0 B7R1.4 Cc1cscc1Br CM10703 [0,0,0,0,0,0|4,0,0]=4 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|3,0,0]=3 3 B7R1.4 Cn1ccnc1I CM10200 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.4 c1csc(c1Br)Cl CM10917 [0,0,0,0,0,0|3,0,0]=3 5 B6R1.2 Cc1cc[nH]n1 CM14373 [1,0,0,0,0,0|2,0,0]=3 6 B6R1.2 Cn1cnnc1 CM10040 [1,0,0,0,0,0|3,0,0]=4 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|2,0,0]=3 9 B6R1.2 c1c(ncs1)Br CM10700 [1,0,0,0,0,0|1,0,0]=2 10 B6R1.2 c1c(scn1)Br CM10418 [1,0,0,0,0,0|1,0,0]=2 11 B6R1.2 c1c(scn1)I CM10701 [1,0,0,0,0,0|1,0,0]=2 12 B6R1.2 c1conc1N CM10019 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.11 c1csc(c1C=O)Br CM10421 [0,1,0,0,0,0|2,0,1]=4 14 B8R1.11 c1csc(c1CO)Br CM10090 [0,1,0,0,0,0|2,0,0]=3 15 B8R1.4 Cc1cccc(n1)Br CM14044 [0,0,0,0,0,1|3,0,0]=4 16 B8R1.4 Cc1ccnc(n1)Cl CM13850 [0,0,0,0,0,1|2,0,0]=3 17 B8R1.4 c1c(ncnc1Br)Br CM10428 [0,0,0,0,0,1|3,0,0]=4 18 B8R1.4 c1c(ncnc1O)N CM11043 [0,0,0,0,0,1|3,0,0]=4 19 B8R1.4 c1cnc(cc1Br)N CM14041 [0,0,0,0,0,1|3,0,0]=4 20 B8R1.4 c1cnc(cc1Cl)Cl CM14034 [0,0,0,0,0,1|3,0,0]=4 21 B8R1.4 c1cnc(cc1I)Cl CM14039 [0,0,0,0,0,1|3,0,0]=4 22 B8R1.4 c1cnc(cc1I)O CM10195 [0,0,0,0,0,1|3,0,0]=4 23 B8R1.4 c1cnc(cc1O)Br CM10678 [0,0,0,0,0,1|3,0,0]=4 24 B8R1.4 c1cnc(nc1Br)Br CM10427 [0,0,0,0,0,1|3,0,0]=4 25 B8R1.4 c1cnc(nc1Br)Cl CM10078 [0,0,0,0,0,1|3,0,0]=4 26 B8R1.4 c1cnc(nc1Br)N CM10436 [0,0,0,0,0,1|3,0,0]=4 27 B8R1.4 c1cnc(nc1N)Br CM10437 [0,0,0,0,0,1|3,0,0]=4 28 B8R1.5 Cc1c(cccn1)N CM14488 [0,0,0,0,0,1|2,0,0]=3 29 B8R1.5 Cc1cccnc1Cl CM13849 [0,0,0,0,0,1|2,0,0]=3 30 B8R1.5 c1c(c(ncn1)N)Br CM10426 [0,0,0,0,0,1|3,0,0]=4 31 B8R1.5 c1c(c(ncn1)N)N CM14060 [0,0,0,0,0,1|3,0,0]=4 32 B8R1.5 c1cc(c(nc1)N)N CM14021 [0,0,0,0,0,1|3,0,0]=4 33 B8R1.5 c1cc(c(nc1)O)F CM10987 [0,0,0,0,0,1|3,0,0]=4 34 B8R1.5 c1cnc(c(n1)N)Br CM10652 [0,0,0,0,0,1|3,0,0]=4 35 B8R1.5 c1cnc(c(n1)N)O CM10654 [0,0,0,0,0,1|3,0,0]=4 36 B8R1.5 c1cncc(c1Cl)Cl CM10292 [0,0,0,0,0,1|3,0,0]=4 37 B8R1.5 c1cncc(c1N)F CM10153 [0,0,0,0,0,1|3,0,0]=4 38 B8R1.5 c1cncc(c1N)N CM14022 [0,0,0,0,0,1|3,0,0]=4 39 B7R1.1 c1c(nc[nH]1)C#N CM14071 [1,1,0,0,0,0|1,0,1]=4 40 B7R1.1 c1c(nc[nH]1)C=O CM14068 [1,1,0,0,0,0|1,0,1]=4 41 B7R1.1 c1c[nH]nc1CCl CM10174 [1,1,0,0,0,0|2,0,0]=4 42 B7R1.1 c1nnc(o1)CN CM10301 [1,1,0,0,0,0|1,1,0]=4 43 B7R1.2 Cc1cc(on1)C CM14486 [1,1,0,0,0,0|2,0,0]=4 44 B7R1.2 Cc1ncc(s1)I CM10702 [1,1,0,0,0,0|1,0,0]=3 45 B7R1.2 Cn1cc(cn1)Br CM14274 [1,1,0,0,0,0|2,0,0]=4 46 B7R1.2 Cn1ccc(n1)I CM10441 [1,1,0,0,0,0|2,0,0]=4 47 B7R1.2 c1c(sc(n1)Br)Cl CM10420 [1,1,0,0,0,0|1,0,0]=3 48 B7R1.2 c1c(sc(n1)Cl)Br CM10419 [1,1,0,0,0,0|1,0,0]=3 49 B7R1.2 c1c(sc(n1)N)Cl CM10443 [1,1,0,0,0,0|1,0,0]=3 50 B7R1.2 c1c(sc(n1)N)F CM10417 [1,1,0,0,0,0|1,0,0]=3 51 B9R1.2 COc1cc(ccn1)Br CM10671 [0,1,0,0,0,1|2,0,0]=4 52 B9R1.2 COc1cc(ncn1)Br CM10842 [0,1,0,0,0,1|2,0,0]=4 53 B9R1.2 COc1cc(ncn1)I CM10843 [0,1,0,0,0,1|2,0,0]=4 54 B9R1.2 COc1cc(ncn1)N CM10847 [0,1,0,0,0,1|2,0,0]=4 55 B9R1.2 COc1ccnc(n1)Br CM10844 [0,1,0,0,0,1|2,0,0]=4 56 B9R1.2 COc1ccnc(n1)N CM10846 [0,1,0,0,0,1|2,0,0]=4 57 B9R1.2 COc1nccc(n1)N CM10845 [0,1,0,0,0,1|2,0,0]=4 58 B9R1.2 Cc1cccc(c1)CF CM13445 [0,1,0,0,0,1|2,0,0]=4 59 B9R1.2 c1cnc(cc1CO)N CM14035 [0,1,0,0,0,1|2,0,0]=4 60 B9R1.3 Cc1cccc(c1Cl)C CM12250 [0,1,0,0,0,1|2,0,0]=4 61 B9R1.3 Cc1cccc(c1F)C CM12254 [0,1,0,0,0,1|2,0,0]=4 62 B9R1.3 Cc1cccc(c1O)C CM11741 [0,1,0,0,0,1|2,0,0]=4 63 B9R1.3 Cc1ccnc(c1Br)C CM10661 [0,1,0,0,0,1|1,0,0]=3 64 B9R1.34 Cc1cc(cc(c1)I)C CM12260 [0,1,0,0,0,1|2,0,0]=4 65 B9R1.34 Cc1cc(cc(n1)Cl)N CM10567 [0,1,0,0,0,1|2,0,0]=4 66 B9R1.34 Cc1cc(nc(n1)C)Cl CM14288 [0,1,0,0,0,1|1,0,0]=3 67 B9R1.34 Cc1cc(nc(n1)Cl)C CM14109 [0,1,0,0,0,1|1,0,0]=3 68 B9R1.34 Cc1nc(cc(n1)Cl)Cl CM14054 [0,1,0,0,0,1|2,0,0]=4 69 B9R1.69 Cc1c(cnc(n1)Br)Br CM10497 [0,1,0,0,0,1|2,0,0]=4 70 B9R1.69 Cc1cc(ncc1Br)N CM11003 [0,1,0,0,0,1|2,0,0]=4 71 B9R1.69 Cc1cc(ncc1N)Cl CM11008 [0,1,0,0,0,1|2,0,0]=4 72 B9R1.69 Cc1ccc(c(c1)C)Br CM12246 [0,1,0,0,0,1|2,0,0]=4 73 B9R1.69 Cc1ccc(c(c1)C)Cl CM12249 [0,1,0,0,0,1|2,0,0]=4 74 B9R1.15 CCc1c(cccn1)Br CM10670 [0,1,0,0,0,1|2,0,0]=4 75 B9R1.15 CNc1ccncc1N CM14025 [0,1,0,0,0,1|2,0,0]=4 76 B9R1.15 COc1c(nccn1)N CM10653 [0,1,0,0,0,1|2,0,0]=4 77 B9R1.15 COc1cccnc1Br CM14120 [0,1,0,0,0,1|2,0,0]=4 78 B9R1.15 COc1cccnc1N CM10903 [0,1,0,0,0,1|2,0,0]=4 79 B9R1.15 COc1cnccc1N CM10329 [0,1,0,0,0,1|2,0,0]=4 80 B9R1.15 Cc1ccncc1C=O CM10260 [0,1,0,0,0,1|1,0,1]=4 81 B9R1.27 Cc1c(c(on1)C)CCl CM14456 [0,2,0,0,0,0|2,0,0]=4