 1802 B9R1.69 CC1=CC(=CN=C1F)Cl C184113 [1,1,0,0,0,0|2,0,0]=4 1803 B9R1.69 CC1=CC(=CN=C1F)N A480624 [1,1,0,0,0,0|2,0,0]=4 1804 B9R1.69 CC1=CC(=CN=C1F)O F587834 [1,1,0,0,0,0|2,0,0]=4 1805 B9R1.69 CC1=CC(=CN=C1N)Br A151675 [1,1,0,0,0,0|2,0,0]=4 1806 B9R1.69 CC1=CC(=CN=C1N)Cl A151671 [1,1,0,0,0,0|2,0,0]=4 1807 B9R1.69 CC1=CC(=CN=C1N)I I132791 [1,1,0,0,0,0|2,0,0]=4 1808 B9R1.69 CC1=CC(=NC=C1Br)Br W134623 [1,1,0,0,0,0|2,0,0]=4 1809 B9R1.69 CC1=CC(=NC=C1Br)Cl B124335 [1,1,0,0,0,0|2,0,0]=4 1810 B9R1.69 CC1=CC(=NC=C1Br)F B187245 [1,1,0,0,0,0|2,0,0]=4 1811 B9R1.69 CC1=CC(=NC=C1Br)N A124300 [1,1,0,0,0,0|2,0,0]=4 1812 B9R1.69 CC1=CC(=NC=C1Cl)N A151751 [1,1,0,0,0,0|2,0,0]=4 1813 B9R1.69 CC1=CC(=NC=C1I)N A151744 [1,1,0,0,0,0|2,0,0]=4 1814 B9R1.69 CC1=CC(=NC=C1N)Br B167565 [1,1,0,0,0,0|2,0,0]=4 1815 B9R1.69 CC1=CC(=NC=C1N)F A467479 [1,1,0,0,0,0|2,0,0]=4 1816 B9R1.69 CC1=CC=C(C(=O)N1)Br B184103 [1,1,0,0,0,0|1,0,1]=4 1817 B9R1.69 CC1=CN=C(C(=N1)C)C T106601 [1,1,0,0,0,0|1,0,0]=3 1818 B9R1.69 CC1=CN=C(C(=N1)C)Cl C153710 [1,1,0,0,0,0|2,0,0]=4 1819 B9R1.69 CC1=CN=C(C(=N1)Cl)C C139492 [1,1,0,0,0,0|1,0,0]=3 1820 B9R1.69 CC1=CN=C(C(=N1)Cl)N C195628 [1,1,0,0,0,0|2,0,0]=4 1821 B9R1.69 CC1=CN=C(C=C1Br)F B586692 [1,1,0,0,0,0|1,0,0]=3 1822 B9R1.69 CC1=CN=C(C=C1Br)N B586207 [1,1,0,0,0,0|1,0,0]=3 1823 B9R1.69 CC1=CN=C(C=C1Cl)Cl D134689 [1,1,0,0,0,0|1,0,0]=3 1824 B9R1.69 CC1=CN=C(C=C1I)Cl C166361 [1,1,0,0,0,0|1,0,0]=3 1825 B9R1.69 CC1=CN=C(C=C1I)F F120740 [1,1,0,0,0,0|1,0,0]=3 1826 B9R1.69 CC1=CN=C(C=C1N)Br B590193 [1,1,0,0,0,0|1,0,0]=3 1827 B9R1.69 CC1=CN=C(N=C1Cl)C C479451 [1,1,0,0,0,0|1,0,0]=3 1828 B9R1.69 CC1=CN=C(N=C1Cl)Cl D115772 [1,1,0,0,0,0|2,0,0]=4 1829 B9R1.69 CC1=CN=C(N=C1Cl)N C175561 [1,1,0,0,0,0|2,0,0]=4 1830 B9R1.69 CC1=CN=C(NC1=O)N A478727 [1,1,0,0,0,0|2,0,0]=4 1831 B9R1.69 CC1=CNC(=O)C(=C1)Br B131796 [1,1,0,0,0,0|1,0,1]=4 1832 B9R1.69 CC1=CNC(=O)C(=C1)I I169502 [1,1,0,0,0,0|1,0,1]=4 1833 B9R1.69 CC1=CNC(=O)C=C1N A196047 [1,1,0,0,0,0|1,0,1]=4 1834 B9R1.69 CC1=NC(=C(C=C1)Br)Br D491558 [1,1,0,0,0,0|1,0,0]=3 1835 B9R1.69 CC1=NC(=C(C=C1)Br)C B138700 [1,1,0,0,0,0|1,0,0]=3 1836 B9R1.69 CC1=NC(=C(C=C1)Br)Cl B587814 [1,1,0,0,0,0|1,0,0]=3 1837 B9R1.69 CC1=NC(=C(C=C1)Br)N A120782 [1,1,0,0,0,0|1,0,0]=3 1838 B9R1.69 CC1=NC(=C(C=C1)Cl)Br B586619 [1,1,0,0,0,0|1,0,0]=3 1839 B9R1.69 CC1=NC(=C(C=C1)Cl)Cl D185160 [1,1,0,0,0,0|1,0,0]=3 1840 B9R1.69 CC1=NC(=C(C=C1)F)Br B169985 [1,1,0,0,0,0|1,0,0]=3 1841 B9R1.69 CC1=NC(=C(C=C1)F)Cl C184102 [1,1,0,0,0,0|1,0,0]=3 1842 B9R1.69 CC1=NC(=C(C=C1)N)Br A180939 [1,1,0,0,0,0|1,0,0]=3 1843 B9R1.69 CC1=NC(=C(C=C1)N)C A121811 [1,1,0,0,0,0|1,0,0]=3 1844 B9R1.69 CC1=NC(=C(C=C1)N)Cl A588986 [1,1,0,0,0,0|1,0,0]=3 1845 B9R1.69 CC1=NC(=C(C=C1)O)Br B183008 [1,1,0,0,0,0|1,0,0]=3 1846 B9R1.69 CC1=NC(=C(C=C1)O)I H121812 [1,1,0,0,0,0|1,0,0]=3 1847 B9R1.69 CC1=NC(=C(C=C1)O)N A191936 [1,1,0,0,0,0|1,0,0]=3 1848 B9R1.69 CC1=NC=C(C(=O)N1)Br B181969 [1,1,0,0,0,0|2,0,0]=4 1849 B9R1.69 CC1=NC=C(N=C1C)Cl C589603 [1,1,0,0,0,0|2,0,0]=4 1850 B9R1.69 CC1=NC=C(N=C1Cl)Cl D590594 [1,1,0,0,0,0|2,0,0]=4 1851 B9R1.69 CC1=NNC(=O)C(=C1)Br B196061 [1,1,0,0,0,0|2,0,0]=4 1852 B9R1.7 CCCN1C=C[N+](=C1)C M101510 [0,1,0,0,1,0|2,0,0]=4 1853 B9R1.7 CCCN1C=C[N+](=C1)C M281603 [0,1,0,0,1,0|2,0,0]=4 1854 B9R1.7 CCCN1C=C[N+](=C1)C M303056 [0,1,0,0,1,0|2,0,0]=4 1855 B9R1.7 CCCN1C=C[N+](=C1)C M303176 [0,1,0,0,1,0|2,0,0]=4 1856 B9R1.7 C[N+]1=CN(C=C1)CCO H157306 [0,1,0,0,1,0|2,0,0]=4 1857 B9R1.7 C[N+]1=CN(C=C1)CCO H405742 [0,1,0,0,1,0|2,0,0]=4 1858 B9R1.21 C1=C(OC(=C1)CN)CN B355365 [0,1,0,0,1,0|2,0,0]=4 1859 B9R1.21 C1=C(OC(=C1)CO)CO F182365 [0,1,0,0,1,0|2,0,0]=4 1860 B9R1.21 CCN1C=C(C=N1)CN E590363 [0,1,0,0,1,0|2,0,0]=4 1861 B9R1.22 CC1=C(SC(=N1)C)CO D193615 [0,1,0,0,1,0|2,0,0]=4 1862 B9R1.22 CC1=CC(=NN1CO)C D154762 [0,1,0,0,1,0|2,0,0]=4 1863 B9R1.22 CC1=NN(C(=C1)CCl)C C177652 [0,1,0,0,1,0|2,0,0]=4 1864 B9R1.22 CC1=NN(C=C1CN)C D589005 [0,1,0,0,1,0|2,0,0]=4 1865 B9R1.23 CCC1=NC(=C(S1)Br)C B187221 [0,1,0,0,1,0|1,0,0]=3 1866 B9R1.35 CC(=O)C1=CN(N=C1)C M588929 [0,1,0,0,1,0|1,0,1]=4 1867 B9R1.35 CC(C)C1=CN=C(S1)Br B586458 [0,1,0,0,1,0|2,0,0]=4 1868 B9R1.35 CC(C)N1C=C(N=C1)Br B589690 [0,1,0,0,1,0|2,0,0]=4 1869 B9R1.35 CC1=CC=C(O1)C(=O)C A113375 [0,1,0,0,1,0|1,0,1]=4 1870 B9R1.35 CC1=CC=C(S1)C(=O)C A113376 [0,1,0,0,1,0|1,0,1]=4 1871 B9R1.35 CC1=CSC(=C1)C(=O)C A167104 [0,1,0,0,1,0|1,0,1]=4 1872 B9R1.35 CC1=CSC(=N1)C(=O)C A469639 [0,1,0,0,1,0|1,0,1]=4 1873 B9R1.35 CC1=CSC(=N1)C(C)C I102627 [0,1,0,0,1,0|1,0,0]=3 1874 B9R1.132 CCN1C=C[N+](=C1C)C E169326 [0,1,0,0,1,0|2,0,0]=4 1875 B9R1.132 CCN1C=C[N+](=C1C)C E189240 [0,1,0,0,1,0|2,0,0]=4 1876 B9R1.132 CCN1C=C[N+](=C1C)C E303395 [0,1,0,0,1,0|2,0,0]=4 1877 B9R1.132 CCN1C=C[N+](=C1C)C E342191 [0,1,0,0,1,0|2,0,0]=4 1878 B11R1.1 C1=CC(=CC=C1CCCN)Cl C191754 [0,2,0,0,0,0|2,0,0]=4 1879 B11R1.1 C1=CC(=CC=C1CCCO)Br B135402 [0,2,0,0,0,0|2,0,0]=4 1880 B11R1.1 C1=CC(=CC=C1CCCO)Cl C405534 [0,2,0,0,0,0|2,0,0]=4 1881 B11R1.1 C1=CC(=CC=C1CCCO)O W132591 [0,2,0,0,0,0|2,0,0]=4 1882 B11R1.1 C1=CC(=CC=C1OCCBr)Cl B152802 [0,2,0,0,0,0|2,0,0]=4 1883 B11R1.1 C1=CC(=CC=C1OCCBr)F F136245 [0,2,0,0,0,0|2,0,0]=4 1884 B11R1.1 C1=CC(=CC=C1OCCO)Br B140261 [0,2,0,0,0,0|2,0,0]=4 1885 B11R1.1 C1=CC(=CC=C1OCCO)Cl C140392 [0,2,0,0,0,0|2,0,0]=4 1886 B11R1.1 CC1=CC=C(C=C1)OCC#N P169700 [0,2,0,0,0,0|1,0,1]=4 1887 B11R1.1 CC1=CC=C(C=C1)OCC=C A151094 [0,2,0,0,0,0|1,0,1]=4 1888 B11R1.1 CC1=CC=C(C=C1)OCCO E140276 [0,2,0,0,0,0|1,0,0]=3 1889 B11R1.1 CCCCC1=CC=C(C=C1)Br B115516 [0,2,0,0,0,0|2,0,0]=4 1890 B11R1.1 CCCCC1=CC=C(C=C1)Cl B167540 [0,2,0,0,0,0|2,0,0]=4 1891 B11R1.1 CCCCC1=CC=C(C=C1)I B124312 [0,2,0,0,0,0|2,0,0]=4 1892 B11R1.1 CCCCC1=CC=C(C=C1)N B100731 [0,2,0,0,0,0|2,0,0]=4 1893 B11R1.1 CCCCC1=CC=C(C=C1)O B152848 [0,2,0,0,0,0|2,0,0]=4 1894 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120508 [0,2,0,0,0,0|2,0,0]=4 1895 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120511 [0,2,0,0,0,0|2,0,0]=4 1896 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B120512 [0,2,0,0,0,0|2,0,0]=4 1897 B11R1.1 CCCC[N+]1=CC=C(C=C1)C B343853 [0,2,0,0,0,0|2,0,0]=4 1898 B11R1.1 CCCC[N+]1=CC=C(C=C1)C W196192 [0,2,0,0,0,0|2,0,0]=4 1899 B11R1.1 CCCOC1=CC=C(C=C1)Br B138795 [0,2,0,0,0,0|2,0,0]=4 1900 B11R1.1 CCCOC1=CC=C(C=C1)N P420032 [0,2,0,0,0,0|2,0,0]=4 1901 B11R1.1 CCCOC1=CC=C(C=C1)O P132532 [0,2,0,0,0,0|2,0,0]=4 1902 B11R1.1 CCOCC1=CC=C(C=C1)O E194029 [0,2,0,0,0,0|2,0,0]=4 1903 B11R1.1 COCCC1=CC=C(C=C1)O M136398 [0,2,0,0,0,0|2,0,0]=4 1904 B11R1.20 C1=CC(=NC=C1CC(=O)O)Cl C134957 [0,2,0,0,0,0|1,0,1]=4 1905 B11R1.20 CC(=O)CC1=CC=C(C=C1)Br B133524 [0,2,0,0,0,0|2,0,0]=4 1906 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl C136193 [0,2,0,0,0,0|2,0,0]=4 1907 B11R1.20 CC(=O)CC1=CC=C(C=C1)F F123996 [0,2,0,0,0,0|2,0,0]=4 1908 B11R1.20 CC(C)CC1=CC=C(C=C1)Br B163036 [0,2,0,0,0,0|2,0,0]=4 1909 B11R1.20 CC(C)NC1=NN=C(C=C1)Cl C349940 [0,2,0,0,0,0|2,0,0]=4 1910 B11R1.20 CC(C)OC1=CC=C(C=C1)N I157723 [0,2,0,0,0,0|2,0,0]=4 1911 B11R1.20 CC1=CC=C(C=C1)CC(=O)O T100785 [0,2,0,0,0,0|1,0,1]=4 1912 B11R1.20 CC1=CC=C(C=C1)NC(=O)C P160549 [0,2,0,0,0,0|1,0,1]=4 1913 B11R1.20 CC1=CC=C(C=C1)OC(=O)C P160555 [0,2,0,0,0,0|1,0,1]=4 1914 B11R1.20 CC1=NC=C(C=C1)CC(=O)O M573259 [0,2,0,0,0,0|0,0,1]=3 1915 B11R1.20 CN(C)CC1=CC=C(C=C1)N A185751 [0,2,0,0,0,0|2,0,0]=4 1916 B11R1.22 C1=CC(=CC=C1C(CN)O)O O101521 [0,2,0,0,0,0|2,0,0]=4 1917 B11R1.22 C1=CC(=CC=C1C(CO)N)Br A587986 [0,2,0,0,0,0|2,0,0]=4 1918 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr M113665 [0,2,0,0,0,0|1,0,1]=4 1919 B11R1.22 CC1=CC=C(C=C1)C(=O)OC M110633 [0,2,0,0,0,0|1,0,1]=4 1920 B11R1.22 CC1=CC=C(C=C1)N(C)C=O N159308 [0,2,0,0,0,0|2,0,0]=4 1921 B11R1.22 CC1=CN=C(C=N1)C(=O)OC M184412 [0,2,0,0,0,0|1,0,1]=4 1922 B11R1.22 CC1=NC=C(C=C1)C(=O)OC M128103 [0,2,0,0,0,0|0,0,1]=3 1923 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br B137954 [0,2,0,0,0,0|2,0,0]=4 1924 B11R1.22 CCC(=O)C1=CC=C(C=C1)C M102232 [0,2,0,0,0,0|1,0,0]=3 1925 B11R1.22 CCC(=O)C1=CC=C(C=C1)Cl C109480 [0,2,0,0,0,0|2,0,0]=4 1926 B11R1.22 CCC(=O)C1=CC=C(C=C1)F F156638 [0,2,0,0,0,0|2,0,0]=4 1927 B11R1.22 CCC(=O)C1=CC=C(C=C1)N A419382 [0,2,0,0,0,0|2,0,0]=4 1928 B11R1.22 CCC(=O)C1=CC=C(C=C1)O H107590 [0,2,0,0,0,0|2,0,0]=4 1929 B11R1.22 CCC(C)C1=CC=C(C=C1)Br B136925 [0,2,0,0,0,0|2,0,0]=4 1930 B11R1.22 CCC(C)C1=CC=C(C=C1)N S161429 [0,2,0,0,0,0|2,0,0]=4 1931 B11R1.22 CCC(C)C1=CC=C(C=C1)O S161081 [0,2,0,0,0,0|2,0,0]=4 1932 B11R1.22 CCC(C1=CC=C(C=C1)Cl)N C489594 [0,2,0,0,0,0|2,0,0]=4 1933 B11R1.22 CNC(=O)C1=CN=C(C=C1)Cl C193841 [0,2,0,0,0,0|1,0,1]=4 1934 B11R1.22 COC(=O)C1=CN=C(C=C1)Br M175933 [0,2,0,0,0,0|1,0,1]=4 1935 B11R1.22 COC(=O)C1=CN=C(C=C1)Cl M158734 [0,2,0,0,0,0|1,0,1]=4 1936 B11R1.22 COC(=O)C1=CN=C(C=C1)N M157823 [0,2,0,0,0,0|1,0,1]=4 1937 B11R1.22 NCC(O)C1=CC=C(O)C=C1 O408184 [0,2,0,0,0,0|2,0,0]=4 1938 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CCBr D165846 [0,2,0,0,0,0|2,0,0]=4 1939 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CCN D154340 [0,2,0,0,0,0|2,0,0]=4 1940 B11R1.81 C1=CC(=C(C=C1Cl)Cl)CCO D134031 [0,2,0,0,0,0|2,0,0]=4 1941 B11R1.81 CCOC1=C(C=C(C=C1)N)Cl C170766 [0,2,0,0,0,0|2,0,0]=4 1942 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Cl D178117 [0,2,0,0,0,0|2,0,0]=4 1943 B11R1.81 CNCC1=C(C=C(C=C1)Cl)Cl D404190 [0,2,0,0,0,0|2,0,0]=4 1944 B11R1.83 C1=CC(=CC=C1CCBr)C#N B194753 [0,2,0,0,0,0|1,0,1]=4 1945 B11R1.83 C1=CC(=CC=C1CCN)C#N A167799 [0,2,0,0,0,0|1,0,1]=4 1946 B11R1.83 C1=CC(=CC=C1CCO)C#N H134819 [0,2,0,0,0,0|1,0,1]=4 1947 B11R1.83 CC=CC1=CC=C(C=C1)OC A111314 [0,2,0,0,0,0|1,0,1]=4 1948 B11R1.83 CC=CC1=CC=C(C=C1)OC A119294 [0,2,0,0,0,0|1,0,1]=4 1949 B11R1.83 CC=CC1=CC=C(C=C1)OC P136392 [0,2,0,0,0,0|1,0,1]=4 1950 B11R1.83 CC=CC1=CC=C(C=C1)OC T423891 [0,2,0,0,0,0|1,0,1]=4 1951 B11R1.83 CCC1=CC=C(C=C1)N=C=O E156038 [0,2,0,0,0,0|1,0,1]=4 1952 B11R1.83 CCC1=CC=C(C=C1)N=C=S E140567 [0,2,0,0,0,0|1,0,1]=4 1953 B11R1.83 CCC1=CC=C(C=C1)OCC E156094 [0,2,0,0,0,0|1,0,0]=3 1954 B11R1.83 CCC1=CN=C(C=C1)CCO E102922 [0,2,0,0,0,0|0,0,0]=2 1955 B11R1.83 CCCC1=CC=C(C=C1)C#C N115542 [0,2,0,0,0,0|1,0,1]=4 1956 B11R1.83 CCCC1=CC=C(C=C1)C=O P135756 [0,2,0,0,0,0|1,0,1]=4 1957 B11R1.83 CCCC1=CC=C(C=C1)OC M586236 [0,2,0,0,0,0|1,0,0]=3 1958 B11R1.83 CCOC1=CC=C(C=C1)C#C E156344 [0,2,0,0,0,0|1,0,1]=4 1959 B11R1.83 CCOC1=CC=C(C=C1)C#N E156327 [0,2,0,0,0,0|1,0,1]=4 1960 B11R1.83 CCOC1=CC=C(C=C1)C=C E477029 [0,2,0,0,0,0|1,0,1]=4 1961 B11R1.83 CCOC1=CC=C(C=C1)C=O E137923 [0,2,0,0,0,0|1,0,1]=4 1962 B11R1.83 CCOC1=CC=C(C=C1)CCl C194480 [0,2,0,0,0,0|1,0,0]=3 1963 B11R1.83 CCOC1=CC=C(C=C1)CO E156108 [0,2,0,0,0,0|1,0,0]=3 1964 B11R1.83 CNCC1=CC=C(C=C1)C#N M183867 [0,2,0,0,0,0|1,0,1]=4 1965 B11R1.83 CNCC1=CC=C(C=C1)OC M121878 [0,2,0,0,0,0|1,0,0]=3 1966 B11R1.83 CNCC1=CC=C(C=C1)OC M187530 [0,2,0,0,0,0|1,0,0]=3 1967 B11R1.83 COC1=CC=C(C=C1)CC#N M124732 [0,2,0,0,0,0|1,0,1]=4 1968 B11R1.83 COC1=CC=C(C=C1)CC=C A151340 [0,2,0,0,0,0|1,0,1]=4 1969 B11R1.83 COC1=CC=C(C=C1)CC=C A421524 [0,2,0,0,0,0|1,0,1]=4 1970 B11R1.83 COC1=CC=C(C=C1)CC=O M193998 [0,2,0,0,0,0|1,0,1]=4 1971 B11R1.83 COC1=CC=C(C=C1)CCBr M353698 [0,2,0,0,0,0|1,0,0]=3 1972 B11R1.83 COC1=CC=C(C=C1)CCN M106422 [0,2,0,0,0,0|1,0,0]=3 1973 B11R1.83 COC1=CC=C(C=C1)CCO M124605 [0,2,0,0,0,0|1,0,0]=3 1974 B11R1.83 COC1=CC=C(C=C1)CCO M493169 [0,2,0,0,0,0|1,0,0]=3 1975 B11R1.83 COC1=CC=C(C=C1)CNN M175563 [0,2,0,0,0,0|2,0,0]=4 1976 B11R1.83 COC1=CC=C(C=C1)CON A479616 [0,2,0,0,0,0|2,0,0]=4 1977 B11R1.83 COCC1=CC=C(C=C1)OC M158116 [0,2,0,0,0,0|1,0,0]=3 1978 B11R1.192 C1=CC(=C(C=C1CCN)Cl)Cl D154344 [0,2,0,0,0,0|2,0,0]=4 1979 B11R1.192 C1=CC(=C(C=C1CCN)O)O A303863 [0,2,0,0,0,0|2,0,0]=4 1980 B11R1.192 C1=CC(=C(C=C1CCN)O)O A303864 [0,2,0,0,0,0|2,0,0]=4 1981 B11R1.192 C1=CC(=C(C=C1CCN)O)O D103111 [0,2,0,0,0,0|2,0,0]=4 1982 B11R1.192 C1=CC(=C(C=C1CCN)O)O D121757 [0,2,0,0,0,0|2,0,0]=4 1983 B11R1.192 C1=CC(=C(C=C1CCN)O)O H350369 [0,2,0,0,0,0|2,0,0]=4 1984 B11R1.192 C1=CC(=C(C=C1CCO)Cl)Cl D134939 [0,2,0,0,0,0|2,0,0]=4 1985 B11R1.192 C1=CC(=C(C=C1CCO)O)O H107675 [0,2,0,0,0,0|2,0,0]=4 1986 B11R1.192 C1=CC(=C(C=C1CCO)O)O H306005 [0,2,0,0,0,0|2,0,0]=4 1987 B11R1.192 C1=CC(=C(C=C1CCO)O)O H420486 [0,2,0,0,0,0|2,0,0]=4 1988 B11R1.192 CCCC1=CC(=C(C=C1)O)O P588420 [0,2,0,0,0,0|2,0,0]=4 1989 B11R1.192 CCOC1=CC(=C(C=C1)N)N E478624 [0,2,0,0,0,0|2,0,0]=4 1990 B11R1.192 NCCC1=CC(=C(O)C=C1)O D408026 [0,2,0,0,0,0|2,0,0]=4 1991 B11R1.3 B(C1=CC=C(C=C1)CC)(O)O E103180 [0,2,0,0,0,0|2,0,0]=4 1992 B11R1.3 B(C1=CN=C(C=C1)OC)(O)O M102581 [0,2,0,0,0,0|2,0,0]=4 1993 B11R1.3 B(C1=CN=C(C=C1)SC)(O)O M169548 [0,2,0,0,0,0|2,0,0]=4 1994 B11R1.3 CC(=C)C1=CC=C(C=C1)OC M587638 [0,2,0,0,0,0|1,0,1]=4 1995 B11R1.3 CC(=O)C1=CC=C(C=C1)NC A196189 [0,2,0,0,0,0|1,0,1]=4 1996 B11R1.3 CC(=O)C1=CC=C(C=C1)OC M103875 [0,2,0,0,0,0|1,0,1]=4 1997 B11R1.3 CC(=O)C1=CC=C(C=C1)SC M101852 [0,2,0,0,0,0|1,0,1]=4 1998 B11R1.3 CC(=O)C1=CN=C(C=C1)OC A115779 [0,2,0,0,0,0|0,0,1]=3 1999 B11R1.3 CC(C)C1=CC=C(C=C1)C#C E588290 [0,2,0,0,0,0|1,0,1]=4 2000 B11R1.3 CC(C)C1=CC=C(C=C1)C=O C117706 [0,2,0,0,0,0|1,0,1]=4 2001 B11R1.3 CC(C)C1=CC=C(C=C1)CBr I194820 [0,2,0,0,0,0|1,0,0]=3 2002 B11R1.3 CC(C)C1=CC=C(C=C1)CCl C191960 [0,2,0,0,0,0|1,0,0]=3 2003 B11R1.3 CC(C)C1=CC=C(C=C1)CN I184550 [0,2,0,0,0,0|1,0,0]=3 2004 B11R1.3 CC(C)C1=CC=C(C=C1)CO I107533 [0,2,0,0,0,0|1,0,0]=3 2005 B11R1.3 CC(C)C1=CC=C(C=C1)NN L102556 [0,2,0,0,0,0|2,0,0]=4 2006 B11R1.3 CC(C)C1=CC=C(C=C1)OC I157470 [0,2,0,0,0,0|1,0,0]=3 2007 B11R1.3 CC(C1=CC=C(C=C1)OC)N M100571 [0,2,0,0,0,0|1,0,0]=3 2008 B11R1.3 CC(C1=CC=C(C=C1)OC)N M106421 [0,2,0,0,0,0|1,0,0]=3 2009 B11R1.3 CC(C1=CC=C(C=C1)OC)N M185667 [0,2,0,0,0,0|1,0,0]=3 2010 B11R1.3 CC(C1=CC=C(C=C1)OC)O M169629 [0,2,0,0,0,0|1,0,0]=3 2011 B11R1.3 CCC1=CC=C(C=C1)C(=O)C E156360 [0,2,0,0,0,0|1,0,0]=3 2012 B11R1.3 CCC1=CC=C(C=C1)C(=O)Cl E103224 [0,2,0,0,0,0|1,0,1]=4 2013 B11R1.3 CCC1=CC=C(C=C1)C(=O)O E156333 [0,2,0,0,0,0|1,0,1]=4 2014 B11R1.3 CCC1=CC=C(C=C1)C(C)C E404444 [0,2,0,0,0,0|1,0,0]=3 2015 B11R1.3 CCC1=CC=C(C=C1)[N+](=O)[O-] E137916 [0,2,0,0,0,0|2,0,0]=4 2016 B11R1.3 CCC1=NC=C(C=C1)[N+](=O)[O-] E588697 [0,2,0,0,0,0|2,0,0]=4 2017 B11R1.3 CN(C)C1=CC=C(C=C1)CN D136160 [0,2,0,0,0,0|2,0,0]=4 2018 B11R1.3 CN(C)C1=CC=C(C=C1)CN D182429 [0,2,0,0,0,0|2,0,0]=4 2019 B11R1.3 CN(C)C1=CC=C(C=C1)CO D155714 [0,2,0,0,0,0|2,0,0]=4 2020 B11R1.3 CN(C)C1=CC=C(C=C1)CO D489122 [0,2,0,0,0,0|2,0,0]=4 2021 B11R1.3 CN(C)C1=CC=C(C=C1)OC M194673 [0,2,0,0,0,0|2,0,0]=4 2022 B11R1.3 COC1=CN=C(C=C1)C(=N)N M586506 [0,2,0,0,0,0|1,0,1]=4 2023 B11R1.3 COC1=NC=C(C=C1)C(=O)N J413630 [0,2,0,0,0,0|1,0,1]=4 2024 B11R1.3 COC1=NC=C(C=C1)C(=O)O M185906 [0,2,0,0,0,0|1,0,1]=4 2025 B11R1.3 COC1=NC=C(C=C1)[N+](=O)[O-] M158827 [0,2,0,0,0,0|2,0,0]=4 2026 B11R1.279 CC1=C(C=CC(=C1)CCl)OC C194161 [0,2,0,0,0,0|2,0,0]=4 2027 B11R1.279 CC1=C(C=CC(=C1)OC)OC D155374 [0,2,0,0,0,0|2,0,0]=4 2028 B11R1.279 COC1=C(C=C(C=C1)CCl)F F404466 [0,2,0,0,0,0|2,0,0]=4 2029 B11R1.279 COC1=C(C=C(C=C1)CN)Cl C405721 [0,2,0,0,0,0|2,0,0]=4 2030 B11R1.279 COC1=C(C=C(C=C1)CN)Cl W133337 [0,2,0,0,0,0|2,0,0]=4 2031 B11R1.279 COC1=C(C=C(C=C1)CN)O H170289 [0,2,0,0,0,0|2,0,0]=4 2032 B11R1.279 COC1=C(C=C(C=C1)CO)Cl C167323 [0,2,0,0,0,0|2,0,0]=4 2033 B11R1.279 COC1=C(C=C(C=C1)CO)I I170835 [0,2,0,0,0,0|2,0,0]=4 2034 B11R1.279 COC1=C(C=C(C=C1)CO)N A586429 [0,2,0,0,0,0|2,0,0]=4 2035 B11R1.279 COC1=C(C=C(C=C1)CO)O I157468 [0,2,0,0,0,0|2,0,0]=4 2036 B11R1.279 COC1=CC(=C(C=C1)OC)Br B101643 [0,2,0,0,0,0|2,0,0]=4 2037 B11R1.279 COC1=CC(=C(C=C1)OC)Cl C132830 [0,2,0,0,0,0|2,0,0]=4 2038 B11R1.279 COC1=CC(=C(C=C1)OC)F D123994 [0,2,0,0,0,0|2,0,0]=4 2039 B11R1.279 COC1=CC(=C(C=C1)OC)N D111647 [0,2,0,0,0,0|2,0,0]=4 2040 B11R1.279 COC1=CC(=C(C=C1)OC)O D191676 [0,2,0,0,0,0|2,0,0]=4 2041 B11R1.279 COC1=CC(=C(C=C1)OC)S D101795 [0,2,0,0,0,0|2,0,0]=4 2042 B11R1.19 C1=CC(=NC=C1C(F)(F)F)Br B124320 [0,2,0,0,0,0|2,0,0]=4 2043 B11R1.19 C1=CC(=NC=C1C(F)(F)F)Cl C117654 [0,2,0,0,0,0|2,0,0]=4 2044 B11R1.19 C1=CC(=NC=C1C(F)(F)F)F F119661 [0,2,0,0,0,0|2,0,0]=4 2045 B11R1.19 C1=CC(=NC=C1C(F)(F)F)I I124767 [0,2,0,0,0,0|2,0,0]=4 2046 B11R1.19 C1=CC(=NC=C1C(F)(F)F)N A113928 [0,2,0,0,0,0|2,0,0]=4 2047 B11R1.19 CC(C)(C)C1=CC=C(C=C1)Br B110129 [0,2,0,0,0,0|2,0,0]=4 2048 B11R1.19 CC(C)(C)C1=CC=C(C=C1)Cl T136308 [0,2,0,0,0,0|2,0,0]=4 2049 B11R1.19 CC(C)(C)C1=CC=C(C=C1)I B100840 [0,2,0,0,0,0|2,0,0]=4 2050 B11R1.19 CC(C)(C)C1=CC=C(C=C1)N T139258 [0,2,0,0,0,0|2,0,0]=4 2051 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O B110664 [0,2,0,0,0,0|2,0,0]=4 2052 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O B110665 [0,2,0,0,0,0|2,0,0]=4 2053 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O B110666 [0,2,0,0,0,0|2,0,0]=4 2054 B11R1.19 CC(C)(C)C1=CC=C(C=C1)S T294572 [0,2,0,0,0,0|2,0,0]=4 2055 B11R1.19 CC(C)(C1=CC=C(C=C1)Br)O B182676 [0,2,0,0,0,0|2,0,0]=4 2056 B11R1.19 CC(C)(C1=CC=C(C=C1)Cl)O C302695 [0,2,0,0,0,0|2,0,0]=4 2057 B11R1.19 CC(C)(C1=CC=C(C=C1)F)O F156597 [0,2,0,0,0,0|2,0,0]=4 2058 B11R1.19 CC(C1=CC=C(C=C1)Br)(F)F B165334 [0,2,0,0,0,0|2,0,0]=4 2059 B11R1.19 CC1=CC=C(C=C1)C(C)(C)C T115327 [0,2,0,0,0,0|1,0,0]=3 2060 B11R1.19 CC1=CC=C(C=C1)C(F)(F)F M120691 [0,2,0,0,0,0|2,0,0]=4 2061 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)C M158446 [0,2,0,0,0,0|2,0,0]=4 2062 B11R1.19 CS(=O)(=O)C1=CN=C(C=C1)Br B169725 [0,2,0,0,0,0|2,0,0]=4 2063 B11R1.21 CC(C)C1=CC(=C(C=C1)N)Br B151827 [0,2,0,0,0,0|2,0,0]=4 2064 B11R1.21 CC(C1=CC(=C(C=C1)F)F)O D183665 [0,2,0,0,0,0|2,0,0]=4 2065 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)Br B151853 [0,2,0,0,0,0|1,0,1]=4 2066 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)C D106331 [0,2,0,0,0,0|1,0,1]=4 2067 B11R1.21 CC1=C(C=C(C=C1)C(=O)C)F F353287 [0,2,0,0,0,0|1,0,1]=4 2068 B11R1.21 CC1=C(C=C(C=C1)C(C)C)N M158615 [0,2,0,0,0,0|1,0,0]=3 2069 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O C107162 [0,2,0,0,0,0|1,0,0]=3 2070 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O C424298 [0,2,0,0,0,0|1,0,0]=3 2071 B11R1.21 CC1=C(C=C(C=N1)[N+](=O)[O-])Br B175303 [0,2,0,0,0,0|2,0,0]=4 2072 B11R1.166 CC(=O)C1=C(N=C(C=C1)Cl)Cl D193315 [0,2,0,0,0,0|1,0,1]=4 2073 B11R1.166 CC(C)C1=C(C=C(C=C1)O)O I588310 [0,2,0,0,0,0|2,0,0]=4 2074 B11R1.166 CC(C1=C(C=C(C=C1)Cl)Cl)N D154339 [0,2,0,0,0,0|2,0,0]=4 2075 B11R1.166 CC(C1=C(C=C(C=C1)Cl)Cl)N R587009 [0,2,0,0,0,0|2,0,0]=4 2076 B11R1.166 CC(C1=C(C=C(C=C1)Cl)Cl)O D155730 [0,2,0,0,0,0|2,0,0]=4 2077 B11R1.166 CC1=C(C=CC(=C1)O)C(C)C I157507 [0,2,0,0,0,0|2,0,0]=4 2078 B11R1.166 CC1=CC(=C(C=C1)C(=O)C)C D108574 [0,2,0,0,0,0|1,0,1]=4 2079 B11R1.166 CC1=CC(=C(C=C1)C(=O)C)O H156900 [0,2,0,0,0,0|1,0,1]=4 2080 B11R1.166 CC1=CC(=C(C=C1)C(C)C)O T104425 [0,2,0,0,0,0|1,0,0]=3 2081 B11R1.166 CC1=CC(=C(C=C1)C(C)C)O T104426 [0,2,0,0,0,0|1,0,0]=3 2082 B11R1.166 CC1=CC(=C(C=C1)C(C)C)O T118449 [0,2,0,0,0,0|1,0,0]=3 2083 B11R1.166 CC1=CC(=C(C=C1)C(C)C)O T426745 [0,2,0,0,0,0|1,0,0]=3 2084 B11R1.166 CC1=CN=C(C(=N1)C)C(=O)C A135006 [0,2,0,0,0,0|1,0,1]=4 2085 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)C D185385 [0,2,0,0,0,0|1,0,1]=4 2086 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)Cl C122461 [0,2,0,0,0,0|1,0,1]=4 2087 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)N A177594 [0,2,0,0,0,0|1,0,1]=4 2088 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])C D131902 [0,2,0,0,0,0|2,0,0]=4 2089 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])Cl C133496 [0,2,0,0,0,0|2,0,0]=4 2090 B11R1.166 CC1=NC(=C(C=C1)[N+](=O)[O-])N A102958 [0,2,0,0,0,0|2,0,0]=4 2091 B11R1.37 CC1=CC(=C(C=C1)OC)C#N M471258 [0,2,0,0,0,0|2,0,0]=4 2092 B11R1.37 CC1=CC(=C(C=C1)OC)OC B135636 [0,2,0,0,0,0|2,0,0]=4 2093 B11R1.37 CC1=NC(=C(C=C1)OC)OC D187204 [0,2,0,0,0,0|1,0,0]=3 2094 B11R1.37 CCC1=NC=C(N=C1CC)C D103575 [0,2,0,0,0,0|1,0,0]=3 2095 B11R1.37 COC1=C(N=C(C=C1)Cl)OC C165861 [0,2,0,0,0,0|2,0,0]=4 2096 B11R1.37 COC1=C(N=C(C=C1)I)OC I183671 [0,2,0,0,0,0|2,0,0]=4 2097 B11R1.277 CC1=C(N=C(C(=N1)C)CO)C T194937 [0,2,0,0,0,0|2,0,0]=4 2098 B11R1.277 CC1=CC(=C(C=C1Br)OC)N B590449 [0,2,0,0,0,0|2,0,0]=4 2099 B11R1.278 CC1=C(C(=C(C=C1)CBr)F)F D300662 [0,2,0,0,0,0|2,0,0]=4 2100 B11R1.278 CC1=C(C(=NC=C1CO)C)O D136095 [0,2,0,0,0,0|1,0,0]=3 2101 B11R1.464 CC1=CC(=C(C(=C1)C)CCl)C S167616 [0,2,0,0,0,0|2,0,0]=4 2102 B11R1.464 CC1=CC(=C(C(=C1)C)CO)C T161538 [0,2,0,0,0,0|2,0,0]=4 2103 B11R1.464 CC1=CC(=C(C(=C1)C)OC)C M589015 [0,2,0,0,0,0|2,0,0]=4 2104 B11R1.464 CC1=CC(=C(C(=O)N1)CN)C A172302 [0,2,0,0,0,0|1,0,1]=4 2105 B11R1.464 CC1=CC(=NC(=C1C#N)Cl)C W131740 [0,2,0,0,0,0|1,0,1]=4 2106 B11R1.280 CC1=C(C=C(C=C1)OC)OC D170028 [0,2,0,0,0,0|2,0,0]=4 2107 B11R1.280 CCC1=CC(=C(C=C1)O)C=O E344459 [0,2,0,0,0,0|2,0,0]=4 2108 B11R1.280 CCC1=CC(=C(C=C1)O)OC E111257 [0,2,0,0,0,0|2,0,0]=4 2109 B9R2.50 C1CC2=CC=CC=C21 B107638 [1,0,0,1,0,0|1,0,0]=3 2110 B11R2.34 C1C(O1)C2=CC=C(C=C2)F I131966 [0,1,0,1,0,0|2,0,0]=4 2111 B11R2.34 C1CC1C2=CC=C(C=C2)Br B189729 [0,1,0,1,0,0|2,0,0]=4 2112 B11R2.34 C1CC1C2=CN=C(C=C2)Br B189780 [0,1,0,1,0,0|1,0,0]=3 2113 B11R2.34 C1CC1C2=CN=C(C=C2)Cl C586231 [0,1,0,1,0,0|1,0,0]=3 2114 B11R2.36 C1C2=C(CN1)C=C(C=C2)Br B178228 [0,1,0,1,0,0|2,0,0]=4 2115 B11R2.36 C1C2=C(CN1)C=C(C=C2)Br B480318 [0,1,0,1,0,0|2,0,0]=4 2116 B11R2.36 C1C2=C(CO1)C=C(C=C2)N D489691 [0,1,0,1,0,0|2,0,0]=4 2117 B11R2.36 C1CC2=C(C1)C=C(C=C2)N A151769 [0,1,0,1,0,0|2,0,0]=4 2118 B11R2.36 C1CC2=C(C1)C=C(C=C2)O H157229 [0,1,0,1,0,0|2,0,0]=4 2119 B11R2.36 C1CC2=C(C1)N=C(C=C2)Cl C586503 [0,1,0,1,0,0|1,0,0]=3 2120 B11R2.36 C1CNC2=C1C=C(C=C2)Br B124815 [0,1,0,1,0,0|2,0,0]=4 2121 B11R2.36 C1CNC2=C1C=C(C=C2)F F124808 [0,1,0,1,0,0|2,0,0]=4 2122 B11R2.36 C1CNC2=C1C=CC(=C2)Cl D303889 [0,1,0,1,0,0|2,0,0]=4 2123 B11R2.36 C1CNC2=C1C=CC(=C2)F F303147 [0,1,0,1,0,0|2,0,0]=4 2124 B11R2.36 C1COC2=C1C=C(C=C2)Br B152996 [0,1,0,1,0,0|2,0,0]=4 2125 B11R2.36 CC1=NC2=C(C=C1)C=CN2 M195188 [0,1,0,1,0,0|0,0,2]=4 2126 B11R2.190 C=CC1=CC2=C(CC2)C=C1 V196176 [0,1,0,1,0,0|1,0,1]=4 2127 B7R1.1 C1=C(C=NN1)CO H175899 [1,0,0,0,1,0|2,0,0]=4 2128 B7R1.1 C1=C(N=CS1)CCl C137365 [1,0,0,0,1,0|2,0,0]=4 2129 B7R1.1 C1=C(NC=N1)CO H113059 [1,0,0,0,1,0|2,0,0]=4 2130 B7R1.1 C1=C(NC=N1)CO I137052 [1,0,0,0,1,0|2,0,0]=4 2131 B7R1.1 C1=C(NN=C1)CN P115816 [1,0,0,0,1,0|2,0,0]=4 2132 B7R1.1 C1=C(SC=N1)CCl C586959 [1,0,0,0,1,0|2,0,0]=4 2133 B7R1.1 C1=C(SC=N1)CN T302352 [1,0,0,0,1,0|2,0,0]=4 2134 B7R1.1 C1=C(SC=N1)CO T119309 [1,0,0,0,1,0|2,0,0]=4 2135 B7R1.1 C1=CN(N=C1)CO H189712 [1,0,0,0,1,0|2,0,0]=4 2136 B7R1.1 C1=CN=C(N1)CN A168767 [1,0,0,0,1,0|2,0,0]=4 2137 B7R1.1 C1=COC(=C1)CN F111778 [1,0,0,0,1,0|2,0,0]=4 2138 B7R1.1 C1=COC(=C1)CN F493732 [1,0,0,0,1,0|2,0,0]=4 2139 B7R1.1 C1=COC(=C1)CO F110603 [1,0,0,0,1,0|2,0,0]=4 2140 B7R1.1 C1=COC(=C1)CO F110604 [1,0,0,0,1,0|2,0,0]=4 2141 B7R1.1 C1=COC(=C1)CS F102900 [1,0,0,0,1,0|2,0,0]=4 2142 B7R1.1 C1=COC=C1CO F122642 [1,0,0,0,1,0|2,0,0]=4 2143 B7R1.1 C1=CSC(=C1)CN T107120 [1,0,0,0,1,0|2,0,0]=4 2144 B7R1.1 C1=CSC(=C1)CO T162809 [1,0,0,0,1,0|2,0,0]=4 2145 B7R1.1 C1=CSC(=C1)CS T134394 [1,0,0,0,1,0|2,0,0]=4 2146 B7R1.1 C1=CSC(=N1)CO H157271 [1,0,0,0,1,0|2,0,0]=4 2147 B7R1.1 C1=CSC=C1CBr B192902 [1,0,0,0,1,0|2,0,0]=4 2148 B7R1.1 C1=CSC=C1CN T123094 [1,0,0,0,1,0|2,0,0]=4 2149 B7R1.1 C1=CSC=C1CN T189819 [1,0,0,0,1,0|2,0,0]=4 2150 B7R1.1 C1=CSC=C1CO T115329 [1,0,0,0,1,0|2,0,0]=4 2151 B7R1.1 CCC1=CC=CN1 E156214 [1,0,0,0,1,0|0,0,1]=3 2152 B7R1.1 CCC1=CC=CO1 E102538 [1,0,0,0,1,0|1,0,0]=3 2153 B7R1.1 CCC1=CC=CO1 E141264 [1,0,0,0,1,0|1,0,0]=3 2154 B7R1.1 CCC1=CC=CS1 E101589 [1,0,0,0,1,0|1,0,0]=3 2155 B7R1.1 CCC1=CC=C[CH-]1 D166828 [1,0,0,0,1,0|0,0,1]=3 2156 B7R1.1 CCC1=CN=CN1 E156331 [1,0,0,0,1,0|1,0,0]=3 2157 B7R1.1 CCC1=CNN=C1 E167848 [1,0,0,0,1,0|1,0,0]=3 2158 B7R1.1 CCC1=CSC=C1 E156073 [1,0,0,0,1,0|1,0,0]=3 2159 B7R1.1 CCC1=NC=CN1 E137989 [1,0,0,0,1,0|1,0,0]=3 2160 B7R1.1 CCC1=[C-]CC=C1 B294778 [1,0,0,0,1,0|0,0,2]=4 2161 B7R1.1 CCN1C=CC=C1 E156213 [1,0,0,0,1,0|1,0,0]=3 2162 B7R1.1 CCN1C=CC=N1 E156393 [1,0,0,0,1,0|1,0,0]=3 2163 B7R1.1 CCN1C=CN=C1 E139207 [1,0,0,0,1,0|1,0,0]=3 2164 B7R1.1 CCN1C=NC=N1 E587605 [1,0,0,0,1,0|2,0,0]=4 2165 B7R1.1 COC1=CC=CO1 M158540 [1,0,0,0,1,0|2,0,0]=4 2166 B7R1.1 COC1=CC=CS1 M103170 [1,0,0,0,1,0|2,0,0]=4 2167 B7R1.1 COC1=CC=NN1 M588136 [1,0,0,0,1,0|2,0,0]=4 2168 B7R1.1 COC1=CSC=C1 M103169 [1,0,0,0,1,0|2,0,0]=4 2169 B7R1.1 COC1=NC=CS1 M158486 [1,0,0,0,1,0|2,0,0]=4 2170 B7R1.1 CSC1=CC=CS1 M123048 [1,0,0,0,1,0|2,0,0]=4 2171 B7R1.1 CSC1=NC=CS1 M158485 [1,0,0,0,1,0|2,0,0]=4 2172 B7R1.2 CC1=CC(=CN1)C D123132 [1,0,0,0,1,0|0,0,1]=3 2173 B7R1.2 CC1=CC(=CS1)Br B111413 [1,0,0,0,1,0|2,0,0]=4 2174 B7R1.2 CC1=CC(=CS1)C D304246 [1,0,0,0,1,0|1,0,0]=3 2175 B7R1.2 CC1=CC(=NN1)C D139167 [1,0,0,0,1,0|1,0,0]=3 2176 B7R1.2 CC1=CC(=NN1)N A151511 [1,0,0,0,1,0|2,0,0]=4 2177 B7R1.2 CC1=CC(=NO1)C D122898 [1,0,0,0,1,0|1,0,0]=3 2178 B7R1.2 CC1=CC(=NO1)N A151654 [1,0,0,0,1,0|2,0,0]=4 2179 B7R1.2 CC1=CC=C(N1)C D113404 [1,0,0,0,1,0|0,0,1]=3 2180 B7R1.2 CC1=CC=C(O1)C D113405 [1,0,0,0,1,0|1,0,0]=3 2181 B7R1.2 CC1=CC=C(S1)Br B101591 [1,0,0,0,1,0|2,0,0]=4 2182 B7R1.2 CC1=CC=C(S1)C D155809 [1,0,0,0,1,0|1,0,0]=3 2183 B7R1.2 CC1=CC=C(S1)Cl C153324 [1,0,0,0,1,0|2,0,0]=4 2184 B7R1.2 CC1=CC=C(S1)I I101863 [1,0,0,0,1,0|2,0,0]=4 2185 B7R1.2 CC1=CN(N=N1)C D589618 [1,0,0,0,1,0|2,0,0]=4 2186 B7R1.2 CC1=CN=C(N1)C D139451 [1,0,0,0,1,0|1,0,0]=3 2187 B7R1.2 CC1=CN=C(S1)Br B152756 [1,0,0,0,1,0|2,0,0]=4 2188 B7R1.2 CC1=CN=C(S1)N A102155 [1,0,0,0,1,0|2,0,0]=4 2189 B7R1.2 CC1=COC(=N1)C D139217 [1,0,0,0,1,0|1,0,0]=3 2190 B7R1.2 CC1=COC(=N1)N M588855 [1,0,0,0,1,0|2,0,0]=4 2191 B7R1.2 CC1=CSC(=C1)Br B153082 [1,0,0,0,1,0|2,0,0]=4 2192 B7R1.2 CC1=CSC(=N1)Br B123638 [1,0,0,0,1,0|2,0,0]=4 2193 B7R1.2 CC1=CSC(=N1)C D119299 [1,0,0,0,1,0|1,0,0]=3 2194 B7R1.2 CC1=CSC(=N1)N A151202 [1,0,0,0,1,0|2,0,0]=4 2195 B7R1.2 CC1=CSC(=N1)N A167666 [1,0,0,0,1,0|2,0,0]=4 2196 B7R1.2 CC1=NC(=CS1)Br B176047 [1,0,0,0,1,0|2,0,0]=4 2197 B7R1.2 CC1=NC(=NN1)C D134424 [1,0,0,0,1,0|2,0,0]=4 2198 B7R1.2 CC1=NC=C(N1)Br B181890 [1,0,0,0,1,0|2,0,0]=4 2199 B7R1.2 CC1=NC=C(S1)Br B344998 [1,0,0,0,1,0|2,0,0]=4 2200 B7R1.2 CC1=NN(C=C1)C D154769 [1,0,0,0,1,0|1,0,0]=3 2201 B7R1.2 CC1=NN=C(S1)C D140446 [1,0,0,0,1,0|2,0,0]=4 2202 B7R1.2 CC1=NOC(=C1)N A151656 [1,0,0,0,1,0|2,0,0]=4 2203 B7R1.2 CC1=NSC(=C1)N A119078 [1,0,0,0,1,0|2,0,0]=4 2204 B7R1.2 CN1C=C(C=N1)Br B122572 [1,0,0,0,1,0|2,0,0]=4 2205 B7R1.2 CN1C=C(C=N1)I I115817 [1,0,0,0,1,0|2,0,0]=4 2206 B7R1.2 CN1C=C(C=N1)N M173173 [1,0,0,0,1,0|2,0,0]=4 2207 B7R1.2 CN1C=C(C=N1)O M590179 [1,0,0,0,1,0|2,0,0]=4 2208 B7R1.2 CN1C=C(N=C1)Br B169079 [1,0,0,0,1,0|2,0,0]=4 2209 B7R1.2 CN1C=CC(=N1)Br B122406 [1,0,0,0,1,0|2,0,0]=4 2210 B7R1.2 CN1C=CC(=N1)I I195872 [1,0,0,0,1,0|2,0,0]=4 2211 B7R1.2 CN1C=CC(=N1)N A103123 [1,0,0,0,1,0|2,0,0]=4 2212 B7R1.2 CN1C=C[N+](=C1)C D120486 [1,0,0,0,1,0|2,0,0]=4 2213 B7R1.2 CN1C=C[N+](=C1)C D121202 [1,0,0,0,1,0|2,0,0]=4 2214 B7R1.2 CN1C=C[N+](=C1)C D154827 [1,0,0,0,1,0|2,0,0]=4 2215 B7R1.2 CN1C=C[N+](=C1)C D281641 [1,0,0,0,1,0|2,0,0]=4 2216 B7R1.2 CN1C=C[N+](=C1)C D303174 [1,0,0,0,1,0|2,0,0]=4 2217 B7R1.2 CN1C=C[N+](=C1)C D305047 [1,0,0,0,1,0|2,0,0]=4 2218 B7R1.2 CN1C=C[N+](=C1)C H302630 [1,0,0,0,1,0|2,0,0]=4 2219 B7R1.2 CN1C=[N+](C=N1)C D467602 [1,0,0,0,1,0|2,0,0]=4