0 B8R1.4 Cc1cccc(n1)Br CM14044 [0,0,0,0,0,0|1,0,0]=1 1 B8R1.4 Cc1ccnc(n1)Cl CM13850 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.4 c1c(cncc1Br)F CM14471 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.4 c1c(cncc1Br)N CM14469 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.4 c1c(cncc1Br)O CM14470 [0,0,0,0,0,0|4,0,0]=4 5 B8R1.4 c1c(cncc1Cl)O CM10662 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.4 c1c(cncc1F)O CM10665 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.4 c1c(cncc1O)O CM10452 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.4 c1cc(c[n+](c1)[O-])Cl CM10322 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.4 c1cc(cc(c1)Br)Br CM12169 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.4 c1cc(cc(c1)Br)Cl CM12036 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.4 c1cc(cc(c1)Br)N CM10037 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.4 c1cc(cc(c1)F)N CM11453 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.4 c1cc(cc(c1)F)O CM11748 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.4 c1cc(cc(c1)I)Br CM12100 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.4 c1cc(cc(c1)I)I CM12235 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.4 c1cc(nc(c1)Br)O CM10270 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.4 c1cnc(cc1Br)N CM14041 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.4 c1cnc(cc1Cl)Cl CM14034 [0,0,0,0,0,0|4,0,0]=4 19 B8R1.4 c1cnc(cc1I)Cl CM14039 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.4 c1cnc(cc1I)O CM10195 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.4 c1cnc(cc1O)Br CM10678 [0,0,0,0,0,0|4,0,0]=4 22 B8R1.4 c1cnc(nc1Br)Br CM10427 [0,0,0,0,0,0|3,0,0]=3 23 B8R1.4 c1cnc(nc1Br)Cl CM10078 [0,0,0,0,0,0|3,0,0]=3 24 B8R1.4 c1cnc(nc1Br)N CM10436 [0,0,0,0,0,0|3,0,0]=3 25 B8R1.4 c1cnc(nc1N)Br CM10437 [0,0,0,0,0,0|3,0,0]=3 26 B7R1.3 c1cc(cnc1)F CM13853 [1,0,0,0,0,0|3,0,0]=4 27 B7R1.3 c1ccnc(c1)Cl CM13847 [1,0,0,0,0,0|1,0,0]=2 28 B7R1.3 c1cnc(nc1)Br CM14046 [1,0,0,0,0,0|2,0,0]=3 29 B7R1.3 c1cnc(nc1)Cl CM14045 [1,0,0,0,0,0|2,0,0]=3 30 B7R1.3 c1cnc(nc1)I CM14295 [1,0,0,0,0,0|2,0,0]=3 31 B7R1.3 c1cncnc1N CM10689 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.2 CCc1cccc(c1)Br CM12087 [0,1,0,0,0,0|2,0,0]=3 33 B9R1.2 CCc1cccc(c1)N CM11452 [0,1,0,0,0,0|2,0,0]=3 34 B9R1.2 CNc1cccc(c1)O CM10115 [0,1,0,0,0,0|2,0,0]=3 35 B9R1.2 COc1cc(ccn1)Br CM10671 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.2 COc1ccnc(n1)Br CM10844 [0,1,0,0,0,0|2,0,0]=3 37 B9R1.2 COc1ccnc(n1)N CM10846 [0,1,0,0,0,0|2,0,0]=3 38 B9R1.2 COc1nccc(n1)N CM10845 [0,1,0,0,0,0|2,0,0]=3 39 B9R1.2 CSc1cccc(n1)Br CM10114 [0,1,0,0,0,0|1,0,0]=2 40 B9R1.2 Cc1cccc(c1)CF CM13445 [0,1,0,0,0,0|1,0,0]=2 41 B9R1.2 c1cc(cc(c1)F)C#N CM13067 [0,1,0,0,0,0|2,0,1]=4 42 B9R1.2 c1cc(cc(c1)I)CBr CM13435 [0,1,0,0,0,0|2,0,0]=3 43 B9R1.2 c1cc(cc(c1)I)CN CM10968 [0,1,0,0,0,0|2,0,0]=3 44 B9R1.2 c1cnc(cc1CO)N CM14035 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.2 c1cnc(nc1C#N)Br CM10923 [0,1,0,0,0,0|2,0,1]=4 46 B9R1.2 c1cnc(nc1C#N)Cl CM10118 [0,1,0,0,0,0|2,0,1]=4 47 B9R1.3 Cc1c(cccc1Br)F CM13926 [0,1,0,0,0,0|3,0,0]=4 48 B9R1.3 Cc1c(cccc1Br)N CM11317 [0,1,0,0,0,0|3,0,0]=4 49 B9R1.3 Cc1c(cccc1Cl)N CM11377 [0,1,0,0,0,0|3,0,0]=4 50 B9R1.3 Cc1c(cccc1F)F CM13956 [0,1,0,0,0,0|3,0,0]=4 51 B9R1.3 Cc1c(cccc1F)N CM11464 [0,1,0,0,0,0|3,0,0]=4 52 B9R1.3 Cc1c(cccc1F)O CM11760 [0,1,0,0,0,0|3,0,0]=4 53 B9R1.3 Cc1c(cccc1I)Cl CM13945 [0,1,0,0,0,0|3,0,0]=4 54 B9R1.3 Cc1cccc(c1Br)Cl CM10337 [0,1,0,0,0,0|2,0,0]=3 55 B9R1.3 Cc1cccc(c1Br)N CM11315 [0,1,0,0,0,0|2,0,0]=3 56 B9R1.3 Cc1cccc(c1C)Br CM12245 [0,1,0,0,0,0|2,0,0]=3 57 B9R1.3 Cc1cccc(c1C)Cl CM12248 [0,1,0,0,0,0|2,0,0]=3 58 B9R1.3 Cc1cccc(c1C)F CM12253 [0,1,0,0,0,0|2,0,0]=3 59 B9R1.3 Cc1cccc(c1Cl)C CM12250 [0,1,0,0,0,0|1,0,0]=2 60 B9R1.3 Cc1cccc(c1F)Br CM13927 [0,1,0,0,0,0|2,0,0]=3 61 B9R1.3 Cc1cccc(c1F)C CM12254 [0,1,0,0,0,0|1,0,0]=2 62 B9R1.3 Cc1cccc(c1F)Cl CM14017 [0,1,0,0,0,0|2,0,0]=3 63 B9R1.3 Cc1cccc(c1F)F CM13954 [0,1,0,0,0,0|2,0,0]=3 64 B9R1.3 Cc1cccc(c1F)N CM11462 [0,1,0,0,0,0|2,0,0]=3 65 B9R1.3 Cc1cccc(c1F)O CM11757 [0,1,0,0,0,0|2,0,0]=3 66 B9R1.3 Cc1cccc(c1I)O CM10210 [0,1,0,0,0,0|2,0,0]=3 67 B9R1.3 Cc1cccc(c1N)Br CM11316 [0,1,0,0,0,0|2,0,0]=3 68 B9R1.3 Cc1cccc(c1N)N CM13949 [0,1,0,0,0,0|2,0,0]=3 69 B9R1.3 Cc1cccc(c1N)O CM11590 [0,1,0,0,0,0|2,0,0]=3 70 B9R1.3 Cc1cccc(c1O)C CM11741 [0,1,0,0,0,0|1,0,0]=2 71 B9R1.3 Cc1cccc(c1O)F CM11759 [0,1,0,0,0,0|2,0,0]=3 72 B9R1.3 Cc1ccnc(c1Br)C CM10661 [0,1,0,0,0,0|2,0,0]=3 73 B9R1.3 Cn1c(=O)cccc1Br CM10359 [0,1,0,0,0,0|2,0,1]=4 74 B9R1.3 Cn1cccc(c1=O)Br CM10262 [0,1,0,0,0,0|3,0,0]=4 75 B9R1.3 c1cc(c(c(c1)Br)Br)F CM12187 [0,1,0,0,0,0|3,0,0]=4 76 B9R1.3 c1cc(c(c(c1)Br)Br)O CM11708 [0,1,0,0,0,0|3,0,0]=4 77 B9R1.3 c1cc(c(c(c1)Br)Cl)Br CM12173 [0,1,0,0,0,0|3,0,0]=4 78 B9R1.3 c1cc(c(c(c1)Br)Cl)F CM12041 [0,1,0,0,0,0|3,0,0]=4 79 B9R1.3 c1cc(c(c(c1)Br)Cl)O CM10471 [0,1,0,0,0,0|3,0,0]=4 80 B9R1.3 c1cc(c(c(c1)Br)F)Br CM12186 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.3 c1cc(c(c(c1)Br)F)Cl CM12042 [0,1,0,0,0,0|3,0,0]=4 82 B9R1.3 c1cc(c(c(c1)Br)F)F CM12211 [0,1,0,0,0,0|3,0,0]=4 83 B9R1.3 c1cc(c(c(c1)Br)F)N CM11302 [0,1,0,0,0,0|3,0,0]=4 84 B9R1.3 c1cc(c(c(c1)Br)F)O CM11634 [0,1,0,0,0,0|3,0,0]=4 85 B9R1.3 c1cc(c(c(c1)Br)I)Br CM12192 [0,1,0,0,0,0|3,0,0]=4 86 B9R1.3 c1cc(c(c(c1)Br)I)O CM11649 [0,1,0,0,0,0|3,0,0]=4 87 B9R1.3 c1cc(c(c(c1)Br)N)Br CM11397 [0,1,0,0,0,0|3,0,0]=4 88 B9R1.3 c1cc(c(c(c1)Br)N)Cl CM11268 [0,1,0,0,0,0|3,0,0]=4 89 B9R1.3 c1cc(c(c(c1)Br)N)F CM11301 [0,1,0,0,0,0|3,0,0]=4 90 B9R1.3 c1cc(c(c(c1)Br)N)O CM11543 [0,1,0,0,0,0|3,0,0]=4 91 B9R1.3 c1cc(c(c(c1)Br)O)Cl CM10890 [0,1,0,0,0,0|3,0,0]=4 92 B9R1.3 c1cc(c(c(c1)Br)O)F CM11632 [0,1,0,0,0,0|3,0,0]=4 93 B9R1.3 c1cc(c(c(c1)Cl)Br)N CM10246 [0,1,0,0,0,0|3,0,0]=4 94 B9R1.3 c1cc(c(c(c1)Cl)Cl)F CM12202 [0,1,0,0,0,0|3,0,0]=4 95 B9R1.3 c1cc(c(c(c1)Cl)F)F CM12214 [0,1,0,0,0,0|3,0,0]=4 96 B9R1.3 c1cc(c(c(c1)Cl)F)N CM11361 [0,1,0,0,0,0|3,0,0]=4 97 B9R1.3 c1cc(c(c(c1)Cl)F)O CM11679 [0,1,0,0,0,0|3,0,0]=4 98 B9R1.3 c1cc(c(c(c1)Cl)I)N CM11373 [0,1,0,0,0,0|3,0,0]=4 99 B9R1.3 c1cc(c(c(c1)Cl)I)O CM11688 [0,1,0,0,0,0|3,0,0]=4 100 B9R1.3 c1cc(c(c(c1)Cl)N)F CM11360 [0,1,0,0,0,0|3,0,0]=4 101 B9R1.3 c1cc(c(c(c1)Cl)O)O CM10873 [0,1,0,0,0,0|3,0,0]=4 102 B9R1.3 c1cc(c(c(c1)F)Br)F CM12212 [0,1,0,0,0,0|3,0,0]=4 103 B9R1.3 c1cc(c(c(c1)F)Br)N CM11298 [0,1,0,0,0,0|3,0,0]=4 104 B9R1.3 c1cc(c(c(c1)F)Cl)F CM12127 [0,1,0,0,0,0|3,0,0]=4 105 B9R1.3 c1cc(c(c(c1)F)Cl)N CM11357 [0,1,0,0,0,0|3,0,0]=4 106 B9R1.3 c1cc(c(c(c1)F)Cl)O CM11674 [0,1,0,0,0,0|3,0,0]=4 107 B9R1.3 c1cc(c(c(c1)F)F)F CM12301 [0,1,0,0,0,0|3,0,0]=4 108 B9R1.3 c1cc(c(c(c1)F)F)N CM11419 [0,1,0,0,0,0|3,0,0]=4 109 B9R1.3 c1cc(c(c(c1)F)I)F CM12222 [0,1,0,0,0,0|3,0,0]=4 110 B9R1.3 c1cc(c(c(c1)F)I)N CM11455 [0,1,0,0,0,0|3,0,0]=4 111 B9R1.3 c1cc(c(c(c1)F)N)F CM11422 [0,1,0,0,0,0|3,0,0]=4 112 B9R1.3 c1cc(c(c(c1)F)N)N CM12164 [0,1,0,0,0,0|3,0,0]=4 113 B9R1.3 c1cc(c(c(c1)F)O)F CM11727 [0,1,0,0,0,0|3,0,0]=4 114 B9R1.3 c1cc(c(c(c1)F)O)O CM11777 [0,1,0,0,0,0|3,0,0]=4 115 B9R1.3 c1cc(c(c(c1)I)Br)F CM10261 [0,1,0,0,0,0|3,0,0]=4 116 B9R1.3 c1cc(c(c(c1)I)F)F CM12220 [0,1,0,0,0,0|3,0,0]=4 117 B9R1.3 c1cc(c(c(c1)I)N)Cl CM11372 [0,1,0,0,0,0|3,0,0]=4 118 B9R1.3 c1cc(c(c(c1)I)O)Br CM10561 [0,1,0,0,0,0|3,0,0]=4 119 B9R1.3 c1cc(c(c(c1)I)O)Cl CM10489 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.3 c1cc(c(c(c1)O)Cl)O CM10872 [0,1,0,0,0,0|3,0,0]=4 121 B9R1.3 c1cc(c(c(c1)O)F)O CM11776 [0,1,0,0,0,0|3,0,0]=4 122 B9R1.34 Cc1cc(cc(c1)Br)O CM11657 [0,1,0,0,0,0|2,0,0]=3 123 B9R1.34 Cc1cc(cc(c1)Cl)Cl CM10249 [0,1,0,0,0,0|2,0,0]=3 124 B9R1.34 Cc1cc(cc(c1)F)N CM11466 [0,1,0,0,0,0|2,0,0]=3 125 B9R1.34 Cc1cc(cc(c1)I)C CM12260 [0,1,0,0,0,0|1,0,0]=2 126 B9R1.34 Cc1cc(cc(n1)Cl)N CM10567 [0,1,0,0,0,0|1,0,0]=2 127 B9R1.34 Cc1cc(nc(n1)C)Cl CM14288 [0,1,0,0,0,0|1,0,0]=2 128 B9R1.34 Cc1cc(nc(n1)Cl)C CM14109 [0,1,0,0,0,0|2,0,0]=3 129 B9R1.34 Cc1nc(cc(n1)Cl)Cl CM14054 [0,1,0,0,0,0|2,0,0]=3 130 B9R1.34 c1c(cc(cc1Br)Br)Cl CM12175 [0,1,0,0,0,0|3,0,0]=4 131 B9R1.34 c1c(cc(cc1Br)Br)F CM12190 [0,1,0,0,0,0|3,0,0]=4 132 B9R1.34 c1c(cc(cc1Br)Br)N CM11398 [0,1,0,0,0,0|3,0,0]=4 133 B9R1.34 c1c(cc(cc1Br)Br)O CM11712 [0,1,0,0,0,0|3,0,0]=4 134 B9R1.34 c1c(cc(cc1Cl)Br)F CM12044 [0,1,0,0,0,0|3,0,0]=4 135 B9R1.34 c1c(cc(cc1Cl)Cl)F CM12203 [0,1,0,0,0,0|3,0,0]=4 136 B9R1.34 c1c(cc(cc1F)Br)F CM12213 [0,1,0,0,0,0|3,0,0]=4 137 B9R1.34 c1c(cc(cc1F)Br)O CM11638 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.34 c1c(cc(cc1F)Cl)F CM12217 [0,1,0,0,0,0|3,0,0]=4 139 B9R1.34 c1c(cc(cc1F)Cl)N CM11362 [0,1,0,0,0,0|3,0,0]=4 140 B9R1.34 c1c(cc(cc1F)F)F CM12303 [0,1,0,0,0,0|3,0,0]=4 141 B9R1.34 c1c(cc(cc1F)F)O CM11729 [0,1,0,0,0,0|3,0,0]=4 142 B9R1.34 c1c(cc(cc1F)I)N CM11457 [0,1,0,0,0,0|3,0,0]=4 143 B9R1.34 c1c(cc(cc1N)N)N CM11525 [0,1,0,0,0,0|3,0,0]=4 144 B9R1.34 c1c(cc(cc1O)Br)O CM11666 [0,1,0,0,0,0|3,0,0]=4 145 B9R1.34 c1c(cc(nc1Br)Br)N CM11084 [0,1,0,0,0,0|2,0,0]=3 146 B9R1.34 c1c(cc(nc1Cl)Cl)N CM11105 [0,1,0,0,0,0|2,0,0]=3 147 B9R1.34 c1c(nc(nc1O)S)N CM11044 [0,1,0,0,0,0|3,0,0]=4 148 B9R1.69 Cc1c(ccc(n1)N)Br CM10976 [0,1,0,0,0,0|1,0,0]=2 149 B9R1.69 Cc1c(cnc(n1)Br)Br CM10497 [0,1,0,0,0,0|2,0,0]=3 150 B9R1.69 Cc1cc(c(nc1)F)I CM10099 [0,1,0,0,0,0|3,0,0]=4 151 B9R1.69 Cc1cc(ccc1Br)Br CM13950 [0,1,0,0,0,0|2,0,0]=3 152 B9R1.69 Cc1cc(ccc1Br)I CM13933 [0,1,0,0,0,0|2,0,0]=3 153 B9R1.69 Cc1cc(ccc1Cl)I CM13944 [0,1,0,0,0,0|2,0,0]=3 154 B9R1.69 Cc1cc(ccc1F)N CM11467 [0,1,0,0,0,0|2,0,0]=3 155 B9R1.69 Cc1cc(ccc1F)O CM11763 [0,1,0,0,0,0|2,0,0]=3 156 B9R1.69 Cc1cc(ccc1N)Br CM11319 [0,1,0,0,0,0|2,0,0]=3 157 B9R1.69 Cc1cc(ccc1O)F CM11762 [0,1,0,0,0,0|2,0,0]=3 158 B9R1.69 Cc1cc(cnc1N)Br CM10974 [0,1,0,0,0,0|3,0,0]=4 159 B9R1.69 Cc1cc(ncc1Br)N CM11003 [0,1,0,0,0,0|3,0,0]=4 160 B9R1.69 Cc1cc(ncc1N)Cl CM11008 [0,1,0,0,0,0|3,0,0]=4 161 B9R1.69 Cc1ccc(c(c1)Br)C CM12247 [0,1,0,0,0,0|2,0,0]=3 162 B9R1.69 Cc1ccc(c(c1)C)Br CM12246 [0,1,0,0,0,0|1,0,0]=2 163 B9R1.69 Cc1ccc(c(c1)C)Cl CM12249 [0,1,0,0,0,0|1,0,0]=2 164 B9R1.69 Cc1ccc(c(c1)Cl)N CM11376 [0,1,0,0,0,0|2,0,0]=3 165 B9R1.69 Cc1ccc(c(c1)Cl)O CM10213 [0,1,0,0,0,0|2,0,0]=3 166 B9R1.69 Cc1ccc(c(c1)F)Br CM13929 [0,1,0,0,0,0|2,0,0]=3 167 B9R1.69 Cc1ccc(c(c1)F)F CM13957 [0,1,0,0,0,0|2,0,0]=3 168 B9R1.69 Cc1ccc(c(c1)F)N CM11463 [0,1,0,0,0,0|2,0,0]=3 169 B9R1.69 Cc1ccc(c(c1)I)N CM11496 [0,1,0,0,0,0|2,0,0]=3 170 B9R1.69 Cc1ccc(c(c1)N)I CM11497 [0,1,0,0,0,0|2,0,0]=3 171 B9R1.69 Cc1ccc(c(c1)O)Br CM10472 [0,1,0,0,0,0|2,0,0]=3 172 B9R1.69 Cc1ccc(c(c1)O)F CM11758 [0,1,0,0,0,0|2,0,0]=3 173 B9R1.69 Cc1ccc(cc1Br)N CM11318 [0,1,0,0,0,0|3,0,0]=4 174 B9R1.69 Cc1ccc(cc1Br)O CM10192 [0,1,0,0,0,0|3,0,0]=4 175 B9R1.69 Cc1ccc(cc1C)Cl CM12251 [0,1,0,0,0,0|2,0,0]=3 176 B9R1.69 Cc1ccc(cc1C)F CM12256 [0,1,0,0,0,0|2,0,0]=3 177 B9R1.69 Cc1ccc(cc1Cl)F CM13940 [0,1,0,0,0,0|3,0,0]=4 178 B9R1.69 Cc1ccc(cc1F)Br CM13928 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.69 Cc1ccc(cc1F)Cl CM13941 [0,1,0,0,0,0|3,0,0]=4 180 B9R1.69 Cc1ccc(cc1F)F CM13955 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.69 Cc1ccc(cc1F)I CM13959 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.69 Cc1ccc(cc1F)N CM11465 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.69 Cc1ccc(cc1N)O CM11593 [0,1,0,0,0,0|3,0,0]=4 184 B9R1.69 Cc1ccc(cc1O)F CM11764 [0,1,0,0,0,0|3,0,0]=4 185 B9R1.69 Cc1ccc(cc1O)N CM11597 [0,1,0,0,0,0|3,0,0]=4 186 B9R1.69 Cc1ccc(cc1O)O CM10187 [0,1,0,0,0,0|3,0,0]=4 187 B9R1.69 Cc1cnc(c(n1)Cl)C CM11071 [0,1,0,0,0,0|2,0,0]=3 188 B9R1.69 Cc1cnc(c(n1)N)C CM11070 [0,1,0,0,0,0|2,0,0]=3 189 B9R1.69 Cn1cc(ccc1=O)N CM10159 [0,1,0,0,0,0|3,0,0]=4 190 B9R1.69 c1c(c(nc(n1)Cl)Cl)Br CM11109 [0,1,0,0,0,0|3,0,0]=4 191 B9R1.69 c1c(c(nc(n1)Cl)Cl)Cl CM11088 [0,1,0,0,0,0|3,0,0]=4 192 B9R1.69 c1c(c(nc(n1)Cl)Cl)I CM14362 [0,1,0,0,0,0|3,0,0]=4 193 B9R1.69 c1c(nc(c(n1)Br)Cl)N CM10655 [0,1,0,0,0,0|3,0,0]=4 194 B9R1.69 c1c(nc(c(n1)Br)N)Cl CM10429 [0,1,0,0,0,0|3,0,0]=4 195 B9R1.69 c1cc(c(cc1Br)Br)Br CM12296 [0,1,0,0,0,0|3,0,0]=4 196 B9R1.69 c1cc(c(cc1Br)Br)F CM12188 [0,1,0,0,0,0|3,0,0]=4 197 B9R1.69 c1cc(c(cc1Br)Cl)Cl CM12198 [0,1,0,0,0,0|3,0,0]=4 198 B9R1.69 c1cc(c(cc1Br)Cl)F CM12043 [0,1,0,0,0,0|3,0,0]=4 199 B9R1.69 c1cc(c(cc1Br)Cl)I CM12047 [0,1,0,0,0,0|3,0,0]=4 200 B9R1.69 c1cc(c(cc1Br)Cl)N CM11270 [0,1,0,0,0,0|3,0,0]=4 201 B9R1.69 c1cc(c(cc1Br)F)N CM11303 [0,1,0,0,0,0|3,0,0]=4 202 B9R1.69 c1cc(c(cc1Br)F)S CM11814 [0,1,0,0,0,0|3,0,0]=4 203 B9R1.69 c1cc(c(cc1Br)I)N CM11314 [0,1,0,0,0,0|3,0,0]=4 204 B9R1.69 c1cc(c(cc1Br)I)O CM11650 [0,1,0,0,0,0|3,0,0]=4 205 B9R1.69 c1cc(c(cc1Br)N)Cl CM11272 [0,1,0,0,0,0|3,0,0]=4 206 B9R1.69 c1cc(c(cc1Br)N)F CM11305 [0,1,0,0,0,0|3,0,0]=4 207 B9R1.69 c1cc(c(cc1Br)N)N CM10015 [0,1,0,0,0,0|3,0,0]=4 208 B9R1.69 c1cc(c(cc1Br)N)O CM11544 [0,1,0,0,0,0|3,0,0]=4 209 B9R1.69 c1cc(c(cc1Br)O)Br CM11709 [0,1,0,0,0,0|3,0,0]=4 210 B9R1.69 c1cc(c(cc1Br)O)Cl CM11610 [0,1,0,0,0,0|3,0,0]=4 211 B9R1.69 c1cc(c(cc1Br)O)F CM11642 [0,1,0,0,0,0|3,0,0]=4 212 B9R1.69 c1cc(c(cc1Br)O)N CM11546 [0,1,0,0,0,0|3,0,0]=4 213 B9R1.69 c1cc(c(cc1Cl)Br)Cl CM12040 [0,1,0,0,0,0|3,0,0]=4 214 B9R1.69 c1cc(c(cc1Cl)Br)I CM12048 [0,1,0,0,0,0|3,0,0]=4 215 B9R1.69 c1cc(c(cc1Cl)F)Br CM12045 [0,1,0,0,0,0|3,0,0]=4 216 B9R1.69 c1cc(c(cc1Cl)F)N CM11363 [0,1,0,0,0,0|3,0,0]=4 217 B9R1.69 c1cc(c(cc1Cl)F)O CM11681 [0,1,0,0,0,0|3,0,0]=4 218 B9R1.69 c1cc(c(cc1Cl)I)N CM11374 [0,1,0,0,0,0|3,0,0]=4 219 B9R1.69 c1cc(c(cc1Cl)I)O CM11689 [0,1,0,0,0,0|3,0,0]=4 220 B9R1.69 c1cc(c(cc1Cl)N)Br CM11267 [0,1,0,0,0,0|3,0,0]=4 221 B9R1.69 c1cc(c(cc1Cl)N)F CM11366 [0,1,0,0,0,0|3,0,0]=4 222 B9R1.69 c1cc(c(cc1Cl)N)I CM11375 [0,1,0,0,0,0|3,0,0]=4 223 B9R1.69 c1cc(c(cc1Cl)N)N CM12157 [0,1,0,0,0,0|3,0,0]=4 224 B9R1.69 c1cc(c(cc1Cl)O)I CM11692 [0,1,0,0,0,0|3,0,0]=4 225 B9R1.69 c1cc(c(cc1F)Br)Br CM12189 [0,1,0,0,0,0|3,0,0]=4 226 B9R1.69 c1cc(c(cc1F)Br)I CM12088 [0,1,0,0,0,0|3,0,0]=4 227 B9R1.69 c1cc(c(cc1F)Br)N CM11299 [0,1,0,0,0,0|3,0,0]=4 228 B9R1.69 c1cc(c(cc1F)Br)O CM11628 [0,1,0,0,0,0|3,0,0]=4 229 B9R1.69 c1cc(c(cc1F)Cl)N CM11358 [0,1,0,0,0,0|3,0,0]=4 230 B9R1.69 c1cc(c(cc1F)Cl)S CM11816 [0,1,0,0,0,0|3,0,0]=4 231 B9R1.69 c1cc(c(cc1F)F)Cl CM12215 [0,1,0,0,0,0|3,0,0]=4 232 B9R1.69 c1cc(c(cc1F)F)F CM12302 [0,1,0,0,0,0|3,0,0]=4 233 B9R1.69 c1cc(c(cc1F)F)I CM12221 [0,1,0,0,0,0|3,0,0]=4 234 B9R1.69 c1cc(c(cc1F)F)N CM11420 [0,1,0,0,0,0|3,0,0]=4 235 B9R1.69 c1cc(c(cc1F)F)O CM11724 [0,1,0,0,0,0|3,0,0]=4 236 B9R1.69 c1cc(c(cc1F)F)S CM11819 [0,1,0,0,0,0|3,0,0]=4 237 B9R1.69 c1cc(c(cc1F)I)Cl CM12140 [0,1,0,0,0,0|3,0,0]=4 238 B9R1.69 c1cc(c(cc1F)I)N CM11458 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.69 c1cc(c(cc1F)I)O CM10851 [0,1,0,0,0,0|3,0,0]=4 240 B9R1.69 c1cc(c(cc1F)N)Br CM11300 [0,1,0,0,0,0|3,0,0]=4 241 B9R1.69 c1cc(c(cc1F)N)Cl CM11359 [0,1,0,0,0,0|3,0,0]=4 242 B9R1.69 c1cc(c(cc1F)N)F CM11421 [0,1,0,0,0,0|3,0,0]=4 243 B9R1.69 c1cc(c(cc1F)N)I CM11459 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.69 c1cc(c(cc1F)N)N CM12165 [0,1,0,0,0,0|3,0,0]=4 245 B9R1.69 c1cc(c(cc1F)N)O CM11571 [0,1,0,0,0,0|3,0,0]=4 246 B9R1.69 c1cc(c(cc1F)O)Cl CM11677 [0,1,0,0,0,0|3,0,0]=4 247 B9R1.69 c1cc(c(cc1F)O)F CM11725 [0,1,0,0,0,0|3,0,0]=4 248 B9R1.69 c1cc(c(cc1F)O)I CM10850 [0,1,0,0,0,0|3,0,0]=4 249 B9R1.69 c1cc(c(cc1F)O)N CM11573 [0,1,0,0,0,0|3,0,0]=4 250 B9R1.69 c1cc(c(cc1I)Br)N CM11313 [0,1,0,0,0,0|3,0,0]=4 251 B9R1.69 c1cc(c(cc1I)Br)O CM10644 [0,1,0,0,0,0|3,0,0]=4 252 B9R1.69 c1cc(c(cc1I)Cl)Cl CM12204 [0,1,0,0,0,0|3,0,0]=4 253 B9R1.69 c1cc(c(cc1I)Cl)F CM12139 [0,1,0,0,0,0|3,0,0]=4 254 B9R1.69 c1cc(c(cc1I)F)Cl CM12141 [0,1,0,0,0,0|3,0,0]=4 255 B9R1.69 c1cc(c(cc1I)F)N CM11454 [0,1,0,0,0,0|3,0,0]=4 256 B9R1.69 c1cc(c(cc1I)F)O CM11751 [0,1,0,0,0,0|3,0,0]=4 257 B9R1.69 c1cc(c(cc1I)N)N CM12168 [0,1,0,0,0,0|3,0,0]=4 258 B9R1.69 c1cc(c(cc1I)O)I CM10916 [0,1,0,0,0,0|3,0,0]=4 259 B9R1.69 c1cc(c(cc1N)Br)N CM12156 [0,1,0,0,0,0|3,0,0]=4 260 B9R1.69 c1cc(c(cc1N)Cl)Br CM11271 [0,1,0,0,0,0|3,0,0]=4 261 B9R1.69 c1cc(c(cc1N)F)Br CM11304 [0,1,0,0,0,0|3,0,0]=4 262 B9R1.69 c1cc(c(cc1N)F)Cl CM11365 [0,1,0,0,0,0|3,0,0]=4 263 B9R1.69 c1cc(c(cc1N)F)F CM11423 [0,1,0,0,0,0|3,0,0]=4 264 B9R1.69 c1cc(c(cc1N)F)I CM10918 [0,1,0,0,0,0|3,0,0]=4 265 B9R1.69 c1cc(c(cc1N)F)O CM11579 [0,1,0,0,0,0|3,0,0]=4 266 B9R1.69 c1cc(c(cc1N)N)Br CM12155 [0,1,0,0,0,0|3,0,0]=4 267 B9R1.69 c1cc(c(cc1N)N)F CM12166 [0,1,0,0,0,0|3,0,0]=4 268 B9R1.69 c1cc(c(cc1N)O)Cl CM11559 [0,1,0,0,0,0|3,0,0]=4 269 B9R1.69 c1cc(c(cc1O)Br)Cl CM11607 [0,1,0,0,0,0|3,0,0]=4 270 B9R1.69 c1cc(c(cc1O)Br)F CM11636 [0,1,0,0,0,0|3,0,0]=4 271 B9R1.69 c1cc(c(cc1O)Cl)Br CM10223 [0,1,0,0,0,0|3,0,0]=4 272 B9R1.69 c1cc(c(cc1O)Cl)I CM10112 [0,1,0,0,0,0|3,0,0]=4 273 B9R1.69 c1cc(c(cc1O)Cl)N CM11558 [0,1,0,0,0,0|3,0,0]=4 274 B9R1.69 c1cc(c(cc1O)Cl)N CM14377 [0,1,0,0,0,0|3,0,0]=4 275 B9R1.69 c1cc(c(cc1O)F)Br CM11641 [0,1,0,0,0,0|3,0,0]=4 276 B9R1.69 c1cc(c(cc1O)F)Cl CM10877 [0,1,0,0,0,0|3,0,0]=4 277 B9R1.69 c1cc(c(cc1O)F)F CM11728 [0,1,0,0,0,0|3,0,0]=4 278 B9R1.69 c1cc(c(cc1O)F)I CM10646 [0,1,0,0,0,0|3,0,0]=4 279 B9R1.69 c1cc(c(cc1O)F)N CM11581 [0,1,0,0,0,0|3,0,0]=4 280 B9R1.69 c1cc(c(cc1O)I)Cl CM11690 [0,1,0,0,0,0|3,0,0]=4 281 B9R1.69 c1cc(c(cc1O)N)F CM11577 [0,1,0,0,0,0|3,0,0]=4 282 B9R1.69 c1cc(c(cc1O)O)Br CM14332 [0,1,0,0,0,0|3,0,0]=4 283 B9R1.69 c1cc(c(cc1O)O)F CM11778 [0,1,0,0,0,0|3,0,0]=4 284 B9R1.69 c1cc(c(cc1O)O)N CM10297 [0,1,0,0,0,0|3,0,0]=4 285 B9R1.69 c1cc(c(cc1S)Cl)F CM11817 [0,1,0,0,0,0|3,0,0]=4 286 B9R1.69 c1cc(c(cc1S)F)F CM11820 [0,1,0,0,0,0|3,0,0]=4 287 B7R1.2 Cc1cc(on1)C CM14486 [0,0,0,0,1,0|3,0,0]=4 288 B7R1.2 Cc1ncc(s1)I CM10702 [0,0,0,0,1,0|3,0,0]=4 289 B7R1.2 Cn1ccc(n1)I CM10441 [0,0,0,0,1,0|2,0,0]=3 290 B7R1.2 Cn1ncc(n1)Br CM10510 [0,0,0,0,1,0|3,0,0]=4 291 B7R1.4 Cc1cscc1Br CM10703 [0,0,0,0,1,0|2,0,0]=3 292 B7R1.4 Cn1ccnc1Br CM10422 [0,0,0,0,1,0|3,0,0]=4 293 B7R1.4 Cn1ccnc1I CM10200 [0,0,0,0,1,0|3,0,0]=4 294 B7R1.4 c1c(c(cs1)Br)Br CM10704 [0,0,0,0,1,0|3,0,0]=4 295 B7R1.4 c1csc(c1Br)Cl CM10917 [0,0,0,0,1,0|3,0,0]=4 296 B6R0.4 CC(=O)C=COC CM11079 [1,0,1,0,0,0|2,0,0]=4 297 B8R1.2 COc1cccnc1 CM10357 [1,1,0,0,0,0|2,0,0]=4 298 B8R1.3 Cc1ccc(=O)[nH]n1 CM11032 [1,1,0,0,0,0|1,0,0]=3 299 B8R1.3 Cc1ccc(cn1)N CM14483 [1,1,0,0,0,0|0,0,0]=2 300 B8R1.3 Cc1ccc(nn1)Br CM11114 [1,1,0,0,0,0|1,0,0]=3 301 B8R1.3 Cc1ncc(cn1)Br CM10466 [1,1,0,0,0,0|1,0,0]=3 302 B8R1.3 c1c(cnc(n1)Br)Br CM14294 [1,1,0,0,0,0|2,0,0]=4 303 B8R1.3 c1c(cnc(n1)Cl)Br CM14376 [1,1,0,0,0,0|2,0,0]=4 304 B8R1.3 c1c(cnc(n1)Cl)O CM14258 [1,1,0,0,0,0|2,0,0]=4 305 B8R1.3 c1c(cnc(n1)F)Br CM14351 [1,1,0,0,0,0|2,0,0]=4 306 B8R1.3 c1c(cnc(n1)I)Br CM14354 [1,1,0,0,0,0|2,0,0]=4 307 B8R1.3 c1c(cnc(n1)I)Cl CM14283 [1,1,0,0,0,0|2,0,0]=4 308 B8R1.3 c1c(cnc(n1)N)Br CM14050 [1,1,0,0,0,0|2,0,0]=4 309 B8R1.3 c1c(ncc(n1)Br)F CM10435 [1,1,0,0,0,0|2,0,0]=4 310 B8R1.3 c1c(ncc(n1)Cl)Cl CM10433 [1,1,0,0,0,0|2,0,0]=4 311 B8R1.3 c1cc(ccc1Br)Br CM12170 [1,1,0,0,0,0|2,0,0]=4 312 B8R1.3 c1cc(ccc1Br)I CM12101 [1,1,0,0,0,0|2,0,0]=4 313 B8R1.3 c1cc(ccc1I)I CM12236 [1,1,0,0,0,0|2,0,0]=4 314 B8R1.3 c1cc(ccc1O)F CM11750 [1,1,0,0,0,0|2,0,0]=4 315 B8R1.3 c1cc(ncc1Br)Br CM14111 [1,1,0,0,0,0|1,0,0]=3 316 B8R1.3 c1cc(ncc1Br)F CM14457 [1,1,0,0,0,0|1,0,0]=3 317 B8R1.3 c1cc(ncc1F)Br CM14029 [1,1,0,0,0,0|1,0,0]=3 318 B8R1.3 c1cc(ncc1N)Cl CM13842 [1,1,0,0,0,0|1,0,0]=3 319 B8R1.5 Cc1c(cccn1)N CM14488 [1,1,0,0,0,0|0,0,0]=2 320 B8R1.5 Cc1cccnc1Cl CM13849 [1,1,0,0,0,0|1,0,0]=3 321 B8R1.5 c1c(c(ncn1)N)Br CM10426 [1,1,0,0,0,0|2,0,0]=4 322 B8R1.5 c1c(c(ncn1)N)N CM14060 [1,1,0,0,0,0|2,0,0]=4 323 B8R1.5 c1cc(c(nc1)N)N CM14021 [1,1,0,0,0,0|1,0,0]=3 324 B8R1.5 c1cc(c(nc1)O)F CM10987 [1,1,0,0,0,0|1,0,0]=3 325 B8R1.5 c1ccc(c(c1)F)Cl CM12138 [1,1,0,0,0,0|2,0,0]=4 326 B8R1.5 c1ccc(c(c1)I)I CM12234 [1,1,0,0,0,0|2,0,0]=4 327 B8R1.5 c1ccc(c(c1)N)Br CM11265 [1,1,0,0,0,0|2,0,0]=4 328 B8R1.5 c1ccc(c(c1)N)I CM11493 [1,1,0,0,0,0|2,0,0]=4 329 B8R1.5 c1cnc(c(n1)N)Br CM10652 [1,1,0,0,0,0|2,0,0]=4 330 B8R1.5 c1cnc(c(n1)N)O CM10654 [1,1,0,0,0,0|2,0,0]=4 331 B8R1.1 c1c(nc(o1)Cl)CBr CM10353 [0,1,0,0,1,0|2,0,0]=4 332 B8R1.11 c1csc(c1CO)Br CM10090 [0,1,0,0,1,0|2,0,0]=4 333 B10R1.2 CCc1cccc(c1F)O CM10380 [0,2,0,0,0,0|2,0,0]=4 334 B10R1.2 CCc1cccc(c1O)Cl CM10496 [0,2,0,0,0,0|2,0,0]=4 335 B10R1.2 COc1cccc(c1Br)I CM10146 [0,2,0,0,0,0|2,0,0]=4 336 B10R1.2 COc1cccc(c1Br)N CM10475 [0,2,0,0,0,0|2,0,0]=4 337 B10R1.2 COc1cccc(c1Cl)Cl CM11715 [0,2,0,0,0,0|2,0,0]=4 338 B10R1.2 COc1cccc(c1Cl)N CM11554 [0,2,0,0,0,0|2,0,0]=4 339 B10R1.2 COc1cccc(c1F)Br CM11633 [0,2,0,0,0,0|2,0,0]=4 340 B10R1.2 COc1cccc(c1F)F CM11722 [0,2,0,0,0,0|2,0,0]=4 341 B10R1.2 COc1cccc(c1F)N CM11575 [0,2,0,0,0,0|2,0,0]=4 342 B10R1.2 COc1cccc(c1F)O CM10645 [0,2,0,0,0,0|2,0,0]=4 343 B10R1.2 COc1cccc(c1I)F CM11753 [0,2,0,0,0,0|2,0,0]=4 344 B10R1.2 COc1cccc(c1I)N CM11587 [0,2,0,0,0,0|2,0,0]=4 345 B10R1.2 COc1cccc(c1N)F CM11569 [0,2,0,0,0,0|2,0,0]=4 346 B10R1.2 COc1cccc(c1O)Cl CM10886 [0,2,0,0,0,0|2,0,0]=4 347 B10R1.2 COc1cccc(c1O)F CM11754 [0,2,0,0,0,0|2,0,0]=4 348 B10R1.2 Cc1c(cccc1Cl)SC CM10023 [0,2,0,0,0,0|2,0,0]=4 349 B10R1.2 Cc1c(cccc1OC)N CM11591 [0,2,0,0,0,0|2,0,0]=4 350 B10R1.2 Cc1cccc(c1C)CBr CM13401 [0,2,0,0,0,0|1,0,0]=3 351 B10R1.2 Cc1cccc(c1C)OC CM11740 [0,2,0,0,0,0|1,0,0]=3 352 B10R1.2 Cc1cccc(c1Cl)C=O CM11894 [0,2,0,0,0,0|1,0,1]=4 353 B10R1.2 Cc1cccc(c1F)C#N CM13087 [0,2,0,0,0,0|1,0,1]=4 354 B10R1.2 Cc1cccc(c1F)C=O CM11968 [0,2,0,0,0,0|1,0,1]=4 355 B10R1.2 Cc1cccc(c1N)C#N CM12930 [0,2,0,0,0,0|1,0,1]=4 356 B10R1.2 c1cc(c(c(c1)Br)F)CBr CM13292 [0,2,0,0,0,0|2,0,0]=4 357 B10R1.2 c1cc(c(c(c1)Cl)Br)CO CM10340 [0,2,0,0,0,0|2,0,0]=4 358 B10R1.2 c1cc(c(c(c1)Cl)F)CBr CM13313 [0,2,0,0,0,0|2,0,0]=4 359 B10R1.2 c1cc(c(c(c1)F)Br)CBr CM13275 [0,2,0,0,0,0|2,0,0]=4 360 B10R1.2 c1cc(c(c(c1)F)Br)CO CM13276 [0,2,0,0,0,0|2,0,0]=4 361 B10R1.2 c1cc(c(c(c1)F)F)CBr CM13349 [0,2,0,0,0,0|2,0,0]=4 362 B10R1.2 c1cc(c(c(c1)F)F)CN CM13532 [0,2,0,0,0,0|2,0,0]=4 363 B10R1.8 COc1cc(cc(c1)Br)Br CM11711 [0,2,0,0,0,0|2,0,0]=4 364 B10R1.8 COc1cc(cc(c1)Br)F CM11637 [0,2,0,0,0,0|2,0,0]=4 365 B10R1.8 COc1cc(cc(c1)Br)O CM11654 [0,2,0,0,0,0|2,0,0]=4 366 B10R1.8 COc1cc(cc(c1)Cl)Cl CM11716 [0,2,0,0,0,0|2,0,0]=4 367 B10R1.8 COc1nc(cc(n1)Cl)Cl CM14048 [0,2,0,0,0,0|2,0,0]=4 368 B10R1.8 CSc1cc(cc(c1)Br)F CM10167 [0,2,0,0,0,0|2,0,0]=4 369 B10R1.8 CSc1cc(cc(c1)Br)O CM10825 [0,2,0,0,0,0|2,0,0]=4 370 B10R1.8 Cc1cc(cc(c1)Br)C#N CM12984 [0,2,0,0,0,0|1,0,1]=4 371 B10R1.8 Cc1cc(cc(c1)Cl)C=O CM11896 [0,2,0,0,0,0|1,0,1]=4 372 B10R1.8 Cc1cc(cc(c1)F)C#N CM13093 [0,2,0,0,0,0|1,0,1]=4 373 B10R1.8 Cc1cc(cc(c1)F)C=O CM11973 [0,2,0,0,0,0|1,0,1]=4 374 B10R1.8 Cc1cc(cc(c1)I)C#N CM13128 [0,2,0,0,0,0|1,0,1]=4 375 B10R1.8 Cc1cc(cc(c1)N)CO CM13266 [0,2,0,0,0,0|1,0,0]=3 376 B10R1.8 Cc1cc(cc(c1)O)C#N CM10560 [0,2,0,0,0,0|1,0,1]=4 377 B10R1.8 Cc1cc(cc(c1)O)C=O CM10898 [0,2,0,0,0,0|1,0,1]=4 378 B10R1.8 Cc1cc(cc(c1)OC)C CM11742 [0,2,0,0,0,0|1,0,0]=3 379 B10R1.8 Cc1nc(cc(n1)Cl)OC CM14055 [0,2,0,0,0,0|1,0,0]=3 380 B10R1.8 c1c(cc(cc1Cl)Cl)CBr CM10250 [0,2,0,0,0,0|2,0,0]=4 381 B10R1.8 c1c(cc(cc1F)Br)CBr CM13293 [0,2,0,0,0,0|2,0,0]=4 382 B10R1.8 c1c(cc(cc1F)Br)CO CM13291 [0,2,0,0,0,0|2,0,0]=4 383 B10R1.8 c1c(cc(cc1F)Cl)CBr CM13317 [0,2,0,0,0,0|2,0,0]=4 384 B10R1.8 c1c(cc(cc1F)F)CN CM13537 [0,2,0,0,0,0|2,0,0]=4 385 B10R1.8 c1c(cc(cc1F)F)CO CM13504 [0,2,0,0,0,0|2,0,0]=4 386 B10R1.10 c1cc(cc(c1)Br)CC#N CM13649 [0,2,0,0,0,0|2,0,0]=4 387 B10R1.10 c1cc(cc(c1)F)CC#N CM13701 [0,2,0,0,0,0|2,0,0]=4 388 B10R1.10 c1cc(cc(c1)F)CCN CM13556 [0,2,0,0,0,0|2,0,0]=4 389 B10R1.10 c1cc(cc(c1)F)CCO CM13507 [0,2,0,0,0,0|2,0,0]=4 390 B10R1.10 c1cc(cc(c1)N)CC#N CM13646 [0,2,0,0,0,0|2,0,0]=4 391 B10R1.10 c1cc(cc(c1)N)CCO CM10010 [0,2,0,0,0,0|2,0,0]=4 392 B10R1.10 c1cc(cc(c1)O)CNN CM14001 [0,2,0,0,0,0|2,0,0]=4 393 B10R1.30 CCc1cc(ccc1F)O CM10379 [0,2,0,0,0,0|2,0,0]=4 394 B10R1.30 CCc1cc(ccc1N)Br CM11297 [0,2,0,0,0,0|2,0,0]=4 395 B10R1.30 COc1c(ccc(n1)Br)N CM10431 [0,2,0,0,0,0|1,0,0]=3 396 B10R1.30 COc1c(ncc(n1)Br)Br CM10345 [0,2,0,0,0,0|2,0,0]=4 397 B10R1.30 COc1c(ncc(n1)Br)N CM10344 [0,2,0,0,0,0|2,0,0]=4 398 B10R1.30 COc1cc(ccc1Br)F CM11630 [0,2,0,0,0,0|2,0,0]=4 399 B10R1.30 COc1cc(ccc1Br)I CM11648 [0,2,0,0,0,0|2,0,0]=4 400 B10R1.30 COc1cc(ccc1Br)N CM11550 [0,2,0,0,0,0|2,0,0]=4 401 B10R1.30 COc1cc(ccc1Cl)F CM11676 [0,2,0,0,0,0|2,0,0]=4 402 B10R1.30 COc1cc(ccc1Cl)I CM11687 [0,2,0,0,0,0|2,0,0]=4 403 B10R1.30 COc1cc(ccc1Cl)N CM11557 [0,2,0,0,0,0|2,0,0]=4 404 B10R1.30 COc1cc(ccc1Cl)O CM10884 [0,2,0,0,0,0|2,0,0]=4 405 B10R1.30 COc1cc(ccc1F)F CM11723 [0,2,0,0,0,0|2,0,0]=4 406 B10R1.30 COc1cc(ccc1F)N CM11582 [0,2,0,0,0,0|2,0,0]=4 407 B10R1.30 COc1cc(ccc1F)O CM11756 [0,2,0,0,0,0|2,0,0]=4 408 B10R1.30 COc1cc(ccc1I)Br CM11652 [0,2,0,0,0,0|2,0,0]=4 409 B10R1.30 COc1cc(ccc1I)Cl CM11691 [0,2,0,0,0,0|2,0,0]=4 410 B10R1.30 COc1cc(ccc1I)I CM10921 [0,2,0,0,0,0|2,0,0]=4 411 B10R1.30 COc1cc(ccc1N)Br CM10651 [0,2,0,0,0,0|2,0,0]=4 412 B10R1.30 COc1cc(ccc1N)F CM11572 [0,2,0,0,0,0|2,0,0]=4 413 B10R1.30 COc1cc(ccc1N)I CM11586 [0,2,0,0,0,0|2,0,0]=4 414 B10R1.30 COc1cc(ccc1O)N CM10211 [0,2,0,0,0,0|2,0,0]=4 415 B10R1.30 CSc1c(cnc(n1)Cl)Br CM10432 [0,2,0,0,0,0|2,0,0]=4 416 B10R1.30 Cc1ccc(c(c1)C#N)F CM13089 [0,2,0,0,0,0|1,0,1]=4 417 B10R1.30 Cc1ccc(c(c1)C#N)O CM10144 [0,2,0,0,0,0|1,0,1]=4 418 B10R1.30 Cc1ccc(c(c1)C=O)F CM11970 [0,2,0,0,0,0|1,0,1]=4 419 B10R1.30 Cc1ccc(c(c1)OC)Br CM11655 [0,2,0,0,0,0|1,0,0]=3 420 B10R1.30 Cc1ccc(cc1CBr)F CM13415 [0,2,0,0,0,0|2,0,0]=4 421 B10R1.30 c1cc(c(cc1Br)CBr)F CM13294 [0,2,0,0,0,0|2,0,0]=4 422 B10R1.30 c1cc(c(cc1Br)CCl)Cl CM13271 [0,2,0,0,0,0|2,0,0]=4 423 B10R1.30 c1cc(c(cc1Br)CO)Cl CM13270 [0,2,0,0,0,0|2,0,0]=4 424 B10R1.30 c1cc(c(cc1Cl)CN)F CM13523 [0,2,0,0,0,0|2,0,0]=4 425 B10R1.30 c1cc(c(cc1F)CBr)Br CM13289 [0,2,0,0,0,0|2,0,0]=4 426 B10R1.30 c1cc(c(cc1F)CCl)Br CM13290 [0,2,0,0,0,0|2,0,0]=4 427 B10R1.30 c1cc(c(cc1F)CN)F CM13534 [0,2,0,0,0,0|2,0,0]=4 428 B10R1.30 c1cc(c(cc1F)CO)Br CM13279 [0,2,0,0,0,0|2,0,0]=4 429 B10R1.30 c1cc(c(cc1I)CBr)Cl CM13321 [0,2,0,0,0,0|2,0,0]=4 430 B10R1.30 c1cc(c(cc1I)CCl)Cl CM13324 [0,2,0,0,0,0|2,0,0]=4 431 B10R1.30 c1cc(c(cc1I)CO)Br CM13297 [0,2,0,0,0,0|2,0,0]=4 432 B10R1.30 c1cc(c(cc1N)CO)Cl CM13265 [0,2,0,0,0,0|2,0,0]=4 433 B10R1.113 CC(=O)c1cccc(c1)F CM11197 [0,2,0,0,0,0|2,0,0]=4 434 B10R1.113 CC(=O)c1cccc(c1)I CM11219 [0,2,0,0,0,0|2,0,0]=4 435 B10R1.113 CC(C)c1cccc(c1)Br CM12107 [0,2,0,0,0,0|2,0,0]=4 436 B10R1.113 CC(C)c1cccc(n1)Br CM13845 [0,2,0,0,0,0|1,0,0]=3 437 B10R1.113 CC(c1cccc(c1)F)N CM13557 [0,2,0,0,0,0|2,0,0]=4 438 B10R1.113 CC(c1cccc(c1)F)O CM13506 [0,2,0,0,0,0|2,0,0]=4 439 B10R1.113 CN(C)c1cccc(n1)Br CM10139 [0,2,0,0,0,0|1,0,0]=3 440 B10R1.113 Cc1cccc(c1)C(=O)C CM11223 [0,2,0,0,0,0|1,0,0]=3 441 B10R1.113 Cc1cccc(c1)C(=S)O CM12849 [0,2,0,0,0,0|1,0,1]=4 442 B10R1.113 Cc1cncc(n1)C(=O)O CM14090 [0,2,0,0,0,0|1,0,1]=4 443 B10R1.113 c1cc(cc(c1)F)C(F)F CM12223 [0,2,0,0,0,0|2,0,0]=4 444 B10R1.113 c1cc(nc(c1)Cl)C(=O)O CM10033 [0,2,0,0,0,0|1,0,1]=4 445 B10R1.172 CCc1cccc(c1)C#N CM13064 [0,2,0,0,0,0|1,0,1]=4 446 B10R1.172 COc1cccc(c1)CCl CM10947 [0,2,0,0,0,0|1,0,0]=3 447 B10R1.172 COc1ccnc(c1)CN CM10131 [0,2,0,0,0,0|2,0,0]=4 448 B10R1.172 c1cc(nc(c1)C#N)CCl CM14031 [0,2,0,0,0,0|0,0,1]=3 449 B10R1.172 c1cc(nc(c1)C=O)C=O CM14110 [0,2,0,0,0,0|0,0,2]=4 450 B10R1.172 c1cc(nc(c1)CCl)CCl CM14033 [0,2,0,0,0,0|0,0,0]=2 451 B10R1.172 c1cc(nc(c1)CO)CO CM14032 [0,2,0,0,0,0|0,0,0]=2 452 B10R1.176 CCc1ccc(c(c1)N)O CM10378 [0,2,0,0,0,0|2,0,0]=4 453 B10R1.176 CCc1ccc(c(c1)O)O CM10874 [0,2,0,0,0,0|2,0,0]=4 454 B10R1.176 CNc1ccc(c(c1)Cl)Cl CM11409 [0,2,0,0,0,0|2,0,0]=4 455 B10R1.176 COc1ccc(c(c1)Br)Br CM11710 [0,2,0,0,0,0|2,0,0]=4 456 B10R1.176 COc1ccc(c(c1)Br)Cl CM11606 [0,2,0,0,0,0|2,0,0]=4 457 B10R1.176 COc1ccc(c(c1)Br)F CM11635 [0,2,0,0,0,0|2,0,0]=4 458 B10R1.176 COc1ccc(c(c1)Br)N CM11549 [0,2,0,0,0,0|2,0,0]=4 459 B10R1.176 COc1ccc(c(c1)Br)O CM10826 [0,2,0,0,0,0|2,0,0]=4 460 B10R1.176 COc1ccc(c(c1)Cl)Br CM11609 [0,2,0,0,0,0|2,0,0]=4 461 B10R1.176 COc1ccc(c(c1)Cl)I CM10120 [0,2,0,0,0,0|2,0,0]=4 462 B10R1.176 COc1ccc(c(c1)Cl)N CM10924 [0,2,0,0,0,0|2,0,0]=4 463 B10R1.176 COc1ccc(c(c1)F)Br CM11640 [0,2,0,0,0,0|2,0,0]=4 464 B10R1.176 COc1ccc(c(c1)F)Cl CM11682 [0,2,0,0,0,0|2,0,0]=4 465 B10R1.176 COc1ccc(c(c1)F)N CM11580 [0,2,0,0,0,0|2,0,0]=4 466 B10R1.176 COc1ccc(c(c1)F)O CM10554 [0,2,0,0,0,0|2,0,0]=4 467 B10R1.176 COc1ccc(c(c1)I)Br CM11651 [0,2,0,0,0,0|2,0,0]=4 468 B10R1.176 COc1ccc(c(c1)I)N CM11588 [0,2,0,0,0,0|2,0,0]=4 469 B10R1.176 COc1ccc(c(c1)N)Cl CM11555 [0,2,0,0,0,0|2,0,0]=4 470 B10R1.176 COc1ccc(c(c1)N)F CM11576 [0,2,0,0,0,0|2,0,0]=4 471 B10R1.176 COc1ccc(c(c1)N)N CM11705 [0,2,0,0,0,0|2,0,0]=4 472 B10R1.176 COc1ccc(c(c1)N)N CM11706 [0,2,0,0,0,0|2,0,0]=4 473 B10R1.176 Cc1c(cnc(n1)OC)Br CM10485 [0,2,0,0,0,0|1,0,0]=3 474 B10R1.176 Cc1cc(ccc1Br)C#N CM12986 [0,2,0,0,0,0|1,0,1]=4 475 B10R1.176 Cc1cc(ccc1Br)OC CM10191 [0,2,0,0,0,0|1,0,0]=3 476 B10R1.176 Cc1cc(ccc1Cl)C=O CM11897 [0,2,0,0,0,0|1,0,1]=4 477 B10R1.176 Cc1cc(ccc1F)C#N CM13095 [0,2,0,0,0,0|1,0,1]=4 478 B10R1.176 Cc1cc(ccc1F)CN CM13541 [0,2,0,0,0,0|1,0,0]=3 479 B10R1.176 Cc1cc(ccc1N)C#N CM12932 [0,2,0,0,0,0|1,0,1]=4 480 B10R1.176 Cc1cc(ccc1N)OC CM11596 [0,2,0,0,0,0|1,0,0]=3 481 B10R1.176 Cc1cc(ccc1O)C=O CM11993 [0,2,0,0,0,0|1,0,1]=4 482 B10R1.176 Cc1ccc(cc1Br)OC CM11656 [0,2,0,0,0,0|2,0,0]=4 483 B10R1.176 Cc1ccc(cc1C)C=O CM11941 [0,2,0,0,0,0|1,0,1]=4 484 B10R1.176 Cc1ccc(cc1Cl)CN CM13525 [0,2,0,0,0,0|2,0,0]=4 485 B10R1.176 Cc1ccc(cc1F)OC CM11761 [0,2,0,0,0,0|2,0,0]=4 486 B10R1.176 Cc1ccc(cc1N)OC CM11592 [0,2,0,0,0,0|2,0,0]=4 487 B10R1.176 c1cc(c(cc1CBr)F)Cl CM13319 [0,2,0,0,0,0|2,0,0]=4 488 B10R1.176 c1cc(c(cc1CBr)F)F CM13382 [0,2,0,0,0,0|2,0,0]=4 489 B10R1.176 c1cc(c(cc1CCl)F)Cl CM13320 [0,2,0,0,0,0|2,0,0]=4 490 B10R1.176 c1cc(c(cc1CCl)F)F CM13383 [0,2,0,0,0,0|2,0,0]=4 491 B10R1.176 c1cc(c(cc1CN)Cl)Cl CM13531 [0,2,0,0,0,0|2,0,0]=4 492 B10R1.176 c1cc(c(cc1CN)Cl)F CM13521 [0,2,0,0,0,0|2,0,0]=4 493 B10R1.176 c1cc(c(cc1CN)F)F CM13536 [0,2,0,0,0,0|2,0,0]=4 494 B10R1.176 c1cc(c(cc1CO)F)F CM13379 [0,2,0,0,0,0|2,0,0]=4 495 B10R1.176 c1cc(c(cc1CO)O)I CM13433 [0,2,0,0,0,0|2,0,0]=4 496 B10R1.22 Cc1cc(c(c(c1)Br)N)C CM11291 [0,2,0,0,0,0|1,0,0]=3 497 B10R1.22 Cc1cc(c(c(c1)C)Br)C CM12328 [0,2,0,0,0,0|1,0,0]=3 498 B10R1.22 Cc1cc(c(c(c1)C)F)C CM12330 [0,2,0,0,0,0|1,0,0]=3 499 B10R1.22 Cc1cc(c(c(c1)C)N)C CM11540 [0,2,0,0,0,0|1,0,0]=3 500 B10R1.22 Cc1cc(c(c(c1)C)O)C CM11813 [0,2,0,0,0,0|1,0,0]=3 501 B10R1.22 Cc1cc(c(c(c1)Cl)N)Cl CM11411 [0,2,0,0,0,0|2,0,0]=4 502 B10R1.22 Cc1cc(c(c(c1)F)F)F CM13976 [0,2,0,0,0,0|2,0,0]=4 503 B10R1.22 Cc1cc(c(c(c1)N)N)C CM12162 [0,2,0,0,0,0|1,0,0]=3 504 B10R1.22 Cc1cc(c(c(c1)N)O)C CM11568 [0,2,0,0,0,0|1,0,0]=3 505 B10R1.22 Cc1cc(cc(c1Br)C)Cl CM12037 [0,2,0,0,0,0|1,0,0]=3 506 B10R1.22 Cc1cc(cc(c1Br)C)F CM12080 [0,2,0,0,0,0|1,0,0]=3 507 B10R1.22 Cc1cc(cc(c1Br)C)N CM11295 [0,2,0,0,0,0|1,0,0]=3 508 B10R1.22 Cc1cc(cc(c1Br)C)O CM11627 [0,2,0,0,0,0|1,0,0]=3 509 B10R1.22 Cc1cc(cc(c1Cl)F)Cl CM13952 [0,2,0,0,0,0|2,0,0]=4 510 B10R1.22 Cc1cc(cc(c1F)C)Br CM12079 [0,2,0,0,0,0|1,0,0]=3 511 B10R1.22 Cc1cc(cc(c1F)C)N CM11442 [0,2,0,0,0,0|1,0,0]=3 512 B10R1.22 Cc1cc(cc(c1I)C)Br CM12081 [0,2,0,0,0,0|1,0,0]=3 513 B10R1.22 Cc1cc(cc(c1I)C)Br CM12082 [0,2,0,0,0,0|1,0,0]=3 514 B10R1.22 Cc1cc(cc(c1N)Br)Br CM11402 [0,2,0,0,0,0|2,0,0]=4 515 B10R1.22 Cc1cc(cc(c1N)Br)F CM11307 [0,2,0,0,0,0|2,0,0]=4 516 B10R1.22 Cc1cc(cc(c1N)C)Br CM11294 [0,2,0,0,0,0|1,0,0]=3 517 B10R1.22 Cc1cc(cc(c1N)C)Cl CM11356 [0,2,0,0,0,0|1,0,0]=3 518 B10R1.22 Cc1cc(cc(c1N)C)I CM11443 [0,2,0,0,0,0|1,0,0]=3 519 B10R1.22 Cc1cc(cc(c1N)I)I CM11437 [0,2,0,0,0,0|2,0,0]=4 520 B10R1.22 Cc1nc(c(c(n1)Cl)N)Cl CM10012 [0,2,0,0,0,0|2,0,0]=4 521 B10R1.22 c1c(c(c(nc1Cl)Cl)N)N CM11042 [0,2,0,0,0,0|2,0,0]=4 522 B10R1.119 Cc1c(c(ccc1F)Br)C CM12078 [0,2,0,0,0,0|2,0,0]=4 523 B10R1.119 Cc1c(c(ccc1N)F)C CM11441 [0,2,0,0,0,0|2,0,0]=4 524 B10R1.119 Cc1c(c(ccc1O)F)C CM11743 [0,2,0,0,0,0|2,0,0]=4 525 B10R1.119 Cc1c(ccc(c1Cl)Br)F CM13924 [0,2,0,0,0,0|2,0,0]=4 526 B10R1.119 Cc1c(ccc(c1Cl)N)Cl CM11410 [0,2,0,0,0,0|2,0,0]=4 527 B10R1.119 Cc1c(ccc(c1Cl)N)F CM11367 [0,2,0,0,0,0|2,0,0]=4 528 B10R1.119 Cc1c(ccc(c1F)Br)S CM11815 [0,2,0,0,0,0|2,0,0]=4 529 B10R1.119 Cc1c(ccc(c1N)N)F CM12167 [0,2,0,0,0,0|2,0,0]=4 530 B10R1.119 Cc1ccc(c(c1Br)C)N CM11292 [0,2,0,0,0,0|1,0,0]=3 531 B10R1.119 Cc1ccc(c(c1F)F)F CM13975 [0,2,0,0,0,0|2,0,0]=4 532 B10R1.119 Cc1ccc(c(c1N)C)Br CM11293 [0,2,0,0,0,0|1,0,0]=3 533 B10R1.245 Cc1cccc(c1C#N)Br CM12983 [0,2,0,0,0,0|2,0,0]=4 534 B10R1.245 Cc1cccc(c1C#N)Cl CM13019 [0,2,0,0,0,0|2,0,0]=4 535 B10R1.245 Cc1cccc(c1C#N)F CM13090 [0,2,0,0,0,0|2,0,0]=4 536 B10R1.245 Cc1cccc(c1C=O)C CM11940 [0,2,0,0,0,0|1,0,0]=3 537 B10R1.245 Cc1cccc(c1C=O)O CM10373 [0,2,0,0,0,0|2,0,0]=4 538 B10R1.25 Cc1cc(ccc1C#N)Br CM12985 [0,2,0,0,0,0|2,0,0]=4 539 B10R1.25 Cc1cc(ccc1C#N)F CM13094 [0,2,0,0,0,0|2,0,0]=4 540 B10R1.25 Cc1cc(ccc1C#N)O CM10086 [0,2,0,0,0,0|2,0,0]=4 541 B10R1.25 Cc1cc(ccc1C=O)F CM11974 [0,2,0,0,0,0|2,0,0]=4 542 B10R1.25 Cc1cc(ccc1C=O)O CM11992 [0,2,0,0,0,0|2,0,0]=4 543 B10R1.25 Cc1cc(ccc1CN)Br CM10182 [0,2,0,0,0,0|2,0,0]=4 544 B10R1.25 Cc1cc(ccc1CN)O CM10123 [0,2,0,0,0,0|2,0,0]=4 545 B10R1.25 Cc1cc(ccc1CO)Br CM13303 [0,2,0,0,0,0|2,0,0]=4 546 B10R1.25 Cc1cc(ccc1OC)N CM11595 [0,2,0,0,0,0|2,0,0]=4 547 B10R1.25 Cc1ccc(c(c1)Cl)NN CM13797 [0,2,0,0,0,0|2,0,0]=4 548 B10R1.25 Cc1ccc(c(c1)Cl)OC CM10214 [0,2,0,0,0,0|2,0,0]=4 549 B10R1.25 Cc1ccc(c(c1)F)C#N CM13088 [0,2,0,0,0,0|2,0,0]=4 550 B10R1.25 Cc1ccc(c(c1)F)C=O CM11969 [0,2,0,0,0,0|2,0,0]=4 551 B10R1.25 Cc1ccc(c(c1)N)C#N CM12931 [0,2,0,0,0,0|2,0,0]=4 552 B10R1.25 Cc1ccc(c(n1)Cl)C#N CM14028 [0,2,0,0,0,0|1,0,0]=3 553 B10R1.25 c1cc(nc(c1C=O)Br)Br CM10104 [0,2,0,0,0,0|2,0,0]=4 554 B10R1.118 Cc1c(cc(c(n1)N)Br)Br CM10971 [0,2,0,0,0,0|1,0,0]=3 555 B10R1.118 Cc1cc(c(cc1Br)Br)Br CM13973 [0,2,0,0,0,0|2,0,0]=4 556 B10R1.118 Cc1cc(c(cc1Br)Br)C CM12185 [0,2,0,0,0,0|1,0,0]=3 557 B10R1.118 Cc1cc(c(cc1Br)F)N CM11308 [0,2,0,0,0,0|2,0,0]=4 558 B10R1.118 Cc1cc(c(cc1C)Cl)N CM11354 [0,2,0,0,0,0|2,0,0]=4 559 B10R1.118 Cc1cc(c(cc1C)F)C CM12329 [0,2,0,0,0,0|1,0,0]=3 560 B10R1.118 Cc1cc(c(cc1C)N)N CM12163 [0,2,0,0,0,0|2,0,0]=4 561 B10R1.118 Cc1cc(c(cc1Cl)Cl)S CM11818 [0,2,0,0,0,0|2,0,0]=4 562 B10R1.118 Cc1cc(c(cc1Cl)F)N CM11369 [0,2,0,0,0,0|2,0,0]=4 563 B10R1.118 Cc1cc(c(cc1F)Br)Cl CM13925 [0,2,0,0,0,0|2,0,0]=4 564 B10R1.118 Cc1cc(c(cc1F)Br)O CM10067 [0,2,0,0,0,0|2,0,0]=4 565 B10R1.118 Cc1cc(c(cc1F)Cl)N CM11368 [0,2,0,0,0,0|2,0,0]=4 566 B10R1.118 Cc1cc(c(cc1F)I)N CM11460 [0,2,0,0,0,0|2,0,0]=4 567 B10R1.118 Cc1cc(c(cc1F)N)N CM12926 [0,2,0,0,0,0|2,0,0]=4 568 B10R1.118 Cc1cc(c(cc1N)Br)F CM11309 [0,2,0,0,0,0|2,0,0]=4 569 B10R1.118 Cc1cc(c(cc1O)F)F CM11731 [0,2,0,0,0,0|2,0,0]=4 570 B10R1.118 Cc1cc(c(cc1O)N)Cl CM10972 [0,2,0,0,0,0|2,0,0]=4 571 B6R1.2 Cc1cc[nH]n1 CM14373 [1,0,0,0,1,0|1,0,0]=3 572 B6R1.2 c1c(nc[nH]1)Br CM14070 [1,0,0,0,1,0|2,0,0]=4 573 B6R1.2 c1c(ncs1)Br CM10700 [1,0,0,0,1,0|2,0,0]=4 574 B6R1.2 c1ccn(c1)N CM14097 [1,0,0,0,1,0|2,0,0]=4 575 B6R1.2 c1conc1N CM10019 [1,0,0,0,1,0|2,0,0]=4