0 B7R1.4 Cc1cscc1Br CM10703 [0,0,0,0,0,0|3,0,0]=3 1 B7R1.4 Cn1c(cnn1)I CM10199 [0,0,0,0,0,0|4,0,0]=4 2 B7R1.4 Cn1ccnc1Br CM10422 [0,0,0,0,0,0|4,0,0]=4 3 B7R1.4 Cn1ccnc1I CM10200 [0,0,0,0,0,0|4,0,0]=4 4 B7R1.4 c1c(c(cs1)Br)Br CM10704 [0,0,0,0,0,0|4,0,0]=4 5 B7R1.4 c1csc(c1Br)Cl CM10917 [0,0,0,0,0,0|2,1,0]=3 6 B6R1.2 Cc1cc[nH]n1 CM14373 [1,0,0,0,0,0|2,0,0]=3 7 B6R1.2 c1c(cn[nH]1)Br CM10025 [1,0,0,0,0,0|3,0,0]=4 8 B6R1.2 c1c(nc[nH]1)Br CM14070 [1,0,0,0,0,0|3,0,0]=4 9 B6R1.2 c1c(ncs1)Br CM10700 [1,0,0,0,0,0|2,1,0]=4 10 B6R1.2 c1c(scn1)Br CM10418 [1,0,0,0,0,0|2,1,0]=4 11 B6R1.2 c1c(scn1)I CM10701 [1,0,0,0,0,0|2,1,0]=4 12 B6R1.2 c1ccn(c1)N CM14097 [1,0,0,0,0,0|3,0,0]=4 13 B6R1.2 c1co[nH]c1=O CM10160 [1,0,0,0,0,0|1,1,0]=3 14 B6R1.2 c1conc1N CM10019 [1,0,0,0,0,0|2,0,0]=3 15 B8R1.11 c1csc(c1C=O)Br CM10421 [0,1,0,0,0,0|1,2,0]=4 16 B8R1.11 c1csc(c1CO)Br CM10090 [0,1,0,0,0,0|1,2,0]=4 17 B8R1.4 Cc1cccc(n1)Br CM14044 [0,0,0,0,0,1|2,0,0]=3 18 B8R1.4 Cc1ccnc(n1)Cl CM13850 [0,0,0,0,0,1|3,0,0]=4 19 B8R1.4 c1cc(cc(c1)Br)Br CM12169 [0,0,0,0,0,1|3,0,0]=4 20 B8R1.4 c1cc(cc(c1)Br)Cl CM12036 [0,0,0,0,0,1|3,0,0]=4 21 B8R1.4 c1cc(cc(c1)Br)N CM10037 [0,0,0,0,0,1|3,0,0]=4 22 B8R1.4 c1cc(cc(c1)F)N CM11453 [0,0,0,0,0,1|3,0,0]=4 23 B8R1.4 c1cc(cc(c1)F)O CM11748 [0,0,0,0,0,1|2,1,0]=4 24 B8R1.4 c1cc(cc(c1)I)Br CM12100 [0,0,0,0,0,1|3,0,0]=4 25 B8R1.4 c1cc(cc(c1)I)I CM12235 [0,0,0,0,0,1|3,0,0]=4 26 B8R1.4 c1cc(nc(c1)Br)O CM10270 [0,0,0,0,0,1|2,1,0]=4 27 B8R1.4 c1cnc(cc1Br)N CM14041 [0,0,0,0,0,1|3,0,0]=4 28 B8R1.4 c1cnc(cc1Cl)Cl CM14034 [0,0,0,0,0,1|3,0,0]=4 29 B8R1.4 c1cnc(cc1I)Cl CM14039 [0,0,0,0,0,1|3,0,0]=4 30 B8R1.4 c1cnc(cc1I)O CM10195 [0,0,0,0,0,1|3,0,0]=4 31 B8R1.4 c1cnc(cc1O)Br CM10678 [0,0,0,0,0,1|2,1,0]=4 32 B8R1.4 c1cnc(nc1Br)Br CM10427 [0,0,0,0,0,1|3,0,0]=4 33 B8R1.4 c1cnc(nc1Br)Cl CM10078 [0,0,0,0,0,1|3,0,0]=4 34 B8R1.4 c1cnc(nc1Br)N CM10436 [0,0,0,0,0,1|3,0,0]=4 35 B8R1.4 c1cnc(nc1N)Br CM10437 [0,0,0,0,0,1|3,0,0]=4 36 B8R1.5 Cc1c(cccn1)N CM14488 [0,0,0,0,0,1|2,0,0]=3 37 B8R1.5 Cc1cccnc1Cl CM13849 [0,0,0,0,0,1|2,0,0]=3 38 B8R1.5 c1c(c(ncn1)N)Br CM10426 [0,0,0,0,0,1|3,0,0]=4 39 B8R1.5 c1c(c(ncn1)N)N CM14060 [0,0,0,0,0,1|3,0,0]=4 40 B8R1.5 c1cc(c(nc1)N)N CM14021 [0,0,0,0,0,1|3,0,0]=4 41 B8R1.5 c1cc(c(nc1)O)F CM10987 [0,0,0,0,0,1|2,1,0]=4 42 B8R1.5 c1ccc(c(c1)F)Cl CM12138 [0,0,0,0,0,1|3,0,0]=4 43 B8R1.5 c1ccc(c(c1)I)I CM12234 [0,0,0,0,0,1|3,0,0]=4 44 B8R1.5 c1ccc(c(c1)N)Br CM11265 [0,0,0,0,0,1|3,0,0]=4 45 B8R1.5 c1ccc(c(c1)N)I CM11493 [0,0,0,0,0,1|3,0,0]=4 46 B8R1.5 c1cnc(c(n1)N)Br CM10652 [0,0,0,0,0,1|3,0,0]=4 47 B8R1.5 c1cnc(c(n1)N)O CM10654 [0,0,0,0,0,1|2,1,0]=4 48 B8R1.5 c1cncc(c1Cl)Cl CM10292 [0,0,0,0,0,1|3,0,0]=4 49 B8R1.5 c1cncc(c1N)F CM10153 [0,0,0,0,0,1|3,0,0]=4 50 B8R1.5 c1cncc(c1N)N CM14022 [0,0,0,0,0,1|3,0,0]=4 51 B7R0.4 CC(=O)OC=CCBr CM11056 [0,1,1,0,0,0|1,0,1]=4 52 B7R1.1 c1c[nH]nc1CCl CM10174 [1,1,0,0,0,0|2,0,0]=4 53 B7R1.1 c1cc([nH]c1)C=O CM13861 [1,1,0,0,0,0|1,0,1]=4 54 B7R1.1 c1nnc(o1)CN CM10301 [1,1,0,0,0,0|2,0,0]=4 55 B7R1.2 C1=CC(=O)OC1O CM11011 [1,1,0,0,0,0|1,0,1]=4 56 B7R1.2 Cc1cc(on1)C CM14486 [1,1,0,0,0,0|1,0,0]=3 57 B7R1.2 Cc1ncc(s1)I CM10702 [1,1,0,0,0,0|1,1,0]=4 58 B7R1.2 Cn1cc(cn1)Br CM14274 [1,1,0,0,0,0|2,0,0]=4 59 B7R1.2 Cn1ccc(n1)I CM10441 [1,1,0,0,0,0|2,0,0]=4 60 B9R1.2 CCc1cccc(c1)Br CM12087 [0,1,0,0,0,1|2,0,0]=4 61 B9R1.2 CCc1cccc(c1)N CM11452 [0,1,0,0,0,1|2,0,0]=4 62 B9R1.2 CNc1cccc(c1)O CM10115 [0,1,0,0,0,1|1,1,0]=4 63 B9R1.2 COc1cc(ccn1)Br CM10671 [0,1,0,0,0,1|2,0,0]=4 64 B9R1.2 COc1nccc(n1)N CM10845 [0,1,0,0,0,1|2,0,0]=4 65 B9R1.2 CSc1cccc(n1)Br CM10114 [0,1,0,0,0,1|2,0,0]=4 66 B9R1.2 Cc1cccc(c1)CF CM13445 [0,1,0,0,0,1|2,0,0]=4 67 B9R1.2 c1cc(cc(c1)I)CBr CM13435 [0,1,0,0,0,1|2,0,0]=4 68 B9R1.2 c1cc(cc(c1)I)CN CM10968 [0,1,0,0,0,1|2,0,0]=4 69 B9R1.3 Cc1cccc(c1Br)Cl CM10337 [0,1,0,0,0,1|2,0,0]=4 70 B9R1.3 Cc1cccc(c1Br)N CM11315 [0,1,0,0,0,1|2,0,0]=4 71 B9R1.3 Cc1cccc(c1C)Br CM12245 [0,1,0,0,0,1|2,0,0]=4 72 B9R1.3 Cc1cccc(c1C)Cl CM12248 [0,1,0,0,0,1|2,0,0]=4 73 B9R1.3 Cc1cccc(c1C)F CM12253 [0,1,0,0,0,1|2,0,0]=4 74 B9R1.3 Cc1cccc(c1Cl)C CM12250 [0,1,0,0,0,1|2,0,0]=4 75 B9R1.3 Cc1cccc(c1F)Br CM13927 [0,1,0,0,0,1|2,0,0]=4 76 B9R1.3 Cc1cccc(c1F)C CM12254 [0,1,0,0,0,1|2,0,0]=4 77 B9R1.3 Cc1cccc(c1F)Cl CM14017 [0,1,0,0,0,1|2,0,0]=4 78 B9R1.3 Cc1cccc(c1F)F CM13954 [0,1,0,0,0,1|2,0,0]=4 79 B9R1.3 Cc1cccc(c1F)N CM11462 [0,1,0,0,0,1|2,0,0]=4 80 B9R1.3 Cc1cccc(c1F)O CM11757 [0,1,0,0,0,1|1,1,0]=4 81 B9R1.3 Cc1cccc(c1I)O CM10210 [0,1,0,0,0,1|1,1,0]=4 82 B9R1.3 Cc1cccc(c1N)Br CM11316 [0,1,0,0,0,1|2,0,0]=4 83 B9R1.3 Cc1cccc(c1N)N CM13949 [0,1,0,0,0,1|2,0,0]=4 84 B9R1.3 Cc1cccc(c1N)O CM11590 [0,1,0,0,0,1|1,1,0]=4 85 B9R1.3 Cc1cccc(c1O)C CM11741 [0,1,0,0,0,1|2,0,0]=4 86 B9R1.3 Cc1cccc(c1O)F CM11759 [0,1,0,0,0,1|2,0,0]=4 87 B9R1.3 Cc1ccnc(c1Br)C CM10661 [0,1,0,0,0,1|2,0,0]=4 88 B9R1.34 Cc1cc(cc(c1)Br)O CM11657 [0,1,0,0,0,1|1,1,0]=4 89 B9R1.34 Cc1cc(cc(c1)Cl)Cl CM10249 [0,1,0,0,0,1|2,0,0]=4 90 B9R1.34 Cc1cc(cc(c1)F)N CM11466 [0,1,0,0,0,1|2,0,0]=4 91 B9R1.34 Cc1cc(cc(c1)I)C CM12260 [0,1,0,0,0,1|2,0,0]=4 92 B9R1.34 Cc1cc(cc(n1)Cl)N CM10567 [0,1,0,0,0,1|2,0,0]=4 93 B9R1.34 Cc1cc(nc(n1)C)Cl CM14288 [0,1,0,0,0,1|2,0,0]=4 94 B9R1.34 Cc1nc(cc(n1)Cl)Cl CM14054 [0,1,0,0,0,1|2,0,0]=4 95 B9R1.69 Cc1c(ccc(n1)N)Br CM10976 [0,1,0,0,0,1|2,0,0]=4 96 B9R1.69 Cc1cc(ccc1Br)Br CM13950 [0,1,0,0,0,1|2,0,0]=4 97 B9R1.69 Cc1cc(ccc1Br)I CM13933 [0,1,0,0,0,1|2,0,0]=4 98 B9R1.69 Cc1cc(ccc1Cl)I CM13944 [0,1,0,0,0,1|2,0,0]=4 99 B9R1.69 Cc1cc(ccc1F)N CM11467 [0,1,0,0,0,1|2,0,0]=4 100 B9R1.69 Cc1cc(ccc1F)O CM11763 [0,1,0,0,0,1|1,1,0]=4 101 B9R1.69 Cc1cc(ccc1N)Br CM11319 [0,1,0,0,0,1|2,0,0]=4 102 B9R1.69 Cc1cc(ccc1O)F CM11762 [0,1,0,0,0,1|2,0,0]=4 103 B9R1.69 Cc1ccc(c(c1)Br)C CM12247 [0,1,0,0,0,1|2,0,0]=4 104 B9R1.69 Cc1ccc(c(c1)C)Br CM12246 [0,1,0,0,0,1|2,0,0]=4 105 B9R1.69 Cc1ccc(c(c1)C)Cl CM12249 [0,1,0,0,0,1|2,0,0]=4 106 B9R1.69 Cc1ccc(c(c1)Cl)N CM11376 [0,1,0,0,0,1|2,0,0]=4 107 B9R1.69 Cc1ccc(c(c1)Cl)O CM10213 [0,1,0,0,0,1|2,0,0]=4 108 B9R1.69 Cc1ccc(c(c1)F)Br CM13929 [0,1,0,0,0,1|2,0,0]=4 109 B9R1.69 Cc1ccc(c(c1)F)F CM13957 [0,1,0,0,0,1|2,0,0]=4 110 B9R1.69 Cc1ccc(c(c1)F)N CM11463 [0,1,0,0,0,1|2,0,0]=4 111 B9R1.69 Cc1ccc(c(c1)I)N CM11496 [0,1,0,0,0,1|2,0,0]=4 112 B9R1.69 Cc1ccc(c(c1)N)I CM11497 [0,1,0,0,0,1|2,0,0]=4 113 B9R1.69 Cc1ccc(c(c1)O)Br CM10472 [0,1,0,0,0,1|1,1,0]=4 114 B9R1.69 Cc1ccc(c(c1)O)F CM11758 [0,1,0,0,0,1|1,1,0]=4 115 B9R1.69 Cc1ccc(cc1C)Cl CM12251 [0,1,0,0,0,1|2,0,0]=4 116 B9R1.69 Cc1ccc(cc1C)F CM12256 [0,1,0,0,0,1|2,0,0]=4 117 B9R1.69 c1cc(c(cc1S)Cl)F CM11817 [0,1,0,0,0,1|2,0,0]=4 118 B9R1.69 c1cc(c(cc1S)F)F CM11820 [0,1,0,0,0,1|2,0,0]=4 119 B9R1.15 CCc1c(cccn1)Br CM10670 [0,1,0,0,0,1|2,0,0]=4 120 B9R1.15 CNc1ccncc1N CM14025 [0,1,0,0,0,1|2,0,0]=4 121 B9R1.15 COc1c(nccn1)N CM10653 [0,1,0,0,0,1|2,0,0]=4 122 B9R1.15 COc1cccnc1Br CM14120 [0,1,0,0,0,1|2,0,0]=4 123 B9R1.15 COc1cccnc1N CM10903 [0,1,0,0,0,1|2,0,0]=4 124 B9R1.15 COc1cnccc1N CM10329 [0,1,0,0,0,1|2,0,0]=4 125 B9R1.15 CSc1ccccc1I CM11822 [0,1,0,0,0,1|2,0,0]=4 126 B9R1.15 Cc1ccncc1C=O CM10260 [0,1,0,0,0,1|1,1,0]=4 127 B9R1.15 c1ccc(c(c1)CBr)Cl CM13308 [0,1,0,0,0,1|2,0,0]=4 128 B9R1.15 c1ccc(c(c1)CCl)F CM13406 [0,1,0,0,0,1|2,0,0]=4 129 B9R1.15 c1ccc(c(c1)CN)F CM13538 [0,1,0,0,0,1|2,0,0]=4 130 B9R1.27 Cc1c(c(on1)C)CCl CM14456 [0,2,0,0,0,0|2,0,0]=4