0 B7R1.2 C1=CC(=O)OC1O CM11011 [0,0,0,0,0,0|3,0,1]=4 1 B7R1.2 Cc1cc(on1)C CM14486 [0,0,0,0,0,0|3,0,0]=3 2 B7R1.2 Cc1ncc(s1)I CM10702 [0,0,0,0,0,0|3,0,0]=3 3 B7R1.2 Cn1cc(cn1)Br CM14274 [0,0,0,0,0,0|4,0,0]=4 4 B7R1.2 Cn1ccc(n1)I CM10441 [0,0,0,0,0,0|2,0,1]=3 5 B7R1.2 Cn1ncc(n1)Br CM10510 [0,0,0,0,0,0|3,0,1]=4 6 B7R1.2 c1c(sc(n1)Br)Cl CM10420 [0,0,0,0,0,0|4,0,0]=4 7 B7R1.2 c1c(sc(n1)Cl)Br CM10419 [0,0,0,0,0,0|4,0,0]=4 8 B7R1.2 c1c(sc(n1)N)Cl CM10443 [0,0,0,0,0,0|4,0,0]=4 9 B7R1.2 c1c(sc(n1)N)F CM10417 [0,0,0,0,0,0|4,0,0]=4 10 B6R1.2 Cc1cc[nH]n1 CM14373 [1,0,0,0,0,0|1,0,1]=3 11 B6R1.2 c1c(nc[nH]1)Br CM14070 [1,0,0,0,0,0|2,0,1]=4 12 B6R1.2 c1c(ncs1)Br CM10700 [1,0,0,0,0,0|2,0,1]=4 13 B6R1.2 c1c(scn1)Br CM10418 [1,0,0,0,0,0|3,0,0]=4 14 B6R1.2 c1c(scn1)I CM10701 [1,0,0,0,0,0|3,0,0]=4 15 B6R1.2 c1ccn(c1)N CM14097 [1,0,0,0,0,0|3,0,0]=4 16 B6R1.2 c1co[nH]c1=O CM10160 [1,0,0,0,0,0|2,0,0]=3 17 B6R1.2 c1conc1N CM10019 [1,0,0,0,0,0|2,0,1]=4 18 B8R1.1 c1c(nc(o1)Cl)CBr CM10353 [0,1,0,0,0,0|2,0,1]=4 19 B6R0.4 CC(=O)C=COC CM11079 [0,0,1,0,0,0|2,0,0]=3 20 B8R1.3 Cc1ccc(=O)[nH]n1 CM11032 [0,0,0,0,0,1|1,0,0]=2 21 B8R1.3 Cc1ccc(cn1)N CM14483 [0,0,0,0,0,1|1,0,1]=3 22 B8R1.3 Cc1ccc(nn1)Br CM11114 [0,0,0,0,0,1|1,0,1]=3 23 B8R1.3 Cc1ncc(cn1)Br CM10466 [0,0,0,0,0,1|2,0,1]=4 24 B8R1.3 c1cc(ccc1Br)Br CM12170 [0,0,0,0,0,1|3,0,0]=4 25 B8R1.3 c1cc(ccc1Br)I CM12101 [0,0,0,0,0,1|3,0,0]=4 26 B8R1.3 c1cc(ccc1I)I CM12236 [0,0,0,0,0,1|3,0,0]=4 27 B8R1.3 c1cc(ccc1O)F CM11750 [0,0,0,0,0,1|3,0,0]=4 28 B8R1.3 c1cc(ncc1Br)Br CM14111 [0,0,0,0,0,1|2,0,1]=4 29 B8R1.3 c1cc(ncc1Br)F CM14457 [0,0,0,0,0,1|2,0,1]=4 30 B8R1.3 c1cc(ncc1F)Br CM14029 [0,0,0,0,0,1|2,0,1]=4 31 B8R1.3 c1cc(ncc1N)Cl CM13842 [0,0,0,0,0,1|2,0,1]=4 32 B8R1.4 Cc1cccc(n1)Br CM14044 [0,0,0,0,0,1|1,0,1]=3 33 B8R1.4 Cc1ccnc(n1)Cl CM13850 [0,0,0,0,0,1|1,0,1]=3 34 B8R1.4 c1c(cncc1Br)F CM14471 [0,0,0,0,0,1|3,0,0]=4 35 B8R1.4 c1c(cncc1Br)N CM14469 [0,0,0,0,0,1|3,0,0]=4 36 B8R1.4 c1c(cncc1Br)O CM14470 [0,0,0,0,0,1|3,0,0]=4 37 B8R1.4 c1c(cncc1Cl)O CM10662 [0,0,0,0,0,1|3,0,0]=4 38 B8R1.4 c1c(cncc1F)O CM10665 [0,0,0,0,0,1|3,0,0]=4 39 B8R1.4 c1c(cncc1O)O CM10452 [0,0,0,0,0,1|3,0,0]=4 40 B8R1.4 c1cc(cc(c1)Br)Br CM12169 [0,0,0,0,0,1|3,0,0]=4 41 B8R1.4 c1cc(cc(c1)Br)Cl CM12036 [0,0,0,0,0,1|3,0,0]=4 42 B8R1.4 c1cc(cc(c1)Br)N CM10037 [0,0,0,0,0,1|3,0,0]=4 43 B8R1.4 c1cc(cc(c1)F)N CM11453 [0,0,0,0,0,1|3,0,0]=4 44 B8R1.4 c1cc(cc(c1)F)O CM11748 [0,0,0,0,0,1|3,0,0]=4 45 B8R1.4 c1cc(cc(c1)I)Br CM12100 [0,0,0,0,0,1|3,0,0]=4 46 B8R1.4 c1cc(cc(c1)I)I CM12235 [0,0,0,0,0,1|3,0,0]=4 47 B8R1.4 c1cc(nc(c1)Br)O CM10270 [0,0,0,0,0,1|2,0,1]=4 48 B8R1.4 c1cnc(cc1Br)N CM14041 [0,0,0,0,0,1|3,0,0]=4 49 B8R1.4 c1cnc(cc1Cl)Cl CM14034 [0,0,0,0,0,1|3,0,0]=4 50 B8R1.4 c1cnc(cc1I)Cl CM14039 [0,0,0,0,0,1|3,0,0]=4 51 B8R1.4 c1cnc(cc1I)O CM10195 [0,0,0,0,0,1|3,0,0]=4 52 B8R1.4 c1cnc(cc1O)Br CM10678 [0,0,0,0,0,1|3,0,0]=4 53 B8R1.4 c1cnc(nc1Br)Br CM10427 [0,0,0,0,0,1|2,0,1]=4 54 B8R1.4 c1cnc(nc1Br)Cl CM10078 [0,0,0,0,0,1|2,0,1]=4 55 B8R1.4 c1cnc(nc1Br)N CM10436 [0,0,0,0,0,1|2,0,1]=4 56 B8R1.4 c1cnc(nc1N)Br CM10437 [0,0,0,0,0,1|2,0,1]=4 57 B5R1.1 C1C=CCN1 CM14480 [2,0,0,0,0,0|0,0,2]=4 58 B7R0.4 CC(=O)OC=CCBr CM11056 [0,1,1,0,0,0|2,0,0]=4 59 B7R1.1 c1c[nH]nc1CCl CM10174 [1,1,0,0,0,0|1,0,1]=4 60 B7R1.1 c1cc([nH]c1)C=O CM13861 [1,1,0,0,0,0|0,0,1]=3 61 B7R1.4 Cc1cscc1Br CM10703 [1,1,0,0,0,0|2,0,0]=4 62 B7R1.4 Cn1ccnc1Br CM10422 [1,1,0,0,0,0|2,0,0]=4 63 B7R1.4 Cn1ccnc1I CM10200 [1,1,0,0,0,0|2,0,0]=4 64 B7R1.4 c1csc(c1Br)Cl CM10917 [1,1,0,0,0,0|2,0,0]=4 65 B9R1.1 CCc1ccc(cc1)F CM10050 [0,1,0,0,0,1|2,0,0]=4 66 B9R1.1 CCc1ccc(cn1)Br CM10444 [0,1,0,0,0,1|1,0,1]=4 67 B9R1.1 CNc1ccc(cc1)I CM11495 [0,1,0,0,0,1|2,0,0]=4 68 B9R1.1 COc1ccc(cc1)F CM11749 [0,1,0,0,0,1|2,0,0]=4 69 B9R1.1 COc1ccc(nc1)Br CM10454 [0,1,0,0,0,1|1,0,1]=4 70 B9R1.1 Cc1ccc(nc1)C#N CM10108 [0,1,0,0,0,1|0,0,2]=4 71 B9R1.1 c1cc(ccc1CCl)F CM13407 [0,1,0,0,0,1|2,0,0]=4 72 B9R1.1 c1cc(ccc1CO)F CM13405 [0,1,0,0,0,1|2,0,0]=4 73 B9R1.1 c1cc(ccc1CO)N CM13264 [0,1,0,0,0,1|2,0,0]=4 74 B9R1.69 Cc1c(cc(cn1)Br)Cl CM10568 [0,1,0,0,0,1|1,0,1]=4 75 B9R1.69 Cc1cc(c(nc1)F)I CM10099 [0,1,0,0,0,1|1,0,1]=4 76 B9R1.69 Cc1ccc(c(c1)Br)C CM12247 [0,1,0,0,0,1|1,0,0]=3 77 B9R1.69 Cc1ccc(c(c1)C)Br CM12246 [0,1,0,0,0,1|2,0,0]=4 78 B9R1.69 Cc1ccc(c(c1)C)Cl CM12249 [0,1,0,0,0,1|2,0,0]=4 79 B9R1.69 Cc1ccc(c(c1)Cl)N CM11376 [0,1,0,0,0,1|2,0,0]=4 80 B9R1.69 Cc1ccc(c(c1)Cl)O CM10213 [0,1,0,0,0,1|2,0,0]=4 81 B9R1.69 Cc1ccc(c(c1)F)Br CM13929 [0,1,0,0,0,1|2,0,0]=4 82 B9R1.69 Cc1ccc(c(c1)F)F CM13957 [0,1,0,0,0,1|2,0,0]=4 83 B9R1.69 Cc1ccc(c(c1)F)N CM11463 [0,1,0,0,0,1|2,0,0]=4 84 B9R1.69 Cc1ccc(c(c1)I)N CM11496 [0,1,0,0,0,1|2,0,0]=4 85 B9R1.69 Cc1ccc(c(c1)N)I CM11497 [0,1,0,0,0,1|2,0,0]=4 86 B9R1.69 Cc1ccc(c(c1)O)Br CM10472 [0,1,0,0,0,1|2,0,0]=4 87 B9R1.69 Cc1ccc(c(c1)O)F CM11758 [0,1,0,0,0,1|2,0,0]=4 88 B9R1.69 Cc1ccc(cc1Br)N CM11318 [0,1,0,0,0,1|2,0,0]=4 89 B9R1.69 Cc1ccc(cc1Br)O CM10192 [0,1,0,0,0,1|2,0,0]=4 90 B9R1.69 Cc1ccc(cc1C)Cl CM12251 [0,1,0,0,0,1|2,0,0]=4 91 B9R1.69 Cc1ccc(cc1C)F CM12256 [0,1,0,0,0,1|2,0,0]=4 92 B9R1.69 Cc1ccc(cc1Cl)F CM13940 [0,1,0,0,0,1|2,0,0]=4 93 B9R1.69 Cc1ccc(cc1F)Br CM13928 [0,1,0,0,0,1|2,0,0]=4 94 B9R1.69 Cc1ccc(cc1F)Cl CM13941 [0,1,0,0,0,1|2,0,0]=4 95 B9R1.69 Cc1ccc(cc1F)F CM13955 [0,1,0,0,0,1|2,0,0]=4 96 B9R1.69 Cc1ccc(cc1F)I CM13959 [0,1,0,0,0,1|2,0,0]=4 97 B9R1.69 Cc1ccc(cc1F)N CM11465 [0,1,0,0,0,1|2,0,0]=4 98 B9R1.69 Cc1ccc(cc1N)O CM11593 [0,1,0,0,0,1|2,0,0]=4 99 B9R1.69 Cc1ccc(cc1O)F CM11764 [0,1,0,0,0,1|2,0,0]=4 100 B9R1.69 Cc1ccc(cc1O)N CM11597 [0,1,0,0,0,1|2,0,0]=4 101 B9R1.69 Cc1ccc(cc1O)O CM10187 [0,1,0,0,0,1|2,0,0]=4 102 B9R1.69 Cc1cnc(c(n1)Cl)C CM11071 [0,1,0,0,0,1|1,0,1]=4 103 B9R1.69 Cc1cnc(c(n1)N)C CM11070 [0,1,0,0,0,1|1,0,1]=4 104 B9R1.69 Cc1cnc(cc1I)F CM10100 [0,1,0,0,0,1|1,0,1]=4 105 B9R1.69 Cn1cc(ccc1=O)N CM10159 [0,1,0,0,0,1|2,0,0]=4 106 B9R1.2 CCc1cccc(c1)Br CM12087 [0,1,0,0,0,1|2,0,0]=4 107 B9R1.2 CCc1cccc(c1)N CM11452 [0,1,0,0,0,1|2,0,0]=4 108 B9R1.2 CNc1cccc(c1)O CM10115 [0,1,0,0,0,1|2,0,0]=4 109 B9R1.2 COc1cc(ccn1)Br CM10671 [0,1,0,0,0,1|2,0,0]=4 110 B9R1.2 COc1ccnc(n1)Br CM10844 [0,1,0,0,0,1|1,0,1]=4 111 B9R1.2 COc1ccnc(n1)N CM10846 [0,1,0,0,0,1|1,0,1]=4 112 B9R1.2 COc1nccc(n1)N CM10845 [0,1,0,0,0,1|1,0,1]=4 113 B9R1.2 CSc1cccc(n1)Br CM10114 [0,1,0,0,0,1|1,0,1]=4 114 B9R1.2 Cc1cccc(c1)CF CM13445 [0,1,0,0,0,1|1,0,0]=3 115 B9R1.2 c1cc(cc(c1)I)CBr CM13435 [0,1,0,0,0,1|2,0,0]=4 116 B9R1.2 c1cc(cc(c1)I)CN CM10968 [0,1,0,0,0,1|2,0,0]=4 117 B9R1.2 c1cnc(cc1CO)N CM14035 [0,1,0,0,0,1|2,0,0]=4 118 B9R1.3 Cc1cccc(c1Br)Cl CM10337 [0,1,0,0,0,1|2,0,0]=4 119 B9R1.3 Cc1cccc(c1Br)N CM11315 [0,1,0,0,0,1|2,0,0]=4 120 B9R1.3 Cc1cccc(c1C)Br CM12245 [0,1,0,0,0,1|2,0,0]=4 121 B9R1.3 Cc1cccc(c1C)Cl CM12248 [0,1,0,0,0,1|2,0,0]=4 122 B9R1.3 Cc1cccc(c1C)F CM12253 [0,1,0,0,0,1|2,0,0]=4 123 B9R1.3 Cc1cccc(c1Cl)C CM12250 [0,1,0,0,0,1|1,0,0]=3 124 B9R1.3 Cc1cccc(c1F)Br CM13927 [0,1,0,0,0,1|2,0,0]=4 125 B9R1.3 Cc1cccc(c1F)C CM12254 [0,1,0,0,0,1|1,0,0]=3 126 B9R1.3 Cc1cccc(c1F)Cl CM14017 [0,1,0,0,0,1|2,0,0]=4 127 B9R1.3 Cc1cccc(c1F)F CM13954 [0,1,0,0,0,1|2,0,0]=4 128 B9R1.3 Cc1cccc(c1F)N CM11462 [0,1,0,0,0,1|2,0,0]=4 129 B9R1.3 Cc1cccc(c1F)O CM11757 [0,1,0,0,0,1|2,0,0]=4 130 B9R1.3 Cc1cccc(c1I)O CM10210 [0,1,0,0,0,1|2,0,0]=4 131 B9R1.3 Cc1cccc(c1N)Br CM11316 [0,1,0,0,0,1|2,0,0]=4 132 B9R1.3 Cc1cccc(c1N)N CM13949 [0,1,0,0,0,1|2,0,0]=4 133 B9R1.3 Cc1cccc(c1N)O CM11590 [0,1,0,0,0,1|2,0,0]=4 134 B9R1.3 Cc1cccc(c1O)C CM11741 [0,1,0,0,0,1|1,0,0]=3 135 B9R1.3 Cc1cccc(c1O)F CM11759 [0,1,0,0,0,1|2,0,0]=4 136 B9R1.3 Cc1ccnc(c1Br)C CM10661 [0,1,0,0,0,1|1,0,0]=3 137 B9R1.3 Cn1c(=O)cccc1Br CM10359 [0,1,0,0,0,1|2,0,0]=4 138 B9R1.34 Cc1cc(cc(c1)Br)O CM11657 [0,1,0,0,0,1|2,0,0]=4 139 B9R1.34 Cc1cc(cc(c1)Cl)Cl CM10249 [0,1,0,0,0,1|2,0,0]=4 140 B9R1.34 Cc1cc(cc(c1)F)N CM11466 [0,1,0,0,0,1|2,0,0]=4 141 B9R1.34 Cc1cc(cc(c1)I)C CM12260 [0,1,0,0,0,1|1,0,0]=3 142 B9R1.34 Cc1cc(cc(n1)Cl)N CM10567 [0,1,0,0,0,1|1,0,1]=4 143 B9R1.34 Cc1cc(nc(n1)C)Cl CM14288 [0,1,0,0,0,1|0,0,1]=3 144 B9R1.34 Cc1cc(nc(n1)Cl)C CM14109 [0,1,0,0,0,1|1,0,1]=4 145 B9R1.34 Cc1nc(cc(n1)Cl)Cl CM14054 [0,1,0,0,0,1|1,0,1]=4