0 B10R1.25 C=Cc1ccc(cc1F)F AS03796 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.25 COc1c(cc(cn1)F)O AS04881 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.25 COc1ccc(cc1Br)Br AS03501 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.25 COc1ccc(cc1Br)Cl AS03118 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.25 COc1ccc(cc1Br)F AS01624 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.25 COc1ccc(cc1Br)I AS03354 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.25 COc1ccc(cc1Br)N AS03267 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.25 COc1ccc(cc1Br)N AS03385 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.25 COc1ccc(cc1Cl)Br AS03121 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.25 COc1ccc(cc1Cl)Cl AS02854 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.25 COc1ccc(cc1Cl)F AS02722 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.25 COc1ccc(cc1Cl)I AS03054 [0,0,0,0,0,0|4,0,0]=4 12 B10R1.25 COc1ccc(cc1Cl)N AS02789 [0,0,0,0,0,0|4,0,0]=4 13 B10R1.25 COc1ccc(cc1F)Br AS03274 [0,0,0,0,0,0|4,0,0]=4 14 B10R1.25 COc1ccc(cc1F)Cl AS02726 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.25 COc1ccc(cc1F)F AS02507 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.25 COc1ccc(cc1F)N AS03264 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.25 COc1ccc(cc1F)N AS04085 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.25 COc1ccc(cc1F)O AS04432 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.25 COc1ccc(cc1I)Br AS03356 [0,0,0,0,0,0|4,0,0]=4 20 B10R1.25 COc1ccc(cc1I)Cl AS03057 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.25 COc1ccc(cc1I)I AS02516 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.25 COc1ccc(cc1I)N AS02234 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.25 COc1ccc(cc1I)N AS02235 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.25 COc1ccc(cc1N)F AS04087 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.25 COc1ccc(cc1N)I AS05428 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.25 COc1ccc(cc1N)N AS04137 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.25 COc1ccc(cc1N)N AS04209 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.25 COc1ccc(cc1O)F AS00192 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.25 CSc1ccc(cc1Br)Cl AS04512 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.25 CSc1ccc(cc1F)F AS04305 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.25 Cc1cc(ccc1C#N)Br AS01631 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.25 Cc1cc(ccc1C#N)F AS03745 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.25 Cc1cc(ccc1C#N)O AS06275 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.25 Cc1cc(ccc1C=O)Br AS03007 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.25 Cc1cc(ccc1C=O)Cl AS06678 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.25 Cc1cc(ccc1C=O)F AS01471 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.25 Cc1cc(ccc1C=O)O AS05602 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.25 Cc1cc(ccc1CN)Br AS06015 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.25 Cc1cc(ccc1CN)F AS00849 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.25 Cc1cc(ccc1CN)O AS06507 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.25 Cc1cc(ccc1CO)Br AS05952 [0,0,0,0,0,0|2,0,2]=4 42 B10R1.25 Cc1cc(ccc1CO)F AS00602 [0,0,0,0,0,0|2,0,2]=4 43 B10R1.25 Cc1cc(ccc1OC)Br AS03407 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.25 Cc1cc(ccc1OC)Cl AS02809 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.25 Cc1cc(ccc1OC)F AS04149 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.25 Cc1cc(ccc1OC)I AS02251 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.25 Cc1cc(ccc1OC)N AS00453 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.25 Cc1ccc(c(c1)Br)C=O AS06927 [0,0,0,0,0,0|1,0,0]=1 49 B10R1.25 Cc1ccc(c(c1)Br)OC AS03405 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.25 Cc1ccc(c(c1)C)CCl AS00710 [0,0,0,0,0,0|2,0,1]=3 51 B10R1.25 Cc1ccc(c(c1)C)NN AS03280 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.25 Cc1ccc(c(c1)C)OC AS02541 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.25 Cc1ccc(c(c1)Cl)C#N AS01650 [0,0,0,0,0,0|2,0,1]=3 54 B10R1.25 Cc1ccc(c(c1)Cl)C=O AS06929 [0,0,0,0,0,0|1,0,0]=1 55 B10R1.25 Cc1ccc(c(c1)Cl)NN AS01996 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.25 Cc1ccc(c(c1)Cl)OC AS02799 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.25 Cc1ccc(c(c1)F)C#N AS01680 [0,0,0,0,0,0|2,0,1]=3 58 B10R1.25 Cc1ccc(c(c1)F)C=O AS01466 [0,0,0,0,0,0|1,0,0]=1 59 B10R1.25 Cc1ccc(c(c1)I)OC AS02092 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.25 Cc1ccc(c(c1)N)C#N AS01609 [0,0,0,0,0,0|2,0,1]=3 61 B10R1.25 c1cc(c(cc1Br)Br)C=O AS03856 [0,0,0,0,0,0|2,0,0]=2 62 B10R1.25 c1cc(c(cc1Br)Br)CO AS03971 [0,0,0,0,0,0|2,0,2]=4 63 B10R1.25 c1cc(c(cc1Br)Cl)C#N AS02396 [0,0,0,0,0,0|3,0,1]=4 64 B10R1.25 c1cc(c(cc1Br)Cl)C=O AS02873 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.25 c1cc(c(cc1Br)F)C=O AS03801 [0,0,0,0,0,0|2,0,0]=2 66 B10R1.25 c1cc(c(cc1Br)F)CBr AS00654 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.25 c1cc(c(cc1Br)F)CN AS01929 [0,0,0,0,0,0|3,0,1]=4 68 B10R1.25 c1cc(c(cc1Br)F)CN AS03304 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.25 c1cc(c(cc1Br)F)CO AS03958 [0,0,0,0,0,0|2,0,2]=4 70 B10R1.25 c1cc(c(cc1Br)F)NN AS01992 [0,0,0,0,0,0|4,0,0]=4 71 B10R1.25 c1cc(c(cc1Br)N)C=O AS06833 [0,0,0,0,0,0|2,0,0]=2 72 B10R1.25 c1cc(c(cc1Br)N)CO AS01411 [0,0,0,0,0,0|2,0,2]=4 73 B10R1.25 c1cc(c(cc1Br)O)C#N AS03703 [0,0,0,0,0,0|2,0,1]=3 74 B10R1.25 c1cc(c(cc1Br)O)C=O AS04630 [0,0,0,0,0,0|1,0,0]=1 75 B10R1.25 c1cc(c(cc1Br)O)CO AS05949 [0,0,0,0,0,0|1,0,2]=3 76 B10R1.25 c1cc(c(cc1Cl)Br)C=O AS03789 [0,0,0,0,0,0|2,0,0]=2 77 B10R1.25 c1cc(c(cc1Cl)Br)CBr AS06264 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.25 c1cc(c(cc1Cl)Cl)C#N AS02650 [0,0,0,0,0,0|3,0,1]=4 79 B10R1.25 c1cc(c(cc1Cl)Cl)CBr AS00003 [0,0,0,0,0,0|3,0,1]=4 80 B10R1.25 c1cc(c(cc1Cl)Cl)CCl AS02062 [0,0,0,0,0,0|3,0,1]=4 81 B10R1.25 c1cc(c(cc1Cl)Cl)CO AS00605 [0,0,0,0,0,0|2,0,2]=4 82 B10R1.25 c1cc(c(cc1Cl)F)C#N AS03716 [0,0,0,0,0,0|3,0,1]=4 83 B10R1.25 c1cc(c(cc1Cl)F)C=O AS03836 [0,0,0,0,0,0|2,0,0]=2 84 B10R1.25 c1cc(c(cc1Cl)F)CCl AS00670 [0,0,0,0,0,0|3,0,1]=4 85 B10R1.25 c1cc(c(cc1Cl)F)CN AS02308 [0,0,0,0,0,0|3,0,1]=4 86 B10R1.25 c1cc(c(cc1Cl)F)CN AS02739 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.25 c1cc(c(cc1Cl)F)CO AS00595 [0,0,0,0,0,0|2,0,2]=4 88 B10R1.25 c1cc(c(cc1Cl)F)NN AS02975 [0,0,0,0,0,0|4,0,0]=4 89 B10R1.25 c1cc(c(cc1Cl)O)C#N AS05818 [0,0,0,0,0,0|2,0,1]=3 90 B10R1.25 c1cc(c(cc1Cl)O)C=O AS05554 [0,0,0,0,0,0|1,0,0]=1 91 B10R1.25 c1cc(c(cc1F)Br)C#N AS02666 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.25 c1cc(c(cc1F)Br)C=O AS03017 [0,0,0,0,0,0|2,0,0]=2 93 B10R1.25 c1cc(c(cc1F)Br)CBr AS00655 [0,0,0,0,0,0|3,0,1]=4 94 B10R1.25 c1cc(c(cc1F)Br)CN AS03302 [0,0,0,0,0,0|3,0,1]=4 95 B10R1.25 c1cc(c(cc1F)Br)CO AS03955 [0,0,0,0,0,0|2,0,2]=4 96 B10R1.25 c1cc(c(cc1F)Cl)C#N AS01639 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.25 c1cc(c(cc1F)Cl)C#N AS02662 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.25 c1cc(c(cc1F)Cl)C=O AS03023 [0,0,0,0,0,0|2,0,0]=2 99 B10R1.25 c1cc(c(cc1F)Cl)CBr AS00679 [0,0,0,0,0,0|3,0,1]=4 100 B10R1.25 c1cc(c(cc1F)Cl)CCl AS00671 [0,0,0,0,0,0|3,0,1]=4 101 B10R1.25 c1cc(c(cc1F)Cl)CN AS02307 [0,0,0,0,0,0|3,0,1]=4 102 B10R1.25 c1cc(c(cc1F)Cl)CN AS02737 [0,0,0,0,0,0|3,0,1]=4 103 B10R1.25 c1cc(c(cc1F)Cl)CO AS03966 [0,0,0,0,0,0|2,0,2]=4 104 B10R1.25 c1cc(c(cc1F)Cl)NN AS01994 [0,0,0,0,0,0|4,0,0]=4 105 B10R1.25 c1cc(c(cc1F)F)C#N AS01658 [0,0,0,0,0,0|3,0,1]=4 106 B10R1.25 c1cc(c(cc1F)F)C=O AS01451 [0,0,0,0,0,0|2,0,0]=2 107 B10R1.25 c1cc(c(cc1F)F)CBr AS00700 [0,0,0,0,0,0|3,0,1]=4 108 B10R1.25 c1cc(c(cc1F)F)CCl AS00685 [0,0,0,0,0,0|3,0,1]=4 109 B10R1.25 c1cc(c(cc1F)F)CN AS01933 [0,0,0,0,0,0|3,0,1]=4 110 B10R1.25 c1cc(c(cc1F)F)CO AS00610 [0,0,0,0,0,0|2,0,2]=4 111 B10R1.25 c1cc(c(cc1F)F)NN AS02000 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.25 c1cc(c(cc1F)N)C#N AS01602 [0,0,0,0,0,0|3,0,1]=4 113 B10R1.25 c1cc(c(cc1F)N)C=O AS05525 [0,0,0,0,0,0|2,0,0]=2 114 B10R1.25 c1cc(c(cc1F)O)C=O AS03068 [0,0,0,0,0,0|1,0,0]=1 115 B10R1.25 c1cc(c(cc1I)F)C#N AS02671 [0,0,0,0,0,0|3,0,1]=4 116 B10R1.25 c1cc(c(cc1I)F)C=O AS03883 [0,0,0,0,0,0|2,0,0]=2 117 B10R1.25 c1cc(c(cc1N)Cl)C#N AS01598 [0,0,0,0,0,0|3,0,1]=4 118 B10R1.25 c1cc(c(cc1N)F)C#N AS01606 [0,0,0,0,0,0|3,0,1]=4 119 B10R1.25 c1cc(c(cc1N)O)C#N AS06282 [0,0,0,0,0,0|2,0,1]=3 120 B10R1.25 c1cc(c(cc1O)Br)C=O AS06475 [0,0,0,0,0,0|2,0,0]=2 121 B10R1.25 c1cc(c(cc1O)Cl)C#N AS05814 [0,0,0,0,0,0|3,0,1]=4 122 B10R1.25 c1cc(c(cc1O)Cl)C=O AS02997 [0,0,0,0,0,0|2,0,0]=2 123 B10R1.25 c1cc(c(cc1O)F)C#N AS03737 [0,0,0,0,0,0|3,0,1]=4 124 B10R1.25 c1cc(c(cc1O)F)C=O AS03069 [0,0,0,0,0,0|2,0,0]=2 125 B10R1.25 c1cc(c(cc1O)I)C=O AS06474 [0,0,0,0,0,0|2,0,0]=2 126 B10R1.25 c1cc(c(cc1O)O)C#N AS07229 [0,0,0,0,0,0|2,0,1]=3 127 B10R1.25 c1cc(c(cc1O)O)C=O AS02995 [0,0,0,0,0,0|1,0,0]=1 128 B9R1.1 C#Cc1ccc(cc1)F AS00454 [1,0,0,0,0,0|2,0,1]=4 129 B9R1.1 C#Cc1ccc(cc1)N AS04615 [1,0,0,0,0,0|2,0,1]=4 130 B9R1.1 C=Cc1ccc(cc1)Br AS03806 [1,0,0,0,0,0|2,0,0]=3 131 B9R1.1 C=Cc1ccc(cc1)F AS03795 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.1 CCc1ccc(cc1)Br AS03254 [1,0,0,0,0,0|2,0,1]=4 133 B9R1.1 CCc1ccc(cc1)F AS04424 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.1 CCc1ccc(cc1)I AS02159 [1,0,0,0,0,0|2,0,1]=4 135 B9R1.1 CNc1ccc(cc1)I AS05390 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.1 COc1ccc(cc1)Br AS02358 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.1 COc1ccc(cc1)Cl AS01802 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.1 COc1ccc(cc1)F AS02586 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.1 COc1ccc(cc1)I AS02208 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.1 COc1ccc(cc1)O AS04576 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 CSc1ccc(cc1)Br AS04293 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.1 CSc1ccc(cc1)Cl AS04289 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.1 CSc1ccc(cc1)F AS04286 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.1 CSc1ccc(cc1)N AS04283 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.1 Cc1ccc(cc1)C#N AS03761 [1,0,0,0,0,0|1,0,1]=3 146 B9R1.1 Cc1ccc(cc1)C=O AS02824 [1,0,0,0,0,0|0,0,0]=1 147 B9R1.1 Cc1ccc(cc1)CCl AS00637 [1,0,0,0,0,0|1,0,1]=3 148 B9R1.1 Cc1ccc(cc1)SC AS04302 [1,0,0,0,0,0|2,0,0]=3 149 B9R1.1 Cc1ccc(nc1)C#N AS04709 [1,0,0,0,0,0|2,0,1]=4 150 B9R1.1 c1cc(ccc1C#N)Br AS03698 [1,0,0,0,0,0|2,0,1]=4 151 B9R1.1 c1cc(ccc1C#N)Cl AS02369 [1,0,0,0,0,0|2,0,1]=4 152 B9R1.1 c1cc(ccc1C#N)F AS03736 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.1 c1cc(ccc1C#N)I AS03752 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.1 c1cc(ccc1C#N)N AS02646 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.1 c1cc(ccc1C#N)O AS02647 [1,0,0,0,0,0|2,0,1]=4 156 B9R1.1 c1cc(ccc1C=O)Br AS02893 [1,0,0,0,0,0|1,0,0]=2 157 B9R1.1 c1cc(ccc1C=O)Cl AS02986 [1,0,0,0,0,0|1,0,0]=2 158 B9R1.1 c1cc(ccc1C=O)F AS02846 [1,0,0,0,0,0|1,0,0]=2 159 B9R1.1 c1cc(ccc1C=O)F AS03001 [1,0,0,0,0,0|1,0,0]=2 160 B9R1.1 c1cc(ccc1C=O)I AS03916 [1,0,0,0,0,0|1,0,0]=2 161 B9R1.1 c1cc(ccc1C=O)N AS06990 [1,0,0,0,0,0|1,0,0]=2 162 B9R1.1 c1cc(ccc1C=O)O AS02994 [1,0,0,0,0,0|1,0,0]=2 163 B9R1.1 c1cc(ccc1CBr)Br AS02044 [1,0,0,0,0,0|2,0,1]=4 164 B9R1.1 c1cc(ccc1CBr)Cl AS02046 [1,0,0,0,0,0|2,0,1]=4 165 B9R1.1 c1cc(ccc1CBr)F AS00664 [1,0,0,0,0,0|2,0,1]=4 166 B9R1.1 c1cc(ccc1CBr)I AS00645 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.1 c1cc(ccc1CCl)Br AS00646 [1,0,0,0,0,0|2,0,1]=4 168 B9R1.1 c1cc(ccc1CCl)F AS00660 [1,0,0,0,0,0|2,0,1]=4 169 B9R1.1 c1cc(ccc1CCl)F AS02054 [1,0,0,0,0,0|2,0,1]=4 170 B9R1.1 c1cc(ccc1CN)Br AS02268 [1,0,0,0,0,0|2,0,1]=4 171 B9R1.1 c1cc(ccc1CN)Br AS03103 [1,0,0,0,0,0|2,0,1]=4 172 B9R1.1 c1cc(ccc1CN)Br AS06970 [1,0,0,0,0,0|2,0,1]=4 173 B9R1.1 c1cc(ccc1CN)Cl AS00379 [1,0,0,0,0,0|2,0,1]=4 174 B9R1.1 c1cc(ccc1CN)Cl AS02689 [1,0,0,0,0,0|2,0,1]=4 175 B9R1.1 c1cc(ccc1CN)F AS00834 [1,0,0,0,0,0|2,0,1]=4 176 B9R1.1 c1cc(ccc1CN)F AS01938 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.1 c1cc(ccc1CN)I AS02223 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.1 c1cc(ccc1CN)I AS02301 [1,0,0,0,0,0|2,0,1]=4 179 B9R1.1 c1cc(ccc1CO)Br AS03954 [1,0,0,0,0,0|1,0,2]=4 180 B9R1.1 c1cc(ccc1CO)Cl AS03965 [1,0,0,0,0,0|1,0,2]=4 181 B9R1.1 c1cc(ccc1CO)F AS03978 [1,0,0,0,0,0|1,0,2]=4 182 B9R1.1 c1cc(ccc1CO)I AS00604 [1,0,0,0,0,0|1,0,2]=4 183 B9R1.1 c1cc(ccc1CO)I AS03987 [1,0,0,0,0,0|1,0,2]=4 184 B9R1.1 c1cc(ccc1CO)N AS00548 [1,0,0,0,0,0|1,0,2]=4 185 B9R1.1 c1cc(ccc1CO)O AS00576 [1,0,0,0,0,0|1,0,2]=4 186 B9R1.1 c1cc(ccc1NN)Br AS02015 [1,0,0,0,0,0|3,0,0]=4 187 B9R1.1 c1cc(ccc1NN)Cl AS04469 [1,0,0,0,0,0|3,0,0]=4 188 B9R1.1 c1cc(ccc1NN)F AS02961 [1,0,0,0,0,0|3,0,0]=4 189 B9R1.1 c1cc(ccc1OS)I AS02948 [1,0,0,0,0,0|2,1,0]=4 190 B9R1.1 c1cc(ncc1C=O)Br AS06180 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.15 C=Cc1ccccc1Br AS03804 [1,0,0,0,0,0|2,0,0]=3 192 B9R1.15 C=Cc1ccccc1F AS03294 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.15 CCc1ccccc1Br AS03252 [1,0,0,0,0,0|2,0,1]=4 194 B9R1.15 CCc1ccccc1I AS02158 [1,0,0,0,0,0|2,0,1]=4 195 B9R1.15 CNc1ccccc1N AS04592 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.15 COc1ccccc1Br AS02357 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.15 COc1ccccc1Cl AS02676 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.15 COc1ccccc1F AS01803 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.15 COc1ccccc1I AS02206 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.15 COc1ccccc1N AS01503 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.15 CSc1ccccc1Br AS04291 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.15 CSc1ccccc1Cl AS04287 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.15 CSc1ccccc1F AS04284 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.15 CSc1ccccc1I AS04299 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.15 CSc1ccccc1N AS04281 [1,0,0,0,0,0|3,0,0]=4 206 B9R1.15 CSc1ccccc1O AS04298 [1,0,0,0,0,0|2,0,0]=3 207 B9R1.15 Cc1ccccc1C=O AS02777 [1,0,0,0,0,0|1,0,0]=2 208 B9R1.15 Cc1ccccc1CBr AS02052 [1,0,0,0,0,0|2,0,1]=4 209 B9R1.15 Cc1ccccc1CCl AS03843 [1,0,0,0,0,0|2,0,1]=4 210 B9R1.15 Cc1ccccc1CN AS00380 [1,0,0,0,0,0|2,0,1]=4 211 B9R1.15 Cc1ccccc1NN AS02962 [1,0,0,0,0,0|3,0,0]=4 212 B9R1.15 Cc1ccccc1OC AS01015 [1,0,0,0,0,0|3,0,0]=4 213 B9R1.15 Cc1ccccc1SC AS04306 [1,0,0,0,0,0|3,0,0]=4 214 B9R1.15 c1ccc(c(c1)C#N)Br AS03696 [1,0,0,0,0,0|2,0,1]=4 215 B9R1.15 c1ccc(c(c1)C#N)Cl AS03713 [1,0,0,0,0,0|2,0,1]=4 216 B9R1.15 c1ccc(c(c1)C#N)F AS03734 [1,0,0,0,0,0|2,0,1]=4 217 B9R1.15 c1ccc(c(c1)C#N)I AS03750 [1,0,0,0,0,0|2,0,1]=4 218 B9R1.15 c1ccc(c(c1)C#N)N AS02644 [1,0,0,0,0,0|2,0,1]=4 219 B9R1.15 c1ccc(c(c1)C#N)O AS02648 [1,0,0,0,0,0|1,0,1]=3 220 B9R1.15 c1ccc(c(c1)C#N)S AS06875 [1,0,0,0,0,0|1,1,1]=4 221 B9R1.15 c1ccc(c(c1)C=O)Br AS03776 [1,0,0,0,0,0|1,0,0]=2 222 B9R1.15 c1ccc(c(c1)C=O)F AS02999 [1,0,0,0,0,0|1,0,0]=2 223 B9R1.15 c1ccc(c(c1)C=O)I AS03914 [1,0,0,0,0,0|1,0,0]=2 224 B9R1.15 c1ccc(c(c1)C=O)N AS04430 [1,0,0,0,0,0|1,0,0]=2 225 B9R1.15 c1ccc(c(c1)C=O)O AS03003 [1,0,0,0,0,0|0,0,0]=1 226 B9R1.15 c1ccc(c(c1)C=O)O AS07244 [1,0,0,0,0,0|0,0,0]=1 227 B9R1.15 c1ccc(c(c1)CBr)Br AS02057 [1,0,0,0,0,0|2,0,1]=4 228 B9R1.15 c1ccc(c(c1)CBr)Cl AS02065 [1,0,0,0,0,0|2,0,1]=4 229 B9R1.15 c1ccc(c(c1)CBr)F AS00662 [1,0,0,0,0,0|2,0,1]=4 230 B9R1.15 c1ccc(c(c1)CBr)I AS00633 [1,0,0,0,0,0|2,0,1]=4 231 B9R1.15 c1ccc(c(c1)CCl)F AS00659 [1,0,0,0,0,0|2,0,1]=4 232 B9R1.15 c1ccc(c(c1)CN)Br AS02252 [1,0,0,0,0,0|2,0,1]=4 233 B9R1.15 c1ccc(c(c1)CN)Br AS03101 [1,0,0,0,0,0|2,0,1]=4 234 B9R1.15 c1ccc(c(c1)CN)Cl AS00369 [1,0,0,0,0,0|2,0,1]=4 235 B9R1.15 c1ccc(c(c1)CN)Cl AS02687 [1,0,0,0,0,0|2,0,1]=4 236 B9R1.15 c1ccc(c(c1)CN)F AS00832 [1,0,0,0,0,0|2,0,1]=4 237 B9R1.15 c1ccc(c(c1)CN)F AS01936 [1,0,0,0,0,0|2,0,1]=4 238 B9R1.15 c1ccc(c(c1)CN)I AS02221 [1,0,0,0,0,0|2,0,1]=4 239 B9R1.15 c1ccc(c(c1)CN)I AS02299 [1,0,0,0,0,0|2,0,1]=4 240 B9R1.15 c1ccc(c(c1)CN)N AS06598 [1,0,0,0,0,0|2,0,1]=4 241 B9R1.15 c1ccc(c(c1)CO)Br AS03952 [1,0,0,0,0,0|1,0,2]=4 242 B9R1.15 c1ccc(c(c1)CO)Cl AS03963 [1,0,0,0,0,0|1,0,2]=4 243 B9R1.15 c1ccc(c(c1)CO)F AS03976 [1,0,0,0,0,0|1,0,2]=4 244 B9R1.15 c1ccc(c(c1)CO)I AS03985 [1,0,0,0,0,0|1,0,2]=4 245 B9R1.15 c1ccc(c(c1)CO)N AS00575 [1,0,0,0,0,0|1,0,2]=4 246 B9R1.15 c1ccc(c(c1)CO)O AS00547 [1,0,0,0,0,0|0,0,2]=3 247 B9R1.15 c1ccc(c(c1)NN)Br AS02014 [1,0,0,0,0,0|3,0,0]=4 248 B9R1.15 c1ccc(c(c1)NN)Cl AS01997 [1,0,0,0,0,0|3,0,0]=4 249 B9R1.15 c1ccc(c(c1)NN)F AS02017 [1,0,0,0,0,0|3,0,0]=4 250 B9R1.15 c1ccc(c(c1)NN)F AS02959 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.69 Cc1cc(c(nc1)Br)F AS04783 [1,0,0,0,0,0|3,0,0]=4 252 B9R1.69 Cc1cc(c(nc1)Cl)F AS04806 [1,0,0,0,0,0|3,0,0]=4 253 B9R1.69 Cc1cc(c(nc1)F)Br AS04792 [1,0,0,0,0,0|3,0,0]=4 254 B9R1.69 Cc1cc(c(nc1)F)I AS04837 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.69 Cc1cc(ccc1Br)Br AS00106 [1,0,0,0,0,0|3,0,0]=4 256 B9R1.69 Cc1cc(ccc1Br)Cl AS03173 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.69 Cc1cc(ccc1Br)F AS01019 [1,0,0,0,0,0|3,0,0]=4 258 B9R1.69 Cc1cc(ccc1Br)I AS03372 [1,0,0,0,0,0|3,0,0]=4 259 B9R1.69 Cc1cc(ccc1Br)N AS03419 [1,0,0,0,0,0|3,0,0]=4 260 B9R1.69 Cc1cc(ccc1Br)N AS04116 [1,0,0,0,0,0|3,0,0]=4 261 B9R1.69 Cc1cc(ccc1Br)N AS06933 [1,0,0,0,0,0|3,0,0]=4 262 B9R1.69 Cc1cc(ccc1Br)O AS06856 [1,0,0,0,0,0|3,0,0]=4 263 B9R1.69 Cc1cc(ccc1Cl)Br AS00100 [1,0,0,0,0,0|3,0,0]=4 264 B9R1.69 Cc1cc(ccc1Cl)Cl AS02895 [1,0,0,0,0,0|3,0,0]=4 265 B9R1.69 Cc1cc(ccc1Cl)F AS02757 [1,0,0,0,0,0|3,0,0]=4 266 B9R1.69 Cc1cc(ccc1Cl)I AS03077 [1,0,0,0,0,0|3,0,0]=4 267 B9R1.69 Cc1cc(ccc1Cl)N AS02804 [1,0,0,0,0,0|3,0,0]=4 268 B9R1.69 Cc1cc(ccc1Cl)N AS02805 [1,0,0,0,0,0|3,0,0]=4 269 B9R1.69 Cc1cc(ccc1F)Br AS03336 [1,0,0,0,0,0|3,0,0]=4 270 B9R1.69 Cc1cc(ccc1F)Cl AS04754 [1,0,0,0,0,0|3,0,0]=4 271 B9R1.69 Cc1cc(ccc1F)F AS02070 [1,0,0,0,0,0|3,0,0]=4 272 B9R1.69 Cc1cc(ccc1F)I AS02074 [1,0,0,0,0,0|3,0,0]=4 273 B9R1.69 Cc1cc(ccc1F)N AS03242 [1,0,0,0,0,0|3,0,0]=4 274 B9R1.69 Cc1cc(ccc1F)O AS01400 [1,0,0,0,0,0|3,0,0]=4 275 B9R1.69 Cc1cc(ccc1I)Br AS03379 [1,0,0,0,0,0|3,0,0]=4 276 B9R1.69 Cc1cc(ccc1I)Cl AS00124 [1,0,0,0,0,0|3,0,0]=4 277 B9R1.69 Cc1cc(ccc1I)F AS02194 [1,0,0,0,0,0|3,0,0]=4 278 B9R1.69 Cc1cc(ccc1I)I AS02148 [1,0,0,0,0,0|3,0,0]=4 279 B9R1.69 Cc1cc(ccc1I)O AS04647 [1,0,0,0,0,0|3,0,0]=4 280 B9R1.69 Cc1cc(ccc1N)Br AS00449 [1,0,0,0,0,0|3,0,0]=4 281 B9R1.69 Cc1cc(ccc1N)Br AS03418 [1,0,0,0,0,0|3,0,0]=4 282 B9R1.69 Cc1cc(ccc1N)Cl AS00413 [1,0,0,0,0,0|3,0,0]=4 283 B9R1.69 Cc1cc(ccc1N)F AS04091 [1,0,0,0,0,0|3,0,0]=4 284 B9R1.69 Cc1cc(ccc1N)I AS02257 [1,0,0,0,0,0|3,0,0]=4 285 B9R1.69 Cc1cc(ccc1O)Br AS00228 [1,0,0,0,0,0|2,0,1]=4 286 B9R1.69 Cc1cc(ccc1O)Br AS06250 [1,0,0,0,0,0|2,0,1]=4 287 B9R1.69 Cc1cc(ccc1O)Cl AS02822 [1,0,0,0,0,0|2,0,1]=4 288 B9R1.69 Cc1cc(ccc1O)F AS01399 [1,0,0,0,0,0|2,0,1]=4 289 B9R1.69 Cc1ccc(c(c1)Br)Br AS00240 [1,0,0,0,0,0|2,0,0]=3 290 B9R1.69 Cc1ccc(c(c1)Br)Br AS02027 [1,0,0,0,0,0|2,0,0]=3 291 B9R1.69 Cc1ccc(c(c1)Br)C AS00264 [1,0,0,0,0,0|1,0,1]=3 292 B9R1.69 Cc1ccc(c(c1)Br)Cl AS00084 [1,0,0,0,0,0|2,0,0]=3 293 B9R1.69 Cc1ccc(c(c1)Br)F AS03335 [1,0,0,0,0,0|2,0,0]=3 294 B9R1.69 Cc1ccc(c(c1)Br)I AS03375 [1,0,0,0,0,0|2,0,0]=3 295 B9R1.69 Cc1ccc(c(c1)Br)N AS03412 [1,0,0,0,0,0|2,0,0]=3 296 B9R1.69 Cc1ccc(c(c1)Br)N AS03417 [1,0,0,0,0,0|2,0,0]=3 297 B9R1.69 Cc1ccc(c(c1)C)Br AS03232 [1,0,0,0,0,0|2,0,0]=3 298 B9R1.69 Cc1ccc(c(c1)C)C AS00262 [1,0,0,0,0,0|1,0,1]=3 299 B9R1.69 Cc1ccc(c(c1)C)Cl AS02702 [1,0,0,0,0,0|2,0,0]=3 300 B9R1.69 Cc1ccc(c(c1)C)F AS00279 [1,0,0,0,0,0|2,0,0]=3 301 B9R1.69 Cc1ccc(c(c1)C)I AS02153 [1,0,0,0,0,0|2,0,0]=3 302 B9R1.69 Cc1ccc(c(c1)C)N AS01548 [1,0,0,0,0,0|2,0,0]=3 303 B9R1.69 Cc1ccc(c(c1)Cl)Br AS03175 [1,0,0,0,0,0|2,0,0]=3 304 B9R1.69 Cc1ccc(c(c1)Cl)C AS02703 [1,0,0,0,0,0|1,0,1]=3 305 B9R1.69 Cc1ccc(c(c1)Cl)F AS02758 [1,0,0,0,0,0|2,0,0]=3 306 B9R1.69 Cc1ccc(c(c1)Cl)I AS00145 [1,0,0,0,0,0|2,0,0]=3 307 B9R1.69 Cc1ccc(c(c1)Cl)N AS05330 [1,0,0,0,0,0|2,0,0]=3 308 B9R1.69 Cc1ccc(c(c1)Cl)O AS02819 [1,0,0,0,0,0|1,0,1]=3 309 B9R1.69 Cc1ccc(c(c1)F)Br AS00304 [1,0,0,0,0,0|2,0,0]=3 310 B9R1.69 Cc1ccc(c(c1)F)Cl AS02760 [1,0,0,0,0,0|2,0,0]=3 311 B9R1.69 Cc1ccc(c(c1)F)F AS02071 [1,0,0,0,0,0|2,0,0]=3 312 B9R1.69 Cc1ccc(c(c1)F)I AS02191 [1,0,0,0,0,0|2,0,0]=3 313 B9R1.69 Cc1ccc(c(c1)F)N AS00425 [1,0,0,0,0,0|2,0,0]=3 314 B9R1.69 Cc1ccc(c(c1)I)Br AS03378 [1,0,0,0,0,0|2,0,0]=3 315 B9R1.69 Cc1ccc(c(c1)I)C AS02155 [1,0,0,0,0,0|1,0,1]=3 316 B9R1.69 Cc1ccc(c(c1)I)F AS02193 [1,0,0,0,0,0|2,0,0]=3 317 B9R1.69 Cc1ccc(c(c1)I)I AS02149 [1,0,0,0,0,0|2,0,0]=3 318 B9R1.69 Cc1ccc(c(c1)I)N AS02255 [1,0,0,0,0,0|2,0,0]=3 319 B9R1.69 Cc1ccc(c(c1)N)Br AS06846 [1,0,0,0,0,0|2,0,0]=3 320 B9R1.69 Cc1ccc(c(c1)N)Br AS06967 [1,0,0,0,0,0|2,0,0]=3 321 B9R1.69 Cc1ccc(c(c1)N)Cl AS04682 [1,0,0,0,0,0|2,0,0]=3 322 B9R1.69 Cc1ccc(c(c1)N)Cl AS06932 [1,0,0,0,0,0|2,0,0]=3 323 B9R1.69 Cc1ccc(c(c1)N)F AS03240 [1,0,0,0,0,0|2,0,0]=3 324 B9R1.69 Cc1ccc(c(c1)N)I AS04099 [1,0,0,0,0,0|2,0,0]=3 325 B9R1.69 Cc1ccc(c(c1)O)Br AS00227 [1,0,0,0,0,0|1,0,0]=2 326 B9R1.69 Cc1ccc(c(c1)O)C AS00223 [1,0,0,0,0,0|0,0,1]=2 327 B9R1.69 Cc1ccc(c(c1)O)Cl AS02820 [1,0,0,0,0,0|1,0,0]=2 328 B9R1.69 Cc1ccc(c(c1)O)F AS00182 [1,0,0,0,0,0|1,0,0]=2 329 B9R1.69 Cc1ccc(c(c1)O)O AS07054 [1,0,0,0,0,0|0,0,1]=2 330 B9R1.69 Cc1ccc(c(c1)S)C AS00079 [1,0,0,0,0,0|0,1,1]=3 331 B9R1.69 Cc1ccc(c(n1)Br)F AS04789 [1,0,0,0,0,0|3,0,0]=4 332 B9R1.69 Cc1ccc(c(n1)Br)N AS04697 [1,0,0,0,0,0|3,0,0]=4 333 B9R1.69 Cc1ccc(c(n1)C)Br AS06965 [1,0,0,0,0,0|3,0,0]=4 334 B9R1.69 Cc1ccc(c(n1)Cl)Br AS04915 [1,0,0,0,0,0|3,0,0]=4 335 B9R1.69 Cc1ccc(c(n1)Cl)F AS04723 [1,0,0,0,0,0|3,0,0]=4 336 B9R1.69 Cc1ccc(c(n1)F)I AS04836 [1,0,0,0,0,0|3,0,0]=4 337 B9R1.69 Cc1ccc(c(n1)F)O AS04857 [1,0,0,0,0,0|2,0,1]=4 338 B9R1.69 Cc1ccc(c(n1)N)Br AS04887 [1,0,0,0,0,0|3,0,0]=4 339 B9R1.69 Cc1ccc(cc1Br)Br AS00135 [1,0,0,0,0,0|2,0,1]=4 340 B9R1.69 Cc1ccc(cc1Br)Cl AS00104 [1,0,0,0,0,0|2,0,1]=4 341 B9R1.69 Cc1ccc(cc1Br)F AS01018 [1,0,0,0,0,0|2,0,1]=4 342 B9R1.69 Cc1ccc(cc1Br)I AS03371 [1,0,0,0,0,0|2,0,1]=4 343 B9R1.69 Cc1ccc(cc1Br)N AS04061 [1,0,0,0,0,0|2,0,1]=4 344 B9R1.69 Cc1ccc(cc1Br)O AS06517 [1,0,0,0,0,0|2,0,1]=4 345 B9R1.69 Cc1ccc(cc1C)Br AS03659 [1,0,0,0,0,0|2,0,1]=4 346 B9R1.69 Cc1ccc(cc1C)Cl AS02704 [1,0,0,0,0,0|2,0,1]=4 347 B9R1.69 Cc1ccc(cc1C)F AS00280 [1,0,0,0,0,0|2,0,1]=4 348 B9R1.69 Cc1ccc(cc1C)I AS02151 [1,0,0,0,0,0|2,0,1]=4 349 B9R1.69 Cc1ccc(cc1C)N AS07069 [1,0,0,0,0,0|2,0,1]=4 350 B9R1.69 Cc1ccc(cc1Cl)Br AS00171 [1,0,0,0,0,0|2,0,1]=4 351 B9R1.69 Cc1ccc(cc1Cl)F AS01022 [1,0,0,0,0,0|2,0,1]=4 352 B9R1.69 Cc1ccc(cc1Cl)I AS03076 [1,0,0,0,0,0|2,0,1]=4 353 B9R1.69 Cc1ccc(cc1Cl)N AS03227 [1,0,0,0,0,0|2,0,1]=4 354 B9R1.69 Cc1ccc(cc1Cl)O AS00234 [1,0,0,0,0,0|2,0,1]=4 355 B9R1.69 Cc1ccc(cc1F)Br AS00241 [1,0,0,0,0,0|2,0,1]=4 356 B9R1.69 Cc1ccc(cc1F)Cl AS02759 [1,0,0,0,0,0|2,0,1]=4 357 B9R1.69 Cc1ccc(cc1F)F AS02069 [1,0,0,0,0,0|2,0,1]=4 358 B9R1.69 Cc1ccc(cc1F)I AS02189 [1,0,0,0,0,0|2,0,1]=4 359 B9R1.69 Cc1ccc(cc1F)N AS00436 [1,0,0,0,0,0|2,0,1]=4 360 B9R1.69 Cc1ccc(cc1F)O AS01398 [1,0,0,0,0,0|2,0,1]=4 361 B9R1.69 Cc1ccc(cc1I)Br AS03377 [1,0,0,0,0,0|2,0,1]=4 362 B9R1.69 Cc1ccc(cc1I)Cl AS03079 [1,0,0,0,0,0|2,0,1]=4 363 B9R1.69 Cc1ccc(cc1I)F AS02192 [1,0,0,0,0,0|2,0,1]=4 364 B9R1.69 Cc1ccc(cc1I)I AS02147 [1,0,0,0,0,0|2,0,1]=4 365 B9R1.69 Cc1ccc(cc1I)N AS02256 [1,0,0,0,0,0|2,0,1]=4 366 B9R1.69 Cc1ccc(cc1N)Br AS00457 [1,0,0,0,0,0|2,0,1]=4 367 B9R1.69 Cc1ccc(cc1N)Cl AS04751 [1,0,0,0,0,0|2,0,1]=4 368 B9R1.69 Cc1ccc(cc1N)F AS00350 [1,0,0,0,0,0|2,0,1]=4 369 B9R1.69 Cc1ccc(cc1N)I AS02328 [1,0,0,0,0,0|2,0,1]=4 370 B9R1.69 Cc1ccc(cc1N)O AS01352 [1,0,0,0,0,0|2,0,1]=4 371 B9R1.69 Cc1ccc(cc1N)O AS02087 [1,0,0,0,0,0|2,0,1]=4 372 B9R1.69 Cc1ccc(cc1O)Br AS04653 [1,0,0,0,0,0|1,0,1]=3 373 B9R1.69 Cc1ccc(cc1O)Cl AS02823 [1,0,0,0,0,0|1,0,1]=3 374 B9R1.69 Cc1ccc(cc1O)F AS00890 [1,0,0,0,0,0|1,0,1]=3 375 B9R1.69 Cc1ccc(cc1O)N AS05434 [1,0,0,0,0,0|1,0,1]=3 376 B9R1.69 Cc1ccc(cc1O)O AS06296 [1,0,0,0,0,0|1,0,1]=3 377 B9R1.69 c1cc(c(cc1Br)Br)Br AS03654 [1,0,0,0,0,0|3,0,0]=4 378 B9R1.69 c1cc(c(cc1Br)Br)Cl AS03480 [1,0,0,0,0,0|3,0,0]=4 379 B9R1.69 c1cc(c(cc1Br)Br)F AS03550 [1,0,0,0,0,0|3,0,0]=4 380 B9R1.69 c1cc(c(cc1Br)Br)I AS03563 [1,0,0,0,0,0|3,0,0]=4 381 B9R1.69 c1cc(c(cc1Br)Br)N AS00467 [1,0,0,0,0,0|3,0,0]=4 382 B9R1.69 c1cc(c(cc1Br)Cl)Br AS03481 [1,0,0,0,0,0|3,0,0]=4 383 B9R1.69 c1cc(c(cc1Br)Cl)Cl AS03185 [1,0,0,0,0,0|3,0,0]=4 384 B9R1.69 c1cc(c(cc1Br)Cl)F AS03144 [1,0,0,0,0,0|3,0,0]=4 385 B9R1.69 c1cc(c(cc1Br)Cl)I AS03153 [1,0,0,0,0,0|3,0,0]=4 386 B9R1.69 c1cc(c(cc1Br)Cl)N AS00435 [1,0,0,0,0,0|3,0,0]=4 387 B9R1.69 c1cc(c(cc1Br)Cl)O AS03169 [1,0,0,0,0,0|2,0,1]=4 388 B9R1.69 c1cc(c(cc1Br)F)Br AS03552 [1,0,0,0,0,0|3,0,0]=4 389 B9R1.69 c1cc(c(cc1Br)F)Cl AS01225 [1,0,0,0,0,0|3,0,0]=4 390 B9R1.69 c1cc(c(cc1Br)F)F AS03202 [1,0,0,0,0,0|3,0,0]=4 391 B9R1.69 c1cc(c(cc1Br)F)I AS03315 [1,0,0,0,0,0|3,0,0]=4 392 B9R1.69 c1cc(c(cc1Br)F)N AS03241 [1,0,0,0,0,0|3,0,0]=4 393 B9R1.69 c1cc(c(cc1Br)F)N AS03271 [1,0,0,0,0,0|3,0,0]=4 394 B9R1.69 c1cc(c(cc1Br)F)O AS00212 [1,0,0,0,0,0|2,0,1]=4 395 B9R1.69 c1cc(c(cc1Br)F)S AS05515 [1,0,0,0,0,0|2,1,0]=4 396 B9R1.69 c1cc(c(cc1Br)I)Br AS03564 [1,0,0,0,0,0|3,0,0]=4 397 B9R1.69 c1cc(c(cc1Br)I)Cl AS03156 [1,0,0,0,0,0|3,0,0]=4 398 B9R1.69 c1cc(c(cc1Br)I)I AS03212 [1,0,0,0,0,0|3,0,0]=4 399 B9R1.69 c1cc(c(cc1Br)I)N AS03351 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.69 c1cc(c(cc1Br)I)O AS05450 [1,0,0,0,0,0|2,0,1]=4 401 B9R1.69 c1cc(c(cc1Br)N)Br AS00471 [1,0,0,0,0,0|3,0,0]=4 402 B9R1.69 c1cc(c(cc1Br)N)Cl AS00433 [1,0,0,0,0,0|3,0,0]=4 403 B9R1.69 c1cc(c(cc1Br)N)F AS03273 [1,0,0,0,0,0|3,0,0]=4 404 B9R1.69 c1cc(c(cc1Br)N)F AS04054 [1,0,0,0,0,0|3,0,0]=4 405 B9R1.69 c1cc(c(cc1Br)N)F AS05296 [1,0,0,0,0,0|3,0,0]=4 406 B9R1.69 c1cc(c(cc1Br)N)I AS03352 [1,0,0,0,0,0|3,0,0]=4 407 B9R1.69 c1cc(c(cc1Br)N)N AS00456 [1,0,0,0,0,0|3,0,0]=4 408 B9R1.69 c1cc(c(cc1Br)N)O AS00170 [1,0,0,0,0,0|2,0,1]=4 409 B9R1.69 c1cc(c(cc1Br)O)Br AS04420 [1,0,0,0,0,0|2,0,0]=3 410 B9R1.69 c1cc(c(cc1Br)O)Cl AS00161 [1,0,0,0,0,0|2,0,0]=3 411 B9R1.69 c1cc(c(cc1Br)O)F AS00226 [1,0,0,0,0,0|2,0,0]=3 412 B9R1.69 c1cc(c(cc1Br)O)N AS05408 [1,0,0,0,0,0|2,0,0]=3 413 B9R1.69 c1cc(c(cc1Cl)Br)Br AS03482 [1,0,0,0,0,0|3,0,0]=4 414 B9R1.69 c1cc(c(cc1Cl)Br)Br AS06883 [1,0,0,0,0,0|3,0,0]=4 415 B9R1.69 c1cc(c(cc1Cl)Br)Cl AS03183 [1,0,0,0,0,0|3,0,0]=4 416 B9R1.69 c1cc(c(cc1Cl)Br)F AS03148 [1,0,0,0,0,0|3,0,0]=4 417 B9R1.69 c1cc(c(cc1Cl)Br)I AS03155 [1,0,0,0,0,0|3,0,0]=4 418 B9R1.69 c1cc(c(cc1Cl)Br)N AS01555 [1,0,0,0,0,0|3,0,0]=4 419 B9R1.69 c1cc(c(cc1Cl)Br)O AS03166 [1,0,0,0,0,0|2,0,1]=4 420 B9R1.69 c1cc(c(cc1Cl)Cl)Br AS03182 [1,0,0,0,0,0|3,0,0]=4 421 B9R1.69 c1cc(c(cc1Cl)Cl)F AS02870 [1,0,0,0,0,0|3,0,0]=4 422 B9R1.69 c1cc(c(cc1Cl)Cl)I AS03086 [1,0,0,0,0,0|3,0,0]=4 423 B9R1.69 c1cc(c(cc1Cl)Cl)N AS01519 [1,0,0,0,0,0|3,0,0]=4 424 B9R1.69 c1cc(c(cc1Cl)F)Br AS03146 [1,0,0,0,0,0|3,0,0]=4 425 B9R1.69 c1cc(c(cc1Cl)F)Cl AS02871 [1,0,0,0,0,0|3,0,0]=4 426 B9R1.69 c1cc(c(cc1Cl)F)F AS02694 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.69 c1cc(c(cc1Cl)F)I AS03049 [1,0,0,0,0,0|3,0,0]=4 428 B9R1.69 c1cc(c(cc1Cl)F)N AS00315 [1,0,0,0,0,0|3,0,0]=4 429 B9R1.69 c1cc(c(cc1Cl)F)O AS00395 [1,0,0,0,0,0|2,0,1]=4 430 B9R1.69 c1cc(c(cc1Cl)I)Br AS00283 [1,0,0,0,0,0|3,0,0]=4 431 B9R1.69 c1cc(c(cc1Cl)I)Cl AS03088 [1,0,0,0,0,0|3,0,0]=4 432 B9R1.69 c1cc(c(cc1Cl)I)I AS03040 [1,0,0,0,0,0|3,0,0]=4 433 B9R1.69 c1cc(c(cc1Cl)I)N AS00455 [1,0,0,0,0,0|3,0,0]=4 434 B9R1.69 c1cc(c(cc1Cl)I)O AS05468 [1,0,0,0,0,0|2,0,1]=4 435 B9R1.69 c1cc(c(cc1Cl)N)Br AS03115 [1,0,0,0,0,0|3,0,0]=4 436 B9R1.69 c1cc(c(cc1Cl)N)F AS00333 [1,0,0,0,0,0|3,0,0]=4 437 B9R1.69 c1cc(c(cc1Cl)N)I AS01557 [1,0,0,0,0,0|3,0,0]=4 438 B9R1.69 c1cc(c(cc1Cl)N)N AS01542 [1,0,0,0,0,0|3,0,0]=4 439 B9R1.69 c1cc(c(cc1Cl)N)O AS04639 [1,0,0,0,0,0|2,0,1]=4 440 B9R1.69 c1cc(c(cc1Cl)O)Cl AS02889 [1,0,0,0,0,0|2,0,0]=3 441 B9R1.69 c1cc(c(cc1Cl)O)F AS01380 [1,0,0,0,0,0|2,0,0]=3 442 B9R1.69 c1cc(c(cc1Cl)O)I AS03074 [1,0,0,0,0,0|2,0,0]=3 443 B9R1.69 c1cc(c(cc1F)Br)Br AS03549 [1,0,0,0,0,0|3,0,0]=4 444 B9R1.69 c1cc(c(cc1F)Br)Cl AS03147 [1,0,0,0,0,0|3,0,0]=4 445 B9R1.69 c1cc(c(cc1F)Br)F AS03201 [1,0,0,0,0,0|3,0,0]=4 446 B9R1.69 c1cc(c(cc1F)Br)I AS03318 [1,0,0,0,0,0|3,0,0]=4 447 B9R1.69 c1cc(c(cc1F)Br)N AS00050 [1,0,0,0,0,0|3,0,0]=4 448 B9R1.69 c1cc(c(cc1F)Br)O AS00231 [1,0,0,0,0,0|2,0,1]=4 449 B9R1.69 c1cc(c(cc1F)Cl)Br AS03143 [1,0,0,0,0,0|3,0,0]=4 450 B9R1.69 c1cc(c(cc1F)Cl)Cl AS02869 [1,0,0,0,0,0|3,0,0]=4 451 B9R1.69 c1cc(c(cc1F)Cl)I AS03048 [1,0,0,0,0,0|3,0,0]=4 452 B9R1.69 c1cc(c(cc1F)Cl)N AS00325 [1,0,0,0,0,0|3,0,0]=4 453 B9R1.69 c1cc(c(cc1F)Cl)N AS02721 [1,0,0,0,0,0|3,0,0]=4 454 B9R1.69 c1cc(c(cc1F)Cl)N AS05323 [1,0,0,0,0,0|3,0,0]=4 455 B9R1.69 c1cc(c(cc1F)Cl)O AS00391 [1,0,0,0,0,0|2,0,1]=4 456 B9R1.69 c1cc(c(cc1F)Cl)S AS05517 [1,0,0,0,0,0|2,1,0]=4 457 B9R1.69 c1cc(c(cc1F)F)Br AS03200 [1,0,0,0,0,0|3,0,0]=4 458 B9R1.69 c1cc(c(cc1F)F)Cl AS00268 [1,0,0,0,0,0|3,0,0]=4 459 B9R1.69 c1cc(c(cc1F)F)F AS01587 [1,0,0,0,0,0|3,0,0]=4 460 B9R1.69 c1cc(c(cc1F)F)I AS03093 [1,0,0,0,0,0|3,0,0]=4 461 B9R1.69 c1cc(c(cc1F)F)N AS01534 [1,0,0,0,0,0|3,0,0]=4 462 B9R1.69 c1cc(c(cc1F)F)O AS00157 [1,0,0,0,0,0|2,0,1]=4 463 B9R1.69 c1cc(c(cc1F)F)S AS05520 [1,0,0,0,0,0|2,1,0]=4 464 B9R1.69 c1cc(c(cc1F)I)Br AS03316 [1,0,0,0,0,0|3,0,0]=4 465 B9R1.69 c1cc(c(cc1F)I)Cl AS03046 [1,0,0,0,0,0|3,0,0]=4 466 B9R1.69 c1cc(c(cc1F)I)F AS02127 [1,0,0,0,0,0|3,0,0]=4 467 B9R1.69 c1cc(c(cc1F)I)I AS02136 [1,0,0,0,0,0|3,0,0]=4 468 B9R1.69 c1cc(c(cc1F)I)N AS04081 [1,0,0,0,0,0|3,0,0]=4 469 B9R1.69 c1cc(c(cc1F)I)O AS06581 [1,0,0,0,0,0|2,0,1]=4 470 B9R1.69 c1cc(c(cc1F)N)Br AS00051 [1,0,0,0,0,0|3,0,0]=4 471 B9R1.69 c1cc(c(cc1F)N)Cl AS00334 [1,0,0,0,0,0|3,0,0]=4 472 B9R1.69 c1cc(c(cc1F)N)F AS01535 [1,0,0,0,0,0|3,0,0]=4 473 B9R1.69 c1cc(c(cc1F)N)I AS03197 [1,0,0,0,0,0|3,0,0]=4 474 B9R1.69 c1cc(c(cc1F)N)N AS01545 [1,0,0,0,0,0|3,0,0]=4 475 B9R1.69 c1cc(c(cc1F)N)O AS00224 [1,0,0,0,0,0|2,0,1]=4 476 B9R1.69 c1cc(c(cc1F)O)Br AS00222 [1,0,0,0,0,0|2,0,0]=3 477 B9R1.69 c1cc(c(cc1F)O)Cl AS00194 [1,0,0,0,0,0|2,0,0]=3 478 B9R1.69 c1cc(c(cc1F)O)F AS00183 [1,0,0,0,0,0|2,0,0]=3 479 B9R1.69 c1cc(c(cc1F)O)I AS06580 [1,0,0,0,0,0|2,0,0]=3 480 B9R1.69 c1cc(c(cc1F)O)N AS01348 [1,0,0,0,0,0|2,0,0]=3 481 B9R1.69 c1cc(c(cc1F)O)O AS01420 [1,0,0,0,0,0|1,0,1]=3 482 B9R1.69 c1cc(c(cc1I)Br)Br AS03562 [1,0,0,0,0,0|3,0,0]=4 483 B9R1.69 c1cc(c(cc1I)Br)Cl AS03154 [1,0,0,0,0,0|3,0,0]=4 484 B9R1.69 c1cc(c(cc1I)Br)Cl AS04633 [1,0,0,0,0,0|3,0,0]=4 485 B9R1.69 c1cc(c(cc1I)Br)F AS00284 [1,0,0,0,0,0|3,0,0]=4 486 B9R1.69 c1cc(c(cc1I)Br)F AS03317 [1,0,0,0,0,0|3,0,0]=4 487 B9R1.69 c1cc(c(cc1I)Br)I AS03211 [1,0,0,0,0,0|3,0,0]=4 488 B9R1.69 c1cc(c(cc1I)Br)N AS03349 [1,0,0,0,0,0|3,0,0]=4 489 B9R1.69 c1cc(c(cc1I)Br)N AS05298 [1,0,0,0,0,0|3,0,0]=4 490 B9R1.69 c1cc(c(cc1I)Br)O AS06568 [1,0,0,0,0,0|2,0,1]=4 491 B9R1.69 c1cc(c(cc1I)Cl)Br AS03152 [1,0,0,0,0,0|3,0,0]=4 492 B9R1.69 c1cc(c(cc1I)Cl)Cl AS03085 [1,0,0,0,0,0|3,0,0]=4 493 B9R1.69 c1cc(c(cc1I)Cl)F AS03047 [1,0,0,0,0,0|3,0,0]=4 494 B9R1.69 c1cc(c(cc1I)Cl)I AS03039 [1,0,0,0,0,0|3,0,0]=4 495 B9R1.69 c1cc(c(cc1I)Cl)N AS00468 [1,0,0,0,0,0|3,0,0]=4 496 B9R1.69 c1cc(c(cc1I)F)Br AS00285 [1,0,0,0,0,0|3,0,0]=4 497 B9R1.69 c1cc(c(cc1I)F)Cl AS03045 [1,0,0,0,0,0|3,0,0]=4 498 B9R1.69 c1cc(c(cc1I)F)F AS03091 [1,0,0,0,0,0|3,0,0]=4 499 B9R1.69 c1cc(c(cc1I)F)I AS02137 [1,0,0,0,0,0|3,0,0]=4 500 B9R1.69 c1cc(c(cc1I)F)N AS00439 [1,0,0,0,0,0|3,0,0]=4 501 B9R1.69 c1cc(c(cc1I)F)O AS05492 [1,0,0,0,0,0|2,0,1]=4 502 B9R1.69 c1cc(c(cc1I)N)N AS05687 [1,0,0,0,0,0|3,0,0]=4 503 B9R1.69 c1cc(c(cc1I)O)Cl AS03072 [1,0,0,0,0,0|2,0,0]=3 504 B9R1.69 c1cc(c(cc1I)O)I AS06590 [1,0,0,0,0,0|2,0,0]=3 505 B9R1.69 c1cc(c(cc1N)Br)Cl AS03116 [1,0,0,0,0,0|3,0,0]=4 506 B9R1.69 c1cc(c(cc1N)Br)Cl AS03684 [1,0,0,0,0,0|3,0,0]=4 507 B9R1.69 c1cc(c(cc1N)Br)F AS03266 [1,0,0,0,0,0|3,0,0]=4 508 B9R1.69 c1cc(c(cc1N)Br)F AS03685 [1,0,0,0,0,0|3,0,0]=4 509 B9R1.69 c1cc(c(cc1N)Br)I AS03350 [1,0,0,0,0,0|3,0,0]=4 510 B9R1.69 c1cc(c(cc1N)Br)N AS05681 [1,0,0,0,0,0|3,0,0]=4 511 B9R1.69 c1cc(c(cc1N)Cl)Br AS01554 [1,0,0,0,0,0|3,0,0]=4 512 B9R1.69 c1cc(c(cc1N)Cl)Cl AS01525 [1,0,0,0,0,0|3,0,0]=4 513 B9R1.69 c1cc(c(cc1N)Cl)F AS00440 [1,0,0,0,0,0|3,0,0]=4 514 B9R1.69 c1cc(c(cc1N)Cl)I AS03051 [1,0,0,0,0,0|3,0,0]=4 515 B9R1.69 c1cc(c(cc1N)Cl)O AS06870 [1,0,0,0,0,0|2,0,1]=4 516 B9R1.69 c1cc(c(cc1N)F)Br AS03869 [1,0,0,0,0,0|3,0,0]=4 517 B9R1.69 c1cc(c(cc1N)F)Cl AS00336 [1,0,0,0,0,0|3,0,0]=4 518 B9R1.69 c1cc(c(cc1N)F)F AS00794 [1,0,0,0,0,0|3,0,0]=4 519 B9R1.69 c1cc(c(cc1N)F)F AS01536 [1,0,0,0,0,0|3,0,0]=4 520 B9R1.69 c1cc(c(cc1N)F)F AS04472 [1,0,0,0,0,0|3,0,0]=4 521 B9R1.69 c1cc(c(cc1N)F)F AS05352 [1,0,0,0,0,0|3,0,0]=4 522 B9R1.69 c1cc(c(cc1N)F)I AS04079 [1,0,0,0,0,0|3,0,0]=4 523 B9R1.69 c1cc(c(cc1N)F)O AS01350 [1,0,0,0,0,0|2,0,1]=4 524 B9R1.69 c1cc(c(cc1N)N)Br AS05680 [1,0,0,0,0,0|3,0,0]=4 525 B9R1.69 c1cc(c(cc1N)N)F AS01546 [1,0,0,0,0,0|3,0,0]=4 526 B9R1.69 c1cc(c(cc1N)O)Cl AS05416 [1,0,0,0,0,0|2,0,0]=3 527 B9R1.69 c1cc(c(cc1O)Br)Br AS03581 [1,0,0,0,0,0|3,0,0]=4 528 B9R1.69 c1cc(c(cc1O)Br)Cl AS03167 [1,0,0,0,0,0|3,0,0]=4 529 B9R1.69 c1cc(c(cc1O)Br)F AS00390 [1,0,0,0,0,0|3,0,0]=4 530 B9R1.69 c1cc(c(cc1O)Cl)Br AS00225 [1,0,0,0,0,0|3,0,0]=4 531 B9R1.69 c1cc(c(cc1O)Cl)Cl AS00195 [1,0,0,0,0,0|3,0,0]=4 532 B9R1.69 c1cc(c(cc1O)Cl)F AS00392 [1,0,0,0,0,0|3,0,0]=4 533 B9R1.69 c1cc(c(cc1O)Cl)I AS06504 [1,0,0,0,0,0|3,0,0]=4 534 B9R1.69 c1cc(c(cc1O)Cl)N AS05415 [1,0,0,0,0,0|3,0,0]=4 535 B9R1.69 c1cc(c(cc1O)Cl)N AS06974 [1,0,0,0,0,0|3,0,0]=4 536 B9R1.69 c1cc(c(cc1O)Cl)O AS02779 [1,0,0,0,0,0|2,0,1]=4 537 B9R1.69 c1cc(c(cc1O)F)Br AS00389 [1,0,0,0,0,0|3,0,0]=4 538 B9R1.69 c1cc(c(cc1O)F)Cl AS00396 [1,0,0,0,0,0|3,0,0]=4 539 B9R1.69 c1cc(c(cc1O)F)F AS00210 [1,0,0,0,0,0|3,0,0]=4 540 B9R1.69 c1cc(c(cc1O)F)I AS06570 [1,0,0,0,0,0|3,0,0]=4 541 B9R1.69 c1cc(c(cc1O)F)N AS01351 [1,0,0,0,0,0|3,0,0]=4 542 B9R1.69 c1cc(c(cc1O)I)Cl AS03073 [1,0,0,0,0,0|3,0,0]=4 543 B9R1.69 c1cc(c(cc1O)I)Cl AS05469 [1,0,0,0,0,0|3,0,0]=4 544 B9R1.69 c1cc(c(cc1O)N)F AS01349 [1,0,0,0,0,0|3,0,0]=4 545 B9R1.69 c1cc(c(cc1O)O)F AS05497 [1,0,0,0,0,0|2,0,0]=3 546 B9R1.69 c1cc(c(cc1O)O)N AS05427 [1,0,0,0,0,0|2,0,0]=3 547 B9R1.69 c1cc(c(cc1O)O)O AS00200 [1,0,0,0,0,0|1,0,1]=3 548 B9R1.69 c1cc(c(cc1S)Cl)F AS05518 [1,0,0,0,0,0|3,0,0]=4 549 B9R1.69 c1cc(c(cc1S)F)F AS05521 [1,0,0,0,0,0|3,0,0]=4 550 B11R1.37 CCc1cc(ccc1C=O)O AS06473 [0,1,0,0,0,0|2,0,0]=3 551 B11R1.37 COc1cc(ccc1C#C)O AS07209 [0,1,0,0,0,0|2,0,1]=4 552 B11R1.37 COc1cc(ccc1C#N)Br AS02600 [0,1,0,0,0,0|2,0,1]=4 553 B11R1.37 COc1cc(ccc1C#N)F AS03742 [0,1,0,0,0,0|2,0,1]=4 554 B11R1.37 COc1cc(ccc1C#N)O AS06316 [0,1,0,0,0,0|2,0,1]=4 555 B11R1.37 COc1cc(ccc1C=O)Br AS02782 [0,1,0,0,0,0|1,0,0]=2 556 B11R1.37 COc1cc(ccc1C=O)Cl AS03934 [0,1,0,0,0,0|1,0,0]=2 557 B11R1.37 COc1cc(ccc1C=O)Cl AS05560 [0,1,0,0,0,0|1,0,0]=2 558 B11R1.37 COc1cc(ccc1C=O)F AS03036 [0,1,0,0,0,0|1,0,0]=2 559 B11R1.37 COc1cc(ccc1C=O)O AS06309 [0,1,0,0,0,0|1,0,0]=2 560 B11R1.37 COc1cc(ccc1CCl)F AS00666 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.37 COc1cc(ccc1CN)F AS02609 [0,1,0,0,0,0|2,0,1]=4 562 B11R1.37 COc1cc(ccc1CO)Br AS00555 [0,1,0,0,0,0|1,0,2]=4 563 B11R1.37 COc1cc(ccc1CO)Cl AS04003 [0,1,0,0,0,0|1,0,2]=4 564 B11R1.37 COc1cc(ccc1CO)F AS03982 [0,1,0,0,0,0|1,0,2]=4 565 B11R1.37 COc1ccc(cc1CO)Br AS00560 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.37 COc1ccc(cc1CO)F AS00599 [0,1,0,0,0,0|3,0,0]=4 567 B11R1.37 COc1ccc(cc1OC)Br AS03218 [0,1,0,0,0,0|3,0,0]=4 568 B11R1.37 COc1ccc(cc1OC)F AS02401 [0,1,0,0,0,0|3,0,0]=4 569 B11R1.37 COc1ccc(cc1OC)I AS02534 [0,1,0,0,0,0|3,0,0]=4 570 B11R1.37 COc1ccc(cc1OC)O AS01392 [0,1,0,0,0,0|3,0,0]=4 571 B11R1.37 Cc1ccc(c(c1)C#N)C=O AS06373 [0,1,0,0,0,0|1,0,0]=2 572 B11R1.37 Cc1ccc(c(c1)OC)C#N AS05867 [0,1,0,0,0,0|1,0,1]=3 573 B11R1.37 Cc1ccc(c(c1)OC)OC AS02540 [0,1,0,0,0,0|2,0,0]=3 574 B11R1.37 c1cc(c(cc1F)CO)C#N AS05963 [0,1,0,0,0,0|2,0,1]=4 575 B11R1.81 CCCc1ccc(cc1O)O AS06999 [0,1,0,0,0,0|2,0,1]=4 576 B11R1.81 c1cc(c(cc1F)F)N=C=O AS00723 [0,1,0,0,0,0|2,0,1]=4 577 B11R1.166 B(c1ccc(cc1C)C)(O)O AS04994 [0,1,0,0,0,0|2,0,1]=4 578 B11R1.166 CC(=O)c1ccc(cc1Br)Br AS03852 [0,1,0,0,0,0|2,0,0]=3 579 B11R1.166 CC(=O)c1ccc(cc1Br)F AS01149 [0,1,0,0,0,0|2,0,0]=3 580 B11R1.166 CC(=O)c1ccc(cc1Br)F AS01174 [0,1,0,0,0,0|2,0,0]=3 581 B11R1.166 CC(=O)c1ccc(cc1Br)N AS05248 [0,1,0,0,0,0|2,0,0]=3 582 B11R1.166 CC(=O)c1ccc(cc1Br)O AS05117 [0,1,0,0,0,0|2,0,0]=3 583 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl AS03861 [0,1,0,0,0,0|2,0,0]=3 584 B11R1.166 CC(=O)c1ccc(cc1Cl)F AS04025 [0,1,0,0,0,0|2,0,0]=3 585 B11R1.166 CC(=O)c1ccc(cc1Cl)N AS05072 [0,1,0,0,0,0|2,0,0]=3 586 B11R1.166 CC(=O)c1ccc(cc1Cl)O AS05144 [0,1,0,0,0,0|2,0,0]=3 587 B11R1.166 CC(=O)c1ccc(cc1Cl)O AS05258 [0,1,0,0,0,0|2,0,0]=3 588 B11R1.166 CC(=O)c1ccc(cc1F)Br AS01131 [0,1,0,0,0,0|2,0,0]=3 589 B11R1.166 CC(=O)c1ccc(cc1F)Cl AS04005 [0,1,0,0,0,0|2,0,0]=3 590 B11R1.166 CC(=O)c1ccc(cc1F)F AS01190 [0,1,0,0,0,0|2,0,0]=3 591 B11R1.166 CC(=O)c1ccc(cc1F)O AS01200 [0,1,0,0,0,0|2,0,0]=3 592 B11R1.166 CC(=O)c1ccc(cc1N)F AS06564 [0,1,0,0,0,0|2,0,0]=3 593 B11R1.166 CC(=O)c1ccc(cc1O)Cl AS05146 [0,1,0,0,0,0|1,0,0]=2 594 B11R1.166 CC(=O)c1ccc(cc1O)F AS01201 [0,1,0,0,0,0|1,0,0]=2 595 B11R1.166 CC(=O)c1ccc(cc1O)N AS05250 [0,1,0,0,0,0|1,0,0]=2 596 B11R1.166 CC(=O)c1ccc(cc1O)O AS01140 [0,1,0,0,0,0|1,0,0]=2 597 B11R1.166 CC(C)c1ccc(cc1O)O AS07039 [0,1,0,0,0,0|2,0,1]=4 598 B11R1.166 Cc1cc(ccc1C(=O)C)Cl AS05148 [0,1,0,0,0,0|2,0,0]=3 599 B11R1.166 Cc1cc(ccc1C(=O)C)F AS01144 [0,1,0,0,0,0|2,0,0]=3 600 B11R1.166 Cc1cc(ccc1C(=O)C)F AS03900 [0,1,0,0,0,0|2,0,0]=3 601 B11R1.166 Cc1cc(ccc1C(=O)C)O AS04594 [0,1,0,0,0,0|2,0,0]=3 602 B11R1.166 Cc1cc(ccc1C(=O)O)Br AS01811 [0,1,0,0,0,0|2,0,0]=3 603 B11R1.166 Cc1cc(ccc1C(=O)O)Cl AS00772 [0,1,0,0,0,0|2,0,0]=3 604 B11R1.166 Cc1cc(ccc1C(=O)O)F AS01874 [0,1,0,0,0,0|2,0,0]=3 605 B11R1.166 Cc1cc(ccc1C(=O)O)F AS04999 [0,1,0,0,0,0|2,0,0]=3 606 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])Cl AS06939 [0,1,0,0,0,0|3,0,0]=4 607 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])F AS02081 [0,1,0,0,0,0|3,0,0]=4 608 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])O AS00180 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.166 Cc1ccc(c(c1)Br)C(=O)O AS00875 [0,1,0,0,0,0|1,0,0]=2 610 B11R1.166 Cc1ccc(c(c1)C)C(=O)Cl AS00021 [0,1,0,0,0,0|1,0,0]=2 611 B11R1.166 Cc1ccc(c(c1)C)C(=O)O AS03894 [0,1,0,0,0,0|1,0,0]=2 612 B11R1.166 Cc1ccc(c(c1)C)C(F)F AS05714 [0,1,0,0,0,0|2,0,1]=4 613 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O AS00152 [0,1,0,0,0,0|1,0,0]=2 614 B11R1.166 Cc1ccc(c(c1)Cl)[N+](=O)[O-] AS02916 [0,1,0,0,0,0|2,0,0]=3 615 B11R1.166 Cc1ccc(c(c1)F)C(=O)O AS00764 [0,1,0,0,0,0|1,0,0]=2 616 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] AS02078 [0,1,0,0,0,0|2,0,0]=3 617 B11R1.166 Cc1ccc(c(c1)I)[N+](=O)[O-] AS02093 [0,1,0,0,0,0|2,0,0]=3 618 B11R1.166 Cc1ccc(c(c1)N)C(=O)O AS00771 [0,1,0,0,0,0|1,0,0]=2 619 B11R1.166 Cc1ccc(c(c1)N)[N+](=O)[O-] AS02089 [0,1,0,0,0,0|2,0,0]=3 620 B11R1.166 Cc1ccc(c(c1)O)C(=O)C AS05195 [0,1,0,0,0,0|0,0,0]=1 621 B11R1.166 Cc1ccc(c(n1)Br)[N+](=O)[O-] AS04903 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.166 Cc1ccc(c(n1)F)[N+](=O)[O-] AS04855 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.166 Cc1ccc(c(n1)N)[N+](=O)[O-] AS04893 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.166 Cc1ccc(c(n1)O)[N+](=O)[O-] AS04943 [0,1,0,0,0,0|2,0,0]=3 625 B11R1.166 c1cc(c(cc1Br)Br)C(=O)N AS05890 [0,1,0,0,0,0|2,0,0]=3 626 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O AS03514 [0,1,0,0,0,0|2,0,0]=3 627 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O AS01793 [0,1,0,0,0,0|2,0,0]=3 628 B11R1.166 c1cc(c(cc1Br)Cl)C(=O)O AS03132 [0,1,0,0,0,0|2,0,0]=3 629 B11R1.166 c1cc(c(cc1Br)F)C(=O)Cl AS00047 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.166 c1cc(c(cc1Br)F)C(=O)O AS03290 [0,1,0,0,0,0|2,0,0]=3 631 B11R1.166 c1cc(c(cc1Br)F)[N+](=O)[O-] AS01521 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.166 c1cc(c(cc1Br)I)C(=O)O AS00147 [0,1,0,0,0,0|2,0,0]=3 633 B11R1.166 c1cc(c(cc1Br)I)[N+](=O)[O-] AS04614 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.166 c1cc(c(cc1Br)N)C(=O)O AS00990 [0,1,0,0,0,0|2,0,0]=3 635 B11R1.166 c1cc(c(cc1Br)N)[N+](=O)[O-] AS05302 [0,1,0,0,0,0|3,0,0]=4 636 B11R1.166 c1cc(c(cc1Br)O)C(=O)N AS03343 [0,1,0,0,0,0|1,0,0]=2 637 B11R1.166 c1cc(c(cc1Br)O)C(=O)O AS00769 [0,1,0,0,0,0|1,0,0]=2 638 B11R1.166 c1cc(c(cc1Br)O)[N+](=O)[O-] AS05458 [0,1,0,0,0,0|2,0,0]=3 639 B11R1.166 c1cc(c(cc1Cl)Br)C(=O)O AS03128 [0,1,0,0,0,0|2,0,0]=3 640 B11R1.166 c1cc(c(cc1Cl)Cl)C(=O)O AS00780 [0,1,0,0,0,0|2,0,0]=3 641 B11R1.166 c1cc(c(cc1Cl)Cl)[N+](=O)[O-] AS06943 [0,1,0,0,0,0|3,0,0]=4 642 B11R1.166 c1cc(c(cc1Cl)F)C(=O)Cl AS00041 [0,1,0,0,0,0|2,0,0]=3 643 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O AS02730 [0,1,0,0,0,0|2,0,0]=3 644 B11R1.166 c1cc(c(cc1Cl)F)[N+](=O)[O-] AS01484 [0,1,0,0,0,0|3,0,0]=4 645 B11R1.166 c1cc(c(cc1Cl)I)C(=O)O AS03067 [0,1,0,0,0,0|2,0,0]=3 646 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N AS05883 [0,1,0,0,0,0|2,0,0]=3 647 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O AS00756 [0,1,0,0,0,0|2,0,0]=3 648 B11R1.166 c1cc(c(cc1Cl)N)[N+](=O)[O-] AS04124 [0,1,0,0,0,0|3,0,0]=4 649 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O AS02762 [0,1,0,0,0,0|1,0,0]=2 650 B11R1.166 c1cc(c(cc1F)Br)C(=O)Cl AS00048 [0,1,0,0,0,0|2,0,0]=3 651 B11R1.166 c1cc(c(cc1F)Br)C(=O)O AS00970 [0,1,0,0,0,0|2,0,0]=3 652 B11R1.166 c1cc(c(cc1F)Br)[N+](=O)[O-] AS05650 [0,1,0,0,0,0|3,0,0]=4 653 B11R1.166 c1cc(c(cc1F)Cl)C(=O)Cl AS00039 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.166 c1cc(c(cc1F)Cl)C(=O)O AS00965 [0,1,0,0,0,0|2,0,0]=3 655 B11R1.166 c1cc(c(cc1F)Cl)[N+](=O)[O-] AS01539 [0,1,0,0,0,0|3,0,0]=4 656 B11R1.166 c1cc(c(cc1F)F)C(=O)Cl AS00033 [0,1,0,0,0,0|2,0,0]=3 657 B11R1.166 c1cc(c(cc1F)F)C(=O)N AS00796 [0,1,0,0,0,0|2,0,0]=3 658 B11R1.166 c1cc(c(cc1F)F)C(=O)O AS00811 [0,1,0,0,0,0|2,0,0]=3 659 B11R1.166 c1cc(c(cc1F)F)C(=O)[O-] AS00779 [0,1,0,0,0,0|2,0,0]=3 660 B11R1.166 c1cc(c(cc1F)F)[N+](=O)[O-] AS04479 [0,1,0,0,0,0|3,0,0]=4 661 B11R1.166 c1cc(c(cc1F)I)C(=O)O AS00944 [0,1,0,0,0,0|2,0,0]=3 662 B11R1.166 c1cc(c(cc1F)N)C(=O)O AS00975 [0,1,0,0,0,0|2,0,0]=3 663 B11R1.166 c1cc(c(cc1F)N)[N+](=O)[O-] AS05385 [0,1,0,0,0,0|3,0,0]=4 664 B11R1.166 c1cc(c(cc1F)O)C(=O)O AS01858 [0,1,0,0,0,0|1,0,0]=2 665 B11R1.166 c1cc(c(cc1F)O)[N+](=O)[O-] AS01405 [0,1,0,0,0,0|2,0,0]=3 666 B11R1.166 c1cc(c(cc1I)Cl)C(=O)O AS03064 [0,1,0,0,0,0|2,0,0]=3 667 B11R1.166 c1cc(c(cc1I)F)C(=O)O AS01860 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.166 c1cc(c(cc1I)F)[N+](=O)[O-] AS06310 [0,1,0,0,0,0|3,0,0]=4 669 B11R1.166 c1cc(c(cc1I)O)C(=O)O AS02196 [0,1,0,0,0,0|1,0,0]=2 670 B11R1.166 c1cc(c(cc1N)Br)[N+](=O)[O-] AS05300 [0,1,0,0,0,0|3,0,0]=4 671 B11R1.166 c1cc(c(cc1N)F)C(=O)O AS01776 [0,1,0,0,0,0|2,0,0]=3 672 B11R1.166 c1cc(c(cc1O)Cl)[N+](=O)[O-] AS05471 [0,1,0,0,0,0|3,0,0]=4 673 B11R1.166 c1cc(c(cc1O)F)C(=O)O AS01854 [0,1,0,0,0,0|2,0,0]=3 674 B11R1.166 c1cc(c(cc1O)F)[N+](=O)[O-] AS00185 [0,1,0,0,0,0|3,0,0]=4 675 B11R1.166 c1cc(c(cc1O)I)C(=O)O AS06293 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.166 c1cc(c(cc1O)O)C(=O)O AS00962 [0,1,0,0,0,0|1,0,0]=2 677 B11R1.166 c1cc(c(cc1O)O)[N+](=O)[O-] AS06332 [0,1,0,0,0,0|2,0,0]=3 678 B11R1.277 COc1cc(c(cc1O)F)Br AS05446 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.277 Cc1cc(c(cc1Br)C=O)F AS04973 [0,1,0,0,0,0|1,0,0]=2 680 B11R1.277 Cc1cc(c(cc1Br)F)C=O AS01432 [0,1,0,0,0,0|2,0,0]=3 681 B11R1.277 Cc1cc(c(cc1C=O)F)Br AS01431 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.277 Cc1cc(c(cc1Cl)C)C=O AS05551 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.277 Cc1cc(c(cc1Cl)C=O)O AS06664 [0,1,0,0,0,0|0,0,0]=1 684 B11R1.277 Cc1cc(c(cc1F)Br)C=O AS04493 [0,1,0,0,0,0|2,0,0]=3 685 B11R1.277 Cc1cc(c(cc1F)C#N)Br AS05800 [0,1,0,0,0,0|2,0,1]=4 686 B11R1.277 Cc1cc(c(cc1F)C#N)F AS05015 [0,1,0,0,0,0|2,0,1]=4 687 B11R1.277 Cc1cc(c(cc1F)C=O)Br AS05536 [0,1,0,0,0,0|1,0,0]=2 688 B11R1.277 Cc1cc(c(cc1F)C=O)O AS07166 [0,1,0,0,0,0|0,0,0]=1 689 B11R1.277 Cc1cc(c(cc1O)C)C=O AS04410 [0,1,0,0,0,0|2,0,0]=3 690 B11R1.277 c1c(c(cc(c1Cl)F)F)C=O AS05548 [0,1,0,0,0,0|2,0,0]=3 691 B11R1.277 c1c(c(cc(c1F)Br)Cl)C=O AS04971 [0,1,0,0,0,0|2,0,0]=3 692 B11R1.277 c1c(c(cc(c1F)Br)F)C=O AS05533 [0,1,0,0,0,0|2,0,0]=3 693 B11R1.277 c1c(c(cc(c1F)Cl)Cl)C=O AS05575 [0,1,0,0,0,0|2,0,0]=3 694 B11R1.277 c1c(c(cc(c1F)Cl)F)C=O AS01436 [0,1,0,0,0,0|2,0,0]=3 695 B11R1.277 c1c(c(cc(c1F)F)Br)C=O AS04967 [0,1,0,0,0,0|2,0,0]=3 696 B11R1.277 c1c(c(cc(c1F)F)Cl)C=O AS04974 [0,1,0,0,0,0|2,0,0]=3 697 B11R1.277 c1c(c(cc(c1F)F)Cl)C=O AS05546 [0,1,0,0,0,0|2,0,0]=3 698 B11R1.277 c1c(c(cc(c1F)F)F)C=O AS03366 [0,1,0,0,0,0|2,0,0]=3 699 B11R1.277 c1c(c(cc(c1F)F)O)C#N AS05834 [0,1,0,0,0,0|2,0,1]=4 700 B11R1.277 c1c(c(cc(c1F)F)O)C=O AS05585 [0,1,0,0,0,0|1,0,0]=2 701 B11R1.277 c1c(c(cc(c1F)O)F)C=O AS06311 [0,1,0,0,0,0|2,0,0]=3 702 B11R1.278 Cc1ccc(c(c1F)F)OC AS04252 [0,1,0,0,0,0|3,0,0]=4 703 B11R1.278 c1cc(c(c(c1C=O)F)F)Br AS05532 [0,1,0,0,0,0|2,0,0]=3 704 B11R1.278 c1cc(c(c(c1C=O)F)F)F AS01487 [0,1,0,0,0,0|2,0,0]=3 705 B11R1.278 c1cc(c(c(c1C=O)F)F)I AS05586 [0,1,0,0,0,0|2,0,0]=3 706 B11R1.278 c1cc(c(c(c1C=O)F)F)O AS04607 [0,1,0,0,0,0|2,0,0]=3 707 B11R1.278 c1cc(c(c(c1C=O)F)O)F AS05584 [0,1,0,0,0,0|2,0,0]=3 708 B11R1.279 COc1ccc(c(c1)Br)C=O AS05539 [0,1,0,0,0,0|1,0,0]=2 709 B11R1.279 COc1ccc(c(c1)Br)OC AS06963 [0,1,0,0,0,0|3,0,0]=4 710 B11R1.279 COc1ccc(c(c1)Cl)C#N AS01648 [0,1,0,0,0,0|2,0,1]=4 711 B11R1.279 COc1ccc(c(c1)Cl)C=O AS05556 [0,1,0,0,0,0|1,0,0]=2 712 B11R1.279 COc1ccc(c(c1)F)C#N AS02602 [0,1,0,0,0,0|2,0,1]=4 713 B11R1.279 COc1ccc(c(c1)F)C#N AS04965 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.279 COc1ccc(c(c1)F)C=O AS03035 [0,1,0,0,0,0|1,0,0]=2 715 B11R1.279 COc1ccc(c(c1)F)CBr AS07192 [0,1,0,0,0,0|2,0,1]=4 716 B11R1.279 COc1ccc(c(c1)F)CCl AS00667 [0,1,0,0,0,0|2,0,1]=4 717 B11R1.279 COc1ccc(c(c1)F)CN AS02606 [0,1,0,0,0,0|2,0,1]=4 718 B11R1.279 COc1ccc(c(c1)F)CO AS03980 [0,1,0,0,0,0|1,0,2]=4 719 B11R1.279 COc1ccc(c(c1)F)NN AS06155 [0,1,0,0,0,0|3,0,0]=4 720 B11R1.279 COc1ccc(c(c1)F)OC AS02400 [0,1,0,0,0,0|3,0,0]=4 721 B11R1.279 COc1ccc(c(c1)I)C#N AS06294 [0,1,0,0,0,0|2,0,1]=4 722 B11R1.279 COc1ccc(c(c1)O)C#N AS06261 [0,1,0,0,0,0|1,0,1]=3 723 B11R1.279 COc1ccc(c(c1)O)OC AS06540 [0,1,0,0,0,0|2,0,0]=3 724 B11R1.279 COc1ccc(cc1Br)CN AS03398 [0,1,0,0,0,0|3,0,0]=4 725 B11R1.279 COc1ccc(cc1Br)CO AS03961 [0,1,0,0,0,0|3,0,0]=4 726 B11R1.279 COc1ccc(cc1Cl)CN AS02796 [0,1,0,0,0,0|3,0,0]=4 727 B11R1.279 COc1ccc(cc1Cl)CO AS03969 [0,1,0,0,0,0|3,0,0]=4 728 B11R1.279 COc1ccc(cc1F)CBr AS00641 [0,1,0,0,0,0|3,0,0]=4 729 B11R1.279 COc1ccc(cc1F)CCl AS00669 [0,1,0,0,0,0|3,0,0]=4 730 B11R1.279 COc1ccc(cc1F)CN AS02608 [0,1,0,0,0,0|3,0,0]=4 731 B11R1.279 COc1ccc(cc1I)CN AS02248 [0,1,0,0,0,0|3,0,0]=4 732 B11R1.279 COc1ccc(cc1I)CO AS03988 [0,1,0,0,0,0|3,0,0]=4 733 B11R1.279 COc1ccc(cc1O)C#N AS02385 [0,1,0,0,0,0|2,0,1]=4 734 B11R1.279 Cc1cc(ccc1C#N)OC AS07023 [0,1,0,0,0,0|2,0,1]=4 735 B11R1.279 Cc1cc(ccc1C=O)OC AS02210 [0,1,0,0,0,0|1,0,0]=2 736 B11R1.279 Cc1cc(ccc1C=O)OC AS07028 [0,1,0,0,0,0|1,0,0]=2 737 B11R1.279 Cc1cc(ccc1OC)OC AS02031 [0,1,0,0,0,0|3,0,0]=4 738 B11R1.279 c1cc(c(cc1C#N)Br)C=O AS06403 [0,1,0,0,0,0|1,0,1]=3 739 B11R1.279 c1cc(c(cc1C#N)F)C=O AS02791 [0,1,0,0,0,0|1,0,1]=3 740 B11R1.279 c1cc(c(cc1CBr)Br)CBr AS03658 [0,1,0,0,0,0|2,0,1]=4 741 B11R1.279 c1cc(c(cc1CBr)F)C#N AS00644 [0,1,0,0,0,0|2,0,1]=4 742 B11R1.464 Cc1cc(c(c(c1)Br)OC)Br AS03569 [0,1,0,0,0,0|3,0,0]=4 743 B11R1.464 Cc1cc(c(c(c1)C)CBr)C AS04444 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.464 Cc1cc(c(c(c1)C)OC)C AS05514 [0,1,0,0,0,0|3,0,0]=4 745 B11R1.464 Cc1cc(c(c(c1)Cl)C=O)Cl AS04591 [0,1,0,0,0,0|1,0,0]=2 746 B11R1.464 Cc1cc(c(c(c1)O)C=O)C AS05593 [0,1,0,0,0,0|0,0,0]=1 747 B11R1.464 Cc1cc(cc(c1C=O)Br)F AS04427 [0,1,0,0,0,0|2,0,0]=3 748 B11R1.464 Cc1cc(cc(c1C=O)C)F AS05591 [0,1,0,0,0,0|2,0,0]=3 749 B11R1.464 Cc1cc(cc(c1C=O)C)O AS05592 [0,1,0,0,0,0|2,0,0]=3 750 B11R1.464 c1c(cc(c(c1Cl)C=O)Cl)Br AS05530 [0,1,0,0,0,0|2,0,0]=3 751 B11R1.464 c1c(cc(c(c1Cl)C=O)Cl)O AS05580 [0,1,0,0,0,0|2,0,0]=3 752 B11R1.464 c1c(cc(c(c1F)C=O)Cl)Cl AS05576 [0,1,0,0,0,0|2,0,0]=3 753 B11R1.464 c1c(cc(c(c1F)C=O)F)Br AS01422 [0,1,0,0,0,0|2,0,0]=3 754 B11R1.464 c1c(cc(c(c1F)C=O)F)Cl AS06494 [0,1,0,0,0,0|2,0,0]=3 755 B11R1.464 c1c(cc(c(c1F)C=O)F)F AS01490 [0,1,0,0,0,0|2,0,0]=3 756 B11R1.464 c1c(cc(c(c1F)C=O)F)F AS03380 [0,1,0,0,0,0|2,0,0]=3 757 B11R2.36 Cc1ccc2c(c1)OCO2 AS01485 [0,0,0,1,0,0|2,0,0]=3 758 B11R2.36 Cc1ccc2c(c1)cco2 AS06433 [0,0,0,1,0,0|3,0,0]=4 759 B11R2.36 Cc1ccc2ccsc2c1 AS06413 [0,0,0,1,0,0|1,1,0]=3 760 B11R2.36 c1cc(cc2c1cc[nH]2)F AS02103 [0,0,0,1,0,0|3,0,0]=4 761 B11R2.36 c1cc(cc2c1cco2)O AS06445 [0,0,0,1,0,0|2,0,0]=3 762 B11R2.36 c1cc(cc2c1ccs2)Br AS06370 [0,0,0,1,0,0|2,1,0]=4 763 B11R2.36 c1cc2c(cc1Br)OCC2 AS06451 [0,0,0,1,0,0|2,0,1]=4 764 B11R2.36 c1cc2c(cc1Br)OCO2 AS00922 [0,0,0,1,0,0|3,0,0]=4 765 B11R2.36 c1cc2c(cc1Cl)OCO2 AS02681 [0,0,0,1,0,0|3,0,0]=4 766 B11R2.36 c1cc2c(cc1I)OCO2 AS02215 [0,0,0,1,0,0|3,0,0]=4 767 B11R2.36 c1cc2c(cc1N)OCO2 AS06260 [0,0,0,1,0,0|3,0,0]=4 768 B9R1.132 c1c(c(c(s1)C=O)Br)Br AS06575 [0,0,0,0,1,0|3,0,0]=4 769 B8R1.2 COc1ccccc1 AS04310 [2,0,0,0,0,0|2,0,0]=4 770 B8R1.2 COc1ccccc1 AS06877 [2,0,0,0,0,0|2,0,0]=4 771 B8R1.2 CSc1ccccc1 AS04279 [2,0,0,0,0,0|2,0,0]=4 772 B8R1.2 c1ccc(cc1)C#N AS02370 [2,0,0,0,0,0|1,0,1]=4 773 B8R1.2 c1ccc(cc1)CBr AS02048 [2,0,0,0,0,0|1,0,1]=4 774 B8R1.2 c1ccc(cc1)CO AS04466 [2,0,0,0,0,0|0,0,2]=4 775 B8R1.2 c1ccc(cc1)N=O AS01444 [2,0,0,0,0,0|1,0,0]=3 776 B8R1.3 Cc1ccc(cc1)C AS00254 [2,0,0,0,0,0|0,0,1]=3 777 B8R1.3 Cc1ccc(cc1)F AS00305 [2,0,0,0,0,0|1,0,0]=3 778 B8R1.3 Cc1ccc(cc1)I AS02294 [2,0,0,0,0,0|1,0,0]=3 779 B8R1.3 Cc1ccc(cc1)N AS06931 [2,0,0,0,0,0|1,0,0]=3 780 B8R1.3 Cc1ccc(cn1)F AS04876 [2,0,0,0,0,0|2,0,0]=4 781 B8R1.3 Cc1ccc(nc1)Br AS04906 [2,0,0,0,0,0|2,0,0]=4 782 B8R1.3 Cc1ccc(nc1)F AS04850 [2,0,0,0,0,0|2,0,0]=4 783 B8R1.3 c1cc(ccc1Br)Br AS05688 [2,0,0,0,0,0|2,0,0]=4 784 B8R1.3 c1cc(ccc1Br)I AS03362 [2,0,0,0,0,0|2,0,0]=4 785 B8R1.3 c1cc(ccc1Cl)Br AS06959 [2,0,0,0,0,0|2,0,0]=4 786 B8R1.3 c1cc(ccc1Cl)Cl AS06944 [2,0,0,0,0,0|2,0,0]=4 787 B8R1.3 c1cc(ccc1Cl)I AS03063 [2,0,0,0,0,0|2,0,0]=4 788 B8R1.3 c1cc(ccc1F)Br AS00255 [2,0,0,0,0,0|2,0,0]=4 789 B8R1.3 c1cc(ccc1F)Cl AS02729 [2,0,0,0,0,0|2,0,0]=4 790 B8R1.3 c1cc(ccc1F)F AS00245 [2,0,0,0,0,0|2,0,0]=4 791 B8R1.3 c1cc(ccc1F)I AS02180 [2,0,0,0,0,0|2,0,0]=4 792 B8R1.3 c1cc(ccc1F)S AS04129 [2,0,0,0,0,0|1,1,0]=4 793 B8R1.3 c1cc(ccc1I)I AS00081 [2,0,0,0,0,0|2,0,0]=4 794 B8R1.3 c1cc(ccc1N)Br AS00914 [2,0,0,0,0,0|2,0,0]=4 795 B8R1.3 c1cc(ccc1N)Cl AS02971 [2,0,0,0,0,0|2,0,0]=4 796 B8R1.3 c1cc(ccc1N)Cl AS06958 [2,0,0,0,0,0|2,0,0]=4 797 B8R1.3 c1cc(ccc1N)F AS00828 [2,0,0,0,0,0|2,0,0]=4 798 B8R1.3 c1cc(ccc1N)F AS01509 [2,0,0,0,0,0|2,0,0]=4 799 B8R1.3 c1cc(ccc1N)I AS00432 [2,0,0,0,0,0|2,0,0]=4 800 B8R1.3 c1cc(ccc1N)N AS00466 [2,0,0,0,0,0|2,0,0]=4 801 B8R1.3 c1cc(ccc1N)O AS04549 [2,0,0,0,0,0|1,0,1]=4 802 B8R1.3 c1cc(ccc1N)S AS04134 [2,0,0,0,0,0|1,1,0]=4 803 B8R1.3 c1cc(ccc1O)Cl AS00215 [2,0,0,0,0,0|1,0,1]=4 804 B8R1.3 c1cc(ccc1O)F AS00216 [2,0,0,0,0,0|1,0,1]=4 805 B8R1.3 c1cc(ccc1O)O AS00174 [2,0,0,0,0,0|1,0,1]=4 806 B8R1.3 c1cc(ccc1S)Cl AS04130 [2,0,0,0,0,0|1,1,0]=4 807 B8R1.5 Cc1ccccc1Br AS03471 [2,0,0,0,0,0|1,0,1]=4 808 B8R1.5 Cc1ccccc1F AS00300 [2,0,0,0,0,0|1,0,1]=4 809 B8R1.5 Cc1ccccc1I AS02292 [2,0,0,0,0,0|1,0,1]=4 810 B8R1.5 Cc1ccccc1N AS01510 [2,0,0,0,0,0|1,0,1]=4 811 B8R1.5 Cc1ccccc1O AS00217 [2,0,0,0,0,0|0,0,1]=3 812 B8R1.5 c1cc(c(nc1)F)O AS04833 [2,0,0,0,0,0|2,0,0]=4 813 B8R1.5 c1cc(c(nc1)O)Br AS04918 [2,0,0,0,0,0|2,0,0]=4 814 B8R1.5 c1ccc(c(c1)Br)Br AS03512 [2,0,0,0,0,0|2,0,0]=4 815 B8R1.5 c1ccc(c(c1)Br)I AS03360 [2,0,0,0,0,0|2,0,0]=4 816 B8R1.5 c1ccc(c(c1)Cl)Br AS03126 [2,0,0,0,0,0|2,0,0]=4 817 B8R1.5 c1ccc(c(c1)Cl)Cl AS00250 [2,0,0,0,0,0|2,0,0]=4 818 B8R1.5 c1ccc(c(c1)Cl)I AS03061 [2,0,0,0,0,0|2,0,0]=4 819 B8R1.5 c1ccc(c(c1)F)Br AS03287 [2,0,0,0,0,0|2,0,0]=4 820 B8R1.5 c1ccc(c(c1)F)Cl AS02728 [2,0,0,0,0,0|2,0,0]=4 821 B8R1.5 c1ccc(c(c1)F)F AS00252 [2,0,0,0,0,0|2,0,0]=4 822 B8R1.5 c1ccc(c(c1)F)I AS02178 [2,0,0,0,0,0|2,0,0]=4 823 B8R1.5 c1ccc(c(c1)F)S AS04132 [2,0,0,0,0,0|1,1,0]=4 824 B8R1.5 c1ccc(c(c1)I)I AS02129 [2,0,0,0,0,0|2,0,0]=4 825 B8R1.5 c1ccc(c(c1)N)Br AS00913 [2,0,0,0,0,0|2,0,0]=4 826 B8R1.5 c1ccc(c(c1)N)F AS00827 [2,0,0,0,0,0|2,0,0]=4 827 B8R1.5 c1ccc(c(c1)N)F AS01506 [2,0,0,0,0,0|2,0,0]=4 828 B8R1.5 c1ccc(c(c1)N)I AS00404 [2,0,0,0,0,0|2,0,0]=4 829 B8R1.5 c1ccc(c(c1)N)O AS00211 [2,0,0,0,0,0|1,0,0]=3 830 B8R1.5 c1ccc(c(c1)O)Br AS03449 [2,0,0,0,0,0|1,0,0]=3 831 B8R1.5 c1ccc(c(c1)O)F AS00891 [2,0,0,0,0,0|1,0,0]=3 832 B8R1.5 c1ccc(c(c1)O)I AS02283 [2,0,0,0,0,0|1,0,0]=3 833 B8R1.5 c1ccc(c(c1)S)Cl AS04136 [2,0,0,0,0,0|1,1,0]=4 834 B8R1.4 Cc1cc(cnc1)Br AS04920 [2,0,0,0,0,0|2,0,0]=4 835 B8R1.4 Cc1cccc(c1)Br AS03472 [2,0,0,0,0,0|1,0,0]=3 836 B8R1.4 Cc1cccc(c1)Cl AS02842 [2,0,0,0,0,0|1,0,0]=3 837 B8R1.4 Cc1cccc(c1)F AS06924 [2,0,0,0,0,0|1,0,0]=3 838 B8R1.4 Cc1cccc(c1)I AS02293 [2,0,0,0,0,0|1,0,0]=3 839 B8R1.4 Cc1cccc(c1)N AS06930 [2,0,0,0,0,0|1,0,0]=3 840 B8R1.4 Cc1cccc(c1)S AS00077 [2,0,0,0,0,0|0,1,0]=3 841 B8R1.4 Cc1cccc(n1)Br AS04907 [2,0,0,0,0,0|2,0,0]=4 842 B8R1.4 Cc1cccc(n1)C AS04947 [2,0,0,0,0,0|2,0,0]=4 843 B8R1.4 Cc1cccc(n1)F AS04851 [2,0,0,0,0,0|2,0,0]=4 844 B8R1.4 Cc1ccnc(c1)Br AS04905 [2,0,0,0,0,0|2,0,0]=4 845 B8R1.4 Cc1ccnc(c1)Cl AS04706 [2,0,0,0,0,0|2,0,0]=4 846 B8R1.4 Cc1ccnc(c1)F AS04730 [2,0,0,0,0,0|2,0,0]=4 847 B8R1.4 c1cc(cc(c1)Br)Br AS03513 [2,0,0,0,0,0|2,0,0]=4 848 B8R1.4 c1cc(cc(c1)Br)Cl AS03127 [2,0,0,0,0,0|2,0,0]=4 849 B8R1.4 c1cc(cc(c1)Br)F AS03288 [2,0,0,0,0,0|2,0,0]=4 850 B8R1.4 c1cc(cc(c1)Br)N AS00407 [2,0,0,0,0,0|2,0,0]=4 851 B8R1.4 c1cc(cc(c1)Br)O AS00214 [2,0,0,0,0,0|1,0,0]=3 852 B8R1.4 c1cc(cc(c1)Cl)Cl AS00251 [2,0,0,0,0,0|2,0,0]=4 853 B8R1.4 c1cc(cc(c1)Cl)F AS00258 [2,0,0,0,0,0|2,0,0]=4 854 B8R1.4 c1cc(cc(c1)Cl)N AS04638 [2,0,0,0,0,0|2,0,0]=4 855 B8R1.4 c1cc(cc(c1)Cl)O AS02833 [2,0,0,0,0,0|1,0,0]=3 856 B8R1.4 c1cc(cc(c1)F)F AS00253 [2,0,0,0,0,0|2,0,0]=4 857 B8R1.4 c1cc(cc(c1)F)N AS00826 [2,0,0,0,0,0|2,0,0]=4 858 B8R1.4 c1cc(cc(c1)F)N AS06739 [2,0,0,0,0,0|2,0,0]=4 859 B8R1.4 c1cc(cc(c1)F)O AS00206 [2,0,0,0,0,0|1,0,0]=3 860 B8R1.4 c1cc(cc(c1)F)O AS00892 [2,0,0,0,0,0|1,0,0]=3 861 B8R1.4 c1cc(cc(c1)I)Br AS03361 [2,0,0,0,0,0|2,0,0]=4 862 B8R1.4 c1cc(cc(c1)I)Cl AS03062 [2,0,0,0,0,0|2,0,0]=4 863 B8R1.4 c1cc(cc(c1)I)F AS02179 [2,0,0,0,0,0|2,0,0]=4 864 B8R1.4 c1cc(cc(c1)I)I AS02130 [2,0,0,0,0,0|2,0,0]=4 865 B8R1.4 c1cc(cc(c1)I)N AS00421 [2,0,0,0,0,0|2,0,0]=4 866 B8R1.4 c1cc(cc(c1)I)O AS02284 [2,0,0,0,0,0|1,0,0]=3 867 B8R1.4 c1cc(cc(c1)N)N AS06865 [2,0,0,0,0,0|2,0,0]=4 868 B8R1.4 c1cc(cc(c1)O)N AS00213 [2,0,0,0,0,0|1,0,0]=3 869 B8R1.4 c1cc(nc(c1)Br)O AS04913 [2,0,0,0,0,0|2,0,0]=4 870 B10R1.1 Cc1ccc(cc1)CC#N AS01373 [1,1,0,0,0,0|1,0,1]=4 871 B10R1.1 Cc1ccc(cc1)CC#N AS06119 [1,1,0,0,0,0|1,0,1]=4 872 B10R1.1 Cc1ccc(cc1)CCBr AS06761 [1,1,0,0,0,0|1,0,1]=4 873 B10R1.1 Cc1ccc(cc1)CCN AS00487 [1,1,0,0,0,0|1,0,1]=4 874 B10R1.1 Cc1ccc(cc1)CCO AS00590 [1,1,0,0,0,0|0,0,2]=4 875 B10R1.1 c1cc(ccc1C=NO)Br AS00917 [1,1,0,0,0,0|1,0,1]=4 876 B10R1.1 c1cc(ccc1C=NO)F AS00303 [1,1,0,0,0,0|1,0,1]=4 877 B10R1.1 c1cc(ccc1N=C=O)Br AS04397 [1,1,0,0,0,0|1,0,1]=4 878 B10R1.1 c1cc(ccc1N=C=O)F AS00722 [1,1,0,0,0,0|1,0,1]=4 879 B10R1.3 CCc1ccc(cc1)OC AS02574 [1,1,0,0,0,0|1,0,1]=4 880 B10R1.3 COc1ccc(cc1)C#N AS02378 [1,1,0,0,0,0|1,0,1]=4 881 B10R1.3 COc1ccc(cc1)C=O AS02988 [1,1,0,0,0,0|0,0,0]=2 882 B10R1.3 COc1ccc(cc1)CCl AS02049 [1,1,0,0,0,0|1,0,1]=4 883 B10R1.3 COc1ccc(cc1)CN AS00371 [1,1,0,0,0,0|1,0,1]=4 884 B10R1.3 COc1ccc(cc1)OC AS06962 [1,1,0,0,0,0|2,0,0]=4 885 B10R1.3 COc1ccc(cc1)SC AS04296 [1,1,0,0,0,0|2,0,0]=4 886 B10R1.3 CSc1ccc(cc1)CN AS06024 [1,1,0,0,0,0|1,0,1]=4 887 B10R1.3 c1cc(ccc1C=O)C#N AS02996 [1,1,0,0,0,0|0,0,1]=3 888 B10R1.3 c1cc(ccc1CBr)C#N AS00649 [1,1,0,0,0,0|1,0,1]=4 889 B10R1.3 c1cc(ccc1CBr)CBr AS00653 [1,1,0,0,0,0|1,0,1]=4 890 B10R1.3 c1cc(ccc1CN)C#N AS05785 [1,1,0,0,0,0|1,0,1]=4 891 B10R1.3 c1cc(ccc1CO)CBr AS05951 [1,1,0,0,0,0|0,0,2]=4 892 B10R1.3 c1cc(ccc1CO)CO AS00556 [1,1,0,0,0,0|0,0,2]=4 893 B10R1.13 B(c1ccc(cc1)C)(O)O AS07183 [1,1,0,0,0,0|1,0,1]=4 894 B10R1.13 CC(=C)c1ccc(cc1)O AS06541 [1,1,0,0,0,0|2,0,0]=4 895 B10R1.13 CC(=O)c1ccc(cc1)Br AS01178 [1,1,0,0,0,0|1,0,0]=3 896 B10R1.13 CC(=O)c1ccc(cc1)Cl AS05257 [1,1,0,0,0,0|1,0,0]=3 897 B10R1.13 CC(=O)c1ccc(cc1)F AS01160 [1,1,0,0,0,0|1,0,0]=3 898 B10R1.13 CC(=O)c1ccc(cc1)I AS04012 [1,1,0,0,0,0|1,0,0]=3 899 B10R1.13 CC(=O)c1ccc(cc1)N AS01150 [1,1,0,0,0,0|1,0,0]=3 900 B10R1.13 CC(=O)c1ccc(cc1)O AS01158 [1,1,0,0,0,0|1,0,0]=3 901 B10R1.13 CC(=O)c1ccc(nc1)Cl AS05261 [1,1,0,0,0,0|2,0,0]=4 902 B10R1.13 CC(=O)c1ccc(nc1)O AS04944 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.13 Cc1ccc(cc1)C(=O)C AS01165 [1,1,0,0,0,0|0,0,0]=2 904 B10R1.13 Cc1ccc(cc1)C(=O)Cl AS00020 [1,1,0,0,0,0|0,0,0]=2 905 B10R1.13 Cc1ccc(cc1)C(=O)N AS05901 [1,1,0,0,0,0|0,0,0]=2 906 B10R1.13 Cc1ccc(cc1)C(=O)O AS00864 [1,1,0,0,0,0|0,0,0]=2 907 B10R1.13 Cc1ccc(cc1)[N+](=O)[O-] AS01013 [1,1,0,0,0,0|1,0,0]=3 908 B10R1.13 Cc1ccc(cn1)[N+](=O)[O-] AS04952 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.13 c1cc(ccc1C(=N)N)N AS01794 [1,1,0,0,0,0|2,0,0]=4 910 B10R1.13 c1cc(ccc1C(=N)N)N AS01988 [1,1,0,0,0,0|2,0,0]=4 911 B10R1.13 c1cc(ccc1C(=O)Cl)I AS00009 [1,1,0,0,0,0|1,0,0]=3 912 B10R1.13 c1cc(ccc1C(=O)N)Br AS00920 [1,1,0,0,0,0|1,0,0]=3 913 B10R1.13 c1cc(ccc1C(=O)N)Cl AS02680 [1,1,0,0,0,0|1,0,0]=3 914 B10R1.13 c1cc(ccc1C(=O)N)F AS00831 [1,1,0,0,0,0|1,0,0]=3 915 B10R1.13 c1cc(ccc1C(=O)O)Br AS00815 [1,1,0,0,0,0|1,0,0]=3 916 B10R1.13 c1cc(ccc1C(=O)O)Cl AS00806 [1,1,0,0,0,0|1,0,0]=3 917 B10R1.13 c1cc(ccc1C(=O)O)F AS00747 [1,1,0,0,0,0|1,0,0]=3 918 B10R1.13 c1cc(ccc1C(=O)O)I AS02218 [1,1,0,0,0,0|1,0,0]=3 919 B10R1.13 c1cc(ccc1C(=O)O)N AS00762 [1,1,0,0,0,0|1,0,0]=3 920 B10R1.13 c1cc(ccc1C(=O)[O-])F AS00778 [1,1,0,0,0,0|1,0,0]=3 921 B10R1.13 c1cc(ccc1C(=S)N)Cl AS06630 [1,1,0,0,0,0|1,1,0]=4 922 B10R1.13 c1cc(ccc1N)[N+](=O)[O-] AS00442 [1,1,0,0,0,0|2,0,0]=4 923 B10R1.13 c1cc(ccc1[N+](=O)[O-])Br AS05660 [1,1,0,0,0,0|2,0,0]=4 924 B10R1.13 c1cc(ccc1[N+](=O)[O-])F AS00083 [1,1,0,0,0,0|2,0,0]=4 925 B10R1.13 c1cc(ccc1[N+](=O)[O-])O AS00220 [1,1,0,0,0,0|2,0,0]=4 926 B10R1.13 c1cc(ncc1C(=O)O)F AS04828 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.13 c1cc(ncc1Cl)C(=O)O AS04938 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.13 c1cc(ncc1F)C(=O)O AS04870 [1,1,0,0,0,0|2,0,0]=4 929 B10R1.176 C=Cc1ccc(c(c1)F)F AS03797 [1,1,0,0,0,0|2,0,0]=4 930 B10R1.176 Cc1cc(ccc1Br)C=O AS06928 [1,1,0,0,0,0|1,0,0]=3 931 B10R1.176 Cc1cc(ccc1Cl)C=O AS05565 [1,1,0,0,0,0|1,0,0]=3 932 B10R1.176 Cc1cc(ccc1F)C=O AS01472 [1,1,0,0,0,0|1,0,0]=3 933 B10R1.176 Cc1cc(ccc1O)C=O AS05603 [1,1,0,0,0,0|1,0,0]=3 934 B10R1.176 Cc1ccc(cc1Br)C#N AS02383 [1,1,0,0,0,0|1,0,1]=4 935 B10R1.176 Cc1ccc(cc1Br)C#N AS04683 [1,1,0,0,0,0|1,0,1]=4 936 B10R1.176 Cc1ccc(cc1Br)C=O AS02205 [1,1,0,0,0,0|0,0,0]=2 937 B10R1.176 Cc1ccc(cc1Br)OC AS05453 [1,1,0,0,0,0|2,0,0]=4 938 B10R1.176 Cc1ccc(cc1C)C=O AS05590 [1,1,0,0,0,0|0,0,0]=2 939 B10R1.176 Cc1ccc(cc1C)CCl AS00712 [1,1,0,0,0,0|1,0,1]=4 940 B10R1.176 Cc1ccc(cc1C)CN AS06971 [1,1,0,0,0,0|1,0,1]=4 941 B10R1.176 Cc1ccc(cc1C)CO AS00594 [1,1,0,0,0,0|0,0,2]=4 942 B10R1.176 Cc1ccc(cc1C)NN AS07068 [1,1,0,0,0,0|2,0,0]=4 943 B10R1.176 Cc1ccc(cc1C)OC AS02544 [1,1,0,0,0,0|2,0,0]=4 944 B10R1.176 Cc1ccc(cc1Cl)C=O AS02998 [1,1,0,0,0,0|0,0,0]=2 945 B10R1.176 Cc1ccc(cc1Cl)CN AS00381 [1,1,0,0,0,0|1,0,1]=4 946 B10R1.176 Cc1ccc(cc1Cl)OC AS02808 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.176 Cc1ccc(cc1F)C#N AS01683 [1,1,0,0,0,0|1,0,1]=4 948 B10R1.176 Cc1ccc(cc1F)C#N AS02711 [1,1,0,0,0,0|1,0,1]=4 949 B10R1.176 Cc1ccc(cc1F)CN AS06972 [1,1,0,0,0,0|1,0,1]=4 950 B10R1.176 Cc1ccc(cc1F)NN AS02007 [1,1,0,0,0,0|2,0,0]=4 951 B10R1.176 Cc1ccc(cc1F)OC AS02625 [1,1,0,0,0,0|2,0,0]=4 952 B10R1.176 Cc1ccc(cc1I)C#N AS03757 [1,1,0,0,0,0|1,0,1]=4 953 B10R1.176 Cc1ccc(cc1N)C#N AS01610 [1,1,0,0,0,0|1,0,1]=4 954 B10R1.176 Cc1ccc(cc1N)OC AS05433 [1,1,0,0,0,0|2,0,0]=4 955 B10R1.176 c1cc(c(cc1C=O)Br)Br AS03024 [1,1,0,0,0,0|1,0,0]=3 956 B10R1.176 c1cc(c(cc1C=O)Br)Cl AS04969 [1,1,0,0,0,0|1,0,0]=3 957 B10R1.176 c1cc(c(cc1C=O)Br)F AS03018 [1,1,0,0,0,0|1,0,0]=3 958 B10R1.176 c1cc(c(cc1C=O)Br)O AS03815 [1,1,0,0,0,0|1,0,0]=3 959 B10R1.176 c1cc(c(cc1C=O)Cl)Cl AS03015 [1,1,0,0,0,0|1,0,0]=3 960 B10R1.176 c1cc(c(cc1C=O)Cl)F AS03021 [1,1,0,0,0,0|1,0,0]=3 961 B10R1.176 c1cc(c(cc1C=O)Cl)O AS06839 [1,1,0,0,0,0|1,0,0]=3 962 B10R1.176 c1cc(c(cc1C=O)F)Br AS01429 [1,1,0,0,0,0|1,0,0]=3 963 B10R1.176 c1cc(c(cc1C=O)F)Br AS03947 [1,1,0,0,0,0|1,0,0]=3 964 B10R1.176 c1cc(c(cc1C=O)F)Cl AS03837 [1,1,0,0,0,0|1,0,0]=3 965 B10R1.176 c1cc(c(cc1C=O)F)F AS01454 [1,1,0,0,0,0|1,0,0]=3 966 B10R1.176 c1cc(c(cc1C=O)F)I AS05595 [1,1,0,0,0,0|1,0,0]=3 967 B10R1.176 c1cc(c(cc1C=O)F)O AS03052 [1,1,0,0,0,0|1,0,0]=3 968 B10R1.176 c1cc(c(cc1C=O)I)Br AS06471 [1,1,0,0,0,0|1,0,0]=3 969 B10R1.176 c1cc(c(cc1C=O)I)Cl AS06472 [1,1,0,0,0,0|1,0,0]=3 970 B10R1.176 c1cc(c(cc1C=O)I)F AS03887 [1,1,0,0,0,0|1,0,0]=3 971 B10R1.176 c1cc(c(cc1C=O)I)F AS05596 [1,1,0,0,0,0|1,0,0]=3 972 B10R1.176 c1cc(c(cc1C=O)I)I AS06470 [1,1,0,0,0,0|1,0,0]=3 973 B10R1.176 c1cc(c(cc1C=O)I)O AS02778 [1,1,0,0,0,0|1,0,0]=3 974 B10R1.176 c1cc(c(cc1C=O)O)Br AS05537 [1,1,0,0,0,0|1,0,0]=3 975 B10R1.2 CCc1cccc(c1O)Cl AS06547 [1,1,0,0,0,0|1,0,1]=4 976 B10R1.2 COc1cccc(c1O)Cl AS06585 [1,1,0,0,0,0|2,0,0]=4 977 B10R1.2 COc1cccc(c1O)F AS05493 [1,1,0,0,0,0|2,0,0]=4 978 B10R1.2 Cc1c(cccc1Cl)C=O AS05563 [1,1,0,0,0,0|1,0,0]=3 979 B10R1.2 Cc1c(cccc1F)C=O AS01468 [1,1,0,0,0,0|1,0,0]=3 980 B10R1.2 Cc1cccc(c1C)C=O AS01456 [1,1,0,0,0,0|1,0,0]=3 981 B10R1.2 Cc1cccc(c1Cl)C=O AS05562 [1,1,0,0,0,0|1,0,0]=3 982 B10R1.2 Cc1cccc(c1F)C=O AS01465 [1,1,0,0,0,0|1,0,0]=3 983 B10R1.2 Cc1cccc(c1O)C=O AS02880 [1,1,0,0,0,0|0,0,0]=2 984 B10R1.2 c1cc(c(c(c1)Br)F)C=O AS04660 [1,1,0,0,0,0|1,0,0]=3 985 B10R1.2 c1cc(c(c(c1)Br)F)C=O AS04970 [1,1,0,0,0,0|1,0,0]=3 986 B10R1.2 c1cc(c(c(c1)Br)O)C=O AS03006 [1,1,0,0,0,0|0,0,0]=2 987 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O AS05526 [1,1,0,0,0,0|1,0,0]=3 988 B10R1.2 c1cc(c(c(c1)Cl)Cl)C=O AS03010 [1,1,0,0,0,0|1,0,0]=3 989 B10R1.2 c1cc(c(c(c1)Cl)F)C=O AS01439 [1,1,0,0,0,0|1,0,0]=3 990 B10R1.2 c1cc(c(c(c1)Cl)O)C#N AS06383 [1,1,0,0,0,0|1,0,1]=4 991 B10R1.2 c1cc(c(c(c1)Cl)O)C=O AS05553 [1,1,0,0,0,0|0,0,0]=2 992 B10R1.2 c1cc(c(c(c1)F)Br)C=O AS04966 [1,1,0,0,0,0|1,0,0]=3 993 B10R1.2 c1cc(c(c(c1)F)Cl)C=O AS01437 [1,1,0,0,0,0|1,0,0]=3 994 B10R1.2 c1cc(c(c(c1)F)F)C=O AS01450 [1,1,0,0,0,0|1,0,0]=3 995 B10R1.2 c1cc(c(c(c1)F)I)C=O AS01458 [1,1,0,0,0,0|1,0,0]=3 996 B10R1.2 c1cc(c(c(c1)F)O)C=O AS03082 [1,1,0,0,0,0|0,0,0]=2 997 B10R1.2 c1cc(c(c(c1)N)O)C#N AS06489 [1,1,0,0,0,0|1,0,1]=4 998 B10R1.2 c1cc(c(c(c1)O)F)C=O AS06364 [1,1,0,0,0,0|1,0,0]=3 999 B10R1.2 c1cc(c(c(c1)O)O)C#N AS06482 [1,1,0,0,0,0|1,0,1]=4 1000 B10R1.2 c1cc(c(c(c1)O)O)C=O AS04455 [1,1,0,0,0,0|0,0,0]=2 1001 B10R1.2 c1cnc(c(c1C=O)F)Cl AS04811 [1,1,0,0,0,0|2,0,0]=4 1002 B10R1.4 c1ccc(c(c1)C=NO)Br AS00915 [1,1,0,0,0,0|1,0,1]=4 1003 B10R1.4 c1ccc(c(c1)C=NO)F AS00301 [1,1,0,0,0,0|1,0,1]=4 1004 B10R1.4 c1ccc(c(c1)N=C=O)Br AS04082 [1,1,0,0,0,0|1,0,1]=4 1005 B10R1.4 c1ccc(c(c1)N=C=O)Cl AS04125 [1,1,0,0,0,0|1,0,1]=4 1006 B10R1.4 c1ccc(c(c1)N=C=O)F AS00717 [1,1,0,0,0,0|1,0,1]=4 1007 B10R1.20 CCc1ccccc1C=O AS04433 [1,1,0,0,0,0|1,0,0]=3 1008 B10R1.20 CCc1ccccc1OC AS02573 [1,1,0,0,0,0|1,0,1]=4 1009 B10R1.20 COc1ccccc1CCl AS05988 [1,1,0,0,0,0|1,0,1]=4 1010 B10R1.20 COc1ccccc1CO AS03989 [1,1,0,0,0,0|0,0,2]=4 1011 B10R1.20 COc1ccccc1NN AS02474 [1,1,0,0,0,0|2,0,0]=4 1012 B10R1.20 COc1ccccc1NN AS06157 [1,1,0,0,0,0|2,0,0]=4 1013 B10R1.20 COc1ccccc1OC AS06960 [1,1,0,0,0,0|2,0,0]=4 1014 B10R1.20 COc1ccccc1SC AS04294 [1,1,0,0,0,0|2,0,0]=4 1015 B10R1.20 c1ccc(c(c1)C=O)C=O AS03002 [1,1,0,0,0,0|0,0,1]=3 1016 B10R1.20 c1ccc(c(c1)CO)C#N AS02592 [1,1,0,0,0,0|1,0,1]=4 1017 B10R1.20 c1ccc(c(c1)CO)CO AS05939 [1,1,0,0,0,0|0,0,2]=4 1018 B10R1.30 C=Cc1cc(ccc1F)F AS03798 [1,1,0,0,0,0|2,0,0]=4 1019 B10R1.30 COc1cc(ccc1O)Cl AS02798 [1,1,0,0,0,0|2,0,0]=4 1020 B10R1.30 COc1cc(ccc1O)F AS00164 [1,1,0,0,0,0|2,0,0]=4 1021 B10R1.30 COc1cc(ccc1O)N AS06520 [1,1,0,0,0,0|2,0,0]=4 1022 B10R1.30 Cc1ccc(c(c1)C#N)O AS06290 [1,1,0,0,0,0|1,0,1]=4 1023 B10R1.30 Cc1ccc(c(c1)C=O)F AS01467 [1,1,0,0,0,0|1,0,0]=3 1024 B10R1.30 Cc1ccc(cc1C=O)Br AS05540 [1,1,0,0,0,0|1,0,0]=3 1025 B10R1.30 Cc1ccc(cc1C=O)F AS01473 [1,1,0,0,0,0|1,0,0]=3 1026 B10R1.30 c1cc(c(cc1Br)C#N)O AS03704 [1,1,0,0,0,0|1,0,1]=4 1027 B10R1.30 c1cc(c(cc1Br)C=O)Cl AS03949 [1,1,0,0,0,0|1,0,0]=3 1028 B10R1.30 c1cc(c(cc1Br)C=O)Cl AS04972 [1,1,0,0,0,0|1,0,0]=3 1029 B10R1.30 c1cc(c(cc1Br)C=O)Cl AS05529 [1,1,0,0,0,0|1,0,0]=3 1030 B10R1.30 c1cc(c(cc1Br)C=O)F AS03802 [1,1,0,0,0,0|1,0,0]=3 1031 B10R1.30 c1cc(c(cc1Br)C=O)I AS05538 [1,1,0,0,0,0|1,0,0]=3 1032 B10R1.30 c1cc(c(cc1Br)C=O)N AS07011 [1,1,0,0,0,0|1,0,0]=3 1033 B10R1.30 c1cc(c(cc1Br)C=O)O AS03816 [1,1,0,0,0,0|0,0,0]=2 1034 B10R1.30 c1cc(c(cc1Br)CO)O AS00554 [1,1,0,0,0,0|0,0,2]=4 1035 B10R1.30 c1cc(c(cc1Cl)C=O)Br AS02865 [1,1,0,0,0,0|1,0,0]=3 1036 B10R1.30 c1cc(c(cc1Cl)C=O)Br AS03932 [1,1,0,0,0,0|1,0,0]=3 1037 B10R1.30 c1cc(c(cc1Cl)C=O)Cl AS03014 [1,1,0,0,0,0|1,0,0]=3 1038 B10R1.30 c1cc(c(cc1Cl)C=O)F AS03948 [1,1,0,0,0,0|1,0,0]=3 1039 B10R1.30 c1cc(c(cc1Cl)C=O)N AS05524 [1,1,0,0,0,0|1,0,0]=3 1040 B10R1.30 c1cc(c(cc1Cl)C=O)O AS02954 [1,1,0,0,0,0|0,0,0]=2 1041 B10R1.30 c1cc(c(cc1Cl)C=O)O AS03840 [1,1,0,0,0,0|0,0,0]=2 1042 B10R1.30 c1cc(c(cc1F)C=O)Br AS03020 [1,1,0,0,0,0|1,0,0]=3 1043 B10R1.30 c1cc(c(cc1F)C=O)Cl AS01438 [1,1,0,0,0,0|1,0,0]=3 1044 B10R1.30 c1cc(c(cc1F)C=O)F AS03100 [1,1,0,0,0,0|1,0,0]=3 1045 B10R1.30 c1cc(c(cc1F)C=O)I AS01459 [1,1,0,0,0,0|1,0,0]=3 1046 B10R1.30 c1cc(c(cc1F)C=O)O AS01457 [1,1,0,0,0,0|0,0,0]=2 1047 B10R1.30 c1cc(c(cc1I)C#N)O AS03748 [1,1,0,0,0,0|1,0,1]=4 1048 B10R1.30 c1cc(c(cc1I)C=O)F AS03884 [1,1,0,0,0,0|1,0,0]=3 1049 B10R1.30 c1cc(c(cc1O)C=O)Br AS02863 [1,1,0,0,0,0|1,0,0]=3 1050 B10R1.30 c1cc(c(cc1O)C=O)F AS03050 [1,1,0,0,0,0|1,0,0]=3 1051 B10R1.61 CC(=O)c1c(cccn1)F AS04769 [1,1,0,0,0,0|2,0,0]=4 1052 B10R1.61 CC(=O)c1ccccc1Br AS01164 [1,1,0,0,0,0|1,0,0]=3 1053 B10R1.61 CC(=O)c1ccccc1Cl AS01142 [1,1,0,0,0,0|1,0,0]=3 1054 B10R1.61 CC(=O)c1ccccc1F AS01129 [1,1,0,0,0,0|1,0,0]=3 1055 B10R1.61 CC(=O)c1ccccc1I AS03911 [1,1,0,0,0,0|1,0,0]=3 1056 B10R1.61 CC(=O)c1ccccc1O AS01159 [1,1,0,0,0,0|0,0,0]=2 1057 B10R1.61 C[C@H](c1ccccc1O)N AS06796 [1,1,0,0,0,0|1,0,1]=4 1058 B10R1.61 Cc1ccccc1[N+](=O)[O-] AS00108 [1,1,0,0,0,0|2,0,0]=4 1059 B10R1.61 c1cc(c(nc1)F)C(=O)O AS04848 [1,1,0,0,0,0|2,0,0]=4 1060 B10R1.61 c1ccc(c(c1)C(=O)Cl)I AS00019 [1,1,0,0,0,0|1,0,0]=3 1061 B10R1.61 c1ccc(c(c1)C(=O)N)Br AS00918 [1,1,0,0,0,0|1,0,0]=3 1062 B10R1.61 c1ccc(c(c1)C(=O)N)Cl AS02678 [1,1,0,0,0,0|1,0,0]=3 1063 B10R1.61 c1ccc(c(c1)C(=O)N)F AS00829 [1,1,0,0,0,0|1,0,0]=3 1064 B10R1.61 c1ccc(c(c1)C(=O)N)I AS02212 [1,1,0,0,0,0|1,0,0]=3 1065 B10R1.61 c1ccc(c(c1)C(=O)O)Br AS00760 [1,1,0,0,0,0|1,0,0]=3 1066 B10R1.61 c1ccc(c(c1)C(=O)O)Cl AS00802 [1,1,0,0,0,0|1,0,0]=3 1067 B10R1.61 c1ccc(c(c1)C(=O)O)F AS00814 [1,1,0,0,0,0|1,0,0]=3 1068 B10R1.61 c1ccc(c(c1)C(=O)O)I AS02216 [1,1,0,0,0,0|1,0,0]=3 1069 B10R1.61 c1ccc(c(c1)C(=O)[O-])F AS00773 [1,1,0,0,0,0|1,0,0]=3 1070 B10R1.61 c1ccc(c(c1)N)[N+](=O)[O-] AS01504 [1,1,0,0,0,0|2,0,0]=4 1071 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])Br AS03439 [1,1,0,0,0,0|2,0,0]=4 1072 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F AS01522 [1,1,0,0,0,0|2,0,0]=4 1073 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F AS04477 [1,1,0,0,0,0|2,0,0]=4 1074 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F AS05721 [1,1,0,0,0,0|2,0,0]=4 1075 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])I AS02273 [1,1,0,0,0,0|2,0,0]=4 1076 B10R1.245 CCc1c(cccc1O)N AS06592 [1,1,0,0,0,0|1,0,1]=4 1077 B10R1.245 COc1c(cccc1Br)O AS06582 [1,1,0,0,0,0|2,0,0]=4 1078 B10R1.245 COc1c(cccc1Cl)O AS06537 [1,1,0,0,0,0|2,0,0]=4 1079 B10R1.245 CSc1c(cccc1Br)O AS06501 [1,1,0,0,0,0|2,0,0]=4 1080 B10R1.245 Cc1cccc(c1C=O)C AS02875 [1,1,0,0,0,0|1,0,0]=3 1081 B10R1.245 Cc1cccc(c1C=O)Cl AS04631 [1,1,0,0,0,0|1,0,0]=3 1082 B10R1.245 Cc1cccc(c1C=O)F AS04975 [1,1,0,0,0,0|1,0,0]=3 1083 B10R1.245 Cc1cccc(c1C=O)O AS06354 [1,1,0,0,0,0|0,0,0]=2 1084 B10R1.245 c1cc(c(c(c1)Br)C#N)O AS05803 [1,1,0,0,0,0|1,0,1]=4 1085 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl AS04968 [1,1,0,0,0,0|1,0,0]=3 1086 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl AS05527 [1,1,0,0,0,0|1,0,0]=3 1087 B10R1.245 c1cc(c(c(c1)Br)C=O)F AS03800 [1,1,0,0,0,0|1,0,0]=3 1088 B10R1.245 c1cc(c(c(c1)Cl)C#N)O AS05816 [1,1,0,0,0,0|1,0,1]=4 1089 B10R1.245 c1cc(c(c(c1)Cl)C=O)F AS03022 [1,1,0,0,0,0|1,0,0]=3 1090 B10R1.245 c1cc(c(c(c1)Cl)C=O)O AS05552 [1,1,0,0,0,0|0,0,0]=2 1091 B10R1.245 c1cc(c(c(c1)F)C#N)O AS01676 [1,1,0,0,0,0|1,0,1]=4 1092 B10R1.245 c1cc(c(c(c1)F)C=O)F AS01453 [1,1,0,0,0,0|1,0,0]=3 1093 B10R1.245 c1cc(c(c(c1)F)C=O)O AS03081 [1,1,0,0,0,0|0,0,0]=2 1094 B10R1.245 c1cc(c(c(c1)I)C=O)F AS03885 [1,1,0,0,0,0|1,0,0]=3 1095 B10R1.245 c1cc(c(c(c1)O)C=O)O AS04668 [1,1,0,0,0,0|0,0,0]=2 1096 B10R1.22 Cc1cc(c(c(c1)Br)Br)Br AS03656 [1,1,0,0,0,0|2,0,0]=4 1097 B10R1.22 Cc1cc(c(c(c1)Br)Br)C AS03540 [1,1,0,0,0,0|2,0,0]=4 1098 B10R1.22 Cc1cc(c(c(c1)Br)Cl)C AS03138 [1,1,0,0,0,0|2,0,0]=4 1099 B10R1.22 Cc1cc(c(c(c1)Br)F)C AS00293 [1,1,0,0,0,0|2,0,0]=4 1100 B10R1.22 Cc1cc(c(c(c1)Br)I)Br AS03568 [1,1,0,0,0,0|2,0,0]=4 1101 B10R1.22 Cc1cc(c(c(c1)Br)I)C AS03237 [1,1,0,0,0,0|2,0,0]=4 1102 B10R1.22 Cc1cc(c(c(c1)Br)N)Br AS03570 [1,1,0,0,0,0|2,0,0]=4 1103 B10R1.22 Cc1cc(c(c(c1)Br)N)C AS03225 [1,1,0,0,0,0|2,0,0]=4 1104 B10R1.22 Cc1cc(c(c(c1)Br)N)F AS03323 [1,1,0,0,0,0|2,0,0]=4 1105 B10R1.22 Cc1cc(c(c(c1)Br)O)Br AS03561 [1,1,0,0,0,0|1,0,1]=4 1106 B10R1.22 Cc1cc(c(c(c1)C)Br)C AS03672 [1,1,0,0,0,0|2,0,0]=4 1107 B10R1.22 Cc1cc(c(c(c1)C)Br)C AS05754 [1,1,0,0,0,0|2,0,0]=4 1108 B10R1.22 Cc1cc(c(c(c1)C)F)C AS05756 [1,1,0,0,0,0|2,0,0]=4 1109 B10R1.22 Cc1cc(c(c(c1)C)N)C AS00416 [1,1,0,0,0,0|2,0,0]=4 1110 B10R1.22 Cc1cc(c(c(c1)C)N)C AS05406 [1,1,0,0,0,0|2,0,0]=4 1111 B10R1.22 Cc1cc(c(c(c1)C)O)C AS04588 [1,1,0,0,0,0|1,0,1]=4 1112 B10R1.22 Cc1cc(c(c(c1)Cl)N)C AS00352 [1,1,0,0,0,0|2,0,0]=4 1113 B10R1.22 Cc1cc(c(c(c1)Cl)N)Cl AS05346 [1,1,0,0,0,0|2,0,0]=4 1114 B10R1.22 Cc1cc(c(c(c1)Cl)O)Cl AS00402 [1,1,0,0,0,0|1,0,1]=4 1115 B10R1.22 Cc1cc(c(c(c1)F)F)F AS02084 [1,1,0,0,0,0|2,0,0]=4 1116 B10R1.22 Cc1cc(c(c(c1)I)Br)Br AS03567 [1,1,0,0,0,0|2,0,0]=4 1117 B10R1.22 Cc1cc(c(c(c1)I)Cl)Br AS03161 [1,1,0,0,0,0|2,0,0]=4 1118 B10R1.22 Cc1cc(c(c(c1)I)I)Br AS03216 [1,1,0,0,0,0|2,0,0]=4 1119 B10R1.22 Cc1cc(c(c(c1)I)N)Br AS03367 [1,1,0,0,0,0|2,0,0]=4 1120 B10R1.22 Cc1cc(c(c(c1)N)N)C AS05684 [1,1,0,0,0,0|2,0,0]=4 1121 B10R1.22 Cc1cc(c(c(c1)N)O)C AS05421 [1,1,0,0,0,0|1,0,1]=4 1122 B10R1.22 Cc1cc(c(c(c1)O)Cl)C AS00203 [1,1,0,0,0,0|1,0,0]=3 1123 B10R1.22 c1c(cc(c(c1O)Cl)F)F AS05461 [1,1,0,0,0,0|2,0,0]=4 1124 B10R1.22 c1c(cc(c(c1O)F)F)Br AS00397 [1,1,0,0,0,0|2,0,0]=4 1125 B10R1.22 c1c(cc(c(c1O)F)F)F AS05513 [1,1,0,0,0,0|2,0,0]=4 1126 B10R1.22 c1c(cc(c(c1O)N)F)F AS00173 [1,1,0,0,0,0|2,0,0]=4 1127 B10R1.22 c1c(cc(c(c1O)O)F)Cl AS05466 [1,1,0,0,0,0|1,0,1]=4 1128 B10R1.118 Cc1cc(c(cc1Br)Br)Br AS00109 [1,1,0,0,0,0|2,0,0]=4 1129 B10R1.118 Cc1cc(c(cc1Br)Br)C AS05695 [1,1,0,0,0,0|2,0,0]=4 1130 B10R1.118 Cc1cc(c(cc1Br)C)Cl AS03139 [1,1,0,0,0,0|1,0,1]=4 1131 B10R1.118 Cc1cc(c(cc1Br)C)N AS03226 [1,1,0,0,0,0|1,0,1]=4 1132 B10R1.118 Cc1cc(c(cc1Br)C)N AS03229 [1,1,0,0,0,0|1,0,1]=4 1133 B10R1.118 Cc1cc(c(cc1Br)C)O AS07207 [1,1,0,0,0,0|0,0,1]=3 1134 B10R1.118 Cc1cc(c(cc1Br)F)N AS04057 [1,1,0,0,0,0|2,0,0]=4 1135 B10R1.118 Cc1cc(c(cc1Br)N)F AS00121 [1,1,0,0,0,0|2,0,0]=4 1136 B10R1.118 Cc1cc(c(cc1C)Br)N AS06829 [1,1,0,0,0,0|2,0,0]=4 1137 B10R1.118 Cc1cc(c(cc1C)Cl)N AS05321 [1,1,0,0,0,0|2,0,0]=4 1138 B10R1.118 Cc1cc(c(cc1C)F)C AS05755 [1,1,0,0,0,0|1,0,1]=4 1139 B10R1.118 Cc1cc(c(cc1C)N)N AS05685 [1,1,0,0,0,0|2,0,0]=4 1140 B10R1.118 Cc1cc(c(cc1Cl)C)Cl AS00297 [1,1,0,0,0,0|1,0,1]=4 1141 B10R1.118 Cc1cc(c(cc1Cl)C)N AS00316 [1,1,0,0,0,0|1,0,1]=4 1142 B10R1.118 Cc1cc(c(cc1Cl)Cl)S AS05519 [1,1,0,0,0,0|1,1,0]=4 1143 B10R1.118 Cc1cc(c(cc1Cl)F)F AS04753 [1,1,0,0,0,0|2,0,0]=4 1144 B10R1.118 Cc1cc(c(cc1Cl)F)N AS05326 [1,1,0,0,0,0|2,0,0]=4 1145 B10R1.118 Cc1cc(c(cc1F)Br)Br AS00123 [1,1,0,0,0,0|2,0,0]=4 1146 B10R1.118 Cc1cc(c(cc1F)Br)Cl AS01026 [1,1,0,0,0,0|2,0,0]=4 1147 B10R1.118 Cc1cc(c(cc1F)Br)I AS03319 [1,1,0,0,0,0|2,0,0]=4 1148 B10R1.118 Cc1cc(c(cc1F)Br)N AS05297 [1,1,0,0,0,0|2,0,0]=4 1149 B10R1.118 Cc1cc(c(cc1F)Cl)Br AS03151 [1,1,0,0,0,0|2,0,0]=4 1150 B10R1.118 Cc1cc(c(cc1F)Cl)N AS02747 [1,1,0,0,0,0|2,0,0]=4 1151 B10R1.118 Cc1cc(c(cc1F)F)Br AS04752 [1,1,0,0,0,0|2,0,0]=4 1152 B10R1.118 Cc1cc(c(cc1F)F)F AS02097 [1,1,0,0,0,0|2,0,0]=4 1153 B10R1.118 Cc1cc(c(cc1F)I)Br AS03320 [1,1,0,0,0,0|2,0,0]=4 1154 B10R1.118 Cc1cc(c(cc1F)I)N AS05375 [1,1,0,0,0,0|2,0,0]=4 1155 B10R1.118 Cc1cc(c(cc1F)N)Br AS04056 [1,1,0,0,0,0|2,0,0]=4 1156 B10R1.118 Cc1cc(c(cc1F)N)N AS05782 [1,1,0,0,0,0|2,0,0]=4 1157 B10R1.118 Cc1cc(c(cc1F)N)N AS06991 [1,1,0,0,0,0|2,0,0]=4 1158 B10R1.118 Cc1cc(c(cc1I)C)Br AS03235 [1,1,0,0,0,0|1,0,1]=4 1159 B10R1.118 Cc1cc(c(cc1N)Br)F AS04058 [1,1,0,0,0,0|2,0,0]=4 1160 B10R1.118 Cc1cc(c(cc1N)Cl)Br AS00437 [1,1,0,0,0,0|2,0,0]=4 1161 B10R1.118 Cc1cc(c(cc1N)F)F AS06838 [1,1,0,0,0,0|2,0,0]=4 1162 B10R1.118 Cc1cc(c(cc1O)C)N AS00209 [1,1,0,0,0,0|0,0,1]=3 1163 B10R1.118 Cc1cc(c(cc1O)F)F AS05483 [1,1,0,0,0,0|1,0,1]=4 1164 B10R1.118 c1c(c(cc(c1Cl)Cl)Cl)O AS05511 [1,1,0,0,0,0|2,0,0]=4 1165 B10R1.118 c1c(c(cc(c1Cl)Cl)O)N AS07179 [1,1,0,0,0,0|2,0,0]=4 1166 B10R1.118 c1c(c(cc(c1F)F)Br)O AS00399 [1,1,0,0,0,0|2,0,0]=4 1167 B10R1.118 c1c(c(cc(c1F)F)F)O AS00169 [1,1,0,0,0,0|2,0,0]=4 1168 B10R1.118 c1c(c(cc(c1F)F)O)N AS06828 [1,1,0,0,0,0|2,0,0]=4 1169 B10R1.118 c1c(c(cc(c1N)O)O)N AS06860 [1,1,0,0,0,0|2,0,0]=4 1170 B10R1.118 c1c(c(cc(c1O)Cl)F)N AS05417 [1,1,0,0,0,0|2,0,0]=4 1171 B10R1.119 CC1=C(C(=O)C=CC1=O)C AS00236 [1,1,0,0,0,0|2,0,0]=4 1172 B10R1.119 Cc1ccc(c(c1Br)C)Br AS00112 [1,1,0,0,0,0|2,0,0]=4 1173 B10R1.119 Cc1ccc(c(c1Br)C)N AS05292 [1,1,0,0,0,0|2,0,0]=4 1174 B10R1.119 Cc1ccc(c(c1Cl)F)Br AS02090 [1,1,0,0,0,0|2,0,0]=4 1175 B10R1.119 Cc1ccc(c(c1F)F)F AS02082 [1,1,0,0,0,0|2,0,0]=4 1176 B10R1.119 Cc1ccc(c(c1N)C)Br AS05293 [1,1,0,0,0,0|2,0,0]=4 1177 B10R1.119 Cc1ccc(c(c1N)C)Cl AS00314 [1,1,0,0,0,0|2,0,0]=4 1178 B10R1.119 Cc1ccc(c(c1N)C)Cl AS02698 [1,1,0,0,0,0|2,0,0]=4 1179 B12R1.46 CC(C)c1cc(ccc1C=O)O AS06478 [0,2,0,0,0,0|2,0,0]=4 1180 B12R1.46 Cc1ccc(c(c1)C(=O)O)OC AS00154 [0,2,0,0,0,0|2,0,0]=4 1181 B12R1.46 Cc1ccc(c(c1)[N+](=O)[O-])C=O AS05609 [0,2,0,0,0,0|0,0,1]=3 1182 B12R1.46 c1cc(c(cc1Br)[N+](=O)[O-])C=O AS02892 [0,2,0,0,0,0|1,0,1]=4 1183 B12R1.46 c1cc(c(cc1Br)[N+](=O)[O-])C=O AS05542 [0,2,0,0,0,0|1,0,1]=4 1184 B12R1.46 c1cc(c(cc1Cl)[N+](=O)[O-])C=O AS03029 [0,2,0,0,0,0|1,0,1]=4 1185 B12R1.46 c1cc(c(cc1Cl)[N+](=O)[O-])C=O AS04640 [0,2,0,0,0,0|1,0,1]=4 1186 B12R1.46 c1cc(c(cc1F)[N+](=O)[O-])C=O AS05600 [0,2,0,0,0,0|1,0,1]=4 1187 B12R1.57 CC(=O)c1ccc(cc1OC)F AS01206 [0,2,0,0,0,0|1,0,0]=3 1188 B12R1.57 COc1cc(ccc1C(=O)O)Br AS00874 [0,2,0,0,0,0|1,0,0]=3 1189 B12R1.57 COc1cc(ccc1C(=O)O)F AS02598 [0,2,0,0,0,0|1,0,0]=3 1190 B12R1.57 COc1cc(ccc1C(=O)O)I AS02241 [0,2,0,0,0,0|1,0,0]=3 1191 B12R1.57 COc1cc(ccc1C(=O)O)N AS01780 [0,2,0,0,0,0|1,0,0]=3 1192 B12R1.57 COc1cc(ccc1C(=O)O)O AS06317 [0,2,0,0,0,0|1,0,0]=3 1193 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Br AS05457 [0,2,0,0,0,0|2,0,0]=4 1194 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Cl AS01382 [0,2,0,0,0,0|2,0,0]=4 1195 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F AS01406 [0,2,0,0,0,0|2,0,0]=4 1196 B12R1.57 Cc1ccc(c(c1)OC)[N+](=O)[O-] AS05504 [0,2,0,0,0,0|1,0,0]=3 1197 B12R1.57 c1cc(c(cc1Cl)CO)[N+](=O)[O-] AS05960 [0,2,0,0,0,0|2,0,0]=4 1198 B12R1.78 CCc1ccc(c(c1)OC)OC AS02528 [0,2,0,0,0,0|2,0,0]=4 1199 B12R1.78 COc1cc(ccc1C=O)C#N AS02784 [0,2,0,0,0,0|0,0,1]=3 1200 B12R1.78 COc1ccc(c(c1)C#N)C=O AS06463 [0,2,0,0,0,0|1,0,0]=3 1201 B12R1.78 COc1ccc(c(c1)OC)C=O AS02817 [0,2,0,0,0,0|0,0,0]=2 1202 B12R1.78 COc1ccc(c(c1)OC)CN AS02517 [0,2,0,0,0,0|1,0,1]=4 1203 B12R1.78 COc1ccc(c(c1)OC)CO AS00570 [0,2,0,0,0,0|0,0,2]=4 1204 B12R1.78 COc1ccc(c(c1)OC)OC AS01075 [0,2,0,0,0,0|2,0,0]=4 1205 B12R1.78 COc1ccc(cc1OC)CN AS02518 [0,2,0,0,0,0|2,0,0]=4 1206 B12R1.78 COc1ccc(cc1OC)CO AS05969 [0,2,0,0,0,0|2,0,0]=4 1207 B12R1.234 COc1cc(cc(c1C=O)F)Cl AS06495 [0,2,0,0,0,0|1,0,0]=3 1208 B12R1.448 COc1cc(c(cc1C=O)F)F AS05587 [0,2,0,0,0,0|1,0,0]=3 1209 B12R1.448 Cc1cc(c(cc1Br)OC)OC AS03220 [0,2,0,0,0,0|2,0,0]=4 1210 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br AS03495 [0,2,0,0,0,0|2,0,0]=4 1211 B12R1.233 CC(=O)Nc1ccc(cc1Br)Cl AS03112 [0,2,0,0,0,0|2,0,0]=4 1212 B12R1.233 CC(=O)Nc1ccc(cc1Br)F AS03257 [0,2,0,0,0,0|2,0,0]=4 1213 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Br AS03113 [0,2,0,0,0,0|2,0,0]=4 1214 B12R1.233 CC(=O)Nc1ccc(cc1Cl)Cl AS02848 [0,2,0,0,0,0|2,0,0]=4 1215 B12R1.233 CC(=O)Nc1ccc(cc1Cl)F AS02716 [0,2,0,0,0,0|2,0,0]=4 1216 B12R1.233 CC(=O)Nc1ccc(cc1F)Br AS03259 [0,2,0,0,0,0|2,0,0]=4 1217 B12R1.233 CC(=O)Nc1ccc(cc1F)Cl AS02718 [0,2,0,0,0,0|2,0,0]=4 1218 B12R1.233 CC(=O)Nc1ccc(cc1F)F AS00792 [0,2,0,0,0,0|2,0,0]=4 1219 B12R1.233 Cc1cc(ccc1CC(=O)O)F AS00504 [0,2,0,0,0,0|2,0,0]=4 1220 B12R1.233 Cc1cc(ccc1NC(=O)C)Br AS03409 [0,2,0,0,0,0|2,0,0]=4 1221 B12R1.233 Cc1ccc(c(c1)Br)NC(=O)C AS03408 [0,2,0,0,0,0|1,0,0]=3 1222 B12R1.233 Cc1ccc(c(c1)Cl)NC(=O)C AS02800 [0,2,0,0,0,0|1,0,0]=3 1223 B12R1.233 Cc1ccc(c(c1)F)CC(=O)O AS01083 [0,2,0,0,0,0|1,0,0]=3 1224 B12R1.233 c1cc(c(cc1Br)F)CC(=O)O AS06078 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.233 c1cc(c(cc1Cl)Br)CC(=O)O AS00523 [0,2,0,0,0,0|2,0,0]=4 1226 B12R1.233 c1cc(c(cc1Cl)F)CC(=O)O AS00536 [0,2,0,0,0,0|2,0,0]=4 1227 B12R1.233 c1cc(c(cc1F)Cl)CC(=O)O AS00526 [0,2,0,0,0,0|2,0,0]=4 1228 B12R1.233 c1cc(c(cc1F)F)CC(=O)O AS01963 [0,2,0,0,0,0|2,0,0]=4 1229 B12R1.233 c1cc(c(cc1N)F)CC(=O)O AS06072 [0,2,0,0,0,0|2,0,0]=4 1230 B12R1.233 c1cc(c(cc1O)F)CC(=O)O AS00528 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.1703 CCC(=O)c1ccc(cc1Cl)Cl AS03866 [0,2,0,0,0,0|2,0,0]=4 1232 B12R1.1703 CCC(=O)c1ccc(cc1F)Br AS06510 [0,2,0,0,0,0|2,0,0]=4 1233 B12R1.1703 CCC(=O)c1ccc(cc1F)F AS03870 [0,2,0,0,0,0|2,0,0]=4 1234 B12R1.1703 CCC(=O)c1ccc(cc1O)O AS07000 [0,2,0,0,0,0|1,0,0]=3 1235 B12R1.1703 CNC(=O)c1ccc(cc1Br)F AS02440 [0,2,0,0,0,0|2,0,0]=4 1236 B12R1.1703 CNC(=O)c1ccc(cc1F)Br AS05903 [0,2,0,0,0,0|2,0,0]=4 1237 B12R1.1703 CNC(=O)c1ccc(cc1F)I AS04599 [0,2,0,0,0,0|2,0,0]=4 1238 B12R1.1703 COC(=O)c1ccc(cc1Cl)Cl AS02939 [0,2,0,0,0,0|2,0,0]=4 1239 B12R1.1703 COC(=O)c1ccc(cc1Cl)N AS01770 [0,2,0,0,0,0|2,0,0]=4 1240 B12R1.1703 COC(=O)c1ccc(cc1F)F AS01306 [0,2,0,0,0,0|2,0,0]=4 1241 B12R1.1703 COC(=O)c1ccc(cc1F)O AS01245 [0,2,0,0,0,0|2,0,0]=4 1242 B12R1.1703 COC(=O)c1ccc(cc1I)Cl AS02930 [0,2,0,0,0,0|2,0,0]=4 1243 B12R1.1703 COC(=O)c1ccc(cc1N)Br AS01768 [0,2,0,0,0,0|2,0,0]=4 1244 B12R1.1703 COC(=O)c1ccc(cc1O)Br AS03632 [0,2,0,0,0,0|1,0,0]=3 1245 B12R1.1703 COC(=O)c1ccc(cc1O)F AS01320 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.1703 COC(=O)c1ccc(cc1O)I AS02314 [0,2,0,0,0,0|1,0,0]=3 1247 B12R1.1703 Cc1cc(ccc1C(=O)OC)F AS00096 [0,2,0,0,0,0|2,0,0]=4 1248 B12R1.1703 Cc1cc(ccc1C(=O)OC)N AS04604 [0,2,0,0,0,0|2,0,0]=4 1249 B12R1.1703 Cc1ccc(c(c1)C)C(=O)CBr AS05109 [0,2,0,0,0,0|1,0,0]=3 1250 B12R1.1703 c1cc(c(cc1Cl)Cl)C(=O)CBr AS01181 [0,2,0,0,0,0|2,0,0]=4 1251 B12R1.1703 c1cc(c(cc1Cl)Cl)C(=O)CN AS05076 [0,2,0,0,0,0|2,0,0]=4 1252 B12R1.1703 c1cc(c(cc1F)F)C(=O)CBr AS05106 [0,2,0,0,0,0|2,0,0]=4 1253 B12R1.1703 c1cc(c(cc1F)F)C(=O)CCl AS04008 [0,2,0,0,0,0|2,0,0]=4 1254 B12R1.1703 c1cc(c(cc1F)F)C(=O)NN AS00256 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.126 Cc1ccc(c(c1)C)S(=O)(=O)Cl AS05041 [0,2,0,0,0,0|2,0,0]=4 1256 B12R1.126 Cc1ccc(c(c1)F)S(=O)(=O)Cl AS05029 [0,2,0,0,0,0|2,0,0]=4 1257 B12R1.232 CC(=O)c1cc(c(cc1Cl)Cl)F AS01146 [0,2,0,0,0,0|2,0,0]=4 1258 B12R1.232 CC(=O)c1cc(c(cc1F)Br)F AS05255 [0,2,0,0,0,0|2,0,0]=4 1259 B12R1.232 CC(=O)c1cc(c(cc1F)F)Br AS06901 [0,2,0,0,0,0|2,0,0]=4 1260 B12R1.232 CC(=O)c1cc(c(cc1F)F)F AS01177 [0,2,0,0,0,0|2,0,0]=4 1261 B12R1.232 CC(=O)c1cc(c(cc1N)Br)F AS05069 [0,2,0,0,0,0|2,0,0]=4 1262 B12R1.232 CC(=O)c1cc(c(cc1N)Cl)Br AS05068 [0,2,0,0,0,0|2,0,0]=4 1263 B12R1.232 CC(=O)c1cc(c(cc1N)Cl)F AS05074 [0,2,0,0,0,0|2,0,0]=4 1264 B12R1.232 CC(=O)c1cc(c(cc1O)F)F AS05169 [0,2,0,0,0,0|1,0,0]=3 1265 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)O AS01805 [0,2,0,0,0,0|2,0,0]=4 1266 B12R1.232 Cc1cc(c(cc1C(=O)O)Br)C AS06300 [0,2,0,0,0,0|1,0,0]=3 1267 B12R1.232 Cc1cc(c(cc1C(=O)O)F)F AS05008 [0,2,0,0,0,0|2,0,0]=4 1268 B12R1.232 Cc1cc(c(cc1C)O)C(=O)C AS05182 [0,2,0,0,0,0|0,0,0]=2 1269 B12R1.232 Cc1cc(c(cc1C)[N+](=O)[O-])N AS05372 [0,2,0,0,0,0|2,0,0]=4 1270 B12R1.232 Cc1cc(c(cc1Cl)[N+](=O)[O-])O AS06982 [0,2,0,0,0,0|1,0,0]=3 1271 B12R1.232 Cc1cc(c(cc1F)C(=O)O)F AS01850 [0,2,0,0,0,0|1,0,0]=3 1272 B12R1.232 Cc1cc(c(cc1F)C(=O)O)F AS05005 [0,2,0,0,0,0|1,0,0]=3 1273 B12R1.232 Cc1cc(c(cc1F)F)C(=O)O AS05003 [0,2,0,0,0,0|2,0,0]=4 1274 B12R1.232 Cc1cc(c(cc1F)[N+](=O)[O-])F AS01570 [0,2,0,0,0,0|2,0,0]=4 1275 B12R1.232 Cc1cc(c(cc1F)[N+](=O)[O-])N AS06992 [0,2,0,0,0,0|2,0,0]=4 1276 B12R1.232 Cc1cc(c(cc1F)[N+](=O)[O-])O AS07238 [0,2,0,0,0,0|1,0,0]=3 1277 B12R1.232 Cc1cc(c(cc1N)[N+](=O)[O-])C AS05370 [0,2,0,0,0,0|2,0,0]=4 1278 B12R1.232 Cc1cc(c(cc1N)[N+](=O)[O-])F AS05379 [0,2,0,0,0,0|2,0,0]=4 1279 B12R1.232 Cc1cc(c(cc1[N+](=O)[O-])Br)C AS05648 [0,2,0,0,0,0|2,0,0]=4 1280 B12R1.232 c1c(c(cc(c1Br)Cl)F)C(=O)O AS03150 [0,2,0,0,0,0|2,0,0]=4 1281 B12R1.232 c1c(c(cc(c1Cl)Cl)F)C(=O)O AS02480 [0,2,0,0,0,0|2,0,0]=4 1282 B12R1.232 c1c(c(cc(c1Cl)F)F)C(=O)O AS01824 [0,2,0,0,0,0|2,0,0]=4 1283 B12R1.232 c1c(c(cc(c1F)Br)Cl)C(=O)O AS04399 [0,2,0,0,0,0|2,0,0]=4 1284 B12R1.232 c1c(c(cc(c1F)Br)N)C(=O)O AS06892 [0,2,0,0,0,0|2,0,0]=4 1285 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)Cl AS00060 [0,2,0,0,0,0|2,0,0]=4 1286 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)O AS02478 [0,2,0,0,0,0|2,0,0]=4 1287 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)Cl AS00027 [0,2,0,0,0,0|2,0,0]=4 1288 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)O AS00748 [0,2,0,0,0,0|2,0,0]=4 1289 B12R1.232 c1c(c(cc(c1F)F)Br)C(=O)O AS00957 [0,2,0,0,0,0|2,0,0]=4 1290 B12R1.232 c1c(c(cc(c1F)F)Cl)C(=O)O AS00728 [0,2,0,0,0,0|2,0,0]=4 1291 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)Cl AS00055 [0,2,0,0,0,0|2,0,0]=4 1292 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)O AS01907 [0,2,0,0,0,0|2,0,0]=4 1293 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)[O-] AS00785 [0,2,0,0,0,0|2,0,0]=4 1294 B12R1.232 c1c(c(cc(c1F)F)N)C(=O)O AS00954 [0,2,0,0,0,0|2,0,0]=4 1295 B12R1.232 c1c(c(cc(c1F)N)F)C(=O)O AS04995 [0,2,0,0,0,0|2,0,0]=4 1296 B12R1.452 CC(=O)c1ccc(cc1F)OC AS01205 [0,2,0,0,0,0|1,0,0]=3 1297 B12R1.452 CC(=O)c1ccc(cc1N)OC AS05088 [0,2,0,0,0,0|1,0,0]=3 1298 B12R1.452 CC(=O)c1ccc(cc1O)OC AS05193 [0,2,0,0,0,0|0,0,0]=2 1299 B12R1.452 COc1ccc(c(c1)Br)C(=O)O AS04623 [0,2,0,0,0,0|1,0,0]=3 1300 B12R1.452 COc1ccc(c(c1)F)C(=O)Cl AS00075 [0,2,0,0,0,0|1,0,0]=3 1301 B12R1.452 COc1ccc(c(c1)F)C(=O)O AS02487 [0,2,0,0,0,0|1,0,0]=3 1302 B12R1.452 COc1ccc(c(c1)F)C(=O)O AS02597 [0,2,0,0,0,0|1,0,0]=3 1303 B12R1.452 COc1ccc(c(c1)F)[N+](=O)[O-] AS01402 [0,2,0,0,0,0|2,0,0]=4 1304 B12R1.452 COc1ccc(c(c1)I)[N+](=O)[O-] AS05501 [0,2,0,0,0,0|2,0,0]=4 1305 B12R1.452 COc1ccc(c(c1)N)C(=O)N AS04407 [0,2,0,0,0,0|1,0,0]=3 1306 B12R1.452 COc1ccc(c(c1)N)C(=O)O AS04457 [0,2,0,0,0,0|1,0,0]=3 1307 B12R1.452 COc1ccc(c(c1)N)[N+](=O)[O-] AS01000 [0,2,0,0,0,0|2,0,0]=4 1308 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] AS05502 [0,2,0,0,0,0|1,0,0]=3 1309 B12R1.452 Cc1cc(ccc1C(=O)O)OC AS07027 [0,2,0,0,0,0|1,0,0]=3 1310 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])CBr AS06878 [0,2,0,0,0,0|2,0,0]=4 1311 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])CO AS05992 [0,2,0,0,0,0|2,0,0]=4 1312 B12R1.452 Cc1cc(ccc1[N+](=O)[O-])OC AS01409 [0,2,0,0,0,0|2,0,0]=4 1313 B12R1.452 c1cc(c(cc1C#N)F)C(=O)O AS01838 [0,2,0,0,0,0|1,0,1]=4 1314 B12R1.452 c1cc(c(cc1CBr)F)[N+](=O)[O-] AS05981 [0,2,0,0,0,0|2,0,0]=4 1315 B12R1.893 CC(=O)c1ccc(c(c1F)F)F AS04043 [0,2,0,0,0,0|2,0,0]=4 1316 B12R1.893 CC(=O)c1ccc(c(c1F)F)F AS05274 [0,2,0,0,0,0|2,0,0]=4 1317 B12R1.893 CC(=O)c1ccc(c(c1F)O)F AS05166 [0,2,0,0,0,0|2,0,0]=4 1318 B12R1.893 Cc1c(ccc(c1F)C(=O)O)F AS01849 [0,2,0,0,0,0|2,0,0]=4 1319 B12R1.893 Cc1c(ccc(c1F)C(=O)O)F AS05002 [0,2,0,0,0,0|2,0,0]=4 1320 B12R1.893 Cc1c(ccc(c1F)F)C(=O)O AS04504 [0,2,0,0,0,0|2,0,0]=4 1321 B12R1.893 Cc1c(ccc(c1F)F)C(=O)O AS05006 [0,2,0,0,0,0|2,0,0]=4 1322 B12R1.893 Cc1ccc(c(c1C)N)C(=O)O AS01774 [0,2,0,0,0,0|1,0,0]=3 1323 B12R1.893 Cc1ccc(c(c1F)C)[N+](=O)[O-] AS05717 [0,2,0,0,0,0|2,0,0]=4 1324 B12R1.893 Cc1ccc(c(c1F)F)C(=O)C AS05174 [0,2,0,0,0,0|1,0,0]=3 1325 B12R1.893 c1cc(c(c(c1C(=O)Cl)F)Cl)F AS01823 [0,2,0,0,0,0|2,0,0]=4 1326 B12R1.893 c1cc(c(c(c1C(=O)Cl)F)F)F AS00054 [0,2,0,0,0,0|2,0,0]=4 1327 B12R1.893 c1cc(c(c(c1C(=O)O)Cl)Cl)F AS01843 [0,2,0,0,0,0|2,0,0]=4 1328 B12R1.893 c1cc(c(c(c1C(=O)O)F)Cl)F AS00767 [0,2,0,0,0,0|2,0,0]=4 1329 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Br AS01795 [0,2,0,0,0,0|2,0,0]=4 1330 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)F AS01904 [0,2,0,0,0,0|2,0,0]=4 1331 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)N AS01772 [0,2,0,0,0,0|2,0,0]=4 1332 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)O AS00960 [0,2,0,0,0,0|2,0,0]=4 1333 B12R1.893 c1cc(c(c(c1C(=O)O)F)O)F AS01846 [0,2,0,0,0,0|2,0,0]=4 1334 B12R1.893 c1cc(c(c(c1C(=O)O)O)F)F AS00740 [0,2,0,0,0,0|1,0,0]=3 1335 B12R1.893 c1cc(c(c(c1C(=O)[O-])F)F)F AS00786 [0,2,0,0,0,0|2,0,0]=4 1336 B12R1.1000 CC(=O)c1c(cc(cc1F)Cl)F AS05135 [0,2,0,0,0,0|2,0,0]=4 1337 B12R1.1000 CC(=O)c1c(cc(cc1F)F)F AS04016 [0,2,0,0,0,0|2,0,0]=4 1338 B12R1.1000 CC(=O)c1c(cc(cc1O)O)O AS01157 [0,2,0,0,0,0|1,0,0]=3 1339 B12R1.1000 Cc1cc(c(c(=O)[nH]1)[N+](=O)[O-])O AS00897 [0,2,0,0,0,0|2,0,0]=4 1340 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)O)C AS06278 [0,2,0,0,0,0|0,0,0]=2 1341 B12R1.1000 c1c(cc(c(c1Cl)C(=O)Cl)Cl)Cl AS06873 [0,2,0,0,0,0|2,0,0]=4 1342 B12R1.1000 c1c(cc(c(c1Cl)C(=O)O)Cl)Cl AS06872 [0,2,0,0,0,0|2,0,0]=4 1343 B12R1.1000 c1c(cc(c(c1F)C(=O)Cl)F)F AS00059 [0,2,0,0,0,0|2,0,0]=4 1344 B12R1.1000 c1c(cc(c(c1F)C(=O)O)Cl)Cl AS00146 [0,2,0,0,0,0|2,0,0]=4 1345 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)Br AS01796 [0,2,0,0,0,0|2,0,0]=4 1346 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)F AS01908 [0,2,0,0,0,0|2,0,0]=4 1347 B12R1.1000 c1c(cc(c(c1O)[N+](=O)[O-])F)F AS04465 [0,2,0,0,0,0|2,0,0]=4 1348 B12R1.14 c1c(c(c(c(c1F)F)F)F)C=O AS01486 [0,2,0,0,0,0|2,0,0]=4 1349 B12R1.98 c1c(c(c(c(c1F)Cl)F)C=O)F AS05567 [0,2,0,0,0,0|2,0,0]=4 1350 B12R1.450 COc1cc(c(cc1F)OC)O AS00175 [0,2,0,0,0,0|2,0,0]=4 1351 B12R1.653 COc1ccc(c(c1O)Cl)C=O AS05555 [0,2,0,0,0,0|1,0,0]=3 1352 B12R1.48 c1cc(c(cc1C(=O)O)Br)C=O AS06280 [0,2,0,0,0,0|1,0,1]=4 1353 B12R1.48 c1cc(c(cc1[N+](=O)[O-])F)C=O AS02992 [0,2,0,0,0,0|2,0,0]=4 1354 B12R1.48 c1cc(c(cc1[N+](=O)[O-])O)C=O AS06350 [0,2,0,0,0,0|1,0,0]=3 1355 B12R1.288 CCOc1ccc(c(c1)O)C=O AS06248 [0,2,0,0,0,0|0,0,0]=2 1356 B12R1.301 COc1cc(c(c(c1)Cl)C=O)Cl AS05582 [0,2,0,0,0,0|1,0,0]=3 1357 B12R1.301 COc1cc(c(c(c1)F)C=O)F AS05588 [0,2,0,0,0,0|1,0,0]=3 1358 B12R1.301 c1c(cc(c(c1Cl)C=O)Cl)C#N AS05572 [0,2,0,0,0,0|1,0,1]=4 1359 B12R1.301 c1c(cc(c(c1F)C=O)F)C#N AS01448 [0,2,0,0,0,0|1,0,1]=4 1360 B12R2.612 c1cc2c(cc1Br)COC2=O AS07099 [0,1,0,1,0,0|1,0,0]=3 1361 B12R2.612 c1cc2c(cc1Br)OCC2=O AS06368 [0,1,0,1,0,0|1,0,0]=3 1362 B12R2.612 c1cc2c(cc1Br)onc2Cl AS06283 [0,1,0,1,0,0|2,0,0]=4 1363 B12R2.612 c1cc2c(cc1Cl)CCC2=O AS04658 [0,1,0,1,0,0|2,0,0]=4 1364 B12R2.612 c1cc2c(cc1Cl)OCC2=O AS06461 [0,1,0,1,0,0|1,0,0]=3 1365 B12R2.612 c1cc2c(cc1Cl)onc2O AS06205 [0,1,0,1,0,0|1,0,1]=4 1366 B12R2.612 c1cc2c(cc1F)OCC2=O AS06460 [0,1,0,1,0,0|1,0,0]=3 1367 B12R2.612 c1cc2c(cc1O)OCC2=O AS06432 [0,1,0,1,0,0|1,0,0]=3 1368 B12R2.246 Cc1cc2ccoc2c(c1)Br AS06431 [0,1,0,1,0,0|2,0,0]=4 1369 B12R2.606 c1cc2c(cc1F)NC(=O)C2 AS06884 [0,1,0,1,0,0|2,0,0]=4 1370 B12R2.82 c1cc(c(c2c1cco2)Br)F AS06424 [0,1,0,1,0,0|2,0,0]=4 1371 B12R2.44 c1cc(cc2c1cco2)C#N AS06430 [0,1,0,1,0,0|1,0,1]=4 1372 B12R2.44 c1cc(cc2c1cco2)C=O AS06420 [0,1,0,1,0,0|1,0,1]=4 1373 B8R1.11 c1csc(c1C=O)Br AS06533 [1,0,0,0,1,0|2,0,0]=4