0 B10R1.61 CC(=O)c1ccccc1Br CM11134 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.61 CC(=O)c1ccccc1I CM11218 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.61 CC(C)c1ccccc1Br CM12111 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.61 CN(C)c1ccccc1F CM11439 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.61 Cc1c(cccn1)[N+](=O)[O-] CM14024 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.61 c1ccc(c(c1)C(=O)N)I CM13180 [0,0,0,0,0,0|1,0,0]=1 6 B10R1.61 c1ccc(c(c1)C(=O)O)F CM12709 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.61 c1ccc(c(c1)C(=O)O)I CM12818 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.61 c1ccc(c(c1)[N+](=O)[O-])F CM12272 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 c1cncc(c1Br)C(=O)O CM14036 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.6 c1cc(c[nH+]c1)C(=N)N CM13840 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.6 c1ccnc(c1)C(=N)N CM13839 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.6 c1cncnc1C(=O)O CM10263 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.15 CSc1ccccc1I CM11822 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.15 Cc1ccncc1C=O CM10260 [1,0,0,0,0,0|2,0,0]=3 15 B9R1.15 c1ccc(c(c1)C#N)F CM13066 [1,0,0,0,0,0|1,0,2]=4 16 B9R1.15 c1ccc(c(c1)C#N)I CM13126 [1,0,0,0,0,0|1,0,2]=4 17 B9R1.15 c1ccc(c(c1)C=O)I CM11995 [1,0,0,0,0,0|1,0,0]=2 18 B9R1.15 c1ccc(c(c1)CBr)Cl CM13308 [1,0,0,0,0,0|2,0,1]=4 19 B9R1.15 c1ccc(c(c1)CCl)F CM13406 [1,0,0,0,0,0|2,0,1]=4 20 B9R1.15 c1ccc(c(c1)CN)F CM13538 [1,0,0,0,0,0|1,0,1]=3 21 B9R1.15 c1ccc(c(c1)NN)Br CM13792 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.15 c1cncc(c1O)C#N CM10064 [1,0,0,0,0,0|1,0,2]=4 23 B11R1.53 CC(=O)c1cccnc1OC CM10529 [0,1,0,0,0,0|2,0,0]=3 24 B11R1.53 COc1c(nccn1)C(=O)O CM10657 [0,1,0,0,0,0|3,0,0]=4 25 B11R1.53 c1ccc(c(c1)C#N)C(=O)O CM12612 [0,1,0,0,0,0|2,0,0]=3 26 B11R1.87 c1ccc(c(c1)C(F)(F)F)O CM11808 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.87 c1ccc(c(c1)F)S(=O)(=O)Cl CM13638 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.156 CC(=O)c1c(cccc1Cl)F CM11160 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.156 CC(=O)c1c(cccc1F)F CM11189 [0,1,0,0,0,0|2,0,0]=3 30 B11R1.156 CC(=O)c1c(cccc1F)O CM11199 [0,1,0,0,0,0|1,0,0]=2 31 B11R1.156 CC(C)c1c(cccc1O)N CM10168 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.156 Cc1cccc(c1C(=O)Cl)F CM12764 [0,1,0,0,0,0|2,0,0]=3 33 B11R1.156 Cc1cccc(c1C(=O)O)Br CM12533 [0,1,0,0,0,0|2,0,0]=3 34 B11R1.156 Cc1cccc(c1C(=O)O)C CM12702 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.156 Cc1cccc(c1C(=O)O)Cl CM12593 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.156 Cc1cccc(c1C(=O)O)F CM12763 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.156 Cc1cccc(c1[N+](=O)[O-])Br CM10307 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.156 Cc1cccc(c1[N+](=O)[O-])Cl CM13947 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.156 Cc1cccc(c1[N+](=O)[O-])N CM10315 [0,1,0,0,0,0|3,0,0]=4 40 B11R1.156 Cc1cccc(c1[N+](=O)[O-])O CM11792 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.156 c1c(c(c(cn1)F)C(=O)O)F CM10664 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)Br CM12637 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)Cl CM12460 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)F CM12491 [0,1,0,0,0,0|2,0,0]=3 45 B11R1.156 c1cc(c(c(c1)Br)C(=O)O)N CM12351 [0,1,0,0,0,0|2,0,0]=3 46 B11R1.156 c1cc(c(c(c1)Br)[N+](=O)[O-])F CM12092 [0,1,0,0,0,0|3,0,0]=4 47 B11R1.156 c1cc(c(c(c1)Br)[N+](=O)[O-])N CM11323 [0,1,0,0,0,0|3,0,0]=4 48 B11R1.156 c1cc(c(c(c1)Cl)[N+](=O)[O-])F CM12144 [0,1,0,0,0,0|3,0,0]=4 49 B11R1.156 c1cc(c(c(c1)Cl)[N+](=O)[O-])N CM11380 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.156 c1cc(c(c(c1)F)C(=O)Cl)F CM12660 [0,1,0,0,0,0|2,0,0]=3 51 B11R1.156 c1cc(c(c(c1)F)C(=O)N)F CM13172 [0,1,0,0,0,0|1,0,0]=2 52 B11R1.156 c1cc(c(c(c1)F)C(=O)O)F CM12659 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.156 c1cc(c(c(c1)F)C(=O)O)N CM12400 [0,1,0,0,0,0|2,0,0]=3 54 B11R1.156 c1cc(c(c(c1)F)C(=O)O)O CM10856 [0,1,0,0,0,0|1,0,0]=2 55 B11R1.156 c1cc(c(c(c1)F)[N+](=O)[O-])F CM12227 [0,1,0,0,0,0|3,0,0]=4 56 B11R1.156 c1cc(c(c(c1)F)[N+](=O)[O-])N CM11478 [0,1,0,0,0,0|3,0,0]=4 57 B11R1.156 c1cc(c(c(c1)F)[N+](=O)[O-])O CM11765 [0,1,0,0,0,0|2,0,0]=3 58 B11R1.156 c1cc(c(c(c1)I)C(=O)Cl)F CM12737 [0,1,0,0,0,0|2,0,0]=3 59 B11R1.156 c1cc(c(c(c1)I)C(=O)N)Cl CM13169 [0,1,0,0,0,0|1,0,0]=2 60 B11R1.156 c1cc(c(c(c1)I)C(=O)O)F CM12736 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.159 CC(=O)c1cccc(c1Cl)Cl CM11179 [0,1,0,0,0,0|2,0,0]=3 62 B11R1.159 CC(=O)c1cccc(c1F)Br CM11143 [0,1,0,0,0,0|2,0,0]=3 63 B11R1.159 CC(=O)c1cccc(c1F)F CM10559 [0,1,0,0,0,0|2,0,0]=3 64 B11R1.159 CC(=O)c1cccc(c1N)Br CM11120 [0,1,0,0,0,0|2,0,0]=3 65 B11R1.159 CC(C)c1cccc(c1O)Cl CM10891 [0,1,0,0,0,0|2,0,1]=4 66 B11R1.159 Cc1c(cccc1Br)[N+](=O)[O-] CM13936 [0,1,0,0,0,0|3,0,0]=4 67 B11R1.159 Cc1c(cccc1Cl)C(=O)O CM12594 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.159 Cc1c(cccc1F)[N+](=O)[O-] CM13963 [0,1,0,0,0,0|3,0,0]=4 69 B11R1.159 Cc1c(cccc1I)C(=O)O CM12823 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.159 Cc1cccc(c1Br)C(=O)O CM12530 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.159 Cc1cccc(c1Br)[N+](=O)[O-] CM13934 [0,1,0,0,0,0|3,0,0]=4 72 B11R1.159 Cc1cccc(c1C)C(=O)Cl CM12700 [0,1,0,0,0,0|2,0,0]=3 73 B11R1.159 Cc1cccc(c1F)C(=O)O CM12758 [0,1,0,0,0,0|2,0,0]=3 74 B11R1.159 Cc1cccc(c1F)[N+](=O)[O-] CM13960 [0,1,0,0,0,0|3,0,0]=4 75 B11R1.159 Cc1cccc(c1I)C(=O)O CM12822 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.159 Cc1cccc(c1N)[N+](=O)[O-] CM11505 [0,1,0,0,0,0|3,0,0]=4 77 B11R1.159 c1cc(c(c(c1)Br)Br)C(=O)O CM12635 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)Cl CM12494 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.159 c1cc(c(c(c1)Br)F)C(=O)O CM12493 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.159 c1cc(c(c(c1)Br)F)[N+](=O)[O-] CM12093 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.159 c1cc(c(c(c1)Br)I)[N+](=O)[O-] CM12103 [0,1,0,0,0,0|3,0,0]=4 82 B11R1.159 c1cc(c(c(c1)Br)N)C(=O)O CM12347 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.159 c1cc(c(c(c1)Br)O)C(=O)O CM12512 [0,1,0,0,0,0|1,0,0]=2 84 B11R1.159 c1cc(c(c(c1)Br)O)[N+](=O)[O-] CM11661 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.159 c1cc(c(c(c1)Cl)Br)C(=O)O CM10327 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.159 c1cc(c(c(c1)Cl)Br)[N+](=O)[O-] CM10245 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.159 c1cc(c(c(c1)Cl)Cl)C(=O)O CM12640 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)Cl CM12574 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.159 c1cc(c(c(c1)Cl)F)C(=O)O CM12573 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.159 c1cc(c(c(c1)Cl)F)[N+](=O)[O-] CM12145 [0,1,0,0,0,0|3,0,0]=4 91 B11R1.159 c1cc(c(c(c1)Cl)N)C(=O)O CM12358 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.159 c1cc(c(c(c1)Cl)N)[N+](=O)[O-] CM10244 [0,1,0,0,0,0|3,0,0]=4 93 B11R1.159 c1cc(c(c(c1)Cl)O)C(=O)O CM12584 [0,1,0,0,0,0|1,0,0]=2 94 B11R1.159 c1cc(c(c(c1)F)Br)C(=O)O CM12486 [0,1,0,0,0,0|2,0,0]=3 95 B11R1.159 c1cc(c(c(c1)F)Br)[N+](=O)[O-] CM12089 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.159 c1cc(c(c(c1)F)Cl)C(=O)O CM12572 [0,1,0,0,0,0|2,0,0]=3 97 B11R1.159 c1cc(c(c(c1)F)Cl)[N+](=O)[O-] CM12142 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.159 c1cc(c(c(c1)F)F)C(=O)O CM12654 [0,1,0,0,0,0|2,0,0]=3 99 B11R1.159 c1cc(c(c(c1)F)F)[N+](=O)[O-] CM12225 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.159 c1cc(c(c(c1)F)I)C(=O)O CM12738 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.159 c1cc(c(c(c1)F)I)[N+](=O)[O-] CM12267 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.159 c1cc(c(c(c1)F)N)C(=O)N CM13165 [0,1,0,0,0,0|1,0,0]=2 103 B11R1.159 c1cc(c(c(c1)F)N)C(=O)O CM12394 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.159 c1cc(c(c(c1)F)N)[N+](=O)[O-] CM11477 [0,1,0,0,0,0|3,0,0]=4 105 B11R1.159 c1cc(c(c(c1)F)O)C(=O)O CM12720 [0,1,0,0,0,0|1,0,0]=2 106 B11R1.159 c1cc(c(c(c1)I)F)C(=O)O CM12731 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.159 c1cc(c(c(c1)N)F)C(=O)O CM12402 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.159 c1cc(c(c(c1)O)Br)C(=O)O CM10231 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.159 c1cc(c(c(c1)O)F)C(=O)O CM12713 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.159 c1cc(c(c(c1)O)I)C(=O)O CM10894 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.159 c1cnc(c(c1Cl)Cl)C(=O)O CM10274 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.166 CC(=O)c1ccc(cc1Br)N CM11122 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl CM11180 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.166 CC(=O)c1ccc(cc1Cl)F CM11158 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.166 CC(=O)c1ccc(cc1Cl)O CM11165 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.166 CC(=O)c1ccc(cc1F)Br CM11145 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.166 CC(=O)c1ccc(cc1F)Cl CM11163 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.166 CC(=O)c1ccc(cc1N)F CM10552 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.166 CC(=O)c1ccc(cc1O)Br CM14016 [0,1,0,0,0,0|1,0,0]=2 120 B11R1.166 CC(=O)c1ccc(cc1O)Cl CM14015 [0,1,0,0,0,0|1,0,0]=2 121 B11R1.166 CC(=O)c1ccc(cc1O)F CM14014 [0,1,0,0,0,0|1,0,0]=2 122 B11R1.166 CC(=O)c1ccc(cc1O)N CM11128 [0,1,0,0,0,0|1,0,0]=2 123 B11R1.166 Cc1cc(ccc1C(=O)O)F CM12767 [0,1,0,0,0,0|2,0,0]=3 124 B11R1.166 Cc1cc(ccc1[N+](=O)[O-])F CM13968 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.166 Cc1ccc(c(c1)C)C(=O)O CM10965 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O CM12591 [0,1,0,0,0,0|2,0,0]=3 127 B11R1.166 Cc1ccc(c(c1)F)C(=O)O CM10021 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.166 Cc1ccc(c(c1)F)[N+](=O)[O-] CM13964 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.166 Cc1ccc(c(c1)N)C(=O)O CM12428 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.166 c1cc(c(cc1Br)Br)C(=O)N CM13171 [0,1,0,0,0,0|1,0,0]=2 131 B11R1.166 c1cc(c(cc1Br)Br)C(=O)O CM12636 [0,1,0,0,0,0|2,0,0]=3 132 B11R1.166 c1cc(c(cc1Br)F)C(=O)O CM12499 [0,1,0,0,0,0|2,0,0]=3 133 B11R1.166 c1cc(c(cc1Br)F)[N+](=O)[O-] CM12095 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.166 c1cc(c(cc1Br)I)[N+](=O)[O-] CM12104 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.166 c1cc(c(cc1Br)N)C(=O)O CM12349 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.166 c1cc(c(cc1Br)N)[N+](=O)[O-] CM11327 [0,1,0,0,0,0|3,0,0]=4 137 B11R1.166 c1cc(c(cc1Br)O)C(=O)O CM12513 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.166 c1cc(c(cc1Br)O)[N+](=O)[O-] CM11665 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.166 c1cc(c(cc1Cl)Br)C(=O)O CM12458 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.166 c1cc(c(cc1Cl)F)C(=O)O CM12577 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.166 c1cc(c(cc1Cl)F)[N+](=O)[O-] CM12146 [0,1,0,0,0,0|3,0,0]=4 142 B11R1.166 c1cc(c(cc1Cl)N)C(=O)N CM13164 [0,1,0,0,0,0|1,0,0]=2 143 B11R1.166 c1cc(c(cc1Cl)N)C(=O)O CM12359 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.166 c1cc(c(cc1Cl)N)[N+](=O)[O-] CM11382 [0,1,0,0,0,0|3,0,0]=4 145 B11R1.166 c1cc(c(cc1Cl)O)C(=O)O CM12585 [0,1,0,0,0,0|1,0,0]=2 146 B11R1.166 c1cc(c(cc1F)Br)C(=O)O CM12488 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.166 c1cc(c(cc1F)Br)[N+](=O)[O-] CM12090 [0,1,0,0,0,0|3,0,0]=4 148 B11R1.166 c1cc(c(cc1F)Cl)[N+](=O)[O-] CM12143 [0,1,0,0,0,0|3,0,0]=4 149 B11R1.166 c1cc(c(cc1F)F)C(=O)O CM12655 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.166 c1cc(c(cc1F)N)C(=O)O CM12396 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.166 c1cc(c(cc1F)N)[N+](=O)[O-] CM11481 [0,1,0,0,0,0|3,0,0]=4 152 B11R1.166 c1cc(c(cc1F)O)C(=O)O CM10955 [0,1,0,0,0,0|1,0,0]=2 153 B11R1.166 c1cc(c(cc1F)O)[N+](=O)[O-] CM11775 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.166 c1cc(c(cc1I)F)C(=O)O CM12733 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.166 c1cc(c(cc1I)F)[N+](=O)[O-] CM10226 [0,1,0,0,0,0|3,0,0]=4 156 B11R1.166 c1cc(c(cc1N)Br)[N+](=O)[O-] CM11324 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.166 c1cc(c(cc1N)Cl)C(=O)O CM12361 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.166 c1cc(c(cc1N)F)C(=O)O CM12405 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.166 c1cc(c(cc1O)Cl)[N+](=O)[O-] CM11695 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.166 c1cc(c(cc1O)F)[N+](=O)[O-] CM11771 [0,1,0,0,0,0|3,0,0]=4 161 B11R1.166 c1cc(c(cc1O)I)C(=O)O CM10163 [0,1,0,0,0,0|2,0,0]=3 162 B11R1.166 c1cc(c(cc1O)O)[N+](=O)[O-] CM10296 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.167 CC(=O)c1cc(ccc1Br)F CM10079 [0,1,0,0,0,0|2,0,0]=3 164 B11R1.167 CC(=O)c1cc(ccc1Cl)F CM11159 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.167 CC(=O)c1cc(ccc1F)Br CM11147 [0,1,0,0,0,0|2,0,0]=3 166 B11R1.167 CC(=O)c1cc(ccc1I)F CM11201 [0,1,0,0,0,0|2,0,0]=3 167 B11R1.167 CC(=O)c1cc(ccc1O)Br CM14330 [0,1,0,0,0,0|1,0,0]=2 168 B11R1.167 CC(C)c1cc(ccc1O)Cl CM10119 [0,1,0,0,0,0|2,0,1]=4 169 B11R1.167 Cc1ccc(c(c1)C(=O)N)N CM13166 [0,1,0,0,0,0|1,0,0]=2 170 B11R1.167 Cc1ccc(c(c1)C(=O)O)Br CM12531 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.167 Cc1ccc(c(c1)C(=O)O)C CM12701 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.167 Cc1ccc(c(c1)C(=O)O)Cl CM12592 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.167 Cc1ccc(c(c1)C(=O)O)F CM12761 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.167 Cc1ccc(c(c1)C(=O)O)I CM12821 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.167 Cc1ccc(c(c1)[N+](=O)[O-])F CM13967 [0,1,0,0,0,0|3,0,0]=4 176 B11R1.167 Cc1ccc(cc1C(=O)O)Br CM12537 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.167 Cc1ccc(cc1C(=O)O)F CM10930 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.167 Cc1ccc(cc1C(=O)O)I CM12825 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.167 Cc1ccc(cc1C(=O)O)N CM12431 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.167 Cc1ccc(cc1C(=O)O)O CM10889 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])F CM13966 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.167 Cc1ccc(cc1[N+](=O)[O-])O CM11793 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.167 c1c(cnc(c1C(=O)N)Cl)Br CM14100 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.167 c1cc(c(cc1Br)C(=O)O)F CM12504 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.167 c1cc(c(cc1Br)C(=O)O)I CM12521 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.167 c1cc(c(cc1Br)[N+](=O)[O-])N CM11326 [0,1,0,0,0,0|3,0,0]=4 187 B11R1.167 c1cc(c(cc1Br)[N+](=O)[O-])O CM11662 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.167 c1cc(c(cc1Cl)C(=O)Cl)F CM12580 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])Br CM12049 [0,1,0,0,0,0|3,0,0]=4 190 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])F CM12148 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.167 c1cc(c(cc1Cl)[N+](=O)[O-])N CM11381 [0,1,0,0,0,0|3,0,0]=4 192 B11R1.167 c1cc(c(cc1F)C(=O)O)F CM12658 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.167 c1cc(c(cc1F)C(=O)O)I CM12741 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.167 c1cc(c(cc1F)C(=O)O)N CM12398 [0,1,0,0,0,0|2,0,0]=3 195 B11R1.167 c1cc(c(cc1F)C(=O)O)O CM12725 [0,1,0,0,0,0|1,0,0]=2 196 B11R1.167 c1cc(c(cc1F)C(=O)[O-])F CM12657 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])Br CM12091 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])F CM12226 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])I CM12270 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])O CM11772 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.167 c1cc(c(cc1I)C(=O)O)Br CM12515 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.167 c1cc(c(cc1I)C(=O)O)Cl CM12586 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.167 c1cc(c(cc1I)C(=O)O)F CM12735 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.167 c1cc(c(cc1I)C(=O)O)I CM12693 [0,1,0,0,0,0|2,0,0]=3 205 B11R1.167 c1cc(c(cc1I)[N+](=O)[O-])F CM12266 [0,1,0,0,0,0|3,0,0]=4 206 B11R1.167 c1cc(c(cc1I)[N+](=O)[O-])I CM12237 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.167 c1cc(c(cc1I)[N+](=O)[O-])N CM11500 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.167 c1cc(c(cc1N)C(=O)O)F CM12408 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.167 c1cc(c(cc1N)[N+](=O)[O-])F CM11480 [0,1,0,0,0,0|3,0,0]=4 210 B11R1.167 c1cc(c(cc1O)C(=O)O)Cl CM12583 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.167 c1cc(c(cc1O)C(=O)O)F CM12716 [0,1,0,0,0,0|2,0,0]=3 212 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])Cl CM11696 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.167 c1cc(c(cc1O)[N+](=O)[O-])F CM11773 [0,1,0,0,0,0|3,0,0]=4 214 B11R1.167 c1cc(nc(c1N)C(=O)N)Cl CM14027 [0,1,0,0,0,0|2,0,0]=3 215 B11R2.1 Cc1c2ccccc2[nH]n1 CM10785 [0,0,0,1,0,0|2,0,1]=4 216 B11R2.1 c1cc2c(n[nH]c2nc1)N CM10550 [0,0,0,1,0,0|3,0,0]=4 217 B11R2.1 c1ccc2c(c1)CNC2=O CM10840 [0,0,0,1,0,0|1,0,0]=2 218 B11R2.1 c1ccc2c(c1)c(=O)[nH][nH]2 CM10841 [0,0,0,1,0,0|1,0,0]=2 219 B11R2.1 c1ccc2c(c1)c(co2)Br CM10750 [0,0,0,1,0,0|2,0,0]=3 220 B11R2.1 c1ccc2c(c1)c(n[nH]2)Br CM10098 [0,0,0,1,0,0|2,0,1]=4 221 B11R2.1 c1ccc2c(c1)c(no2)Cl CM10136 [0,0,0,1,0,0|1,0,1]=3 222 B11R2.1 c1ccc2c(c1)c(no2)O CM10137 [0,0,0,1,0,0|0,0,2]=3 223 B11R1.86 CC(=O)Cc1ccccc1Cl CM10944 [0,0,0,0,0,1|2,0,0]=3 224 B11R1.86 CC(=O)Cc1ccccc1F CM10960 [0,0,0,0,0,1|2,0,0]=3 225 B8R1.5 Cc1c(cccn1)N CM14488 [2,0,0,0,0,0|2,0,0]=4 226 B8R1.5 c1cc(c(nc1)N)N CM14021 [2,0,0,0,0,0|2,0,0]=4 227 B8R1.5 c1cc(c(nc1)O)F CM10987 [2,0,0,0,0,0|2,0,0]=4 228 B8R1.5 c1ccc(c(c1)F)Cl CM12138 [2,0,0,0,0,0|2,0,0]=4 229 B8R1.5 c1ccc(c(c1)I)I CM12234 [2,0,0,0,0,0|2,0,0]=4 230 B8R1.5 c1ccc(c(c1)N)Br CM11265 [2,0,0,0,0,0|1,0,0]=3 231 B8R1.5 c1ccc(c(c1)N)I CM11493 [2,0,0,0,0,0|1,0,0]=3 232 B8R1.5 c1cnc(c(n1)N)O CM10654 [2,0,0,0,0,0|2,0,0]=4 233 B8R1.5 c1cncc(c1N)F CM10153 [2,0,0,0,0,0|2,0,0]=4 234 B8R1.5 c1cncc(c1N)N CM14022 [2,0,0,0,0,0|2,0,0]=4 235 B10R1.13 CC(=C)c1ccc(cc1)O CM10479 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.13 CC(=O)c1ccc(cc1)Cl CM11155 [1,1,0,0,0,0|1,0,0]=3 237 B10R1.13 CC(=O)c1ccc(cc1)F CM11198 [1,1,0,0,0,0|1,0,0]=3 238 B10R1.13 CC(=O)c1ccc(cc1)I CM11220 [1,1,0,0,0,0|1,0,0]=3 239 B10R1.13 CC(=O)c1ccc(nc1)Cl CM11170 [1,1,0,0,0,0|2,0,0]=4 240 B10R1.13 CC(c1ccc(cc1)Cl)N CM13559 [1,1,0,0,0,0|1,0,1]=4 241 B10R1.13 Cc1ccc(cc1)C(=O)C CM10006 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.13 Cc1ccc(cc1)C(=O)N CM13184 [1,1,0,0,0,0|0,0,0]=2 243 B10R1.13 c1cc(ccc1C(=O)Cl)Br CM12451 [1,1,0,0,0,0|1,0,0]=3 244 B10R1.13 c1cc(ccc1C(=O)Cl)F CM12712 [1,1,0,0,0,0|1,0,0]=3 245 B10R1.13 c1cc(ccc1C(=O)Cl)I CM12820 [1,1,0,0,0,0|1,0,0]=3 246 B10R1.13 c1cc(ccc1C(=O)N)F CM13176 [1,1,0,0,0,0|0,0,0]=2 247 B10R1.13 c1cc(ccc1C(=O)O)F CM12711 [1,1,0,0,0,0|1,0,0]=3 248 B10R1.13 c1cc(ccc1C(=O)O)I CM12819 [1,1,0,0,0,0|1,0,0]=3 249 B10R1.13 c1cc(ccc1[N+](=O)[O-])Br CM12110 [1,1,0,0,0,0|2,0,0]=4 250 B10R1.13 c1cc(ccc1[N+](=O)[O-])F CM12273 [1,1,0,0,0,0|2,0,0]=4 251 B10R1.13 c1cc(ncc1C(=O)O)N CM10961 [1,1,0,0,0,0|2,0,0]=4 252 B10R1.13 c1cc(ncc1F)C(=O)O CM14030 [1,1,0,0,0,0|2,0,0]=4 253 B10R1.13 c1cc(ncc1I)C(=O)O CM10490 [1,1,0,0,0,0|2,0,0]=4 254 B10R1.15 COC(=O)c1cccnc1 CM10959 [1,1,0,0,0,0|2,0,0]=4 255 B10R1.15 c1ccc(cc1)C(=O)CF CM11196 [1,1,0,0,0,0|1,0,0]=3 256 B10R1.15 c1ccc(cc1)C(C#N)N CM11081 [1,1,0,0,0,0|1,0,1]=4 257 B10R1.113 CC(=O)c1cc(ccn1)Cl CM10835 [1,1,0,0,0,0|2,0,0]=4 258 B10R1.113 CC(=O)c1cccc(c1)F CM11197 [1,1,0,0,0,0|1,0,0]=3 259 B10R1.113 CC(=O)c1cccc(c1)I CM11219 [1,1,0,0,0,0|1,0,0]=3 260 B10R1.113 CC(c1cccc(c1)F)N CM13557 [1,1,0,0,0,0|1,0,1]=4 261 B10R1.113 Cc1cccc(c1)C(=O)C CM11223 [1,1,0,0,0,0|1,0,0]=3 262 B10R1.113 Cc1cccc(c1)C(=S)O CM12849 [1,1,0,0,0,0|1,0,1]=4 263 B10R1.113 c1c(cncc1Br)C(=O)O CM14037 [1,1,0,0,0,0|2,0,0]=4 264 B10R1.113 c1cc(cc(c1)F)C(=O)O CM12710 [1,1,0,0,0,0|1,0,0]=3 265 B10R1.113 c1cc(cc(c1)N)C(=O)N CM13163 [1,1,0,0,0,0|0,0,0]=2 266 B10R1.113 c1cc(cc(c1)S)C(=O)O CM10051 [1,1,0,0,0,0|1,0,0]=3 267 B10R1.113 c1cc(nc(c1)Cl)C(=O)O CM10033 [1,1,0,0,0,0|2,0,0]=4 268 B10R1.113 c1cnc(cc1C(=O)O)N CM14043 [1,1,0,0,0,0|2,0,0]=4 269 B10R1.113 c1cnc(cc1I)C(=O)O CM10569 [1,1,0,0,0,0|2,0,0]=4 270 B10R1.2 CCc1cccc(c1O)Cl CM10496 [1,1,0,0,0,0|1,0,1]=4 271 B10R1.2 COc1cccc(c1O)Cl CM10886 [1,1,0,0,0,0|2,0,0]=4 272 B10R1.2 COc1cccc(c1O)F CM11754 [1,1,0,0,0,0|2,0,0]=4 273 B10R1.2 Cc1c(cccc1Cl)C=O CM11895 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.2 Cc1c(cccc1F)C=O CM11971 [1,1,0,0,0,0|1,0,0]=3 275 B10R1.2 Cc1c(ccnc1C=O)Br CM10400 [1,1,0,0,0,0|2,0,0]=4 276 B10R1.2 Cc1cccc(c1Cl)C=O CM11894 [1,1,0,0,0,0|1,0,0]=3 277 B10R1.2 Cc1cccc(c1F)C=O CM11968 [1,1,0,0,0,0|1,0,0]=3 278 B10R1.2 c1cc(c(c(c1)Br)Br)C=O CM14314 [1,1,0,0,0,0|1,0,0]=3 279 B10R1.2 c1cc(c(c(c1)Br)F)C=O CM11840 [1,1,0,0,0,0|1,0,0]=3 280 B10R1.2 c1cc(c(c(c1)Br)O)C=O CM11851 [1,1,0,0,0,0|0,0,0]=2 281 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O CM10328 [1,1,0,0,0,0|1,0,0]=3 282 B10R1.2 c1cc(c(c(c1)Cl)F)C=O CM11878 [1,1,0,0,0,0|1,0,0]=3 283 B10R1.2 c1cc(c(c(c1)Cl)F)NN CM13795 [1,1,0,0,0,0|2,0,0]=4 284 B10R1.2 c1cc(c(c(c1)Cl)O)C#N CM10555 [1,1,0,0,0,0|0,0,2]=4 285 B10R1.2 c1cc(c(c(c1)Cl)O)C=O CM11885 [1,1,0,0,0,0|0,0,0]=2 286 B10R1.2 c1cc(c(c(c1)F)Cl)C=O CM11875 [1,1,0,0,0,0|1,0,0]=3 287 B10R1.2 c1cc(c(c(c1)F)F)C=O CM10129 [1,1,0,0,0,0|1,0,0]=3 288 B10R1.2 c1cc(c(c(c1)F)F)CN CM13532 [1,1,0,0,0,0|1,0,1]=4 289 B10R1.2 c1cc(c(c(c1)F)I)C=O CM11954 [1,1,0,0,0,0|1,0,0]=3 290 B10R1.2 c1cc(c(c(c1)F)O)C=O CM10374 [1,1,0,0,0,0|0,0,0]=2 291 B10R1.2 c1cc(c(c(c1)N)O)C#N CM10899 [1,1,0,0,0,0|0,0,2]=4 292 B10R1.2 c1cc(c(c(c1)O)F)C=O CM10470 [1,1,0,0,0,0|1,0,0]=3 293 B10R1.2 c1cc(c(c(c1)O)O)C#N CM10875 [1,1,0,0,0,0|0,0,2]=4 294 B10R1.4 c1ccc(c(c1)C=NO)F CM12025 [1,1,0,0,0,0|1,0,1]=4 295 B10R1.20 COc1ccccc1CCl CM13440 [1,1,0,0,0,0|1,0,1]=4 296 B10R1.20 COc1ccccc1NN CM13803 [1,1,0,0,0,0|1,0,0]=3 297 B10R1.20 c1ccc(c(c1)CO)CO CM13268 [1,1,0,0,0,0|0,0,2]=4 298 B10R1.25 Cc1cc(ccc1C=O)F CM11974 [1,1,0,0,0,0|1,0,0]=3 299 B10R1.25 Cc1cc(ccc1C=O)O CM11992 [1,1,0,0,0,0|1,0,0]=3 300 B10R1.25 Cc1cc(ccc1CN)Br CM10182 [1,1,0,0,0,0|1,0,1]=4 301 B10R1.25 Cc1cc(ccc1CN)O CM10123 [1,1,0,0,0,0|1,0,1]=4 302 B10R1.25 Cc1ccc(c(c1)Cl)NN CM13797 [1,1,0,0,0,0|2,0,0]=4 303 B10R1.25 Cc1ccc(c(c1)F)C=O CM11969 [1,1,0,0,0,0|1,0,0]=3 304 B10R1.25 c1cc(c(cc1Br)Br)C=O CM11917 [1,1,0,0,0,0|1,0,0]=3 305 B10R1.25 c1cc(c(cc1Br)Cl)C=O CM11829 [1,1,0,0,0,0|1,0,0]=3 306 B10R1.25 c1cc(c(cc1Br)F)C=O CM11842 [1,1,0,0,0,0|1,0,0]=3 307 B10R1.25 c1cc(c(cc1Br)F)CN CM13516 [1,1,0,0,0,0|1,0,1]=4 308 B10R1.25 c1cc(c(cc1Br)O)C=O CM11853 [1,1,0,0,0,0|0,0,0]=2 309 B10R1.25 c1cc(c(cc1Br)O)CO CM13296 [1,1,0,0,0,0|0,0,2]=4 310 B10R1.25 c1cc(c(cc1Cl)F)C=O CM11881 [1,1,0,0,0,0|1,0,0]=3 311 B10R1.25 c1cc(c(cc1Cl)F)CN CM13522 [1,1,0,0,0,0|1,0,1]=4 312 B10R1.25 c1cc(c(cc1Cl)O)C#N CM13012 [1,1,0,0,0,0|0,0,2]=4 313 B10R1.25 c1cc(c(cc1Cl)O)C=O CM11886 [1,1,0,0,0,0|0,0,0]=2 314 B10R1.25 c1cc(c(cc1F)Br)C=O CM11837 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.25 c1cc(c(cc1F)Cl)C=O CM11876 [1,1,0,0,0,0|1,0,0]=3 316 B10R1.25 c1cc(c(cc1F)Cl)NN CM13793 [1,1,0,0,0,0|2,0,0]=4 317 B10R1.25 c1cc(c(cc1F)F)C=O CM11929 [1,1,0,0,0,0|1,0,0]=3 318 B10R1.25 c1cc(c(cc1F)F)CN CM13533 [1,1,0,0,0,0|1,0,1]=4 319 B10R1.25 c1cc(c(cc1F)N)C=O CM11825 [1,1,0,0,0,0|1,0,0]=3 320 B10R1.25 c1cc(c(cc1F)O)C=O CM11951 [1,1,0,0,0,0|0,0,0]=2 321 B10R1.25 c1cc(c(cc1I)F)C=O CM11953 [1,1,0,0,0,0|1,0,0]=3 322 B10R1.25 c1cc(c(cc1N)O)C#N CM10121 [1,1,0,0,0,0|0,0,2]=4 323 B10R1.25 c1cc(c(cc1O)Br)C=O CM10868 [1,1,0,0,0,0|1,0,0]=3 324 B10R1.25 c1cc(c(cc1O)Cl)C=O CM10154 [1,1,0,0,0,0|1,0,0]=3 325 B10R1.25 c1cc(c(cc1O)F)C=O CM11947 [1,1,0,0,0,0|1,0,0]=3 326 B10R1.25 c1cc(c(cc1O)I)C=O CM10867 [1,1,0,0,0,0|1,0,0]=3 327 B10R1.25 c1cc(c(cc1O)O)C#N CM14137 [1,1,0,0,0,0|0,0,2]=4 328 B10R1.25 c1cc(nc(c1C=O)Br)Br CM10104 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.30 COc1cc(ccc1O)N CM10211 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.30 Cc1ccc(c(c1)C#N)O CM10144 [1,1,0,0,0,0|0,0,2]=4 331 B10R1.30 Cc1ccc(c(c1)C=O)F CM11970 [1,1,0,0,0,0|1,0,0]=3 332 B10R1.30 Cc1ccc(cc1C=O)Br CM11858 [1,1,0,0,0,0|1,0,0]=3 333 B10R1.30 Cc1ccc(cc1C=O)F CM11975 [1,1,0,0,0,0|1,0,0]=3 334 B10R1.30 Cc1ccc(cc1NN)F CM13802 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.30 c1cc(c(cc1Br)C=O)Cl CM11830 [1,1,0,0,0,0|1,0,0]=3 336 B10R1.30 c1cc(c(cc1Br)C=O)F CM11844 [1,1,0,0,0,0|1,0,0]=3 337 B10R1.30 c1cc(c(cc1Br)C=O)I CM11855 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.30 c1cc(c(cc1Cl)C=O)Br CM14485 [1,1,0,0,0,0|1,0,0]=3 339 B10R1.30 c1cc(c(cc1Cl)C=O)N CM11824 [1,1,0,0,0,0|1,0,0]=3 340 B10R1.30 c1cc(c(cc1Cl)CN)F CM13523 [1,1,0,0,0,0|1,0,1]=4 341 B10R1.30 c1cc(c(cc1Cl)NN)F CM13796 [1,1,0,0,0,0|2,0,0]=4 342 B10R1.30 c1cc(c(cc1F)C=O)Br CM11838 [1,1,0,0,0,0|1,0,0]=3 343 B10R1.30 c1cc(c(cc1F)C=O)Cl CM11877 [1,1,0,0,0,0|1,0,0]=3 344 B10R1.30 c1cc(c(cc1F)C=O)F CM11930 [1,1,0,0,0,0|1,0,0]=3 345 B10R1.30 c1cc(c(cc1F)C=O)I CM11958 [1,1,0,0,0,0|1,0,0]=3 346 B10R1.30 c1cc(c(cc1F)C=O)O CM11952 [1,1,0,0,0,0|0,0,0]=2 347 B10R1.30 c1cc(c(cc1F)CN)F CM13534 [1,1,0,0,0,0|1,0,1]=4 348 B10R1.30 c1cc(c(cc1F)NN)Cl CM13794 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.30 c1cc(c(cc1O)C=O)F CM10372 [1,1,0,0,0,0|1,0,0]=3 350 B10R1.245 C=Cc1c(cccc1F)F CM13492 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.245 CCc1c(cccc1O)N CM10920 [1,1,0,0,0,0|1,0,1]=4 352 B10R1.245 COc1c(cccc1Br)O CM10876 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.245 COc1c(cccc1Cl)O CM10468 [1,1,0,0,0,0|2,0,0]=4 354 B10R1.245 CSc1c(cccc1Br)O CM10097 [1,1,0,0,0,0|2,0,0]=4 355 B10R1.245 Cc1cccc(c1C=O)C CM11940 [1,1,0,0,0,0|1,0,0]=3 356 B10R1.245 Cc1cccc(c1C=O)O CM10373 [1,1,0,0,0,0|0,0,0]=2 357 B10R1.245 c1cc(c(c(c1)Br)C#N)O CM12977 [1,1,0,0,0,0|0,0,2]=4 358 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl CM10551 [1,1,0,0,0,0|1,0,0]=3 359 B10R1.245 c1cc(c(c(c1)Br)C=O)F CM11839 [1,1,0,0,0,0|1,0,0]=3 360 B10R1.245 c1cc(c(c(c1)Cl)C#N)O CM13009 [1,1,0,0,0,0|0,0,2]=4 361 B10R1.245 c1cc(c(c(c1)Cl)C=O)O CM11884 [1,1,0,0,0,0|0,0,0]=2 362 B10R1.245 c1cc(c(c(c1)F)C=O)F CM11931 [1,1,0,0,0,0|1,0,0]=3 363 B10R1.245 c1cc(c(c(c1)F)C=O)O CM10484 [1,1,0,0,0,0|0,0,0]=2 364 B10R1.245 c1cc(c(c(c1)F)CN)F CM13535 [1,1,0,0,0,0|1,0,1]=4 365 B10R1.245 c1cc(c(c(c1)F)NN)F CM13798 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.245 c1cnc(c(c1Cl)C=O)Cl CM10668 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.245 c1cnc(c(c1I)C=O)Cl CM10358 [1,1,0,0,0,0|2,0,0]=4 368 B12R1.75 c1ccc(c(c1)CC(=O)O)C#N CM13682 [0,1,0,0,0,1|2,0,0]=4 369 B12R1.127 c1cc(c(cc1Br)CC(=O)O)Br CM13689 [0,1,0,0,0,1|2,0,0]=4 370 B12R1.127 c1cc(c(cc1Br)CC(=O)O)F CM10070 [0,1,0,0,0,1|2,0,0]=4 371 B12R1.224 Cc1cccc(c1C)CC(=O)O CM13696 [0,1,0,0,0,1|2,0,0]=4 372 B12R1.233 c1cc(c(cc1Br)F)CC(=O)O CM13655 [0,1,0,0,0,1|2,0,0]=4 373 B12R1.233 c1cc(c(cc1Cl)F)CC(=O)O CM13670 [0,1,0,0,0,1|2,0,0]=4 374 B12R1.233 c1cc(c(cc1F)F)CC(=O)O CM13690 [0,1,0,0,0,1|2,0,0]=4 375 B12R1.233 c1cc(c(cc1N)F)CC(=O)O CM13648 [0,1,0,0,0,1|2,0,0]=4 376 B12R1.1009 c1cc(c(c(c1)Cl)CC(=O)O)F CM13665 [0,1,0,0,0,1|2,0,0]=4 377 B12R1.46 COc1ccc(cc1C(=O)O)F CM10931 [0,2,0,0,0,0|1,0,0]=3 378 B12R1.46 c1cc(c(cc1Br)C(=O)O)C#N CM12472 [0,2,0,0,0,0|2,0,0]=4 379 B12R1.46 c1cc(c(cc1Cl)[N+](=O)[O-])CO CM13327 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.46 c1cc(c(cc1F)[N+](=O)[O-])CO CM13426 [0,2,0,0,0,0|2,0,0]=4 381 B12R1.57 COc1c(ccc(n1)F)C(=O)O CM10675 [0,2,0,0,0,0|2,0,0]=4 382 B12R1.57 COc1cc(ccc1C(=O)O)F CM12752 [0,2,0,0,0,0|1,0,0]=3 383 B12R1.57 COc1cc(ccc1C(=O)O)O CM10237 [0,2,0,0,0,0|1,0,0]=3 384 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Br CM11664 [0,2,0,0,0,0|2,0,0]=4 385 B12R1.57 COc1cc(ccc1[N+](=O)[O-])Cl CM11697 [0,2,0,0,0,0|2,0,0]=4 386 B12R1.57 COc1cc(ccc1[N+](=O)[O-])F CM11774 [0,2,0,0,0,0|2,0,0]=4 387 B12R1.57 Cc1ccc(c(c1)OC)[N+](=O)[O-] CM11790 [0,2,0,0,0,0|2,0,0]=4 388 B12R1.57 c1cc(c(cc1Cl)CO)[N+](=O)[O-] CM13328 [0,2,0,0,0,0|2,0,0]=4 389 B12R1.77 COC(=O)c1ccccc1CBr CM12526 [0,2,0,0,0,0|2,0,0]=4 390 B12R1.87 COc1c(cccc1Br)[N+](=O)[O-] CM11660 [0,2,0,0,0,0|2,0,0]=4 391 B12R1.87 COc1c(cccc1Cl)[N+](=O)[O-] CM11694 [0,2,0,0,0,0|2,0,0]=4 392 B12R1.87 COc1c(cccc1F)C(=O)O CM12749 [0,2,0,0,0,0|1,0,0]=3 393 B12R1.261 CC(C)c1ccccc1C(=O)O CM12827 [0,2,0,0,0,0|2,0,0]=4 394 B12R1.283 c1ccc(c(c1)CCO)[N+](=O)[O-] CM14329 [0,2,0,0,0,0|2,0,0]=4 395 B12R1.437 CC(=O)c1c(cccc1OC)O CM11215 [0,2,0,0,0,0|1,0,0]=3 396 B12R1.437 COc1cccc(c1C(=O)O)Br CM12522 [0,2,0,0,0,0|1,0,0]=3 397 B12R1.437 COc1cccc(c1C(=O)O)F CM10857 [0,2,0,0,0,0|1,0,0]=3 398 B12R1.437 COc1cccc(c1C(=O)O)N CM12424 [0,2,0,0,0,0|1,0,0]=3 399 B12R1.437 Cc1cccc(c1C(=O)N)OC CM13182 [0,2,0,0,0,0|0,0,0]=2 400 B12R1.437 Cc1cccc(c1C(=O)O)OC CM12829 [0,2,0,0,0,0|1,0,0]=3 401 B12R1.437 c1cc(c(c(c1)Cl)[N+](=O)[O-])CO CM13326 [0,2,0,0,0,0|2,0,0]=4 402 B12R1.437 c1cc(c(c(c1)F)[N+](=O)[O-])CO CM13423 [0,2,0,0,0,0|2,0,0]=4 403 B12R1.128 c1cc(c(cc1O)S(=O)(=O)[O-])O CM14383 [0,2,0,0,0,0|2,0,0]=4 404 B12R1.894 CC(=O)c1c(ccc(c1F)F)F CM11232 [0,2,0,0,0,0|2,0,0]=4 405 B12R1.894 c1cc(c(c(c1F)C(=O)Cl)F)F CM12876 [0,2,0,0,0,0|2,0,0]=4 406 B12R1.894 c1cc(c(c(c1F)C(=O)O)Br)F CM12475 [0,2,0,0,0,0|2,0,0]=4 407 B12R1.894 c1cc(c(c(c1F)C(=O)O)F)Cl CM12566 [0,2,0,0,0,0|2,0,0]=4 408 B12R1.894 c1cc(c(c(c1F)C(=O)O)F)F CM12875 [0,2,0,0,0,0|2,0,0]=4 409 B12R1.894 c1cc(c(c(c1F)Cl)C(=O)O)Cl CM12647 [0,2,0,0,0,0|2,0,0]=4 410 B12R1.894 c1cc(c(c(c1F)F)C(=O)O)Br CM12483 [0,2,0,0,0,0|2,0,0]=4 411 B12R1.894 c1cc(c(c(c1N)C(=O)O)F)F CM12382 [0,2,0,0,0,0|2,0,0]=4 412 B12R1.894 c1cc(c(c(c1N)F)C(=O)O)F CM12378 [0,2,0,0,0,0|2,0,0]=4 413 B12R1.1000 CC(=O)c1c(cc(cc1F)F)F CM11234 [0,2,0,0,0,0|2,0,0]=4 414 B12R1.1000 Cc1cc(c(c(c1)O)C(=O)O)C CM10102 [0,2,0,0,0,0|1,0,0]=3 415 B12R1.1000 Cc1cc(cc(c1C(=O)O)Br)F CM12507 [0,2,0,0,0,0|2,0,0]=4 416 B12R1.1000 Cc1cc(cc(c1C(=O)O)C)F CM12704 [0,2,0,0,0,0|2,0,0]=4 417 B12R1.1000 Cc1cc(cc(c1C(=O)O)F)Br CM12510 [0,2,0,0,0,0|2,0,0]=4 418 B12R1.1000 c1c(cc(c(c1F)C(=O)Cl)F)F CM12883 [0,2,0,0,0,0|2,0,0]=4 419 B12R1.1000 c1c(cc(c(c1F)C(=O)O)Cl)Cl CM12646 [0,2,0,0,0,0|2,0,0]=4 420 B12R1.1000 c1c(cc(c(c1F)C(=O)O)Cl)F CM12564 [0,2,0,0,0,0|2,0,0]=4 421 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)Br CM12481 [0,2,0,0,0,0|2,0,0]=4 422 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)F CM12882 [0,2,0,0,0,0|2,0,0]=4 423 B12R1.1000 c1c(cc(c(c1F)C(=O)O)F)O CM12672 [0,2,0,0,0,0|2,0,0]=4 424 B12R1.1000 c1c(cc(c(c1N)C(=O)O)F)F CM12376 [0,2,0,0,0,0|2,0,0]=4 425 B12R1.1000 c1c(cc(c(c1O)[N+](=O)[O-])F)F CM11736 [0,2,0,0,0,0|2,0,0]=4 426 B12R1.3441 COC(=O)c1c(cccc1Br)F CM12490 [0,2,0,0,0,0|2,0,0]=4 427 B12R1.3441 COC(=O)c1c(cccc1F)N CM12399 [0,2,0,0,0,0|2,0,0]=4 428 B12R1.3441 COC(=O)c1c(cccc1F)O CM12717 [0,2,0,0,0,0|1,0,0]=3 429 B12R1.3441 Cc1cccc(c1C(=O)OC)Br CM12532 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.3441 Cc1cccc(c1C(=O)OC)F CM12762 [0,2,0,0,0,0|2,0,0]=4 431 B12R1.3441 c1cc(c(c(c1)F)C(=O)CBr)F CM11138 [0,2,0,0,0,0|2,0,0]=4 432 B12R1.24 COC(=O)c1cccc(c1F)Br CM12492 [0,2,0,0,0,0|2,0,0]=4 433 B12R1.24 COC(=O)c1cccc(c1F)N CM12401 [0,2,0,0,0,0|2,0,0]=4 434 B12R1.24 COC(=O)c1cccc(c1N)Br CM12346 [0,2,0,0,0,0|2,0,0]=4 435 B12R1.24 COC(=O)c1cccc(c1N)Cl CM12357 [0,2,0,0,0,0|2,0,0]=4 436 B12R1.24 COC(=O)c1cccc(c1N)F CM12393 [0,2,0,0,0,0|2,0,0]=4 437 B12R1.24 COC(=O)c1cccc(c1N)N CM12633 [0,2,0,0,0,0|2,0,0]=4 438 B12R1.24 COC(=O)c1cccc(c1N)O CM12414 [0,2,0,0,0,0|2,0,0]=4 439 B12R1.24 COC(=O)c1cccc(c1O)Br CM12511 [0,2,0,0,0,0|1,0,0]=3 440 B12R1.24 COC(=O)c1cccc(c1O)F CM12719 [0,2,0,0,0,0|1,0,0]=3 441 B12R1.24 Cc1c(cccc1Br)C(=O)OC CM12534 [0,2,0,0,0,0|2,0,0]=4 442 B12R1.24 Cc1c(cccc1N)C(=O)OC CM12427 [0,2,0,0,0,0|2,0,0]=4 443 B12R1.24 Cc1cccc(c1Br)C(=O)OC CM12529 [0,2,0,0,0,0|2,0,0]=4 444 B12R1.24 Cc1cccc(c1F)C(=O)OC CM12757 [0,2,0,0,0,0|2,0,0]=4 445 B12R1.24 c1cc(c(c(c1)F)N)C(=O)C=O CM13865 [0,2,0,0,0,0|2,0,0]=4 446 B12R1.440 CC(=O)c1cccc(c1O)C#N CM10368 [0,2,0,0,0,0|1,0,0]=3 447 B12R1.440 CCc1cccc(c1N)C(=O)O CM10234 [0,2,0,0,0,0|2,0,0]=4 448 B12R1.440 COc1cccc(c1Cl)C(=O)O CM12588 [0,2,0,0,0,0|2,0,0]=4 449 B12R1.440 COc1cccc(c1F)C(=O)O CM12743 [0,2,0,0,0,0|2,0,0]=4 450 B12R1.440 COc1cccc(c1N)C(=O)O CM12420 [0,2,0,0,0,0|2,0,0]=4 451 B12R1.440 Cc1c(cccc1OC)C(=O)O CM12830 [0,2,0,0,0,0|2,0,0]=4 452 B12R1.440 c1cc(c(c(c1)C(=O)O)F)C#N CM10172 [0,2,0,0,0,0|2,0,0]=4 453 B12R1.440 c1cc(c(c(c1)C(=O)O)F)CO CM10072 [0,2,0,0,0,0|2,0,0]=4 454 B12R1.440 c1cc(c(c(c1)C(=O)O)N)C#N CM10170 [0,2,0,0,0,0|2,0,0]=4 455 B12R1.440 c1cc(c(c(c1)C(=O)O)O)C#N CM10553 [0,2,0,0,0,0|1,0,0]=3 456 B12R1.511 CC(=O)c1cc(cc(c1F)Cl)Cl CM11183 [0,2,0,0,0,0|2,0,0]=4 457 B12R1.511 CC(=O)c1cc(cc(c1F)F)F CM11231 [0,2,0,0,0,0|2,0,0]=4 458 B12R1.511 Cc1cc(c(c(c1)C(=O)O)N)C CM12385 [0,2,0,0,0,0|2,0,0]=4 459 B12R1.511 Cc1cc(c(c(c1)F)F)C(=O)O CM12681 [0,2,0,0,0,0|2,0,0]=4 460 B12R1.511 Cc1cc(c(c(c1)[N+](=O)[O-])O)C CM11745 [0,2,0,0,0,0|2,0,0]=4 461 B12R1.511 c1c(cc(c(c1C(=O)O)Br)F)F CM12474 [0,2,0,0,0,0|2,0,0]=4 462 B12R1.511 c1c(cc(c(c1C(=O)O)Cl)F)F CM12561 [0,2,0,0,0,0|2,0,0]=4 463 B12R1.511 c1c(cc(c(c1C(=O)O)F)Cl)Cl CM12648 [0,2,0,0,0,0|2,0,0]=4 464 B12R1.511 c1c(cc(c(c1C(=O)O)F)F)Br CM12482 [0,2,0,0,0,0|2,0,0]=4 465 B12R1.511 c1c(cc(c(c1C(=O)O)F)F)F CM12874 [0,2,0,0,0,0|2,0,0]=4 466 B12R1.511 c1c(cc(c(c1C(=O)O)O)Br)Br CM12639 [0,2,0,0,0,0|1,0,0]=3 467 B12R1.511 c1c(cc(c(c1C(=O)O)O)Cl)Cl CM12653 [0,2,0,0,0,0|1,0,0]=3 468 B12R1.511 c1c(cc(c(c1[N+](=O)[O-])O)F)Br CM11646 [0,2,0,0,0,0|2,0,0]=4 469 B12R1.893 CC(=O)c1ccc(c(c1F)F)F CM11230 [0,2,0,0,0,0|2,0,0]=4 470 B12R1.893 Cc1c(c(ccc1C(=O)O)N)C CM12387 [0,2,0,0,0,0|2,0,0]=4 471 B12R1.893 Cc1ccc(c(c1C)N)C(=O)O CM12384 [0,2,0,0,0,0|2,0,0]=4 472 B12R1.893 c1cc(c(c(c1C(=O)Cl)F)F)F CM12873 [0,2,0,0,0,0|2,0,0]=4 473 B12R1.893 c1cc(c(c(c1C(=O)O)Br)F)F CM12473 [0,2,0,0,0,0|2,0,0]=4 474 B12R1.893 c1cc(c(c(c1C(=O)O)Cl)Cl)F CM12643 [0,2,0,0,0,0|2,0,0]=4 475 B12R1.893 c1cc(c(c(c1C(=O)O)F)Cl)F CM12565 [0,2,0,0,0,0|2,0,0]=4 476 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)Br CM12479 [0,2,0,0,0,0|2,0,0]=4 477 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)F CM12872 [0,2,0,0,0,0|2,0,0]=4 478 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)N CM12380 [0,2,0,0,0,0|2,0,0]=4 479 B12R1.893 c1cc(c(c(c1C(=O)O)F)F)O CM12668 [0,2,0,0,0,0|2,0,0]=4 480 B12R1.893 c1cc(c(c(c1C(=O)O)F)O)F CM12670 [0,2,0,0,0,0|2,0,0]=4 481 B12R1.893 c1cc(c(c(c1C(=O)O)N)F)F CM12372 [0,2,0,0,0,0|2,0,0]=4 482 B12R1.893 c1cc(c(c(c1C(=O)O)O)F)F CM12673 [0,2,0,0,0,0|1,0,0]=3 483 B12R1.893 c1cc(c(c(c1C(=O)[O-])F)F)F CM12871 [0,2,0,0,0,0|2,0,0]=4 484 B12R1.232 CC(=O)c1cc(c(cc1F)Br)F CM11140 [0,2,0,0,0,0|2,0,0]=4 485 B12R1.232 CC(=O)c1cc(c(cc1F)F)F CM11233 [0,2,0,0,0,0|2,0,0]=4 486 B12R1.232 Cc1cc(c(cc1Br)F)C(=O)O CM12509 [0,2,0,0,0,0|2,0,0]=4 487 B12R1.232 Cc1cc(c(cc1C(=O)O)Br)C CM10198 [0,2,0,0,0,0|2,0,0]=4 488 B12R1.232 Cc1cc(c(cc1C)N)C(=O)O CM12386 [0,2,0,0,0,0|2,0,0]=4 489 B12R1.232 Cc1cc(c(cc1F)Br)C(=O)O CM12506 [0,2,0,0,0,0|2,0,0]=4 490 B12R1.232 Cc1cc(c(cc1F)C(=O)O)Br CM12508 [0,2,0,0,0,0|2,0,0]=4 491 B12R1.232 Cc1cc(c(cc1I)C(=O)O)O CM12804 [0,2,0,0,0,0|1,0,0]=3 492 B12R1.232 Cc1cc(c(cc1O)C(=O)O)F CM12728 [0,2,0,0,0,0|2,0,0]=4 493 B12R1.232 c1c(c(cc(c1Br)Br)N)C(=O)O CM12366 [0,2,0,0,0,0|2,0,0]=4 494 B12R1.232 c1c(c(cc(c1Br)Cl)F)C(=O)O CM12468 [0,2,0,0,0,0|2,0,0]=4 495 B12R1.232 c1c(c(cc(c1Cl)Cl)N)C(=O)O CM12368 [0,2,0,0,0,0|2,0,0]=4 496 B12R1.232 c1c(c(cc(c1Cl)F)F)C(=O)O CM12570 [0,2,0,0,0,0|2,0,0]=4 497 B12R1.232 c1c(c(cc(c1F)Br)Cl)C(=O)O CM12467 [0,2,0,0,0,0|2,0,0]=4 498 B12R1.232 c1c(c(cc(c1F)Br)F)C(=O)O CM12480 [0,2,0,0,0,0|2,0,0]=4 499 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)Cl CM12645 [0,2,0,0,0,0|2,0,0]=4 500 B12R1.232 c1c(c(cc(c1F)Cl)Cl)C(=O)O CM12644 [0,2,0,0,0,0|2,0,0]=4 501 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)Cl CM12569 [0,2,0,0,0,0|2,0,0]=4 502 B12R1.232 c1c(c(cc(c1F)Cl)F)C(=O)O CM12568 [0,2,0,0,0,0|2,0,0]=4 503 B12R1.232 c1c(c(cc(c1F)F)Br)C(=O)O CM12477 [0,2,0,0,0,0|2,0,0]=4 504 B12R1.232 c1c(c(cc(c1F)F)Cl)C(=O)O CM12562 [0,2,0,0,0,0|2,0,0]=4 505 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)Cl CM12881 [0,2,0,0,0,0|2,0,0]=4 506 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)O CM12880 [0,2,0,0,0,0|2,0,0]=4 507 B12R1.232 c1c(c(cc(c1F)F)F)C(=O)[O-] CM12879 [0,2,0,0,0,0|2,0,0]=4 508 B12R1.232 c1c(c(cc(c1F)F)N)C(=O)O CM12375 [0,2,0,0,0,0|2,0,0]=4 509 B12R1.232 c1c(c(cc(c1N)Cl)Cl)C(=O)O CM12371 [0,2,0,0,0,0|2,0,0]=4 510 B12R1.452 CC(=O)c1ccc(cc1F)OC CM11202 [0,2,0,0,0,0|2,0,0]=4 511 B12R1.452 COc1ccc(c(c1)F)C(=O)Cl CM12745 [0,2,0,0,0,0|2,0,0]=4 512 B12R1.452 COc1ccc(c(c1)F)C(=O)O CM12744 [0,2,0,0,0,0|2,0,0]=4 513 B12R1.452 COc1ccc(c(c1)N)C(=O)O CM12421 [0,2,0,0,0,0|2,0,0]=4 514 B12R1.452 COc1ccc(c(c1)O)[N+](=O)[O-] CM11786 [0,2,0,0,0,0|2,0,0]=4 515 B12R1.452 c1cc(c(cc1C#N)F)C(=O)O CM12621 [0,2,0,0,0,0|2,0,0]=4 516 B12R1.1703 CCC(=O)c1ccc(cc1F)Br CM10141 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.1703 CNC(=O)c1ccc(cc1F)Br CM13187 [0,2,0,0,0,0|1,0,0]=3 518 B12R1.1703 CNC(=O)c1ccc(cc1F)I CM13186 [0,2,0,0,0,0|1,0,0]=3 519 B12R1.1703 COC(=O)c1ccc(cc1Br)Cl CM12459 [0,2,0,0,0,0|2,0,0]=4 520 B12R1.1703 COC(=O)c1ccc(cc1Br)F CM12487 [0,2,0,0,0,0|2,0,0]=4 521 B12R1.1703 COC(=O)c1ccc(cc1Cl)Br CM12464 [0,2,0,0,0,0|2,0,0]=4 522 B12R1.1703 COC(=O)c1ccc(cc1Cl)N CM12362 [0,2,0,0,0,0|2,0,0]=4 523 B12R1.1703 COC(=O)c1ccc(cc1F)Br CM12498 [0,2,0,0,0,0|2,0,0]=4 524 B12R1.1703 COC(=O)c1ccc(cc1F)F CM12656 [0,2,0,0,0,0|2,0,0]=4 525 B12R1.1703 COC(=O)c1ccc(cc1F)I CM12732 [0,2,0,0,0,0|2,0,0]=4 526 B12R1.1703 COC(=O)c1ccc(cc1F)N CM12404 [0,2,0,0,0,0|2,0,0]=4 527 B12R1.1703 COC(=O)c1ccc(cc1F)O CM12714 [0,2,0,0,0,0|2,0,0]=4 528 B12R1.1703 COC(=O)c1ccc(cc1N)Br CM12348 [0,2,0,0,0,0|2,0,0]=4 529 B12R1.1703 COC(=O)c1ccc(cc1N)F CM12395 [0,2,0,0,0,0|2,0,0]=4 530 B12R1.1703 COC(=O)c1ccc(cc1O)F CM12722 [0,2,0,0,0,0|1,0,0]=3 531 B12R1.354 COC(=O)c1cc(ccc1Br)F CM12489 [0,2,0,0,0,0|2,0,0]=4 532 B12R1.354 COC(=O)c1cc(ccc1Cl)Br CM12466 [0,2,0,0,0,0|2,0,0]=4 533 B12R1.354 COC(=O)c1cc(ccc1F)Br CM12503 [0,2,0,0,0,0|2,0,0]=4 534 B12R1.354 COC(=O)c1cc(ccc1F)I CM12734 [0,2,0,0,0,0|2,0,0]=4 535 B12R1.354 COC(=O)c1cc(ccc1I)Br CM12520 [0,2,0,0,0,0|2,0,0]=4 536 B12R1.354 COC(=O)c1cc(ccc1N)Br CM12350 [0,2,0,0,0,0|2,0,0]=4 537 B12R1.354 COC(=O)c1cc(ccc1N)F CM12397 [0,2,0,0,0,0|2,0,0]=4 538 B12R1.354 Cc1ccc(cc1C(=O)OC)Br CM12536 [0,2,0,0,0,0|2,0,0]=4 539 B12R1.354 Cc1ccc(cc1C(=O)OC)F CM12768 [0,2,0,0,0,0|2,0,0]=4 540 B12R1.354 Cc1ccc(cc1C(=O)OC)I CM12826 [0,2,0,0,0,0|2,0,0]=4 541 B12R1.354 Cc1ccc(cc1C(=O)OC)O CM12807 [0,2,0,0,0,0|2,0,0]=4 542 B12R1.354 c1cc(c(cc1F)C(=O)CCl)F CM11156 [0,2,0,0,0,0|2,0,0]=4 543 B12R1.453 CCc1ccc(c(c1)[N+](=O)[O-])O CM10377 [0,2,0,0,0,0|2,0,0]=4 544 B12R1.453 COc1ccc(c(c1)C(=O)O)Cl CM12589 [0,2,0,0,0,0|2,0,0]=4 545 B12R1.453 COc1ccc(c(c1)C(=O)O)F CM12746 [0,2,0,0,0,0|2,0,0]=4 546 B12R1.453 COc1ccc(c(c1)C(=O)O)N CM12423 [0,2,0,0,0,0|2,0,0]=4 547 B12R1.453 Cc1ccc(cc1C(=O)O)OC CM12834 [0,2,0,0,0,0|2,0,0]=4 548 B12R1.453 c1cc(c(cc1C#N)C(=O)O)Br CM12469 [0,2,0,0,0,0|2,0,0]=4 549 B12R1.453 c1cc(c(cc1C#N)C(=O)O)F CM12625 [0,2,0,0,0,0|2,0,0]=4 550 B12R1.453 c1cc(c(cc1C#N)C(=O)O)I CM10354 [0,2,0,0,0,0|2,0,0]=4 551 B12R1.453 c1cc(c(cc1CO)[N+](=O)[O-])O CM13434 [0,2,0,0,0,0|2,0,0]=4 552 B12R1.308 c1ccc(c(c1)C(=O)CC#N)F CM13161 [0,2,0,0,0,0|1,0,1]=4 553 B10R2.7 c1ccc2c(c1)CNC2 CM10320 [1,0,0,1,0,0|1,0,1]=4 554 B12R2.24 c1ccc2c(c1)[nH]c(=O)cn2 CM14099 [0,0,0,1,0,1|2,0,0]=4 555 B12R2.202 c1cc2c(c(c1)Br)CC(=O)N2 CM14303 [0,0,0,1,0,1|1,0,0]=3 556 B12R2.202 c1cc2c(c(c1)Br)NC(=O)C2 CM14308 [0,0,0,1,0,1|2,0,0]=4 557 B12R2.202 c1cc2c(c(c1)Cl)NC(=O)C2 CM14306 [0,0,0,1,0,1|2,0,0]=4 558 B12R2.202 c1cc2c(c(c1)F)NC(=O)C2 CM14365 [0,0,0,1,0,1|2,0,0]=4 559 B12R2.202 c1cc2c(c(c1)F)sc(n2)N CM13864 [0,0,0,1,0,1|2,0,0]=4 560 B12R2.1081 c1ccc2c(c1)C(=O)CCN2 CM10829 [0,1,0,1,0,0|2,0,0]=4 561 B12R2.1081 c1ccc2c(c1)C(=O)CCO2 CM13881 [0,1,0,1,0,0|1,0,0]=3 562 B12R2.1081 c1ccc2c(c1)C(CCO2)N CM10306 [0,1,0,1,0,0|1,0,1]=4 563 B12R2.1081 c1ccc2c(c1)CCOC2=O CM10132 [0,1,0,1,0,0|2,0,0]=4 564 B12R2.1081 c1ccc2c(c1)ccnc2N CM10316 [0,1,0,1,0,0|2,0,0]=4 565 B12R2.203 Cc1c2c(cccc2Br)[nH]n1 CM10789 [0,1,0,1,0,0|2,0,0]=4 566 B12R2.203 Cc1c2c(cccc2F)[nH]n1 CM10794 [0,1,0,1,0,0|2,0,0]=4 567 B12R2.203 Cc1c2c(cccc2[nH]n1)N CM10819 [0,1,0,1,0,0|2,0,0]=4 568 B12R2.196 c1cc2c(c(c1)Br)CCC2=O CM10103 [0,1,0,1,0,0|2,0,0]=4 569 B12R2.196 c1cc2c(c(c1)Cl)CCC2=O CM10362 [0,1,0,1,0,0|2,0,0]=4 570 B12R2.196 c1cc2c(c(c1)F)CCC2=O CM10386 [0,1,0,1,0,0|2,0,0]=4 571 B12R2.612 c1cc2c(cc1Br)CCC2=O CM14359 [0,1,0,1,0,0|2,0,0]=4 572 B12R2.612 c1cc2c(cc1Br)OCC2=O CM10487 [0,1,0,1,0,0|1,0,0]=3 573 B12R2.612 c1cc2c(cc1Br)onc2Cl CM10126 [0,1,0,1,0,0|1,0,1]=4 574 B12R2.612 c1cc2c(cc1Cl)OCC2=O CM10772 [0,1,0,1,0,0|1,0,0]=3 575 B12R2.612 c1cc2c(cc1Cl)onc2O CM13873 [0,1,0,1,0,0|0,0,2]=4 576 B12R2.612 c1cc2c(cc1F)CCC2=O CM14361 [0,1,0,1,0,0|2,0,0]=4 577 B12R2.612 c1cc2c(cc1O)OCC2=O CM10744 [0,1,0,1,0,0|1,0,0]=3 578 B12R2.132 c1cc2c(cc1Br)C(=O)CC2 CM14374 [0,1,0,1,0,0|2,0,0]=4 579 B12R2.132 c1cc2c(cc1Br)C(=O)CO2 CM10486 [0,1,0,1,0,0|1,0,0]=3 580 B12R2.132 c1cc2c(cc1Br)C(=O)CO2 CM10771 [0,1,0,1,0,0|1,0,0]=3 581 B12R2.132 c1cc2c(cc1Br)C(=O)NC2 CM10602 [0,1,0,1,0,0|1,0,0]=3 582 B12R2.132 c1cc2c(cc1Cl)C(=O)CO2 CM10770 [0,1,0,1,0,0|1,0,0]=3 583 B12R2.18 Cn1c(=O)c2ccccc2[nH]1 CM10169 [0,1,0,1,0,0|1,0,0]=3 584 B12R2.18 Cn1c2ccccc2oc1=O CM14408 [0,1,0,1,0,0|2,0,0]=4 585 B8R1.11 c1csc(c1C=O)Br CM10421 [1,0,0,0,1,0|2,0,0]=4 586 B12R1.125 c1ccc(c(c1)CCC(=O)O)Br CM13747 [0,0,0,0,0,2|2,0,0]=4