0 B8R1.4 C1C(=CN=NC1=O)I PB18920 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.4 C1C(=CN=NC1=O)N PB19162 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.4 Cc1cc(ccn1)Br AB17599 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.4 Cc1cc(ccn1)Br PB26077 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.4 Cc1cc(ccn1)Cl AB01756 [0,0,0,0,0,0|4,0,0]=4 5 B8R1.4 Cc1cc(ccn1)F AB17919 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.4 Cc1cc(ccn1)O PB24839 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.4 Cc1cc(cnc1)Br AB09597 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.4 Cc1cc(cnc1)Cl AB17994 [0,0,0,0,0,0|2,0,0]=2 9 B8R1.4 Cc1cc(cnc1)F AB13643 [0,0,0,0,0,0|2,0,0]=2 10 B8R1.4 Cc1cc(cnc1)N AB17573 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.4 Cc1cc(cnc1)O MB01362 [0,0,0,0,0,0|2,0,0]=2 12 B8R1.4 Cc1cc(cnn1)N MB11385 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.4 Cc1cc(ncn1)C PB24534 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.4 Cc1cc(nnc1)Cl PB14716 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.4 Cc1cc(nnc1)N AB61142 [0,0,0,0,0,0|3,0,0]=3 16 B8R1.4 Cc1cc[nH]c(=O)n1 PB19074 [0,0,0,0,0,0|3,0,0]=3 17 B8R1.4 Cc1cccc(n1)Br AB01812 [0,0,0,0,0,0|2,0,0]=2 18 B8R1.4 Cc1cccc(n1)Cl AB00666 [0,0,0,0,0,0|2,0,0]=2 19 B8R1.4 Cc1cccc(n1)F AB01860 [0,0,0,0,0,0|2,0,0]=2 20 B8R1.4 Cc1cccc(n1)N AB00717 [0,0,0,0,0,0|2,0,0]=2 21 B8R1.4 Cc1cccc(n1)O AB00679 [0,0,0,0,0,0|2,0,0]=2 22 B8R1.4 Cc1cccc(n1)S AB25230 [0,0,0,0,0,0|2,0,0]=2 23 B8R1.4 Cc1ccnc(c1)Br AB03099 [0,0,0,0,0,0|4,0,0]=4 24 B8R1.4 Cc1ccnc(c1)Cl PB10051 [0,0,0,0,0,0|4,0,0]=4 25 B8R1.4 Cc1ccnc(c1)F AB01854 [0,0,0,0,0,0|4,0,0]=4 26 B8R1.4 Cc1ccnc(c1)N AB00703 [0,0,0,0,0,0|4,0,0]=4 27 B8R1.4 Cc1ccnc(c1)O AB03735 [0,0,0,0,0,0|4,0,0]=4 28 B8R1.4 Cc1ccnc(n1)Cl PB14106 [0,0,0,0,0,0|3,0,0]=3 29 B8R1.4 Cc1ccnc(n1)N MB00179 [0,0,0,0,0,0|3,0,0]=3 30 B8R1.4 Cc1cncc(n1)Br AB48617 [0,0,0,0,0,0|1,0,0]=1 31 B8R1.4 Cc1cncc(n1)Cl AB02267 [0,0,0,0,0,0|1,0,0]=1 32 B8R1.4 Cc1cncc(n1)N AB43812 [0,0,0,0,0,0|1,0,0]=1 33 B8R1.4 Cc1cnnc(n1)Cl AB85248 [0,0,0,0,0,0|2,0,0]=2 34 B8R1.4 Cc1nc(cnn1)Cl AB66817 [0,0,0,0,0,0|2,0,0]=2 35 B8R1.4 Cc1nccc(n1)Cl PB30633 [0,0,0,0,0,0|3,0,0]=3 36 B8R1.4 Cc1nccc(n1)N AB06587 [0,0,0,0,0,0|3,0,0]=3 37 B8R1.4 c1c(cncc1Br)Br AB01172 [0,0,0,0,0,0|3,0,0]=3 38 B8R1.4 c1c(cncc1Br)Cl AB18001 [0,0,0,0,0,0|3,0,0]=3 39 B8R1.4 c1c(cncc1Br)N PB12251 [0,0,0,0,0,0|3,0,0]=3 40 B8R1.4 c1c(cncc1Br)O PB30658 [0,0,0,0,0,0|3,0,0]=3 41 B8R1.4 c1c(cncc1Cl)Cl AB00743 [0,0,0,0,0,0|3,0,0]=3 42 B8R1.4 c1c(cncc1Cl)F AB21896 [0,0,0,0,0,0|3,0,0]=3 43 B8R1.4 c1c(cncc1Cl)N AB15758 [0,0,0,0,0,0|3,0,0]=3 44 B8R1.4 c1c(cncc1F)F AB14383 [0,0,0,0,0,0|3,0,0]=3 45 B8R1.4 c1c(cncc1F)N AB05123 [0,0,0,0,0,0|3,0,0]=3 46 B8R1.4 c1c(cncc1F)O AB13569 [0,0,0,0,0,0|3,0,0]=3 47 B8R1.4 c1c(cncc1I)Br AB13102 [0,0,0,0,0,0|3,0,0]=3 48 B8R1.4 c1c(cncc1I)Cl AB43784 [0,0,0,0,0,0|3,0,0]=3 49 B8R1.4 c1c(cncc1I)F AB45557 [0,0,0,0,0,0|3,0,0]=3 50 B8R1.4 c1c(cncc1I)I PB19957 [0,0,0,0,0,0|3,0,0]=3 51 B8R1.4 c1c(cncc1I)N AB43802 [0,0,0,0,0,0|3,0,0]=3 52 B8R1.4 c1c(cncc1N)N AB07746 [0,0,0,0,0,0|3,0,0]=3 53 B8R1.4 c1c(cncc1O)N AB17983 [0,0,0,0,0,0|3,0,0]=3 54 B8R1.4 c1c(cncc1O)O MB02073 [0,0,0,0,0,0|3,0,0]=3 55 B8R1.4 c1c(cnnc1Br)Br AB70143 [0,0,0,0,0,0|4,0,0]=4 56 B8R1.4 c1c(cnnc1Cl)Br AB70142 [0,0,0,0,0,0|4,0,0]=4 57 B8R1.4 c1c(cnnc1Cl)Cl AB61136 [0,0,0,0,0,0|4,0,0]=4 58 B8R1.4 c1c(cnnc1Cl)N PB20792 [0,0,0,0,0,0|4,0,0]=4 59 B8R1.4 c1c(cnnc1N)Cl PB15393 [0,0,0,0,0,0|4,0,0]=4 60 B8R1.4 c1c(cnnc1O)Cl AB61137 [0,0,0,0,0,0|4,0,0]=4 61 B8R1.4 c1c(nc(cn1)Br)Br AB52791 [0,0,0,0,0,0|2,0,0]=2 62 B8R1.4 c1c(nc(cn1)Br)Cl AB48957 [0,0,0,0,0,0|2,0,0]=2 63 B8R1.4 c1c(nc(cn1)Br)F MB14129 [0,0,0,0,0,0|2,0,0]=2 64 B8R1.4 c1c(nc(cn1)Br)N AB60541 [0,0,0,0,0,0|2,0,0]=2 65 B8R1.4 c1c(nc(cn1)Cl)Cl PB14072 [0,0,0,0,0,0|2,0,0]=2 66 B8R1.4 c1c(nc(cn1)Cl)F MB14158 [0,0,0,0,0,0|2,0,0]=2 67 B8R1.4 c1c(nc(cn1)Cl)N PB12992 [0,0,0,0,0,0|2,0,0]=2 68 B8R1.4 c1c(nc(cn1)Cl)O MB00903 [0,0,0,0,0,0|2,0,0]=2 69 B8R1.4 c1c(nc(nn1)Cl)Cl AB65511 [0,0,0,0,0,0|3,0,0]=3 70 B8R1.4 c1c(nc(nn1)Cl)N AB71508 [0,0,0,0,0,0|3,0,0]=3 71 B8R1.4 c1cc(nc(c1)Br)Br AB00637 [0,0,0,0,0,0|3,0,0]=3 72 B8R1.4 c1cc(nc(c1)Br)Cl PB33830 [0,0,0,0,0,0|3,0,0]=3 73 B8R1.4 c1cc(nc(c1)Br)F AB13626 [0,0,0,0,0,0|3,0,0]=3 74 B8R1.4 c1cc(nc(c1)Br)N PB32140 [0,0,0,0,0,0|3,0,0]=3 75 B8R1.4 c1cc(nc(c1)Br)O AB05100 [0,0,0,0,0,0|3,0,0]=3 76 B8R1.4 c1cc(nc(c1)Cl)Cl AB00664 [0,0,0,0,0,0|3,0,0]=3 77 B8R1.4 c1cc(nc(c1)Cl)F AB02970 [0,0,0,0,0,0|3,0,0]=3 78 B8R1.4 c1cc(nc(c1)Cl)N PB26011 [0,0,0,0,0,0|3,0,0]=3 79 B8R1.4 c1cc(nc(c1)F)N AB17974 [0,0,0,0,0,0|3,0,0]=3 80 B8R1.4 c1cc(nc(c1)I)Cl AB42915 [0,0,0,0,0,0|3,0,0]=3 81 B8R1.4 c1cc(nc(c1)I)I AB31088 [0,0,0,0,0,0|3,0,0]=3 82 B8R1.4 c1cc(nc(c1)I)N AB42508 [0,0,0,0,0,0|3,0,0]=3 83 B8R1.4 c1cnc(nc1Br)Br PB17395 [0,0,0,0,0,0|4,0,0]=4 84 B8R1.4 c1cnc(nc1Br)F MB14189 [0,0,0,0,0,0|4,0,0]=4 85 B8R1.4 c1cnc(nc1Br)N PB13233 [0,0,0,0,0,0|4,0,0]=4 86 B8R1.4 c1cnc(nc1Cl)Br MB10108 [0,0,0,0,0,0|4,0,0]=4 87 B8R1.4 c1cnc(nc1Cl)Cl AB00576 [0,0,0,0,0,0|4,0,0]=4 88 B8R1.4 c1cnc(nc1Cl)N PB21638 [0,0,0,0,0,0|4,0,0]=4 89 B8R1.4 c1cnc(nc1Cl)O AB68453 [0,0,0,0,0,0|4,0,0]=4 90 B8R1.4 c1cnc(nc1F)Br MB14089 [0,0,0,0,0,0|4,0,0]=4 91 B8R1.4 c1cnc(nc1N)Br MB09311 [0,0,0,0,0,0|4,0,0]=4 92 B8R1.4 c1cnc(nc1N)Cl PB14147 [0,0,0,0,0,0|4,0,0]=4 93 B7R1.3 Cc1cccnn1 PB33649 [1,0,0,0,0,0|2,0,0]=3 94 B7R1.3 Cc1ccncn1 PB17038 [1,0,0,0,0,0|2,0,0]=3 95 B7R1.3 Cc1ccnnc1 PB24546 [1,0,0,0,0,0|2,0,0]=3 96 B7R1.3 Cc1nccnn1 AB55984 [1,0,0,0,0,0|1,0,0]=2 97 B7R1.3 c1c(cncn1)Br PB28945 [1,0,0,0,0,0|3,0,0]=4 98 B7R1.3 c1c(cncn1)Cl AB16528 [1,0,0,0,0,0|3,0,0]=4 99 B7R1.3 c1c(cncn1)N PB12745 [1,0,0,0,0,0|3,0,0]=4 100 B7R1.3 c1c(cncn1)O PB27730 [1,0,0,0,0,0|3,0,0]=4 101 B7R1.3 c1cc(cnc1)Br AB00739 [1,0,0,0,0,0|2,0,0]=3 102 B7R1.3 c1cc(cnc1)I AB01382 [1,0,0,0,0,0|2,0,0]=3 103 B7R1.3 c1cc(cnc1)[O-] MB00567 [1,0,0,0,0,0|2,0,0]=3 104 B7R1.3 c1cc(nnc1)Br MB08580 [1,0,0,0,0,0|3,0,0]=4 105 B7R1.3 c1cc(nnc1)Cl AB30021 [1,0,0,0,0,0|3,0,0]=4 106 B7R1.3 c1cc(nnc1)Cl PB34726 [1,0,0,0,0,0|3,0,0]=4 107 B7R1.3 c1cc(nnc1)N PB17217 [1,0,0,0,0,0|3,0,0]=4 108 B7R1.3 c1cc(nnc1)O PB32258 [1,0,0,0,0,0|3,0,0]=4 109 B7R1.3 c1ccnc(c1)Br AB00627 [1,0,0,0,0,0|2,0,0]=3 110 B7R1.3 c1cnc(cn1)Br MB06072 [1,0,0,0,0,0|1,0,0]=2 111 B7R1.3 c1cnc(cn1)I AB08841 [1,0,0,0,0,0|1,0,0]=2 112 B7R1.3 c1cnc(cn1)N PB30528 [1,0,0,0,0,0|1,0,0]=2 113 B7R1.3 c1cnc(cn1)O AB05056 [1,0,0,0,0,0|1,0,0]=2 114 B7R1.3 c1cnc(nc1)Cl AB00572 [1,0,0,0,0,0|3,0,0]=4 115 B7R1.3 c1cnc(nc1)N MB00175 [1,0,0,0,0,0|3,0,0]=4 116 B7R1.3 c1cncnc1Br PB10690 [1,0,0,0,0,0|3,0,0]=4 117 B7R1.3 c1cncnc1Cl AB43600 [1,0,0,0,0,0|3,0,0]=4 118 B7R1.3 c1cncnc1Cl PB13479 [1,0,0,0,0,0|3,0,0]=4 119 B7R1.3 c1cncnc1N PB11581 [1,0,0,0,0,0|3,0,0]=4 120 B7R1.3 c1cncnc1O PB32093 [1,0,0,0,0,0|3,0,0]=4 121 B7R1.3 c1cnnc(n1)Cl AB72415 [1,0,0,0,0,0|2,0,0]=3 122 B7R1.3 c1cnnc(n1)N AB00769 [1,0,0,0,0,0|2,0,0]=3 123 B7R1.3 c1cnncc1Br AB48350 [1,0,0,0,0,0|3,0,0]=4 124 B7R1.3 c1cnncc1Cl AB50535 [1,0,0,0,0,0|3,0,0]=4 125 B7R1.3 c1cnncc1I AB70137 [1,0,0,0,0,0|3,0,0]=4 126 B7R1.3 c1cnncc1N PB29051 [1,0,0,0,0,0|3,0,0]=4 127 B7R1.3 c1cnncc1N PB39062 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.2 C#Cc1cc(cnc1)Br AB61376 [0,1,0,0,0,0|2,0,1]=4 129 B9R1.2 C#Cc1cc(cnc1)Cl AB52703 [0,1,0,0,0,0|2,0,1]=4 130 B9R1.2 C#Cc1cc(cnc1)F AB66583 [0,1,0,0,0,0|2,0,1]=4 131 B9R1.2 C#Cc1cc(cnc1)N AB71894 [0,1,0,0,0,0|2,0,1]=4 132 B9R1.2 C#Cc1cccc(n1)Br AB68980 [0,1,0,0,0,0|2,0,1]=4 133 B9R1.2 C#Cc1cccc(n1)Cl AB68981 [0,1,0,0,0,0|2,0,1]=4 134 B9R1.2 C#Cc1cncc(n1)Cl AB69154 [0,1,0,0,0,0|1,0,1]=3 135 B9R1.2 C=Cc1cccc(n1)Br AB74634 [0,1,0,0,0,0|2,0,1]=4 136 B9R1.2 CCc1cc(cnc1)Br PB34416 [0,1,0,0,0,0|2,0,0]=3 137 B9R1.2 CCc1cc(cnc1)O MB12329 [0,1,0,0,0,0|2,0,0]=3 138 B9R1.2 CCc1cccc(n1)Br MB10338 [0,1,0,0,0,0|2,0,0]=3 139 B9R1.2 CCc1nccc(n1)Cl AB51249 [0,1,0,0,0,0|3,0,0]=4 140 B9R1.2 CNc1cc(cnc1)Br MB13417 [0,1,0,0,0,0|2,0,0]=3 141 B9R1.2 CNc1cc(cnc1)O MB32689 [0,1,0,0,0,0|2,0,0]=3 142 B9R1.2 CNc1cc[nH]c(=O)n1 AB60627 [0,1,0,0,0,0|3,0,0]=4 143 B9R1.2 CNc1cccc(c1)O MB25493 [0,1,0,0,0,0|3,0,0]=4 144 B9R1.2 CNc1cccc(n1)Br AB50070 [0,1,0,0,0,0|2,0,0]=3 145 B9R1.2 CNc1cccc(n1)Cl AB05190 [0,1,0,0,0,0|2,0,0]=3 146 B9R1.2 CNc1ccnc(n1)Br MB14143 [0,1,0,0,0,0|3,0,0]=4 147 B9R1.2 CNc1ccnc(n1)Cl AB49666 [0,1,0,0,0,0|3,0,0]=4 148 B9R1.2 CNc1cncc(n1)Cl MB07975 [0,1,0,0,0,0|1,0,0]=2 149 B9R1.2 CNc1nccc(n1)Br MB13471 [0,1,0,0,0,0|3,0,0]=4 150 B9R1.2 CNc1nccc(n1)Cl AB52980 [0,1,0,0,0,0|3,0,0]=4 151 B9R1.2 COC1=CN=NC(=O)C1 AB22384 [0,1,0,0,0,0|3,0,0]=4 152 B9R1.2 COc1cc(cnc1)Br PB24634 [0,1,0,0,0,0|2,0,0]=3 153 B9R1.2 COc1cc(cnc1)Cl AB55073 [0,1,0,0,0,0|2,0,0]=3 154 B9R1.2 COc1cc(cnc1)F AB66777 [0,1,0,0,0,0|2,0,0]=3 155 B9R1.2 COc1cc(cnc1)I AB43793 [0,1,0,0,0,0|2,0,0]=3 156 B9R1.2 COc1cc(cnc1)N PB12653 [0,1,0,0,0,0|2,0,0]=3 157 B9R1.2 COc1cc(cnc1)N PB25488 [0,1,0,0,0,0|2,0,0]=3 158 B9R1.2 COc1cc(cnc1)O AB29711 [0,1,0,0,0,0|2,0,0]=3 159 B9R1.2 COc1cc(cnn1)N AB76247 [0,1,0,0,0,0|3,0,0]=4 160 B9R1.2 COc1cc(nnc1)Cl PB27887 [0,1,0,0,0,0|3,0,0]=4 161 B9R1.2 COc1cccc(n1)Cl AB00671 [0,1,0,0,0,0|2,0,0]=3 162 B9R1.2 COc1cccc(n1)F AB55818 [0,1,0,0,0,0|2,0,0]=3 163 B9R1.2 COc1cccc(n1)I AB31101 [0,1,0,0,0,0|2,0,0]=3 164 B9R1.2 COc1cccc(n1)N AB21183 [0,1,0,0,0,0|2,0,0]=3 165 B9R1.2 COc1cccc(n1)O AB31854 [0,1,0,0,0,0|2,0,0]=3 166 B9R1.2 COc1ccnc(n1)Br MB07472 [0,1,0,0,0,0|3,0,0]=4 167 B9R1.2 COc1cncc(n1)Cl PB29367 [0,1,0,0,0,0|1,0,0]=2 168 B9R1.2 COc1cncc(n1)N AB54770 [0,1,0,0,0,0|1,0,0]=2 169 B9R1.2 COc1cnnc(n1)Cl AB71503 [0,1,0,0,0,0|2,0,0]=3 170 B9R1.2 COc1nccc(n1)Br AB54361 [0,1,0,0,0,0|3,0,0]=4 171 B9R1.2 COc1nccc(n1)Cl AB49109 [0,1,0,0,0,0|3,0,0]=4 172 B9R1.2 COc1nccc(n1)N PB29013 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.2 CSc1cc(cnc1)Br MB06469 [0,1,0,0,0,0|2,0,0]=3 174 B9R1.2 CSc1cc(cnc1)O MB28894 [0,1,0,0,0,0|2,0,0]=3 175 B9R1.2 CSc1cccc(n1)Br MB07302 [0,1,0,0,0,0|2,0,0]=3 176 B9R1.2 CSc1ccnc(n1)Br MB14073 [0,1,0,0,0,0|3,0,0]=4 177 B9R1.2 CSc1cnnc(n1)Cl AB71510 [0,1,0,0,0,0|2,0,0]=3 178 B9R1.2 CSc1nccc(n1)Br AB54070 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.2 CSc1nccc(n1)Cl PB10012 [0,1,0,0,0,0|3,0,0]=4 180 B9R1.2 CSc1nccc(n1)I AB08843 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.2 Cc1cc(ccn1)CCl AB59910 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.2 Cc1cc(ccn1)CN AB25370 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.2 Cc1cc(cnc1)C=O PB18860 [0,1,0,0,0,0|1,0,1]=3 184 B9R1.2 Cc1cc(cnc1)CCl AB55820 [0,1,0,0,0,0|1,0,0]=2 185 B9R1.2 Cc1cc(cnc1)CN AB23459 [0,1,0,0,0,0|1,0,0]=2 186 B9R1.2 Cc1cc(cnc1)CO PB10532 [0,1,0,0,0,0|1,0,0]=2 187 B9R1.2 Cc1cc(cnc1)OC AB64998 [0,1,0,0,0,0|1,0,0]=2 188 B9R1.2 Cc1cc(nnc1)C#N PB11387 [0,1,0,0,0,0|2,0,1]=4 189 B9R1.2 Cc1cc(nnc1)CN PB37868 [0,1,0,0,0,0|2,0,0]=3 190 B9R1.2 Cc1cccc(n1)C#N AB04512 [0,1,0,0,0,0|1,0,1]=3 191 B9R1.2 Cc1cccc(n1)C=O AB00683 [0,1,0,0,0,0|1,0,1]=3 192 B9R1.2 Cc1cccc(n1)CCl AB49651 [0,1,0,0,0,0|1,0,0]=2 193 B9R1.2 Cc1cccc(n1)CN AB22796 [0,1,0,0,0,0|1,0,0]=2 194 B9R1.2 Cc1cccc(n1)NC AB60602 [0,1,0,0,0,0|1,0,0]=2 195 B9R1.2 Cc1ccnc(c1)CCl AB42303 [0,1,0,0,0,0|3,0,0]=4 196 B9R1.2 Cc1ccnc(c1)CN AB23452 [0,1,0,0,0,0|3,0,0]=4 197 B9R1.2 Cc1ccnc(n1)C#C AB69142 [0,1,0,0,0,0|2,0,1]=4 198 B9R1.2 Cc1ccnc(n1)C#N PB33166 [0,1,0,0,0,0|2,0,1]=4 199 B9R1.2 Cc1ccnc(n1)C=O PB28177 [0,1,0,0,0,0|2,0,1]=4 200 B9R1.2 Cc1ccnc(n1)CCl PB25297 [0,1,0,0,0,0|2,0,0]=3 201 B9R1.2 Cc1ccnc(n1)CN PB16292 [0,1,0,0,0,0|2,0,0]=3 202 B9R1.2 Cc1ccnc(n1)CO PB24151 [0,1,0,0,0,0|2,0,0]=3 203 B9R1.2 Cc1cncc(n1)C=O AB62637 [0,1,0,0,0,0|0,0,1]=2 204 B9R1.2 Cc1cncc(n1)CCl AB60498 [0,1,0,0,0,0|0,0,0]=1 205 B9R1.2 Cc1cncc(n1)CN AB72296 [0,1,0,0,0,0|0,0,0]=1 206 B9R1.2 Cc1nccc(n1)C=O AB52721 [0,1,0,0,0,0|2,0,1]=4 207 B9R1.2 Cc1nccc(n1)CCl AB58939 [0,1,0,0,0,0|2,0,0]=3 208 B9R1.2 Cc1nccc(n1)CN AB43194 [0,1,0,0,0,0|2,0,0]=3 209 B9R1.2 c1c(cncc1Br)C#N PB14142 [0,1,0,0,0,0|2,0,1]=4 210 B9R1.2 c1c(cncc1Br)C=O PB10234 [0,1,0,0,0,0|2,0,1]=4 211 B9R1.2 c1c(cncc1Br)CCl AB60029 [0,1,0,0,0,0|2,0,0]=3 212 B9R1.2 c1c(cncc1Br)CCl PB25120 [0,1,0,0,0,0|2,0,0]=3 213 B9R1.2 c1c(cncc1Br)CN PB23445 [0,1,0,0,0,0|2,0,0]=3 214 B9R1.2 c1c(cncc1Br)CO PB29242 [0,1,0,0,0,0|2,0,0]=3 215 B9R1.2 c1c(cncc1Cl)C#N AB14095 [0,1,0,0,0,0|2,0,1]=4 216 B9R1.2 c1c(cncc1Cl)C=O PB29540 [0,1,0,0,0,0|2,0,1]=4 217 B9R1.2 c1c(cncc1Cl)CCl AB60038 [0,1,0,0,0,0|2,0,0]=3 218 B9R1.2 c1c(cncc1Cl)CCl PB33259 [0,1,0,0,0,0|2,0,0]=3 219 B9R1.2 c1c(cncc1Cl)CN AB63152 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.2 c1c(cncc1F)C#N AB49149 [0,1,0,0,0,0|2,0,1]=4 221 B9R1.2 c1c(cncc1F)C=O PB12469 [0,1,0,0,0,0|2,0,1]=4 222 B9R1.2 c1c(cncc1F)CCl PB35002 [0,1,0,0,0,0|2,0,0]=3 223 B9R1.2 c1c(cncc1F)CN PB29533 [0,1,0,0,0,0|2,0,0]=3 224 B9R1.2 c1c(cncc1F)CO PB12255 [0,1,0,0,0,0|2,0,0]=3 225 B9R1.2 c1c(cncc1I)C=O AB45533 [0,1,0,0,0,0|2,0,1]=4 226 B9R1.2 c1c(cncc1I)CCl AB45545 [0,1,0,0,0,0|2,0,0]=3 227 B9R1.2 c1c(cncc1I)CO AB45541 [0,1,0,0,0,0|2,0,0]=3 228 B9R1.2 c1c(cncc1N)C#N AB31378 [0,1,0,0,0,0|2,0,1]=4 229 B9R1.2 c1c(cncc1N)C=O AB67741 [0,1,0,0,0,0|2,0,1]=4 230 B9R1.2 c1c(cncc1N)CN AB31384 [0,1,0,0,0,0|2,0,0]=3 231 B9R1.2 c1c(cncc1N)CO AB31625 [0,1,0,0,0,0|2,0,0]=3 232 B9R1.2 c1c(cncc1O)C#N MB09110 [0,1,0,0,0,0|2,0,1]=4 233 B9R1.2 c1c(cncc1O)C=O AB67779 [0,1,0,0,0,0|2,0,1]=4 234 B9R1.2 c1c(cncc1O)CN MB28837 [0,1,0,0,0,0|2,0,0]=3 235 B9R1.2 c1c(nc(cn1)Br)CCl AB69950 [0,1,0,0,0,0|1,0,0]=2 236 B9R1.2 c1c(nc(cn1)Br)CO MB14063 [0,1,0,0,0,0|1,0,0]=2 237 B9R1.2 c1c(nc(cn1)Cl)C#N PB26471 [0,1,0,0,0,0|1,0,1]=3 238 B9R1.2 c1c(nc(cn1)Cl)C=O PB16295 [0,1,0,0,0,0|1,0,1]=3 239 B9R1.2 c1c(nc(cn1)Cl)CCl AB69949 [0,1,0,0,0,0|1,0,0]=2 240 B9R1.2 c1c(nc(cn1)Cl)CN PB19729 [0,1,0,0,0,0|1,0,0]=2 241 B9R1.2 c1c(nc(cn1)Cl)CO PB11152 [0,1,0,0,0,0|1,0,0]=2 242 B9R1.2 c1c(nc(cn1)N)C#N PB28163 [0,1,0,0,0,0|1,0,1]=3 243 B9R1.2 c1cc(cc(c1)Br)CBr AB00107 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.2 c1cc(cc(c1)O)CBr MB05606 [0,1,0,0,0,0|3,0,0]=4 245 B9R1.2 c1cc(nc(c1)Br)C#N PB24633 [0,1,0,0,0,0|2,0,1]=4 246 B9R1.2 c1cc(nc(c1)Br)C=O PB27582 [0,1,0,0,0,0|2,0,1]=4 247 B9R1.2 c1cc(nc(c1)Br)CCl AB59969 [0,1,0,0,0,0|2,0,0]=3 248 B9R1.2 c1cc(nc(c1)Br)CCl AB59992 [0,1,0,0,0,0|2,0,0]=3 249 B9R1.2 c1cc(nc(c1)Br)CN AB31432 [0,1,0,0,0,0|2,0,0]=3 250 B9R1.2 c1cc(nc(c1)Br)CO PB29304 [0,1,0,0,0,0|2,0,0]=3 251 B9R1.2 c1cc(nc(c1)Br)NN AB51209 [0,1,0,0,0,0|3,0,0]=4 252 B9R1.2 c1cc(nc(c1)Cl)C#N AB05877 [0,1,0,0,0,0|2,0,1]=4 253 B9R1.2 c1cc(nc(c1)Cl)C=O AB52723 [0,1,0,0,0,0|2,0,1]=4 254 B9R1.2 c1cc(nc(c1)Cl)CCl AB42311 [0,1,0,0,0,0|2,0,0]=3 255 B9R1.2 c1cc(nc(c1)Cl)CN AB62988 [0,1,0,0,0,0|2,0,0]=3 256 B9R1.2 c1cc(nc(c1)Cl)CO AB42312 [0,1,0,0,0,0|2,0,0]=3 257 B9R1.2 c1cc(nc(c1)F)C#N AB50189 [0,1,0,0,0,0|2,0,1]=4 258 B9R1.2 c1cc(nc(c1)F)C=O AB13533 [0,1,0,0,0,0|2,0,1]=4 259 B9R1.2 c1cc(nc(c1)F)CCl AB42316 [0,1,0,0,0,0|2,0,0]=3 260 B9R1.2 c1cc(nc(c1)F)CN AB66365 [0,1,0,0,0,0|2,0,0]=3 261 B9R1.2 c1cc(nc(c1)I)CO AB42511 [0,1,0,0,0,0|2,0,0]=3 262 B9R1.2 c1cc(nc(c1)N)C#N AB62904 [0,1,0,0,0,0|2,0,1]=4 263 B9R1.2 c1cc(nc(c1)N)CO AB53761 [0,1,0,0,0,0|2,0,0]=3 264 B9R1.2 c1cc(nc(c1)O)C#N AB62925 [0,1,0,0,0,0|2,0,1]=4 265 B9R1.2 c1cnc(nc1CCl)Cl AB58935 [0,1,0,0,0,0|3,0,0]=4 266 B9R1.2 c1cnc(nc1CN)Cl AB58851 [0,1,0,0,0,0|3,0,0]=4 267 B9R1.2 c1cnc(nc1CN)O PB23029 [0,1,0,0,0,0|3,0,0]=4 268 B9R1.2 c1cnc(nc1Cl)CCl AB59104 [0,1,0,0,0,0|3,0,0]=4 269 B9R1.2 c1cnc(nc1Cl)CN AB05129 [0,1,0,0,0,0|3,0,0]=4 270 B9R1.2 c1cnc(nc1Cl)CO AB64233 [0,1,0,0,0,0|3,0,0]=4 271 B9R1.2 c1cnc(nc1N)CCl AB59419 [0,1,0,0,0,0|3,0,0]=4 272 B9R1.2 c1cnc(nc1N)CN AB62661 [0,1,0,0,0,0|3,0,0]=4 273 B9R1.2 c1cnc(nc1O)CCl AB59397 [0,1,0,0,0,0|3,0,0]=4 274 B9R1.2 c1cnc(nc1O)CN AB63186 [0,1,0,0,0,0|3,0,0]=4 275 B9R1.3 Cc1c(cncc1Br)Br AB03597 [0,1,0,0,0,0|3,0,0]=4 276 B9R1.3 Cc1c(cncc1Br)Cl AB75733 [0,1,0,0,0,0|3,0,0]=4 277 B9R1.3 Cc1c(cncc1Br)F AB74995 [0,1,0,0,0,0|3,0,0]=4 278 B9R1.3 Cc1c(cncc1Br)N AB42002 [0,1,0,0,0,0|3,0,0]=4 279 B9R1.3 Cc1c(cncc1Cl)N AB41999 [0,1,0,0,0,0|3,0,0]=4 280 B9R1.3 Cc1c(cncc1Cl)O AB70586 [0,1,0,0,0,0|3,0,0]=4 281 B9R1.3 Cc1cccc(c1Br)O MB08359 [0,1,0,0,0,0|3,0,0]=4 282 B9R1.3 Cc1cccc(c1Cl)O MB00390 [0,1,0,0,0,0|3,0,0]=4 283 B9R1.3 Cc1cccc(c1F)N AB25121 [0,1,0,0,0,0|3,0,0]=4 284 B9R1.3 Cc1cccc(c1I)O MB23494 [0,1,0,0,0,0|3,0,0]=4 285 B9R1.3 Cc1cccc(c1N)Br MB03160 [0,1,0,0,0,0|3,0,0]=4 286 B9R1.3 Cc1cccc(c1N)F MB03934 [0,1,0,0,0,0|3,0,0]=4 287 B9R1.3 Cc1cccc(c1O)F MB11516 [0,1,0,0,0,0|3,0,0]=4 288 B9R1.3 Cc1cccc(c1O)I MB23471 [0,1,0,0,0,0|3,0,0]=4 289 B9R1.3 Cc1cccc(c1O)N MB02950 [0,1,0,0,0,0|3,0,0]=4 290 B9R1.3 Cc1ccnc(c1Br)C AB53712 [0,1,0,0,0,0|3,0,0]=4 291 B9R1.3 Cc1ccnc(c1N)C AB43810 [0,1,0,0,0,0|3,0,0]=4 292 B9R1.3 Cc1ccnc(c1O)C AB43831 [0,1,0,0,0,0|3,0,0]=4 293 B9R1.3 Cc1cncc(c1Br)C AB53717 [0,1,0,0,0,0|1,0,0]=2 294 B9R1.3 Cc1cncc(c1Br)Cl AB74973 [0,1,0,0,0,0|2,0,0]=3 295 B9R1.3 Cc1cncc(c1Br)F AB74996 [0,1,0,0,0,0|2,0,0]=3 296 B9R1.3 Cc1cncc(c1C)Br AB64494 [0,1,0,0,0,0|2,0,0]=3 297 B9R1.3 Cc1cncc(c1C)N AB76783 [0,1,0,0,0,0|2,0,0]=3 298 B9R1.3 Cc1cncc(c1C)O AB65620 [0,1,0,0,0,0|2,0,0]=3 299 B9R1.3 Cc1cncc(c1Cl)Br AB75732 [0,1,0,0,0,0|2,0,0]=3 300 B9R1.3 Cc1cncc(c1Cl)C AB50483 [0,1,0,0,0,0|1,0,0]=2 301 B9R1.3 Cc1cncc(c1Cl)N AB75728 [0,1,0,0,0,0|2,0,0]=3 302 B9R1.3 Cc1cncc(c1Cl)O AB71654 [0,1,0,0,0,0|2,0,0]=3 303 B9R1.3 Cc1cncc(c1F)Br AB74994 [0,1,0,0,0,0|2,0,0]=3 304 B9R1.3 Cc1cncc(c1F)N AB66587 [0,1,0,0,0,0|2,0,0]=3 305 B9R1.3 Cc1cncc(c1F)O AB82936 [0,1,0,0,0,0|2,0,0]=3 306 B9R1.3 Cc1cncc(c1N)C AB14443 [0,1,0,0,0,0|1,0,0]=2 307 B9R1.3 Cc1cncc(c1N)Cl AB44879 [0,1,0,0,0,0|2,0,0]=3 308 B9R1.3 Cc1cncc(c1N)F AB75360 [0,1,0,0,0,0|2,0,0]=3 309 B9R1.3 Cc1cncc(c1N)N AB60255 [0,1,0,0,0,0|2,0,0]=3 310 B9R1.3 Cc1cncc(c1O)C AB82550 [0,1,0,0,0,0|1,0,0]=2 311 B9R1.3 Cc1cncc(c1O)Cl AB75744 [0,1,0,0,0,0|2,0,0]=3 312 B9R1.3 Cc1cncc(c1O)F AB25961 [0,1,0,0,0,0|2,0,0]=3 313 B9R1.3 c1c(c(c(cn1)Br)Cl)Br PB24627 [0,1,0,0,0,0|3,0,0]=4 314 B9R1.3 c1c(c(c(cn1)Br)Cl)F AB74956 [0,1,0,0,0,0|3,0,0]=4 315 B9R1.3 c1c(c(c(cn1)Br)Cl)N AB66381 [0,1,0,0,0,0|3,0,0]=4 316 B9R1.3 c1c(c(c(cn1)Br)Cl)O AB74970 [0,1,0,0,0,0|3,0,0]=4 317 B9R1.3 c1c(c(c(cn1)Br)F)Cl AB82965 [0,1,0,0,0,0|3,0,0]=4 318 B9R1.3 c1c(c(c(cn1)Br)N)Cl AB56437 [0,1,0,0,0,0|3,0,0]=4 319 B9R1.3 c1c(c(c(cn1)Br)O)Cl AB66732 [0,1,0,0,0,0|3,0,0]=4 320 B9R1.3 c1c(c(c(cn1)Br)O)N AB48393 [0,1,0,0,0,0|3,0,0]=4 321 B9R1.3 c1c(c(c(cn1)Cl)Br)Cl MB04163 [0,1,0,0,0,0|3,0,0]=4 322 B9R1.3 c1c(c(c(cn1)Cl)Br)F AB70924 [0,1,0,0,0,0|3,0,0]=4 323 B9R1.3 c1c(c(c(cn1)Cl)Cl)N AB55065 [0,1,0,0,0,0|3,0,0]=4 324 B9R1.3 c1c(c(c(cn1)Cl)F)N AB75054 [0,1,0,0,0,0|3,0,0]=4 325 B9R1.3 c1c(c(c(cn1)Cl)F)O AB82968 [0,1,0,0,0,0|3,0,0]=4 326 B9R1.3 c1c(c(c(cn1)Cl)I)Cl CB10652 [0,1,0,0,0,0|3,0,0]=4 327 B9R1.3 c1c(c(c(cn1)Cl)N)Cl AB03509 [0,1,0,0,0,0|3,0,0]=4 328 B9R1.3 c1c(c(c(cn1)Cl)N)F AB70854 [0,1,0,0,0,0|3,0,0]=4 329 B9R1.3 c1c(c(c(cn1)Cl)N)N AB50200 [0,1,0,0,0,0|3,0,0]=4 330 B9R1.3 c1c(c(c(cn1)Cl)N)O AB83899 [0,1,0,0,0,0|3,0,0]=4 331 B9R1.3 c1c(c(c(cn1)Cl)O)Cl AB02053 [0,1,0,0,0,0|3,0,0]=4 332 B9R1.3 c1c(c(c(cn1)Cl)O)F AB66744 [0,1,0,0,0,0|3,0,0]=4 333 B9R1.3 c1c(c(c(cn1)Cl)O)N AB84022 [0,1,0,0,0,0|3,0,0]=4 334 B9R1.3 c1c(c(c(cn1)Cl)O)O AB84021 [0,1,0,0,0,0|3,0,0]=4 335 B9R1.3 c1c(c(c(cn1)F)Cl)N AB83146 [0,1,0,0,0,0|3,0,0]=4 336 B9R1.3 c1c(c(c(cn1)F)Cl)O AB83144 [0,1,0,0,0,0|3,0,0]=4 337 B9R1.3 c1c(c(c(cn1)F)N)F AB10209 [0,1,0,0,0,0|3,0,0]=4 338 B9R1.3 c1c(c(c(cn1)N)Cl)N AB71544 [0,1,0,0,0,0|3,0,0]=4 339 B9R1.3 c1c(c(c(cn1)O)Cl)N AB83874 [0,1,0,0,0,0|3,0,0]=4 340 B9R1.3 c1c(c(c(cn1)O)Cl)O AB83993 [0,1,0,0,0,0|3,0,0]=4 341 B9R1.34 Cc1cc(cc(c1)Br)Cl AB45173 [0,1,0,0,0,0|3,0,0]=4 342 B9R1.34 Cc1cc(cc(c1)Br)F AB10112 [0,1,0,0,0,0|3,0,0]=4 343 B9R1.34 Cc1cc(cc(c1)Br)O MB06890 [0,1,0,0,0,0|3,0,0]=4 344 B9R1.34 Cc1cc(cc(c1)Cl)Cl MB00382 [0,1,0,0,0,0|3,0,0]=4 345 B9R1.34 Cc1cc(cc(c1)Cl)F AB13848 [0,1,0,0,0,0|3,0,0]=4 346 B9R1.34 Cc1cc(cc(c1)Cl)O MB05590 [0,1,0,0,0,0|3,0,0]=4 347 B9R1.34 Cc1cc(cc(c1)I)O MB11871 [0,1,0,0,0,0|3,0,0]=4 348 B9R1.34 Cc1cc(cc(c1)O)N MB00602 [0,1,0,0,0,0|3,0,0]=4 349 B9R1.34 Cc1cc(cc(n1)Br)Cl AB70506 [0,1,0,0,0,0|2,0,0]=3 350 B9R1.34 Cc1cc(cc(n1)Br)F AB71085 [0,1,0,0,0,0|2,0,0]=3 351 B9R1.34 Cc1cc(cc(n1)Br)N AB65433 [0,1,0,0,0,0|2,0,0]=3 352 B9R1.34 Cc1cc(cc(n1)C)Br AB06743 [0,1,0,0,0,0|1,0,0]=2 353 B9R1.34 Cc1cc(cc(n1)C)Cl AB09599 [0,1,0,0,0,0|1,0,0]=2 354 B9R1.34 Cc1cc(cc(n1)C)N AB03678 [0,1,0,0,0,0|1,0,0]=2 355 B9R1.34 Cc1cc(cc(n1)C)O AB07775 [0,1,0,0,0,0|1,0,0]=2 356 B9R1.34 Cc1cc(cc(n1)Cl)Cl AB46092 [0,1,0,0,0,0|2,0,0]=3 357 B9R1.34 Cc1cc(cc(n1)Cl)N AB05304 [0,1,0,0,0,0|2,0,0]=3 358 B9R1.34 Cc1cc(cc(n1)F)Br AB71093 [0,1,0,0,0,0|2,0,0]=3 359 B9R1.34 Cc1cc(cc(n1)N)Cl AB07298 [0,1,0,0,0,0|2,0,0]=3 360 B9R1.34 Cc1cc(cc(n1)N)F AB70902 [0,1,0,0,0,0|2,0,0]=3 361 B9R1.34 Cc1cc(cc(n1)O)Cl AB71203 [0,1,0,0,0,0|2,0,0]=3 362 B9R1.34 Cc1cc(cc(n1)O)F AB71321 [0,1,0,0,0,0|2,0,0]=3 363 B9R1.34 Cc1cc(cc(n1)O)O AB10075 [0,1,0,0,0,0|2,0,0]=3 364 B9R1.34 Cc1cc(nc(c1)Br)C AB03103 [0,1,0,0,0,0|2,0,0]=3 365 B9R1.34 Cc1cc(nc(c1)Br)Cl AB53549 [0,1,0,0,0,0|3,0,0]=4 366 B9R1.34 Cc1cc(nc(c1)Br)F AB53551 [0,1,0,0,0,0|3,0,0]=4 367 B9R1.34 Cc1cc(nc(c1)Cl)Cl PB31372 [0,1,0,0,0,0|3,0,0]=4 368 B9R1.34 Cc1cc(nc(c1)Cl)N AB53542 [0,1,0,0,0,0|3,0,0]=4 369 B9R1.34 Cc1cc(nc(c1)Cl)O AB71189 [0,1,0,0,0,0|3,0,0]=4 370 B9R1.34 Cc1cc(nc(c1)F)N AB83076 [0,1,0,0,0,0|3,0,0]=4 371 B9R1.34 Cc1cc(nc(c1)F)O AB71308 [0,1,0,0,0,0|3,0,0]=4 372 B9R1.34 Cc1cc(nc(c1)N)C AB00706 [0,1,0,0,0,0|2,0,0]=3 373 B9R1.34 Cc1cc(nc(c1)O)C AB07368 [0,1,0,0,0,0|2,0,0]=3 374 B9R1.34 Cc1cc(nc(n1)C)Cl AB05193 [0,1,0,0,0,0|2,0,0]=3 375 B9R1.34 Cc1cc(nc(n1)C)O AB00587 [0,1,0,0,0,0|2,0,0]=3 376 B9R1.34 Cc1cc(nc(n1)Cl)Br AB72373 [0,1,0,0,0,0|3,0,0]=4 377 B9R1.34 Cc1cc(nc(n1)Cl)C AB01348 [0,1,0,0,0,0|3,0,0]=4 378 B9R1.34 Cc1cc(nc(n1)Cl)N PB12352 [0,1,0,0,0,0|3,0,0]=4 379 B9R1.34 Cc1nc(cc(n1)Cl)Cl PB20912 [0,1,0,0,0,0|3,0,0]=4 380 B9R1.34 Cc1nc(cc(n1)Cl)N PB26286 [0,1,0,0,0,0|3,0,0]=4 381 B9R1.34 c1c(cc(nc1Br)Br)Cl AB68802 [0,1,0,0,0,0|3,0,0]=4 382 B9R1.34 c1c(cc(nc1Br)Br)N AB05102 [0,1,0,0,0,0|3,0,0]=4 383 B9R1.34 c1c(cc(nc1Cl)Br)Cl AB62525 [0,1,0,0,0,0|3,0,0]=4 384 B9R1.34 c1c(cc(nc1Cl)Br)F AB83211 [0,1,0,0,0,0|3,0,0]=4 385 B9R1.34 c1c(cc(nc1Cl)Br)N AB68218 [0,1,0,0,0,0|3,0,0]=4 386 B9R1.34 c1c(cc(nc1Cl)Cl)Br AB64829 [0,1,0,0,0,0|3,0,0]=4 387 B9R1.34 c1c(cc(nc1Cl)Cl)Cl PB19901 [0,1,0,0,0,0|3,0,0]=4 388 B9R1.34 c1c(cc(nc1Cl)Cl)F AB66757 [0,1,0,0,0,0|3,0,0]=4 389 B9R1.34 c1c(cc(nc1Cl)Cl)I AB32018 [0,1,0,0,0,0|3,0,0]=4 390 B9R1.34 c1c(cc(nc1Cl)Cl)N AB02218 [0,1,0,0,0,0|3,0,0]=4 391 B9R1.34 c1c(cc(nc1F)Br)Cl AB83180 [0,1,0,0,0,0|3,0,0]=4 392 B9R1.34 c1c(cc(nc1F)Cl)Cl AB72861 [0,1,0,0,0,0|3,0,0]=4 393 B9R1.34 c1c(cc(nc1F)F)F PB32320 [0,1,0,0,0,0|3,0,0]=4 394 B9R1.34 c1c(cc(nc1N)Cl)Cl AB17004 [0,1,0,0,0,0|3,0,0]=4 395 B9R1.34 c1c(cc(nc1N)Cl)F AB83213 [0,1,0,0,0,0|3,0,0]=4 396 B9R1.34 c1c(cc(nc1N)F)Cl AB83181 [0,1,0,0,0,0|3,0,0]=4 397 B9R1.34 c1c(cc(nc1N)N)Br CB10800 [0,1,0,0,0,0|3,0,0]=4 398 B9R1.34 c1c(cc(nc1O)Cl)Cl AB62522 [0,1,0,0,0,0|3,0,0]=4 399 B9R1.34 c1c(cc(nc1O)Cl)F AB71139 [0,1,0,0,0,0|3,0,0]=4 400 B9R1.34 c1c(cc(nc1O)F)Cl AB71154 [0,1,0,0,0,0|3,0,0]=4 401 B9R1.69 CC1C=C(N=NC1=O)C PB18522 [0,1,0,0,0,0|2,0,1]=4 402 B9R1.69 Cc1c(cc(cn1)Br)Br PB30636 [0,1,0,0,0,0|3,0,0]=4 403 B9R1.69 Cc1c(cc(cn1)Br)Cl PB25103 [0,1,0,0,0,0|3,0,0]=4 404 B9R1.69 Cc1c(cc(cn1)Br)F AB65410 [0,1,0,0,0,0|3,0,0]=4 405 B9R1.69 Cc1c(cc(cn1)Br)N PB18946 [0,1,0,0,0,0|3,0,0]=4 406 B9R1.69 Cc1c(cc(cn1)Cl)N PB22604 [0,1,0,0,0,0|3,0,0]=4 407 B9R1.69 Cc1c(cc(cn1)F)N AB73550 [0,1,0,0,0,0|3,0,0]=4 408 B9R1.69 Cc1c(cc(cn1)N)Br PB15954 [0,1,0,0,0,0|3,0,0]=4 409 B9R1.69 Cc1c(cc(cn1)N)Cl AB62794 [0,1,0,0,0,0|3,0,0]=4 410 B9R1.69 Cc1c(cc(cn1)N)F AB73533 [0,1,0,0,0,0|3,0,0]=4 411 B9R1.69 Cc1c(cc(cn1)O)Cl AB71195 [0,1,0,0,0,0|3,0,0]=4 412 B9R1.69 Cc1c(cc(cn1)O)F AB71314 [0,1,0,0,0,0|3,0,0]=4 413 B9R1.69 Cc1c(ccc(n1)Br)Cl AB63580 [0,1,0,0,0,0|2,0,0]=3 414 B9R1.69 Cc1c(ccc(n1)Br)F AB13446 [0,1,0,0,0,0|2,0,0]=3 415 B9R1.69 Cc1c(ccc(n1)Br)N PB20014 [0,1,0,0,0,0|2,0,0]=3 416 B9R1.69 Cc1c(ccc(n1)Cl)Br AB41208 [0,1,0,0,0,0|2,0,0]=3 417 B9R1.69 Cc1c(ccc(n1)Cl)N PB20018 [0,1,0,0,0,0|2,0,0]=3 418 B9R1.69 Cc1c(ccc(n1)F)Br AB13479 [0,1,0,0,0,0|2,0,0]=3 419 B9R1.69 Cc1c(ccc(n1)I)Br MB09866 [0,1,0,0,0,0|2,0,0]=3 420 B9R1.69 Cc1c(ccc(n1)N)Br AB02783 [0,1,0,0,0,0|2,0,0]=3 421 B9R1.69 Cc1c(ccc(n1)N)Cl AB50593 [0,1,0,0,0,0|2,0,0]=3 422 B9R1.69 Cc1c(ccc(n1)N)F AB53307 [0,1,0,0,0,0|2,0,0]=3 423 B9R1.69 Cc1c(ccc(n1)N)I AB20800 [0,1,0,0,0,0|2,0,0]=3 424 B9R1.69 Cc1c(ccc(n1)O)Br AB15079 [0,1,0,0,0,0|2,0,0]=3 425 B9R1.69 Cc1c(ccc(n1)O)Cl AB71196 [0,1,0,0,0,0|2,0,0]=3 426 B9R1.69 Cc1c(ccc(n1)O)F AB71316 [0,1,0,0,0,0|2,0,0]=3 427 B9R1.69 Cc1c(ccc(n1)O)N AB41212 [0,1,0,0,0,0|2,0,0]=3 428 B9R1.69 Cc1c(cnc(n1)C)Br AB70482 [0,1,0,0,0,0|2,0,0]=3 429 B9R1.69 Cc1c(cnc(n1)Cl)Br AB70433 [0,1,0,0,0,0|3,0,0]=4 430 B9R1.69 Cc1c(cnc(n1)Cl)N AB66433 [0,1,0,0,0,0|3,0,0]=4 431 B9R1.69 Cc1c(nc(cn1)Br)N AB85726 [0,1,0,0,0,0|2,0,0]=3 432 B9R1.69 Cc1c(nc(cn1)Cl)C AB68573 [0,1,0,0,0,0|1,0,0]=2 433 B9R1.69 Cc1c(nc(cn1)N)Br CB11882 [0,1,0,0,0,0|2,0,0]=3 434 B9R1.69 Cc1c(nc(cn1)N)C AB53106 [0,1,0,0,0,0|1,0,0]=2 435 B9R1.69 Cc1c(ncc(n1)Br)Br AB72476 [0,1,0,0,0,0|1,0,0]=2 436 B9R1.69 Cc1c(ncc(n1)Br)Cl AB72492 [0,1,0,0,0,0|1,0,0]=2 437 B9R1.69 Cc1c(ncc(n1)Br)I AB72495 [0,1,0,0,0,0|1,0,0]=2 438 B9R1.69 Cc1c(ncc(n1)Br)N AB48639 [0,1,0,0,0,0|1,0,0]=2 439 B9R1.69 Cc1c(ncc(n1)Br)O AB85718 [0,1,0,0,0,0|1,0,0]=2 440 B9R1.69 Cc1c(ncc(n1)Cl)Br AB72477 [0,1,0,0,0,0|1,0,0]=2 441 B9R1.69 Cc1c(ncc(n1)Cl)Cl AB70649 [0,1,0,0,0,0|1,0,0]=2 442 B9R1.69 Cc1c(ncc(n1)Cl)F AB85699 [0,1,0,0,0,0|1,0,0]=2 443 B9R1.69 Cc1c(ncc(n1)Cl)I AB72504 [0,1,0,0,0,0|1,0,0]=2 444 B9R1.69 Cc1c(ncc(n1)Cl)N AB54525 [0,1,0,0,0,0|1,0,0]=2 445 B9R1.69 Cc1c(ncc(n1)F)Br AB85703 [0,1,0,0,0,0|1,0,0]=2 446 B9R1.69 Cc1c(ncc(n1)F)Cl AB85700 [0,1,0,0,0,0|1,0,0]=2 447 B9R1.69 Cc1c(ncc(n1)I)Br AB72480 [0,1,0,0,0,0|1,0,0]=2 448 B9R1.69 Cc1c(ncc(n1)N)Br AB48621 [0,1,0,0,0,0|1,0,0]=2 449 B9R1.69 Cc1c(nnc(n1)C)Cl AB72440 [0,1,0,0,0,0|1,0,0]=2 450 B9R1.69 Cc1c(nnc(n1)Cl)Cl AB72423 [0,1,0,0,0,0|2,0,0]=3 451 B9R1.69 Cc1cc(c(nc1)Br)C AB05204 [0,1,0,0,0,0|1,0,0]=2 452 B9R1.69 Cc1cc(c(nc1)Br)Cl AB53543 [0,1,0,0,0,0|2,0,0]=3 453 B9R1.69 Cc1cc(c(nc1)Br)F AB55034 [0,1,0,0,0,0|2,0,0]=3 454 B9R1.69 Cc1cc(c(nc1)C)Br AB05199 [0,1,0,0,0,0|2,0,0]=3 455 B9R1.69 Cc1cc(c(nc1)C)N AB66586 [0,1,0,0,0,0|2,0,0]=3 456 B9R1.69 Cc1cc(c(nc1)C)O AB65617 [0,1,0,0,0,0|2,0,0]=3 457 B9R1.69 Cc1cc(c(nc1)Cl)Br AB09970 [0,1,0,0,0,0|2,0,0]=3 458 B9R1.69 Cc1cc(c(nc1)Cl)N AB15085 [0,1,0,0,0,0|2,0,0]=3 459 B9R1.69 Cc1cc(c(nc1)Cl)O AB53552 [0,1,0,0,0,0|2,0,0]=3 460 B9R1.69 Cc1cc(c(nc1)F)Br AB13665 [0,1,0,0,0,0|2,0,0]=3 461 B9R1.69 Cc1cc(c(nc1)F)N AB66726 [0,1,0,0,0,0|2,0,0]=3 462 B9R1.69 Cc1cc(c(nc1)F)O AB71300 [0,1,0,0,0,0|2,0,0]=3 463 B9R1.69 Cc1cc(c(nc1)N)Br AB02784 [0,1,0,0,0,0|2,0,0]=3 464 B9R1.69 Cc1cc(c(nc1)N)C AB62796 [0,1,0,0,0,0|1,0,0]=2 465 B9R1.69 Cc1cc(c(nc1)N)Cl AB32106 [0,1,0,0,0,0|2,0,0]=3 466 B9R1.69 Cc1cc(c(nc1)N)F AB66724 [0,1,0,0,0,0|2,0,0]=3 467 B9R1.69 Cc1cc(c(nc1)N)N AB16874 [0,1,0,0,0,0|2,0,0]=3 468 B9R1.69 Cc1cc(c(nc1)O)Br AB16221 [0,1,0,0,0,0|2,0,0]=3 469 B9R1.69 Cc1cc(c(nc1)O)C AB71284 [0,1,0,0,0,0|1,0,0]=2 470 B9R1.69 Cc1cc(c(nc1)O)Cl AB70490 [0,1,0,0,0,0|2,0,0]=3 471 B9R1.69 Cc1cc(c(nc1)O)F AB71311 [0,1,0,0,0,0|2,0,0]=3 472 B9R1.69 Cc1cc(c(nc1)O)N AB53563 [0,1,0,0,0,0|2,0,0]=3 473 B9R1.69 Cc1cc(ccc1I)O MB06793 [0,1,0,0,0,0|3,0,0]=4 474 B9R1.69 Cc1cc(cnc1Br)Br AB10779 [0,1,0,0,0,0|2,0,0]=3 475 B9R1.69 Cc1cc(cnc1Br)Cl AB13444 [0,1,0,0,0,0|2,0,0]=3 476 B9R1.69 Cc1cc(cnc1Br)F AB53312 [0,1,0,0,0,0|2,0,0]=3 477 B9R1.69 Cc1cc(cnc1Br)N AB13464 [0,1,0,0,0,0|2,0,0]=3 478 B9R1.69 Cc1cc(cnc1Br)O AB53545 [0,1,0,0,0,0|2,0,0]=3 479 B9R1.69 Cc1cc(cnc1C)Br AB64498 [0,1,0,0,0,0|2,0,0]=3 480 B9R1.69 Cc1cc(cnc1C)Cl AB75734 [0,1,0,0,0,0|2,0,0]=3 481 B9R1.69 Cc1cc(cnc1C)N AB42833 [0,1,0,0,0,0|2,0,0]=3 482 B9R1.69 Cc1cc(cnc1C)O AB65534 [0,1,0,0,0,0|2,0,0]=3 483 B9R1.69 Cc1cc(cnc1Cl)Cl AB16614 [0,1,0,0,0,0|2,0,0]=3 484 B9R1.69 Cc1cc(cnc1Cl)F AB21234 [0,1,0,0,0,0|2,0,0]=3 485 B9R1.69 Cc1cc(cnc1Cl)I CB11216 [0,1,0,0,0,0|2,0,0]=3 486 B9R1.69 Cc1cc(cnc1Cl)N AB13470 [0,1,0,0,0,0|2,0,0]=3 487 B9R1.69 Cc1cc(cnc1Cl)O PB31577 [0,1,0,0,0,0|2,0,0]=3 488 B9R1.69 Cc1cc(cnc1F)Br AB13475 [0,1,0,0,0,0|2,0,0]=3 489 B9R1.69 Cc1cc(cnc1F)Cl AB13483 [0,1,0,0,0,0|2,0,0]=3 490 B9R1.69 Cc1cc(cnc1F)N AB13474 [0,1,0,0,0,0|2,0,0]=3 491 B9R1.69 Cc1cc(cnc1F)O AB53562 [0,1,0,0,0,0|2,0,0]=3 492 B9R1.69 Cc1cc(cnc1I)Br AB42361 [0,1,0,0,0,0|2,0,0]=3 493 B9R1.69 Cc1cc(cnc1I)Cl AB75751 [0,1,0,0,0,0|2,0,0]=3 494 B9R1.69 Cc1cc(cnc1N)Br AB02787 [0,1,0,0,0,0|2,0,0]=3 495 B9R1.69 Cc1cc(cnc1N)Cl AB03635 [0,1,0,0,0,0|2,0,0]=3 496 B9R1.69 Cc1cc(cnc1N)F AB41238 [0,1,0,0,0,0|2,0,0]=3 497 B9R1.69 Cc1cc(cnc1N)I AB10923 [0,1,0,0,0,0|2,0,0]=3 498 B9R1.69 Cc1cc(cnc1O)Br AB15087 [0,1,0,0,0,0|2,0,0]=3 499 B9R1.69 Cc1cc(cnc1O)Cl AB03537 [0,1,0,0,0,0|2,0,0]=3 500 B9R1.69 Cc1cc(cnc1O)F AB82901 [0,1,0,0,0,0|2,0,0]=3 501 B9R1.69 Cc1cc(cnc1O)I CB10781 [0,1,0,0,0,0|2,0,0]=3 502 B9R1.69 Cc1cc(cnc1O)N AB41215 [0,1,0,0,0,0|2,0,0]=3 503 B9R1.69 Cc1cc(ncc1Br)C AB53714 [0,1,0,0,0,0|3,0,0]=4 504 B9R1.69 Cc1cc(ncc1N)C AB41994 [0,1,0,0,0,0|3,0,0]=4 505 B9R1.69 Cc1cc(ncc1O)C AB44457 [0,1,0,0,0,0|3,0,0]=4 506 B9R1.69 Cc1cc(nnc1Cl)C PB31877 [0,1,0,0,0,0|2,0,0]=3 507 B9R1.69 Cc1cc(nnc1Cl)Cl PB23168 [0,1,0,0,0,0|3,0,0]=4 508 B9R1.69 Cc1cc(nnc1O)O PB15638 [0,1,0,0,0,0|3,0,0]=4 509 B9R1.69 Cc1ccc(c(c1)Br)S AB16734 [0,1,0,0,0,0|3,0,0]=4 510 B9R1.69 Cc1ccc(c(c1)F)Br AB01835 [0,1,0,0,0,0|3,0,0]=4 511 B9R1.69 Cc1ccc(c(c1)I)O MB00839 [0,1,0,0,0,0|3,0,0]=4 512 B9R1.69 Cc1ccc(c(c1)N)Br AB09930 [0,1,0,0,0,0|3,0,0]=4 513 B9R1.69 Cc1ccc(c(c1)O)Br MB09252 [0,1,0,0,0,0|3,0,0]=4 514 B9R1.69 Cc1ccc(c(c1)O)I MB23426 [0,1,0,0,0,0|3,0,0]=4 515 B9R1.69 Cc1ccc(c(c1)O)N AB00890 [0,1,0,0,0,0|3,0,0]=4 516 B9R1.69 Cc1ccc(c(n1)Br)N AB13459 [0,1,0,0,0,0|2,0,0]=3 517 B9R1.69 Cc1ccc(c(n1)Br)O PB10360 [0,1,0,0,0,0|2,0,0]=3 518 B9R1.69 Cc1ccc(c(n1)C)Br AB05311 [0,1,0,0,0,0|1,0,0]=2 519 B9R1.69 Cc1ccc(c(n1)Cl)Br AB13590 [0,1,0,0,0,0|2,0,0]=3 520 B9R1.69 Cc1ccc(c(n1)Cl)N AB13580 [0,1,0,0,0,0|2,0,0]=3 521 B9R1.69 Cc1ccc(c(n1)Cl)O AB42392 [0,1,0,0,0,0|2,0,0]=3 522 B9R1.69 Cc1ccc(c(n1)F)N AB13597 [0,1,0,0,0,0|2,0,0]=3 523 B9R1.69 Cc1ccc(c(n1)N)Br AB13584 [0,1,0,0,0,0|2,0,0]=3 524 B9R1.69 Cc1ccc(c(n1)N)Cl AB41203 [0,1,0,0,0,0|2,0,0]=3 525 B9R1.69 Cc1ccc(c(n1)N)N AB15083 [0,1,0,0,0,0|2,0,0]=3 526 B9R1.69 Cc1ccc(c(n1)N)O AB53537 [0,1,0,0,0,0|2,0,0]=3 527 B9R1.69 Cc1ccc(c(n1)O)Br AB13586 [0,1,0,0,0,0|2,0,0]=3 528 B9R1.69 Cc1ccc(c(n1)O)Cl AB41205 [0,1,0,0,0,0|2,0,0]=3 529 B9R1.69 Cc1ccc(nc1Br)Br AB16615 [0,1,0,0,0,0|3,0,0]=4 530 B9R1.69 Cc1ccc(nc1Br)C AB65454 [0,1,0,0,0,0|2,0,0]=3 531 B9R1.69 Cc1ccc(nc1Br)Cl AB62917 [0,1,0,0,0,0|3,0,0]=4 532 B9R1.69 Cc1ccc(nc1Br)F AB71569 [0,1,0,0,0,0|3,0,0]=4 533 B9R1.69 Cc1ccc(nc1C)Br AB64947 [0,1,0,0,0,0|2,0,0]=3 534 B9R1.69 Cc1ccc(nc1C)N AB23050 [0,1,0,0,0,0|2,0,0]=3 535 B9R1.69 Cc1ccc(nc1C)O AB54521 [0,1,0,0,0,0|2,0,0]=3 536 B9R1.69 Cc1ccc(nc1Cl)Br AB74690 [0,1,0,0,0,0|3,0,0]=4 537 B9R1.69 Cc1ccc(nc1Cl)N AB70428 [0,1,0,0,0,0|3,0,0]=4 538 B9R1.69 Cc1ccc(nc1Cl)O AB71186 [0,1,0,0,0,0|3,0,0]=4 539 B9R1.69 Cc1ccc(nc1F)Br AB74556 [0,1,0,0,0,0|3,0,0]=4 540 B9R1.69 Cc1ccc(nc1F)N AB83080 [0,1,0,0,0,0|3,0,0]=4 541 B9R1.69 Cc1ccc(nc1F)O AB71306 [0,1,0,0,0,0|3,0,0]=4 542 B9R1.69 Cc1ccc(nc1N)Br AB71668 [0,1,0,0,0,0|3,0,0]=4 543 B9R1.69 Cc1ccc(nc1N)C AB25382 [0,1,0,0,0,0|2,0,0]=3 544 B9R1.69 Cc1ccc(nc1N)Cl AB73562 [0,1,0,0,0,0|3,0,0]=4 545 B9R1.69 Cc1ccc(nc1N)F AB82883 [0,1,0,0,0,0|3,0,0]=4 546 B9R1.69 Cc1ccc(nc1N)N AB43423 [0,1,0,0,0,0|3,0,0]=4 547 B9R1.69 Cc1ccc(nc1O)C AB71286 [0,1,0,0,0,0|2,0,0]=3 548 B9R1.69 Cc1ccc(nc1O)Cl AB75750 [0,1,0,0,0,0|3,0,0]=4 549 B9R1.69 Cc1ccc(nc1O)F AB82880 [0,1,0,0,0,0|3,0,0]=4 550 B9R1.69 Cc1cnc(c(n1)Br)C AB65522 [0,1,0,0,0,0|1,0,0]=2 551 B9R1.69 Cc1cnc(c(n1)Br)N CB11261 [0,1,0,0,0,0|1,0,0]=2 552 B9R1.69 Cc1cnc(c(n1)C)Br AB73101 [0,1,0,0,0,0|0,0,0]=1 553 B9R1.69 Cc1cnc(c(n1)C)Cl AB03542 [0,1,0,0,0,0|0,0,0]=1 554 B9R1.69 Cc1cnc(c(n1)C)N AB03436 [0,1,0,0,0,0|0,0,0]=1 555 B9R1.69 Cc1cnc(c(n1)Cl)C AB00609 [0,1,0,0,0,0|1,0,0]=2 556 B9R1.69 Cc1cnc(nc1Cl)C AB51539 [0,1,0,0,0,0|3,0,0]=4 557 B9R1.69 Cc1cnc(nc1N)C AB54986 [0,1,0,0,0,0|3,0,0]=4 558 B9R1.69 Cc1cnc(nc1O)C AB21544 [0,1,0,0,0,0|3,0,0]=4 559 B9R1.69 Cc1ncc(c(n1)Cl)F AB52955 [0,1,0,0,0,0|3,0,0]=4 560 B9R1.69 Cc1ncc(c(n1)N)N AB70427 [0,1,0,0,0,0|3,0,0]=4 561 B9R1.69 Cc1ncc(c(n1)O)F AB04979 [0,1,0,0,0,0|3,0,0]=4 562 B9R1.69 Cn1c(=O)ccc(n1)Cl MB02254 [0,1,0,0,0,0|3,0,0]=4 563 B9R1.69 c1(c(nnc(n1)Cl)Br)Cl AB72409 [0,1,0,0,0,0|3,0,0]=4 564 B9R1.69 c1(c(nnc(n1)Cl)Cl)Cl AB49394 [0,1,0,0,0,0|3,0,0]=4 565 B9R1.69 c1(c(nnc(n1)Cl)Cl)N AB72421 [0,1,0,0,0,0|3,0,0]=4 566 B9R1.69 c1(c(nnc(n1)N)Br)N AB44313 [0,1,0,0,0,0|3,0,0]=4 567 B9R1.69 c1(c(nnc(n1)O)Br)O AB03586 [0,1,0,0,0,0|3,0,0]=4 568 B9R1.69 c1c(cnc(c1Br)Cl)Cl AB25941 [0,1,0,0,0,0|3,0,0]=4 569 B9R1.69 c1c(cnc(c1Br)Cl)F AB13638 [0,1,0,0,0,0|3,0,0]=4 570 B9R1.69 c1c(cnc(c1Br)Cl)N CB10761 [0,1,0,0,0,0|3,0,0]=4 571 B9R1.69 c1c(cnc(c1Br)Cl)O CB11311 [0,1,0,0,0,0|3,0,0]=4 572 B9R1.69 c1c(cnc(c1Br)F)Cl AB20989 [0,1,0,0,0,0|3,0,0]=4 573 B9R1.69 c1c(cnc(c1Br)I)Cl AB64692 [0,1,0,0,0,0|3,0,0]=4 574 B9R1.69 c1c(cnc(c1Br)N)Br AB01699 [0,1,0,0,0,0|3,0,0]=4 575 B9R1.69 c1c(cnc(c1Br)N)Cl AB07737 [0,1,0,0,0,0|3,0,0]=4 576 B9R1.69 c1c(cnc(c1Br)N)I AB44276 [0,1,0,0,0,0|3,0,0]=4 577 B9R1.69 c1c(cnc(c1Br)O)Br AB01360 [0,1,0,0,0,0|3,0,0]=4 578 B9R1.69 c1c(cnc(c1Br)O)Cl AB09921 [0,1,0,0,0,0|3,0,0]=4 579 B9R1.69 c1c(cnc(c1Cl)Br)Br PB18868 [0,1,0,0,0,0|3,0,0]=4 580 B9R1.69 c1c(cnc(c1Cl)Br)Cl AB05062 [0,1,0,0,0,0|3,0,0]=4 581 B9R1.69 c1c(cnc(c1Cl)Br)F AB66730 [0,1,0,0,0,0|3,0,0]=4 582 B9R1.69 c1c(cnc(c1Cl)Cl)I PB23692 [0,1,0,0,0,0|3,0,0]=4 583 B9R1.69 c1c(cnc(c1Cl)F)Br AB52757 [0,1,0,0,0,0|3,0,0]=4 584 B9R1.69 c1c(cnc(c1Cl)F)N AB75047 [0,1,0,0,0,0|3,0,0]=4 585 B9R1.69 c1c(cnc(c1Cl)F)O AB43291 [0,1,0,0,0,0|3,0,0]=4 586 B9R1.69 c1c(cnc(c1Cl)N)Br AB63574 [0,1,0,0,0,0|3,0,0]=4 587 B9R1.69 c1c(cnc(c1Cl)N)Cl AB00689 [0,1,0,0,0,0|3,0,0]=4 588 B9R1.69 c1c(cnc(c1Cl)N)F AB50026 [0,1,0,0,0,0|3,0,0]=4 589 B9R1.69 c1c(cnc(c1Cl)N)N AB70626 [0,1,0,0,0,0|3,0,0]=4 590 B9R1.69 c1c(cnc(c1Cl)O)Br AB05076 [0,1,0,0,0,0|3,0,0]=4 591 B9R1.69 c1c(cnc(c1Cl)O)Cl AB03534 [0,1,0,0,0,0|3,0,0]=4 592 B9R1.69 c1c(cnc(c1Cl)O)F AB66743 [0,1,0,0,0,0|3,0,0]=4 593 B9R1.69 c1c(cnc(c1Cl)O)N AB76242 [0,1,0,0,0,0|3,0,0]=4 594 B9R1.69 c1c(cnc(c1Cl)O)O AB71133 [0,1,0,0,0,0|3,0,0]=4 595 B9R1.69 c1c(cnc(c1F)Br)Cl AB62913 [0,1,0,0,0,0|3,0,0]=4 596 B9R1.69 c1c(cnc(c1F)Cl)Br AB14161 [0,1,0,0,0,0|3,0,0]=4 597 B9R1.69 c1c(cnc(c1F)Cl)N AB75042 [0,1,0,0,0,0|3,0,0]=4 598 B9R1.69 c1c(cnc(c1F)Cl)O AB14157 [0,1,0,0,0,0|3,0,0]=4 599 B9R1.69 c1c(cnc(c1F)I)Br AB73520 [0,1,0,0,0,0|3,0,0]=4 600 B9R1.69 c1c(cnc(c1F)N)Cl AB53928 [0,1,0,0,0,0|3,0,0]=4 601 B9R1.69 c1c(cnc(c1F)O)Br AB40961 [0,1,0,0,0,0|3,0,0]=4 602 B9R1.69 c1c(cnc(c1F)O)Cl AB41032 [0,1,0,0,0,0|3,0,0]=4 603 B9R1.69 c1c(cnc(c1I)Cl)Br AB48194 [0,1,0,0,0,0|3,0,0]=4 604 B9R1.69 c1c(cnc(c1I)Cl)F AB13622 [0,1,0,0,0,0|3,0,0]=4 605 B9R1.69 c1c(cnc(c1I)N)Br AB25852 [0,1,0,0,0,0|3,0,0]=4 606 B9R1.69 c1c(cnc(c1I)N)Cl AB42079 [0,1,0,0,0,0|3,0,0]=4 607 B9R1.69 c1c(cnc(c1I)N)F AB48199 [0,1,0,0,0,0|3,0,0]=4 608 B9R1.69 c1c(cnc(c1I)O)Br AB48195 [0,1,0,0,0,0|3,0,0]=4 609 B9R1.69 c1c(cnc(c1N)Br)Br PB32717 [0,1,0,0,0,0|3,0,0]=4 610 B9R1.69 c1c(cnc(c1N)Br)F AB21745 [0,1,0,0,0,0|3,0,0]=4 611 B9R1.69 c1c(cnc(c1N)Cl)Br PB21183 [0,1,0,0,0,0|3,0,0]=4 612 B9R1.69 c1c(cnc(c1N)Cl)Cl AB04748 [0,1,0,0,0,0|3,0,0]=4 613 B9R1.69 c1c(cnc(c1N)Cl)F AB44890 [0,1,0,0,0,0|3,0,0]=4 614 B9R1.69 c1c(cnc(c1N)Cl)I AB17086 [0,1,0,0,0,0|3,0,0]=4 615 B9R1.69 c1c(cnc(c1N)Cl)N AB51565 [0,1,0,0,0,0|3,0,0]=4 616 B9R1.69 c1c(cnc(c1N)Cl)O AB70860 [0,1,0,0,0,0|3,0,0]=4 617 B9R1.69 c1c(cnc(c1N)F)Cl AB25964 [0,1,0,0,0,0|3,0,0]=4 618 B9R1.69 c1c(cnc(c1N)N)Br PB10156 [0,1,0,0,0,0|3,0,0]=4 619 B9R1.69 c1c(cnc(c1N)N)Cl AB08400 [0,1,0,0,0,0|3,0,0]=4 620 B9R1.69 c1c(cnc(c1N)N)I AB60257 [0,1,0,0,0,0|3,0,0]=4 621 B9R1.69 c1c(cnc(c1N)O)Br AB16428 [0,1,0,0,0,0|3,0,0]=4 622 B9R1.69 c1c(cnc(c1N)O)Cl AB40990 [0,1,0,0,0,0|3,0,0]=4 623 B9R1.69 c1c(cnc(c1N)O)N AB64414 [0,1,0,0,0,0|3,0,0]=4 624 B9R1.69 c1c(cnc(c1N)S)Br AB40982 [0,1,0,0,0,0|3,0,0]=4 625 B9R1.69 c1c(cnc(c1N)S)Cl AB41057 [0,1,0,0,0,0|3,0,0]=4 626 B9R1.69 c1c(cnc(c1O)Br)F MB09912 [0,1,0,0,0,0|3,0,0]=4 627 B9R1.69 c1c(cnc(c1O)Cl)Br PB17565 [0,1,0,0,0,0|3,0,0]=4 628 B9R1.69 c1c(cnc(c1O)Cl)Cl AB66760 [0,1,0,0,0,0|3,0,0]=4 629 B9R1.69 c1c(cnc(c1O)Cl)F AB13634 [0,1,0,0,0,0|3,0,0]=4 630 B9R1.69 c1c(cnc(c1O)Cl)N AB76704 [0,1,0,0,0,0|3,0,0]=4 631 B9R1.69 c1c(cnc(c1O)Cl)O AB71129 [0,1,0,0,0,0|3,0,0]=4 632 B9R1.69 c1c(nc(c(n1)Br)Cl)Br AB72488 [0,1,0,0,0,0|2,0,0]=3 633 B9R1.69 c1c(nc(c(n1)Br)Cl)I AB72490 [0,1,0,0,0,0|2,0,0]=3 634 B9R1.69 c1c(nc(c(n1)Br)Cl)N PB28090 [0,1,0,0,0,0|2,0,0]=3 635 B9R1.69 c1c(nc(c(n1)Br)N)Br PB11968 [0,1,0,0,0,0|2,0,0]=3 636 B9R1.69 c1c(nc(c(n1)Br)N)Cl PB25331 [0,1,0,0,0,0|2,0,0]=3 637 B9R1.69 c1c(nc(c(n1)Cl)Br)Br PB28518 [0,1,0,0,0,0|2,0,0]=3 638 B9R1.69 c1c(nc(c(n1)Cl)Cl)N AB76542 [0,1,0,0,0,0|2,0,0]=3 639 B9R1.69 c1c(nc(c(n1)Cl)N)Cl AB70503 [0,1,0,0,0,0|2,0,0]=3 640 B9R1.69 c1c(nc(c(n1)I)Cl)Cl AB69264 [0,1,0,0,0,0|2,0,0]=3 641 B9R1.69 c1c(nc(c(n1)N)Br)Br PB10167 [0,1,0,0,0,0|2,0,0]=3 642 B9R1.69 c1c(nc(c(n1)N)Br)Cl AB54749 [0,1,0,0,0,0|2,0,0]=3 643 B9R1.69 c1c(nc(c(n1)N)Cl)Br PB34579 [0,1,0,0,0,0|2,0,0]=3 644 B9R1.69 c1c(nc(c(n1)N)Cl)Cl AB62777 [0,1,0,0,0,0|2,0,0]=3 645 B9R1.69 c1c(nc(c(n1)N)Cl)I PB36564 [0,1,0,0,0,0|2,0,0]=3 646 B9R1.69 c1c(nc(c(n1)N)N)Br PB20156 [0,1,0,0,0,0|2,0,0]=3 647 B9R1.69 c1c(nc(c(n1)N)N)Cl AB71823 [0,1,0,0,0,0|2,0,0]=3 648 B9R1.69 c1cc(nc(c1Br)Cl)I AB73525 [0,1,0,0,0,0|3,0,0]=4 649 B9R1.69 c1cc(nc(c1Br)F)I AB73526 [0,1,0,0,0,0|3,0,0]=4 650 B9R1.69 c1cc(nc(c1Br)I)N CB11794 [0,1,0,0,0,0|3,0,0]=4 651 B9R1.69 c1cc(nc(c1Br)N)Br AB13816 [0,1,0,0,0,0|3,0,0]=4 652 B9R1.69 c1cc(nc(c1Br)N)Cl AB68223 [0,1,0,0,0,0|3,0,0]=4 653 B9R1.69 c1cc(nc(c1Br)N)N PB14375 [0,1,0,0,0,0|3,0,0]=4 654 B9R1.69 c1cc(nc(c1Cl)F)Br AB74962 [0,1,0,0,0,0|3,0,0]=4 655 B9R1.69 c1cc(nc(c1Cl)F)N AB74549 [0,1,0,0,0,0|3,0,0]=4 656 B9R1.69 c1cc(nc(c1Cl)F)O AB71143 [0,1,0,0,0,0|3,0,0]=4 657 B9R1.69 c1cc(nc(c1Cl)N)Br AB68234 [0,1,0,0,0,0|3,0,0]=4 658 B9R1.69 c1cc(nc(c1Cl)N)Cl AB06148 [0,1,0,0,0,0|3,0,0]=4 659 B9R1.69 c1cc(nc(c1Cl)N)N AB03196 [0,1,0,0,0,0|3,0,0]=4 660 B9R1.69 c1cc(nc(c1Cl)N)O AB83953 [0,1,0,0,0,0|3,0,0]=4 661 B9R1.69 c1cc(nc(c1Cl)O)Br AB84077 [0,1,0,0,0,0|3,0,0]=4 662 B9R1.69 c1cc(nc(c1Cl)O)Cl AB10185 [0,1,0,0,0,0|3,0,0]=4 663 B9R1.69 c1cc(nc(c1Cl)O)N AB84080 [0,1,0,0,0,0|3,0,0]=4 664 B9R1.69 c1cc(nc(c1Cl)O)O AB84078 [0,1,0,0,0,0|3,0,0]=4 665 B9R1.69 c1cc(nc(c1F)Br)Cl AB74954 [0,1,0,0,0,0|3,0,0]=4 666 B9R1.69 c1cc(nc(c1F)Cl)Br AB74951 [0,1,0,0,0,0|3,0,0]=4 667 B9R1.69 c1cc(nc(c1F)Cl)N AB75035 [0,1,0,0,0,0|3,0,0]=4 668 B9R1.69 c1cc(nc(c1F)Cl)O AB71136 [0,1,0,0,0,0|3,0,0]=4 669 B9R1.69 c1cc(nc(c1F)N)Cl AB73059 [0,1,0,0,0,0|3,0,0]=4 670 B9R1.69 c1cc(nc(c1F)O)Cl AB83102 [0,1,0,0,0,0|3,0,0]=4 671 B9R1.69 c1cc(nc(c1N)Br)Br PB17118 [0,1,0,0,0,0|3,0,0]=4 672 B9R1.69 c1cc(nc(c1N)Br)Cl PB34600 [0,1,0,0,0,0|3,0,0]=4 673 B9R1.69 c1cc(nc(c1N)Cl)Br AB20901 [0,1,0,0,0,0|3,0,0]=4 674 B9R1.69 c1cc(nc(c1N)Cl)Cl AB01354 [0,1,0,0,0,0|3,0,0]=4 675 B9R1.69 c1cc(nc(c1N)Cl)N AB83963 [0,1,0,0,0,0|3,0,0]=4 676 B9R1.69 c1cc(nc(c1N)Cl)O AB70861 [0,1,0,0,0,0|3,0,0]=4 677 B9R1.69 c1cc(nc(c1N)N)Br AB60264 [0,1,0,0,0,0|3,0,0]=4 678 B9R1.69 c1cc(nc(c1N)N)Cl PB14154 [0,1,0,0,0,0|3,0,0]=4 679 B9R1.69 c1cc(nc(c1N)N)F AB66676 [0,1,0,0,0,0|3,0,0]=4 680 B9R1.69 c1cc(nc(c1N)N)N AB03630 [0,1,0,0,0,0|3,0,0]=4 681 B9R1.69 c1cc(nc(c1N)O)Br AB26870 [0,1,0,0,0,0|3,0,0]=4 682 B9R1.69 c1cc(nc(c1O)Cl)Br AB64867 [0,1,0,0,0,0|3,0,0]=4 683 B9R1.69 c1cc(nc(c1O)Cl)Cl AB62926 [0,1,0,0,0,0|3,0,0]=4 684 B9R1.69 c1cc(nc(c1O)Cl)N AB84093 [0,1,0,0,0,0|3,0,0]=4 685 B9R1.69 c1cc(nc(c1O)Cl)O AB71131 [0,1,0,0,0,0|3,0,0]=4 686 B9R1.69 c1cc(nc(c1O)N)Br AB63559 [0,1,0,0,0,0|3,0,0]=4 687 B9R1.69 c1cc(nc(c1O)N)Cl AB69334 [0,1,0,0,0,0|3,0,0]=4 688 B7R1.2 C1=NC(=NC1Br)Br AB11297 [0,0,0,0,1,0|2,0,1]=4 689 B7R1.2 CC1=NC(=NC1)Br AB26590 [0,0,0,0,1,0|1,0,1]=3 690 B7R1.2 CC1=NC(=NC1)Cl AB53096 [0,0,0,0,1,0|1,0,1]=3 691 B7R1.2 CC1=NC(=NC1)N AB27175 [0,0,0,0,1,0|1,0,1]=3 692 B7R1.2 CC1=NC(=NC1)N AB27178 [0,0,0,0,1,0|1,0,1]=3 693 B7R1.2 CC1=NC(=O)N=C1 AB05017 [0,0,0,0,1,0|1,0,0]=2 694 B7R1.2 CC1=NN=C(C1)Br AB63797 [0,0,0,0,1,0|3,0,0]=4 695 B7R1.2 CC1=NN=C(C1)Cl PB14164 [0,0,0,0,1,0|3,0,0]=4 696 B7R1.2 CC1=NN=C(C1)N PB33812 [0,0,0,0,1,0|3,0,0]=4 697 B7R1.2 Cc1[nH]c(cn1)Cl AB58131 [0,0,0,0,1,0|1,0,1]=3 698 B7R1.2 Cc1[nH]c(nn1)S AB06112 [0,0,0,0,1,0|2,0,1]=4 699 B7R1.2 Cc1[nH]cc(n1)Br AB14336 [0,0,0,0,1,0|1,0,1]=3 700 B7R1.2 Cc1[nH]cc(n1)N AB60590 [0,0,0,0,1,0|1,0,1]=3 701 B7R1.2 Cc1[nH]nc(n1)C PB23188 [0,0,0,0,1,0|1,0,0]=2 702 B7R1.2 Cc1cc(cs1)Br AB20690 [0,0,0,0,1,0|3,0,0]=4 703 B7R1.2 Cc1cc(no1)N PB28932 [0,0,0,0,1,0|3,0,0]=4 704 B7R1.2 Cc1cc(on1)N MB00134 [0,0,0,0,1,0|3,0,0]=4 705 B7R1.2 Cc1cc(sc1)C CB10250 [0,0,0,0,1,0|2,0,0]=3 706 B7R1.2 Cc1ccc(o1)Br AB64979 [0,0,0,0,1,0|2,0,0]=3 707 B7R1.2 Cc1ccn(n1)C PB27396 [0,0,0,0,1,0|1,0,0]=2 708 B7R1.2 Cc1cnc(o1)Br AB71573 [0,0,0,0,1,0|2,0,0]=3 709 B7R1.2 Cc1cnc(o1)C AB72158 [0,0,0,0,1,0|1,0,0]=2 710 B7R1.2 Cc1cnc(o1)Cl AB53091 [0,0,0,0,1,0|2,0,0]=3 711 B7R1.2 Cc1cnc(o1)N AB52683 [0,0,0,0,1,0|2,0,0]=3 712 B7R1.2 Cc1cnc(o1)O AB53086 [0,0,0,0,1,0|2,0,0]=3 713 B7R1.2 Cc1cnc(s1)Br AB45716 [0,0,0,0,1,0|2,0,0]=3 714 B7R1.2 Cc1cnc(s1)Cl AB13892 [0,0,0,0,1,0|2,0,0]=3 715 B7R1.2 Cc1cnc(s1)N AB03001 [0,0,0,0,1,0|2,0,0]=3 716 B7R1.2 Cc1cnc(s1)O AB53102 [0,0,0,0,1,0|2,0,0]=3 717 B7R1.2 Cc1coc(n1)Br AB68303 [0,0,0,0,1,0|2,0,0]=3 718 B7R1.2 Cc1coc(n1)Cl AB68302 [0,0,0,0,1,0|2,0,0]=3 719 B7R1.2 Cc1coc(n1)N PB17112 [0,0,0,0,1,0|2,0,0]=3 720 B7R1.2 Cc1csc(n1)Br PB26224 [0,0,0,0,1,0|2,0,0]=3 721 B7R1.2 Cc1csc(n1)N AB00403 [0,0,0,0,1,0|2,0,0]=3 722 B7R1.2 Cc1nc(co1)N MB11373 [0,0,0,0,1,0|2,0,0]=3 723 B7R1.2 Cc1nc(cs1)Br AB23819 [0,0,0,0,1,0|2,0,0]=3 724 B7R1.2 Cc1nc(no1)Cl AB76625 [0,0,0,0,1,0|2,0,0]=3 725 B7R1.2 Cc1nc(no1)N AB44303 [0,0,0,0,1,0|2,0,0]=3 726 B7R1.2 Cc1nc(ns1)Cl AB76996 [0,0,0,0,1,0|2,0,0]=3 727 B7R1.2 Cc1nc(on1)C AB44073 [0,0,0,0,1,0|1,0,0]=2 728 B7R1.2 Cc1nc(on1)Cl AB44075 [0,0,0,0,1,0|2,0,0]=3 729 B7R1.2 Cc1nc(on1)N AB44302 [0,0,0,0,1,0|2,0,0]=3 730 B7R1.2 Cc1nc(on1)O AB50309 [0,0,0,0,1,0|2,0,0]=3 731 B7R1.2 Cc1nc(sn1)Cl MB05736 [0,0,0,0,1,0|2,0,0]=3 732 B7R1.2 Cc1ncc(o1)N MB11377 [0,0,0,0,1,0|2,0,0]=3 733 B7R1.2 Cc1ncc(s1)Br AB54339 [0,0,0,0,1,0|2,0,0]=3 734 B7R1.2 Cc1nnc(o1)N PB23353 [0,0,0,0,1,0|3,0,0]=4 735 B7R1.2 Cn1cc(cn1)Br PB34028 [0,0,0,0,1,0|3,0,0]=4 736 B7R1.2 Cn1cc(cn1)F AB68792 [0,0,0,0,1,0|3,0,0]=4 737 B7R1.2 Cn1cc(cn1)N PB29344 [0,0,0,0,1,0|3,0,0]=4 738 B7R1.2 Cn1cc(nc1)I PB23238 [0,0,0,0,1,0|3,0,0]=4 739 B7R1.2 Cn1cc(nc1)N AB11896 [0,0,0,0,1,0|3,0,0]=4 740 B7R1.2 Cn1ccc(c1)Br AB63663 [0,0,0,0,1,0|3,0,0]=4 741 B7R1.2 Cn1ccc(n1)Br PB19136 [0,0,0,0,1,0|2,0,0]=3 742 B7R1.2 Cn1ccc(n1)I PB26365 [0,0,0,0,1,0|2,0,0]=3 743 B7R1.2 Cn1ccc(n1)N PB12171 [0,0,0,0,1,0|2,0,0]=3 744 B7R1.2 c1([nH]nc(n1)Br)Br AB06324 [0,0,0,0,1,0|3,0,0]=4 745 B7R1.2 c1([nH]nc(n1)N)N MB00154 [0,0,0,0,1,0|3,0,0]=4 746 B7R1.2 c1(nc(ns1)Br)N CB11754 [0,0,0,0,1,0|3,0,0]=4 747 B7R1.2 c1(nc(on1)Cl)Cl AB44078 [0,0,0,0,1,0|3,0,0]=4 748 B7R1.2 c1(nc(sn1)Cl)Br AB07235 [0,0,0,0,1,0|3,0,0]=4 749 B7R1.2 c1(nc(sn1)Cl)N MB05740 [0,0,0,0,1,0|3,0,0]=4 750 B7R1.2 c1c(nc(s1)Br)Br AB08804 [0,0,0,0,1,0|3,0,0]=4 751 B7R1.2 c1c(nc(s1)Br)Cl MB14083 [0,0,0,0,1,0|3,0,0]=4 752 B7R1.2 c1c(nc(s1)Br)F MB14090 [0,0,0,0,1,0|3,0,0]=4 753 B7R1.2 c1c(nc(s1)Br)N MB09052 [0,0,0,0,1,0|3,0,0]=4 754 B7R1.2 c1c(nc(s1)Cl)Br MB07558 [0,0,0,0,1,0|3,0,0]=4 755 B7R1.2 c1c(nc(s1)F)Br MB14192 [0,0,0,0,1,0|3,0,0]=4 756 B7R1.2 c1c(nc(s1)N)Br AB30368 [0,0,0,0,1,0|3,0,0]=4 757 B7R1.2 c1c(sc(n1)Br)Cl PB17692 [0,0,0,0,1,0|3,0,0]=4 758 B7R1.2 c1c(sc(n1)Br)F PB13624 [0,0,0,0,1,0|3,0,0]=4 759 B7R1.2 c1c(sc(n1)Br)N AB53265 [0,0,0,0,1,0|3,0,0]=4 760 B7R1.2 c1c(sc(n1)Cl)Br MB14237 [0,0,0,0,1,0|3,0,0]=4 761 B7R1.2 c1c(sc(n1)Cl)Cl PB16960 [0,0,0,0,1,0|3,0,0]=4 762 B7R1.2 c1c(sc(n1)F)Br MB14245 [0,0,0,0,1,0|3,0,0]=4 763 B7R1.2 c1c(sc(n1)N)Cl PB27400 [0,0,0,0,1,0|3,0,0]=4 764 B7R1.2 c1c(sc(n1)N)F PB24037 [0,0,0,0,1,0|3,0,0]=4 765 B7R1.2 c1c(sc(n1)N)N AB53268 [0,0,0,0,1,0|3,0,0]=4 766 B7R1.4 C1=NC=C(C1F)F AB51492 [0,0,0,0,1,0|2,0,1]=4 767 B7R1.4 CC1=C(C=NC1)C PB27606 [0,0,0,0,1,0|0,0,1]=2 768 B7R1.4 CC1=C(N=NC1)Br PB11022 [0,0,0,0,1,0|2,0,1]=4 769 B7R1.4 CC1=C(N=NC1)N AB44283 [0,0,0,0,1,0|2,0,1]=4 770 B7R1.4 CC1=C(N=NC1)N AB72239 [0,0,0,0,1,0|2,0,1]=4 771 B7R1.4 CC1=NN=CC1Br CB10025 [0,0,0,0,1,0|2,0,1]=4 772 B7R1.4 CC1=NN=CC1N MB09907 [0,0,0,0,1,0|2,0,1]=4 773 B7R1.4 Cc1c(cco1)N AB71442 [0,0,0,0,1,0|3,0,0]=4 774 B7R1.4 Cc1c(cno1)N MB10128 [0,0,0,0,1,0|2,0,0]=3 775 B7R1.4 Cc1c(con1)N MB11367 [0,0,0,0,1,0|3,0,0]=4 776 B7R1.4 Cc1c(ocn1)C AB63543 [0,0,0,0,1,0|3,0,0]=4 777 B7R1.4 Cc1ccsc1Br PB25943 [0,0,0,0,1,0|3,0,0]=4 778 B7R1.4 Cc1cnoc1N MB11360 [0,0,0,0,1,0|2,0,0]=3 779 B7R1.4 Cc1conc1N MB11363 [0,0,0,0,1,0|3,0,0]=4 780 B7R1.4 Cn1c(cnn1)Br AB69597 [0,0,0,0,1,0|3,0,0]=4 781 B7R1.4 Cn1c(cnn1)I AB69606 [0,0,0,0,1,0|3,0,0]=4 782 B7R1.4 Cn1cncc1Br AB09509 [0,0,0,0,1,0|2,0,0]=3 783 B7R1.4 Cn1cncc1I PB12244 [0,0,0,0,1,0|2,0,0]=3 784 B7R1.4 Cn1cnnc1Br AB57304 [0,0,0,0,1,0|3,0,0]=4 785 B7R1.4 c1c(c(cs1)Br)Br AB00432 [0,0,0,0,1,0|3,0,0]=4 786 B6R0.4 CC(=O)\C=C\OC AB00959 [1,0,1,0,0,0|2,0,0]=4 787 B8R1.2 C#Cc1ccccn1 PB17077 [1,1,0,0,0,0|1,0,1]=4 788 B8R1.2 C#Cc1cccnc1 PB29186 [1,1,0,0,0,0|1,0,1]=4 789 B8R1.2 C#Cc1cnccn1 PB18058 [1,1,0,0,0,0|0,0,1]=3 790 B8R1.2 CNc1cccnc1 AB09114 [1,1,0,0,0,0|1,0,0]=3 791 B8R1.2 CNc1ccncn1 AB60623 [1,1,0,0,0,0|2,0,0]=4 792 B8R1.2 CNc1cncnc1 AB60774 [1,1,0,0,0,0|2,0,0]=4 793 B8R1.2 CNc1ncccn1 AB05135 [1,1,0,0,0,0|2,0,0]=4 794 B8R1.2 COc1cccnc1 AB06864 [1,1,0,0,0,0|1,0,0]=3 795 B8R1.2 COc1cccnn1 AB05130 [1,1,0,0,0,0|2,0,0]=4 796 B8R1.2 COc1ccnnc1 AB44150 [1,1,0,0,0,0|2,0,0]=4 797 B8R1.2 c1c(cncn1)CCl PB31962 [1,1,0,0,0,0|2,0,0]=4 798 B8R1.2 c1c(cncn1)CCl PB34530 [1,1,0,0,0,0|2,0,0]=4 799 B8R1.2 c1c(cncn1)CN PB26277 [1,1,0,0,0,0|2,0,0]=4 800 B8R1.2 c1c(cncn1)CO PB18631 [1,1,0,0,0,0|2,0,0]=4 801 B8R1.2 c1cc(cnc1)C=O AB00744 [1,1,0,0,0,0|1,0,1]=4 802 B8R1.2 c1cc(cnc1)CCl AB01984 [1,1,0,0,0,0|1,0,0]=3 803 B8R1.2 c1cc(cnc1)CN AB00752 [1,1,0,0,0,0|1,0,0]=3 804 B8R1.2 c1cc(cnc1)NN AB42924 [1,1,0,0,0,0|2,0,0]=4 805 B8R1.2 c1cc(cnc1)NN PB18886 [1,1,0,0,0,0|2,0,0]=4 806 B8R1.2 c1cc(nnc1)CCl PB28814 [1,1,0,0,0,0|2,0,0]=4 807 B8R1.2 c1cc(nnc1)CN PB29341 [1,1,0,0,0,0|2,0,0]=4 808 B8R1.2 c1cc(nnc1)CO PB30818 [1,1,0,0,0,0|2,0,0]=4 809 B8R1.2 c1ccnc(c1)C=O AB00680 [1,1,0,0,0,0|1,0,1]=4 810 B8R1.2 c1ccnc(c1)CBr MB02148 [1,1,0,0,0,0|1,0,0]=3 811 B8R1.2 c1ccnc(c1)CCl AB22495 [1,1,0,0,0,0|1,0,0]=3 812 B8R1.2 c1ccnc(c1)CN AB00731 [1,1,0,0,0,0|1,0,0]=3 813 B8R1.2 c1cnc(cn1)C#N AB02102 [1,1,0,0,0,0|0,0,1]=3 814 B8R1.2 c1cnc(cn1)C=O PB19982 [1,1,0,0,0,0|0,0,1]=3 815 B8R1.2 c1cnc(cn1)CCl PB20483 [1,1,0,0,0,0|0,0,0]=2 816 B8R1.2 c1cnc(cn1)CN PB14180 [1,1,0,0,0,0|0,0,0]=2 817 B8R1.2 c1cnc(cn1)CO PB21779 [1,1,0,0,0,0|0,0,0]=2 818 B8R1.2 c1cnc(cn1)NN PB12798 [1,1,0,0,0,0|1,0,0]=3 819 B8R1.2 c1cnc(nc1)CCl PB20403 [1,1,0,0,0,0|2,0,0]=4 820 B8R1.2 c1cnc(nc1)CN CB11589 [1,1,0,0,0,0|2,0,0]=4 821 B8R1.2 c1cnc(nc1)CN PB23443 [1,1,0,0,0,0|2,0,0]=4 822 B8R1.2 c1cnc(nc1)CO PB12410 [1,1,0,0,0,0|2,0,0]=4 823 B8R1.2 c1cncnc1CCl AB58895 [1,1,0,0,0,0|2,0,0]=4 824 B8R1.2 c1cncnc1CN PB10439 [1,1,0,0,0,0|2,0,0]=4 825 B8R1.2 c1cncnc1CO PB12296 [1,1,0,0,0,0|2,0,0]=4 826 B8R1.2 c1cnncc1CN PB31361 [1,1,0,0,0,0|2,0,0]=4 827 B8R1.2 c1cnncc1CO PB26178 [1,1,0,0,0,0|2,0,0]=4 828 B8R1.3 Cc1ccc(=O)[nH]n1 PB21643 [1,1,0,0,0,0|2,0,0]=4 829 B8R1.3 Cc1ccc(cn1)Br AB06624 [1,1,0,0,0,0|1,0,0]=3 830 B8R1.3 Cc1ccc(cn1)Cl AB17956 [1,1,0,0,0,0|1,0,0]=3 831 B8R1.3 Cc1ccc(cn1)F PB18589 [1,1,0,0,0,0|1,0,0]=3 832 B8R1.3 Cc1ccc(cn1)N PB32227 [1,1,0,0,0,0|1,0,0]=3 833 B8R1.3 Cc1ccc(cn1)O PB30543 [1,1,0,0,0,0|1,0,0]=3 834 B8R1.3 Cc1ccc(nc1)Br PB17145 [1,1,0,0,0,0|1,0,0]=3 835 B8R1.3 Cc1ccc(nc1)Cl AB07104 [1,1,0,0,0,0|1,0,0]=3 836 B8R1.3 Cc1ccc(nc1)F AB01857 [1,1,0,0,0,0|1,0,0]=3 837 B8R1.3 Cc1ccc(nc1)N AB17938 [1,1,0,0,0,0|1,0,0]=3 838 B8R1.3 Cc1ccc(nc1)O AB13138 [1,1,0,0,0,0|1,0,0]=3 839 B8R1.3 Cc1ccc(nn1)Br PB26503 [1,1,0,0,0,0|2,0,0]=4 840 B8R1.3 Cc1ccc(nn1)Cl PB20885 [1,1,0,0,0,0|2,0,0]=4 841 B8R1.3 Cc1ccc(nn1)I PB11607 [1,1,0,0,0,0|2,0,0]=4 842 B8R1.3 Cc1ccc(nn1)N PB33947 [1,1,0,0,0,0|2,0,0]=4 843 B8R1.3 Cc1cnc(cn1)Br PB27954 [1,1,0,0,0,0|0,0,0]=2 844 B8R1.3 Cc1cnc(cn1)Cl AB02272 [1,1,0,0,0,0|0,0,0]=2 845 B8R1.3 Cc1cnc(cn1)N PB32613 [1,1,0,0,0,0|0,0,0]=2 846 B8R1.3 Cc1cnc(nc1)Cl PB25116 [1,1,0,0,0,0|2,0,0]=4 847 B8R1.3 Cc1cnc(nc1)N AB06143 [1,1,0,0,0,0|2,0,0]=4 848 B8R1.3 Cc1ncc(cn1)Br PB18804 [1,1,0,0,0,0|2,0,0]=4 849 B8R1.3 Cc1ncc(cn1)Cl AB56396 [1,1,0,0,0,0|2,0,0]=4 850 B8R1.3 Cc1ncc(cn1)N PB10666 [1,1,0,0,0,0|2,0,0]=4 851 B8R1.3 Cc1ncc(cn1)O AB54467 [1,1,0,0,0,0|2,0,0]=4 852 B8R1.3 c1c(ncc(n1)Br)Br PB17488 [1,1,0,0,0,0|1,0,0]=3 853 B8R1.3 c1c(ncc(n1)Br)Cl PB26374 [1,1,0,0,0,0|1,0,0]=3 854 B8R1.3 c1c(ncc(n1)Br)F MB14114 [1,1,0,0,0,0|1,0,0]=3 855 B8R1.3 c1c(ncc(n1)Br)N PB26019 [1,1,0,0,0,0|1,0,0]=3 856 B8R1.3 c1c(ncc(n1)Br)O PB26179 [1,1,0,0,0,0|1,0,0]=3 857 B8R1.3 c1c(ncc(n1)Cl)Cl PB21866 [1,1,0,0,0,0|1,0,0]=3 858 B8R1.3 c1c(ncc(n1)Cl)F AB50800 [1,1,0,0,0,0|1,0,0]=3 859 B8R1.3 c1c(ncc(n1)Cl)N PB14352 [1,1,0,0,0,0|1,0,0]=3 860 B8R1.3 c1c(ncc(n1)Cl)O MB09316 [1,1,0,0,0,0|1,0,0]=3 861 B8R1.3 c1c(ncc(n1)F)F AB85705 [1,1,0,0,0,0|1,0,0]=3 862 B8R1.3 c1c(ncc(n1)I)Br PB27853 [1,1,0,0,0,0|1,0,0]=3 863 B8R1.3 c1c(ncc(n1)I)Cl AB54777 [1,1,0,0,0,0|1,0,0]=3 864 B8R1.3 c1c(ncc(n1)N)N AB53076 [1,1,0,0,0,0|1,0,0]=3 865 B8R1.3 c1c(ncc(n1)O)O AB44015 [1,1,0,0,0,0|1,0,0]=3 866 B8R1.3 c1c(nnc(n1)Cl)Br AB72404 [1,1,0,0,0,0|2,0,0]=4 867 B8R1.3 c1c(nnc(n1)Cl)Cl AB85254 [1,1,0,0,0,0|2,0,0]=4 868 B8R1.3 c1c(nnc(n1)N)Br AB71547 [1,1,0,0,0,0|2,0,0]=4 869 B8R1.3 c1cc(ncc1Br)Br AB00634 [1,1,0,0,0,0|2,0,0]=4 870 B8R1.3 c1cc(ncc1Br)Cl AB08767 [1,1,0,0,0,0|2,0,0]=4 871 B8R1.3 c1cc(ncc1Br)F PB30707 [1,1,0,0,0,0|2,0,0]=4 872 B8R1.3 c1cc(ncc1Br)N PB30536 [1,1,0,0,0,0|2,0,0]=4 873 B8R1.3 c1cc(ncc1Br)O AB05097 [1,1,0,0,0,0|2,0,0]=4 874 B8R1.3 c1cc(ncc1Br)S AB51097 [1,1,0,0,0,0|2,0,0]=4 875 B8R1.3 c1cc(ncc1Cl)Br AB05069 [1,1,0,0,0,0|2,0,0]=4 876 B8R1.3 c1cc(ncc1Cl)Cl AB00654 [1,1,0,0,0,0|2,0,0]=4 877 B8R1.3 c1cc(ncc1Cl)F AB17577 [1,1,0,0,0,0|2,0,0]=4 878 B8R1.3 c1cc(ncc1Cl)I AB32114 [1,1,0,0,0,0|2,0,0]=4 879 B8R1.3 c1cc(ncc1Cl)N AB00712 [1,1,0,0,0,0|2,0,0]=4 880 B8R1.3 c1cc(ncc1F)Br PB17160 [1,1,0,0,0,0|2,0,0]=4 881 B8R1.3 c1cc(ncc1F)I AB42989 [1,1,0,0,0,0|2,0,0]=4 882 B8R1.3 c1cc(ncc1F)N AB10107 [1,1,0,0,0,0|2,0,0]=4 883 B8R1.3 c1cc(ncc1I)Br PB14333 [1,1,0,0,0,0|2,0,0]=4 884 B8R1.3 c1cc(ncc1I)Cl AB10394 [1,1,0,0,0,0|2,0,0]=4 885 B8R1.3 c1cc(ncc1I)N PB25985 [1,1,0,0,0,0|2,0,0]=4 886 B8R1.3 c1cc(ncc1I)O AB05112 [1,1,0,0,0,0|2,0,0]=4 887 B8R1.3 c1cc(ncc1N)Br PB17224 [1,1,0,0,0,0|2,0,0]=4 888 B8R1.3 c1cc(ncc1N)Cl AB00661 [1,1,0,0,0,0|2,0,0]=4 889 B8R1.3 c1cc(ncc1N)F PB33962 [1,1,0,0,0,0|2,0,0]=4 890 B8R1.3 c1cc(ncc1N)O AB15078 [1,1,0,0,0,0|2,0,0]=4 891 B8R1.3 c1cc(ncc1O)Br PB15771 [1,1,0,0,0,0|2,0,0]=4 892 B8R1.3 c1cc(ncc1O)Cl PB32188 [1,1,0,0,0,0|2,0,0]=4 893 B8R1.3 c1cc(ncc1O)F AB08123 [1,1,0,0,0,0|2,0,0]=4 894 B8R1.3 c1cc(ncc1O)I AB50021 [1,1,0,0,0,0|2,0,0]=4 895 B8R1.3 c1cc(ncc1O)N AB15563 [1,1,0,0,0,0|2,0,0]=4 896 B8R1.5 C1=NC(C(=O)N=C1)N AB51505 [1,1,0,0,0,0|1,0,1]=4 897 B8R1.5 Cc1c(cccn1)Br PB27472 [1,1,0,0,0,0|1,0,0]=3 898 B8R1.5 Cc1c(cccn1)Cl AB17903 [1,1,0,0,0,0|1,0,0]=3 899 B8R1.5 Cc1c(cccn1)F AB48604 [1,1,0,0,0,0|1,0,0]=3 900 B8R1.5 Cc1c(cccn1)N PB33695 [1,1,0,0,0,0|1,0,0]=3 901 B8R1.5 Cc1c(cccn1)O PB18442 [1,1,0,0,0,0|1,0,0]=3 902 B8R1.5 Cc1c(ccnn1)N MB11382 [1,1,0,0,0,0|2,0,0]=4 903 B8R1.5 Cc1c(cncn1)Br PB26552 [1,1,0,0,0,0|2,0,0]=4 904 B8R1.5 Cc1c(cncn1)N PB26435 [1,1,0,0,0,0|2,0,0]=4 905 B8R1.5 Cc1c(nccn1)Br PB10597 [1,1,0,0,0,0|0,0,0]=2 906 B8R1.5 Cc1c(nccn1)Cl PB18413 [1,1,0,0,0,0|0,0,0]=2 907 B8R1.5 Cc1c(nccn1)I PB26409 [1,1,0,0,0,0|0,0,0]=2 908 B8R1.5 Cc1c(nccn1)N PB32667 [1,1,0,0,0,0|0,0,0]=2 909 B8R1.5 Cc1c(nccn1)O PB12942 [1,1,0,0,0,0|0,0,0]=2 910 B8R1.5 Cc1cccnc1Br AB05448 [1,1,0,0,0,0|1,0,0]=3 911 B8R1.5 Cc1cccnc1Cl AB05179 [1,1,0,0,0,0|1,0,0]=3 912 B8R1.5 Cc1cccnc1N AB17908 [1,1,0,0,0,0|1,0,0]=3 913 B8R1.5 Cc1cccnc1O AB03538 [1,1,0,0,0,0|1,0,0]=3 914 B8R1.5 Cc1ccncc1Br AB03104 [1,1,0,0,0,0|2,0,0]=4 915 B8R1.5 Cc1ccncc1Cl AB18019 [1,1,0,0,0,0|2,0,0]=4 916 B8R1.5 Cc1ccncc1F AB18002 [1,1,0,0,0,0|2,0,0]=4 917 B8R1.5 Cc1ccncc1N PB14127 [1,1,0,0,0,0|2,0,0]=4 918 B8R1.5 Cc1ccncc1O PB23391 [1,1,0,0,0,0|2,0,0]=4 919 B8R1.5 Cc1ccnnc1Cl PB34304 [1,1,0,0,0,0|2,0,0]=4 920 B8R1.5 Cc1ccnnc1N MB06298 [1,1,0,0,0,0|2,0,0]=4 921 B8R1.5 Cc1cnccc1Br AB20846 [1,1,0,0,0,0|1,0,0]=3 922 B8R1.5 Cc1cnccc1Br PB23248 [1,1,0,0,0,0|1,0,0]=3 923 B8R1.5 Cc1cnccc1Cl AB11511 [1,1,0,0,0,0|1,0,0]=3 924 B8R1.5 Cc1cnccc1F AB18013 [1,1,0,0,0,0|1,0,0]=3 925 B8R1.5 Cc1cnccc1N PB17234 [1,1,0,0,0,0|1,0,0]=3 926 B8R1.5 Cc1cncnc1Cl AB44072 [1,1,0,0,0,0|2,0,0]=4 927 B8R1.5 Cc1cncnc1N AB54983 [1,1,0,0,0,0|2,0,0]=4 928 B8R1.5 Cc1cncnc1O AB09558 [1,1,0,0,0,0|2,0,0]=4 929 B8R1.5 Cc1cnncc1N MB11384 [1,1,0,0,0,0|2,0,0]=4 930 B8R1.5 c1cc(c(nc1)Br)Br AB05083 [1,1,0,0,0,0|2,0,0]=4 931 B8R1.5 c1cc(c(nc1)Br)Cl AB17348 [1,1,0,0,0,0|2,0,0]=4 932 B8R1.5 c1cc(c(nc1)Br)F PB14380 [1,1,0,0,0,0|2,0,0]=4 933 B8R1.5 c1cc(c(nc1)Br)I MB06974 [1,1,0,0,0,0|2,0,0]=4 934 B8R1.5 c1cc(c(nc1)Br)N AB17900 [1,1,0,0,0,0|2,0,0]=4 935 B8R1.5 c1cc(c(nc1)Br)N PB26005 [1,1,0,0,0,0|2,0,0]=4 936 B8R1.5 c1cc(c(nc1)Br)O PB28951 [1,1,0,0,0,0|2,0,0]=4 937 B8R1.5 c1cc(c(nc1)Cl)Br PB33875 [1,1,0,0,0,0|2,0,0]=4 938 B8R1.5 c1cc(c(nc1)Cl)Cl AB00641 [1,1,0,0,0,0|2,0,0]=4 939 B8R1.5 c1cc(c(nc1)Cl)F AB13662 [1,1,0,0,0,0|2,0,0]=4 940 B8R1.5 c1cc(c(nc1)Cl)I AB06631 [1,1,0,0,0,0|2,0,0]=4 941 B8R1.5 c1cc(c(nc1)Cl)N PB23167 [1,1,0,0,0,0|2,0,0]=4 942 B8R1.5 c1cc(c(nc1)Cl)O PB21615 [1,1,0,0,0,0|2,0,0]=4 943 B8R1.5 c1cc(c(nc1)F)I AB13652 [1,1,0,0,0,0|2,0,0]=4 944 B8R1.5 c1cc(c(nc1)F)N AB17917 [1,1,0,0,0,0|2,0,0]=4 945 B8R1.5 c1cc(c(nc1)I)Br AB45745 [1,1,0,0,0,0|2,0,0]=4 946 B8R1.5 c1cc(c(nc1)I)F AB13656 [1,1,0,0,0,0|2,0,0]=4 947 B8R1.5 c1cc(c(nc1)I)I AB25846 [1,1,0,0,0,0|2,0,0]=4 948 B8R1.5 c1cc(c(nc1)I)O MB00322 [1,1,0,0,0,0|2,0,0]=4 949 B8R1.5 c1cc(c(nc1)N)Br PB20016 [1,1,0,0,0,0|2,0,0]=4 950 B8R1.5 c1cc(c(nc1)N)Cl AB15555 [1,1,0,0,0,0|2,0,0]=4 951 B8R1.5 c1cc(c(nc1)N)F AB17912 [1,1,0,0,0,0|2,0,0]=4 952 B8R1.5 c1cc(c(nc1)N)I PB12756 [1,1,0,0,0,0|2,0,0]=4 953 B8R1.5 c1cc(c(nc1)N)O AB00700 [1,1,0,0,0,0|2,0,0]=4 954 B8R1.5 c1cc(c(nc1)N)O AB17906 [1,1,0,0,0,0|2,0,0]=4 955 B8R1.5 c1cc(c(nc1)N)S AB64540 [1,1,0,0,0,0|2,0,0]=4 956 B8R1.5 c1cc(c(nc1)O)Br PB12284 [1,1,0,0,0,0|2,0,0]=4 957 B8R1.5 c1cc(c(nc1)O)F AB13427 [1,1,0,0,0,0|2,0,0]=4 958 B8R1.5 c1cc(c(nc1)O)I AB53303 [1,1,0,0,0,0|2,0,0]=4 959 B8R1.5 c1cc(c(nc1)O)N PB30752 [1,1,0,0,0,0|2,0,0]=4 960 B8R1.5 c1cnc(c(n1)Cl)Cl PB15620 [1,1,0,0,0,0|1,0,0]=3 961 B8R1.5 c1cnc(c(n1)N)Br MB08183 [1,1,0,0,0,0|1,0,0]=3 962 B8R1.5 c1cnc(c(n1)N)Cl PB24841 [1,1,0,0,0,0|1,0,0]=3 963 B8R1.5 c1cnc(c(n1)N)N PB10452 [1,1,0,0,0,0|1,0,0]=3 964 B8R1.5 c1cncc(c1Br)Br AB05087 [1,1,0,0,0,0|2,0,0]=4 965 B8R1.5 c1cncc(c1Br)Cl AB17643 [1,1,0,0,0,0|2,0,0]=4 966 B8R1.5 c1cncc(c1Br)F PB23387 [1,1,0,0,0,0|2,0,0]=4 967 B8R1.5 c1cncc(c1Br)N AB17638 [1,1,0,0,0,0|2,0,0]=4 968 B8R1.5 c1cncc(c1Br)O AB13187 [1,1,0,0,0,0|2,0,0]=4 969 B8R1.5 c1cncc(c1Cl)Br AB05074 [1,1,0,0,0,0|2,0,0]=4 970 B8R1.5 c1cncc(c1Cl)Cl AB10192 [1,1,0,0,0,0|2,0,0]=4 971 B8R1.5 c1cncc(c1Cl)F AB15511 [1,1,0,0,0,0|2,0,0]=4 972 B8R1.5 c1cncc(c1Cl)I AB05089 [1,1,0,0,0,0|2,0,0]=4 973 B8R1.5 c1cncc(c1Cl)N AB05299 [1,1,0,0,0,0|2,0,0]=4 974 B8R1.5 c1cncc(c1Cl)O AB12281 [1,1,0,0,0,0|2,0,0]=4 975 B8R1.5 c1cncc(c1F)Br AB17892 [1,1,0,0,0,0|2,0,0]=4 976 B8R1.5 c1cncc(c1F)Cl AB21349 [1,1,0,0,0,0|2,0,0]=4 977 B8R1.5 c1cncc(c1F)F AB18023 [1,1,0,0,0,0|2,0,0]=4 978 B8R1.5 c1cncc(c1F)N AB50028 [1,1,0,0,0,0|2,0,0]=4 979 B8R1.5 c1cncc(c1F)O AB64515 [1,1,0,0,0,0|2,0,0]=4 980 B8R1.5 c1cncc(c1I)F PB21191 [1,1,0,0,0,0|2,0,0]=4 981 B8R1.5 c1cncc(c1I)N PB23406 [1,1,0,0,0,0|2,0,0]=4 982 B8R1.5 c1cncc(c1I)O MB06807 [1,1,0,0,0,0|2,0,0]=4 983 B8R1.5 c1cncc(c1N)Br AB28611 [1,1,0,0,0,0|2,0,0]=4 984 B8R1.5 c1cncc(c1N)Cl AB16891 [1,1,0,0,0,0|2,0,0]=4 985 B8R1.5 c1cncc(c1N)F PB33879 [1,1,0,0,0,0|2,0,0]=4 986 B8R1.5 c1cncc(c1N)I AB12095 [1,1,0,0,0,0|2,0,0]=4 987 B8R1.5 c1cncc(c1O)Br AB09574 [1,1,0,0,0,0|2,0,0]=4 988 B8R1.5 c1cncc(c1O)F AB18011 [1,1,0,0,0,0|2,0,0]=4 989 B8R1.1 C(C1=NC(=O)N=N1)Cl AB42369 [0,1,0,0,1,0|2,0,0]=4 990 B8R1.1 C(C1=NC(=O)N=N1)N AB27910 [0,1,0,0,1,0|2,0,0]=4 991 B8R1.1 C(c1nc(no1)Cl)Cl AB76283 [0,1,0,0,1,0|2,0,0]=4 992 B8R1.1 C(c1nc(on1)N)Cl AB76237 [0,1,0,0,1,0|2,0,0]=4 993 B8R1.1 C1=NC(=NC1Br)CN AB58032 [0,1,0,0,1,0|1,0,1]=4 994 B8R1.1 C1=NC(=NC1CO)N AB56993 [0,1,0,0,1,0|1,0,1]=4 995 B8R1.1 CC1=CN=C(C1)C=O AB43814 [0,1,0,0,1,0|1,0,1]=4 996 B8R1.1 CC1=NC(=CC1)C=O AB43978 [0,1,0,0,1,0|0,0,2]=4 997 B8R1.1 CC1=NC(=NC1)C=O AB22828 [0,1,0,0,1,0|0,0,2]=4 998 B8R1.1 CC1=NC(=NC1)CN AB28116 [0,1,0,0,1,0|0,0,1]=3 999 B8R1.1 CC1=NN=C(C1)CN AB51378 [0,1,0,0,1,0|2,0,0]=4 1000 B8R1.1 CCC1=NC(=NC1)N AB54794 [0,1,0,0,1,0|1,0,1]=4 1001 B8R1.1 CCc1[nH]c(cn1)Cl AB45181 [0,1,0,0,1,0|1,0,1]=4 1002 B8R1.1 CCc1cnc(o1)N AB64704 [0,1,0,0,1,0|2,0,0]=4 1003 B8R1.1 CCc1nc(on1)Cl AB71527 [0,1,0,0,1,0|2,0,0]=4 1004 B8R1.1 CNc1nc(cs1)Br MB14222 [0,1,0,0,1,0|2,0,0]=4 1005 B8R1.1 CNc1ncc(s1)Br MB14261 [0,1,0,0,1,0|2,0,0]=4 1006 B8R1.1 COc1cnc(s1)N AB09307 [0,1,0,0,1,0|2,0,0]=4 1007 B8R1.1 COc1nc(cs1)Br AB42965 [0,1,0,0,1,0|2,0,0]=4 1008 B8R1.1 COc1ncc(s1)Br MB06715 [0,1,0,0,1,0|2,0,0]=4 1009 B8R1.1 CSc1[nH]nc(n1)N MB00152 [0,1,0,0,1,0|2,0,0]=4 1010 B8R1.1 CSc1nc(ns1)Br CB10626 [0,1,0,0,1,0|2,0,0]=4 1011 B8R1.1 Cc1[nH]c(cn1)C=O AB05024 [0,1,0,0,1,0|0,0,2]=4 1012 B8R1.1 Cc1[nH]c(cn1)CCl AB57911 [0,1,0,0,1,0|0,0,1]=3 1013 B8R1.1 Cc1[nH]c(cn1)CN AB57919 [0,1,0,0,1,0|0,0,1]=3 1014 B8R1.1 Cc1[nH]c(cn1)CO AB57908 [0,1,0,0,1,0|0,0,1]=3 1015 B8R1.1 Cc1[nH]c(nn1)CN AB46091 [0,1,0,0,1,0|1,0,1]=4 1016 B8R1.1 Cc1cc(no1)CN AB06189 [0,1,0,0,1,0|2,0,0]=4 1017 B8R1.1 Cc1cc(oc1)CN PB24200 [0,1,0,0,1,0|2,0,0]=4 1018 B8R1.1 Cc1cc(on1)CCl AB42093 [0,1,0,0,1,0|2,0,0]=4 1019 B8R1.1 Cc1cc(on1)CN AB28053 [0,1,0,0,1,0|2,0,0]=4 1020 B8R1.1 Cc1cc(sc1)CCl AB72607 [0,1,0,0,1,0|2,0,0]=4 1021 B8R1.1 Cc1cc(sc1)CN AB25763 [0,1,0,0,1,0|2,0,0]=4 1022 B8R1.1 Cc1ccc(s1)C#N PB12235 [0,1,0,0,1,0|1,0,1]=4 1023 B8R1.1 Cc1ccc(s1)C=O AB00417 [0,1,0,0,1,0|1,0,1]=4 1024 B8R1.1 Cc1ccc(s1)CCl AB50993 [0,1,0,0,1,0|1,0,0]=3 1025 B8R1.1 Cc1ccc(s1)CN AB07827 [0,1,0,0,1,0|1,0,0]=3 1026 B8R1.1 Cc1cnc(o1)CO AB63479 [0,1,0,0,1,0|1,0,0]=3 1027 B8R1.1 Cc1cnc(o1)NC AB65971 [0,1,0,0,1,0|1,0,0]=3 1028 B8R1.1 Cc1cnc(s1)C=O AB43202 [0,1,0,0,1,0|1,0,1]=4 1029 B8R1.1 Cc1cnc(s1)CCl AB43206 [0,1,0,0,1,0|1,0,0]=3 1030 B8R1.1 Cc1cnc(s1)CN AB43201 [0,1,0,0,1,0|1,0,0]=3 1031 B8R1.1 Cc1coc(n1)C=O PB28183 [0,1,0,0,1,0|1,0,1]=4 1032 B8R1.1 Cc1coc(n1)CCl AB70149 [0,1,0,0,1,0|1,0,0]=3 1033 B8R1.1 Cc1coc(n1)CN AB70147 [0,1,0,0,1,0|1,0,0]=3 1034 B8R1.1 Cc1coc(n1)NC AB65967 [0,1,0,0,1,0|1,0,0]=3 1035 B8R1.1 Cc1csc(n1)C#N PB10548 [0,1,0,0,1,0|1,0,1]=4 1036 B8R1.1 Cc1csc(n1)C=O PB14084 [0,1,0,0,1,0|1,0,1]=4 1037 B8R1.1 Cc1csc(n1)CCl AB43168 [0,1,0,0,1,0|1,0,0]=3 1038 B8R1.1 Cc1csc(n1)CN AB59755 [0,1,0,0,1,0|1,0,0]=3 1039 B8R1.1 Cc1csc(n1)CO AB44110 [0,1,0,0,1,0|1,0,0]=3 1040 B8R1.1 Cc1csc(n1)NC AB10516 [0,1,0,0,1,0|1,0,0]=3 1041 B8R1.1 Cc1nc(co1)C=O AB13940 [0,1,0,0,1,0|1,0,1]=4 1042 B8R1.1 Cc1nc(co1)CCl AB45871 [0,1,0,0,1,0|1,0,0]=3 1043 B8R1.1 Cc1nc(co1)CN AB54740 [0,1,0,0,1,0|1,0,0]=3 1044 B8R1.1 Cc1nc(co1)CO AB48508 [0,1,0,0,1,0|1,0,0]=3 1045 B8R1.1 Cc1nc(cs1)C=O AB25415 [0,1,0,0,1,0|1,0,1]=4 1046 B8R1.1 Cc1nc(cs1)CCl AB02129 [0,1,0,0,1,0|1,0,0]=3 1047 B8R1.1 Cc1nc(cs1)CN AB23320 [0,1,0,0,1,0|1,0,0]=3 1048 B8R1.1 Cc1nc(no1)CCl AB09935 [0,1,0,0,1,0|1,0,0]=3 1049 B8R1.1 Cc1nc(no1)CO AB43139 [0,1,0,0,1,0|1,0,0]=3 1050 B8R1.1 Cc1nc(on1)C=O AB57238 [0,1,0,0,1,0|1,0,1]=4 1051 B8R1.1 Cc1nc(on1)CCl AB45279 [0,1,0,0,1,0|1,0,0]=3 1052 B8R1.1 Cc1nc(on1)CN AB57218 [0,1,0,0,1,0|1,0,0]=3 1053 B8R1.1 Cc1nc(on1)CO AB44080 [0,1,0,0,1,0|1,0,0]=3 1054 B8R1.1 Cc1ncc(o1)C=O AB27658 [0,1,0,0,1,0|1,0,1]=4 1055 B8R1.1 Cc1ncc(o1)CCl AB70153 [0,1,0,0,1,0|1,0,0]=3 1056 B8R1.1 Cc1ncc(o1)CN AB64071 [0,1,0,0,1,0|1,0,0]=3 1057 B8R1.1 Cc1ncc(s1)C=O CB11336 [0,1,0,0,1,0|1,0,1]=4 1058 B8R1.1 Cc1nnc(o1)CCl AB25410 [0,1,0,0,1,0|2,0,0]=4 1059 B8R1.1 Cc1nnc(o1)CN AB28132 [0,1,0,0,1,0|2,0,0]=4 1060 B8R1.1 Cc1nnc(o1)CN AB28474 [0,1,0,0,1,0|2,0,0]=4 1061 B8R1.1 Cc1nnc(s1)CCl AB66821 [0,1,0,0,1,0|2,0,0]=4 1062 B8R1.1 Cc1nnc(s1)CN AB62645 [0,1,0,0,1,0|2,0,0]=4 1063 B8R1.1 Cn1cc(cn1)CCl AB53748 [0,1,0,0,1,0|2,0,0]=4 1064 B8R1.1 Cn1cc(cn1)CN PB29175 [0,1,0,0,1,0|2,0,0]=4 1065 B8R1.1 Cn1cc(cn1)CO PB19942 [0,1,0,0,1,0|2,0,0]=4 1066 B8R1.1 Cn1cc(nc1)CCl AB60095 [0,1,0,0,1,0|2,0,0]=4 1067 B8R1.1 Cn1cc(nc1)CN PB10356 [0,1,0,0,1,0|2,0,0]=4 1068 B8R1.1 Cn1cc(nc1)CO PB13038 [0,1,0,0,1,0|2,0,0]=4 1069 B8R1.1 Cn1ccc(c1)CN AB48514 [0,1,0,0,1,0|2,0,0]=4 1070 B8R1.1 Cn1ccc(c1)CO AB09760 [0,1,0,0,1,0|2,0,0]=4 1071 B8R1.1 Cn1ccc(n1)C#N PB29091 [0,1,0,0,1,0|1,0,1]=4 1072 B8R1.1 Cn1ccc(n1)C=O AB14508 [0,1,0,0,1,0|1,0,1]=4 1073 B8R1.1 Cn1ccc(n1)CBr AB27867 [0,1,0,0,1,0|1,0,0]=3 1074 B8R1.1 Cn1ccc(n1)CN PB29254 [0,1,0,0,1,0|1,0,0]=3 1075 B8R1.1 Cn1ccc(n1)CO PB20290 [0,1,0,0,1,0|1,0,0]=3 1076 B8R1.1 Cn1cnc(n1)CCl AB28284 [0,1,0,0,1,0|1,0,0]=3 1077 B8R1.1 Cn1cnc(n1)CN PB35871 [0,1,0,0,1,0|1,0,0]=3 1078 B8R1.1 Cn1cnc(n1)CO PB34812 [0,1,0,0,1,0|1,0,0]=3 1079 B8R1.1 c1c(nc(o1)Cl)CBr AB43619 [0,1,0,0,1,0|2,0,0]=4 1080 B8R1.1 c1c(nc(o1)Cl)CCl AB71583 [0,1,0,0,1,0|2,0,0]=4 1081 B8R1.1 c1c(nc(o1)Cl)CN AB72277 [0,1,0,0,1,0|2,0,0]=4 1082 B8R1.1 c1c(nc(o1)Cl)CO PB31033 [0,1,0,0,1,0|2,0,0]=4 1083 B8R1.1 c1c(nc(s1)Br)CCl AB50547 [0,1,0,0,1,0|2,0,0]=4 1084 B8R1.1 c1c(nc(s1)N)CCl AB01560 [0,1,0,0,1,0|2,0,0]=4 1085 B8R1.1 c1c(nc(s1)N)CCl PB33908 [0,1,0,0,1,0|2,0,0]=4 1086 B8R1.1 c1c(sc(n1)Br)CCl AB51428 [0,1,0,0,1,0|2,0,0]=4 1087 B8R1.1 c1c(sc(n1)Br)CN AB49802 [0,1,0,0,1,0|2,0,0]=4 1088 B8R1.1 c1c(sc(n1)Br)CO AB20494 [0,1,0,0,1,0|2,0,0]=4 1089 B8R1.1 c1c(sc(n1)CN)Br PB39018 [0,1,0,0,1,0|2,0,0]=4 1090 B8R1.1 c1c(sc(n1)CN)Cl PB37009 [0,1,0,0,1,0|2,0,0]=4 1091 B8R1.1 c1c(sc(n1)CO)Br PB24473 [0,1,0,0,1,0|2,0,0]=4 1092 B8R1.1 c1c(sc(n1)CO)Cl PB36635 [0,1,0,0,1,0|2,0,0]=4 1093 B8R1.1 c1c(sc(n1)Cl)CCl AB08016 [0,1,0,0,1,0|2,0,0]=4 1094 B8R1.1 c1c(sc(n1)N)CO AB23150 [0,1,0,0,1,0|2,0,0]=4 1095 B8R1.1 c1cc(sc1CCl)Cl AB00990 [0,1,0,0,1,0|2,0,0]=4 1096 B8R1.1 c1cc(sc1CN)Br PB24892 [0,1,0,0,1,0|2,0,0]=4 1097 B8R1.1 c1cc(sc1CN)Cl PB22134 [0,1,0,0,1,0|2,0,0]=4 1098 B8R1.1 c1cc(sc1CN)F PB33422 [0,1,0,0,1,0|2,0,0]=4 1099 B8R1.1 c1cc(sc1CO)Br PB23435 [0,1,0,0,1,0|2,0,0]=4 1100 B8R1.1 c1cc(sc1CO)Cl PB23436 [0,1,0,0,1,0|2,0,0]=4 1101 B8R1.1 c1cc(sc1CO)F PB31763 [0,1,0,0,1,0|2,0,0]=4 1102 B8R1.18 CC1=NC(=NC1Br)Br AB11303 [0,1,0,0,1,0|1,0,1]=4 1103 B8R1.18 CC1=NC(=NC1Cl)C AB58139 [0,1,0,0,1,0|0,0,1]=3 1104 B8R1.18 CC1=NC(=NC1I)I AB11305 [0,1,0,0,1,0|1,0,1]=4 1105 B8R1.18 CC1C(=NC(=N1)Cl)C AB54802 [0,1,0,0,1,0|1,0,1]=4 1106 B8R1.18 CC1C(=NC(=N1)N)C AB54790 [0,1,0,0,1,0|1,0,1]=4 1107 B8R1.18 Cc1[nH]c(c(n1)Br)Br AB06612 [0,1,0,0,1,0|1,0,1]=4 1108 B8R1.18 Cc1[nH]c(c(n1)I)I AB06210 [0,1,0,0,1,0|1,0,1]=4 1109 B8R1.18 Cc1c(cc(s1)Br)Br MB04800 [0,1,0,0,1,0|2,0,0]=4 1110 B8R1.18 Cc1c(cn(n1)C)Br PB23204 [0,1,0,0,1,0|1,0,0]=3 1111 B8R1.18 Cc1c(cn(n1)C)N AB10629 [0,1,0,0,1,0|1,0,0]=3 1112 B8R1.18 Cc1c(cn(n1)C)N PB34221 [0,1,0,0,1,0|1,0,0]=3 1113 B8R1.18 Cc1c(nn(n1)C)Br MB14575 [0,1,0,0,1,0|1,0,0]=3 1114 B8R1.18 Cc1c(oc(n1)N)C AB25421 [0,1,0,0,1,0|2,0,0]=4 1115 B8R1.18 Cc1cc(n(n1)C)Br PB11837 [0,1,0,0,1,0|1,0,0]=3 1116 B8R1.18 Cc1cc(n(n1)C)N AB02131 [0,1,0,0,1,0|1,0,0]=3 1117 B8R1.18 Cc1cn(c(n1)Br)C AB26588 [0,1,0,0,1,0|1,0,1]=4 1118 B8R1.18 Cc1nc(cn1C)Br AB26584 [0,1,0,0,1,0|1,0,1]=4 1119 B8R1.18 Cn1c(cc(n1)Cl)N PB30426 [0,1,0,0,1,0|2,0,0]=4 1120 B8R1.50 Cc1c(c(on1)C)Br PB14113 [0,1,0,0,1,0|2,0,0]=4 1121 B8R1.50 Cc1c(c(on1)C)I AB04361 [0,1,0,0,1,0|2,0,0]=4 1122 B8R1.50 Cc1cnc(n1C)Br AB26586 [0,1,0,0,1,0|1,0,1]=4 1123 B8R1.50 Cc1cnn(c1Br)C AB84867 [0,1,0,0,1,0|2,0,0]=4 1124 B8R1.50 Cc1ncc(n1C)Br AB26592 [0,1,0,0,1,0|1,0,1]=4 1125 B8R1.50 Cc1nnc(n1C)C AB07353 [0,1,0,0,1,0|1,0,1]=4 1126 B8R1.11 Cc1c(ccs1)CCl AB76281 [0,1,0,0,1,0|2,0,0]=4 1127 B8R1.11 Cc1c(con1)CN MB06775 [0,1,0,0,1,0|2,0,0]=4 1128 B8R1.11 Cn1c(cnn1)CCl AB69595 [0,1,0,0,1,0|2,0,0]=4 1129 B8R1.11 Cn1c(cnn1)CN AB57111 [0,1,0,0,1,0|2,0,0]=4 1130 B8R1.11 Cn1cncc1C#N PB24888 [0,1,0,0,1,0|1,0,1]=4 1131 B8R1.11 Cn1cncc1C=O PB21631 [0,1,0,0,1,0|1,0,1]=4 1132 B8R1.11 Cn1cncc1CCl AB49658 [0,1,0,0,1,0|1,0,0]=3 1133 B8R1.11 Cn1cncc1CN PB24886 [0,1,0,0,1,0|1,0,0]=3 1134 B8R1.11 Cn1cncc1CO PB17276 [0,1,0,0,1,0|1,0,0]=3 1135 B8R1.11 Cn1cnnc1CCl AB69765 [0,1,0,0,1,0|2,0,0]=4 1136 B8R1.11 Cn1cnnc1CN AB53790 [0,1,0,0,1,0|2,0,0]=4 1137 B8R1.11 Cn1cnnc1CO AB69764 [0,1,0,0,1,0|2,0,0]=4 1138 B8R1.11 Cn1cnnc1SC AB20821 [0,1,0,0,1,0|2,0,0]=4 1139 B10R1.2 COc1cncc(c1Cl)N AB64859 [0,2,0,0,0,0|2,0,0]=4 1140 B10R1.2 COc1cncc(c1Cl)O AB75741 [0,2,0,0,0,0|2,0,0]=4 1141 B10R1.2 COc1cncc(c1N)Cl AB75723 [0,2,0,0,0,0|2,0,0]=4 1142 B10R1.2 COc1cncc(c1O)Cl AB75737 [0,2,0,0,0,0|2,0,0]=4 1143 B10R1.2 Cc1c(cncc1Cl)CCl AB83287 [0,2,0,0,0,0|2,0,0]=4 1144 B10R1.2 Cc1c(cncc1Cl)CN AB83289 [0,2,0,0,0,0|2,0,0]=4 1145 B10R1.2 Cc1c(cncc1OC)N CB11797 [0,2,0,0,0,0|2,0,0]=4 1146 B10R1.2 Cc1cccc(c1N)CN MB08906 [0,2,0,0,0,0|2,0,0]=4 1147 B10R1.2 Cc1cccc(c1N)OC AB02877 [0,2,0,0,0,0|2,0,0]=4 1148 B10R1.2 Cc1cccc(c1O)CN MB05058 [0,2,0,0,0,0|2,0,0]=4 1149 B10R1.2 Cc1cccc(c1O)NC MB31993 [0,2,0,0,0,0|2,0,0]=4 1150 B10R1.2 Cc1cccc(c1O)SC MB31066 [0,2,0,0,0,0|2,0,0]=4 1151 B10R1.2 Cc1cncc(c1C)C=O AB76785 [0,2,0,0,0,0|1,0,1]=4 1152 B10R1.2 Cc1cncc(c1C)CCl AB75396 [0,2,0,0,0,0|1,0,0]=3 1153 B10R1.2 Cc1cncc(c1C)CN AB76787 [0,2,0,0,0,0|1,0,0]=3 1154 B10R1.2 Cc1cncc(c1Cl)C=O AB67499 [0,2,0,0,0,0|1,0,1]=4 1155 B10R1.2 Cc1cncc(c1Cl)CCl AB83266 [0,2,0,0,0,0|1,0,0]=3 1156 B10R1.2 Cc1cncc(c1Cl)CN AB83269 [0,2,0,0,0,0|1,0,0]=3 1157 B10R1.2 Cc1cncc(c1F)C=O AB75176 [0,2,0,0,0,0|1,0,1]=4 1158 B10R1.2 Cc1cncc(c1F)CCl AB82938 [0,2,0,0,0,0|1,0,0]=3 1159 B10R1.2 Cc1cncc(c1F)CN AB82941 [0,2,0,0,0,0|1,0,0]=3 1160 B10R1.2 Cc1cncc(c1N)C=O AB83665 [0,2,0,0,0,0|1,0,1]=4 1161 B10R1.2 Cc1cncc(c1O)C=O AB75247 [0,2,0,0,0,0|1,0,1]=4 1162 B10R1.2 c1c(c(c(cn1)Cl)F)CCl AB82974 [0,2,0,0,0,0|2,0,0]=4 1163 B10R1.2 c1c(c(c(cn1)Cl)F)CN AB75056 [0,2,0,0,0,0|2,0,0]=4 1164 B10R1.2 c1c(c(c(cn1)Cl)N)CN AB83904 [0,2,0,0,0,0|2,0,0]=4 1165 B10R1.2 c1c(c(c(cn1)Cl)O)CCl AB84031 [0,2,0,0,0,0|2,0,0]=4 1166 B10R1.2 c1c(c(c(cn1)Cl)O)CN AB84033 [0,2,0,0,0,0|2,0,0]=4 1167 B10R1.2 c1c(c(c(cn1)F)Cl)CCl AB83148 [0,2,0,0,0,0|2,0,0]=4 1168 B10R1.2 c1c(c(c(cn1)F)Cl)CN AB83149 [0,2,0,0,0,0|2,0,0]=4 1169 B10R1.2 c1c(c(c(cn1)N)Cl)CN AB83884 [0,2,0,0,0,0|2,0,0]=4 1170 B10R1.2 c1c(c(c(cn1)O)Cl)CCl AB83999 [0,2,0,0,0,0|2,0,0]=4 1171 B10R1.2 c1c(c(c(cn1)O)Cl)CN AB84000 [0,2,0,0,0,0|2,0,0]=4 1172 B10R1.8 CCc1cc(nc(n1)C)Cl AB42755 [0,2,0,0,0,0|2,0,0]=4 1173 B10R1.8 CCc1cc(nc(n1)C)N AB54967 [0,2,0,0,0,0|2,0,0]=4 1174 B10R1.8 CCc1cc(nc(n1)C)O AB13893 [0,2,0,0,0,0|2,0,0]=4 1175 B10R1.8 COc1cc(cc(n1)Br)Cl AB69575 [0,2,0,0,0,0|2,0,0]=4 1176 B10R1.8 COc1cc(cc(n1)Br)N AB62723 [0,2,0,0,0,0|2,0,0]=4 1177 B10R1.8 COc1cc(cc(n1)Cl)Br AB69577 [0,2,0,0,0,0|2,0,0]=4 1178 B10R1.8 COc1cc(cc(n1)Cl)N AB68188 [0,2,0,0,0,0|2,0,0]=4 1179 B10R1.8 Cc1cc(cc(c1)Br)CCl AB71866 [0,2,0,0,0,0|2,0,0]=4 1180 B10R1.8 Cc1cc(cc(c1)Br)CN AB75545 [0,2,0,0,0,0|2,0,0]=4 1181 B10R1.8 Cc1cc(cc(c1)Br)OC AB43364 [0,2,0,0,0,0|2,0,0]=4 1182 B10R1.8 Cc1cc(cc(c1)C=O)C AB03134 [0,2,0,0,0,0|2,0,0]=4 1183 B10R1.8 Cc1cc(cc(c1)CCl)C AB56154 [0,2,0,0,0,0|2,0,0]=4 1184 B10R1.8 Cc1cc(cc(c1)CN)C AB01824 [0,2,0,0,0,0|2,0,0]=4 1185 B10R1.8 Cc1cc(cc(c1)Cl)CCl AB75575 [0,2,0,0,0,0|2,0,0]=4 1186 B10R1.8 Cc1cc(cc(c1)Cl)CN AB75470 [0,2,0,0,0,0|2,0,0]=4 1187 B10R1.8 Cc1cc(cc(c1)Cl)OC MB05593 [0,2,0,0,0,0|2,0,0]=4 1188 B10R1.8 Cc1cc(cc(c1)F)CCl AB66782 [0,2,0,0,0,0|2,0,0]=4 1189 B10R1.8 Cc1cc(cc(c1)F)CN AB23427 [0,2,0,0,0,0|2,0,0]=4 1190 B10R1.8 Cc1cc(cc(c1)I)CCl AB75649 [0,2,0,0,0,0|2,0,0]=4 1191 B10R1.8 Cc1cc(cc(c1)I)CN AB75648 [0,2,0,0,0,0|2,0,0]=4 1192 B10R1.8 Cc1cc(cc(c1)N)CN AB75515 [0,2,0,0,0,0|2,0,0]=4 1193 B10R1.8 Cc1cc(cc(c1)O)CN AB71617 [0,2,0,0,0,0|2,0,0]=4 1194 B10R1.8 Cc1cc(cc(c1)O)NC MB25938 [0,2,0,0,0,0|2,0,0]=4 1195 B10R1.8 Cc1cc(cc(c1)SC)O MB37868 [0,2,0,0,0,0|2,0,0]=4 1196 B10R1.8 Cc1cc(cc(n1)Br)C=O AB66852 [0,2,0,0,0,0|2,0,0]=4 1197 B10R1.8 Cc1cc(cc(n1)Br)CCl AB71050 [0,2,0,0,0,0|2,0,0]=4 1198 B10R1.8 Cc1cc(cc(n1)Br)CN AB68161 [0,2,0,0,0,0|2,0,0]=4 1199 B10R1.8 Cc1cc(cc(n1)C#N)Br AB40796 [0,2,0,0,0,0|1,0,1]=4 1200 B10R1.8 Cc1cc(cc(n1)C#N)Cl AB40808 [0,2,0,0,0,0|1,0,1]=4 1201 B10R1.8 Cc1cc(cc(n1)C)C=O AB24839 [0,2,0,0,0,0|1,0,0]=3 1202 B10R1.8 Cc1cc(cc(n1)C)CCl AB68655 [0,2,0,0,0,0|1,0,0]=3 1203 B10R1.8 Cc1cc(cc(n1)C)CN AB65427 [0,2,0,0,0,0|1,0,0]=3 1204 B10R1.8 Cc1cc(cc(n1)C=O)Br AB40795 [0,2,0,0,0,0|1,0,1]=4 1205 B10R1.8 Cc1cc(cc(n1)C=O)Cl AB40806 [0,2,0,0,0,0|1,0,1]=4 1206 B10R1.8 Cc1cc(cc(n1)C=O)F AB75160 [0,2,0,0,0,0|1,0,1]=4 1207 B10R1.8 Cc1cc(cc(n1)C=O)I AB79033 [0,2,0,0,0,0|1,0,1]=4 1208 B10R1.8 Cc1cc(cc(n1)C=O)O AB78936 [0,2,0,0,0,0|1,0,1]=4 1209 B10R1.8 Cc1cc(cc(n1)CCl)Br AB68657 [0,2,0,0,0,0|1,0,0]=3 1210 B10R1.8 Cc1cc(cc(n1)CCl)Cl AB74787 [0,2,0,0,0,0|1,0,0]=3 1211 B10R1.8 Cc1cc(cc(n1)CCl)F AB78533 [0,2,0,0,0,0|1,0,0]=3 1212 B10R1.8 Cc1cc(cc(n1)CCl)I AB78583 [0,2,0,0,0,0|1,0,0]=3 1213 B10R1.8 Cc1cc(cc(n1)CCl)O AB78458 [0,2,0,0,0,0|1,0,0]=3 1214 B10R1.8 Cc1cc(cc(n1)CN)Br AB40798 [0,2,0,0,0,0|1,0,0]=3 1215 B10R1.8 Cc1cc(cc(n1)CN)Cl AB40810 [0,2,0,0,0,0|1,0,0]=3 1216 B10R1.8 Cc1cc(cc(n1)CN)F AB80224 [0,2,0,0,0,0|1,0,0]=3 1217 B10R1.8 Cc1cc(cc(n1)CN)I AB80278 [0,2,0,0,0,0|1,0,0]=3 1218 B10R1.8 Cc1cc(cc(n1)CN)N AB80135 [0,2,0,0,0,0|1,0,0]=3 1219 B10R1.8 Cc1cc(cc(n1)CN)O AB80150 [0,2,0,0,0,0|1,0,0]=3 1220 B10R1.8 Cc1cc(cc(n1)CO)Br AB40787 [0,2,0,0,0,0|1,0,0]=3 1221 B10R1.8 Cc1cc(cc(n1)CO)Cl AB40801 [0,2,0,0,0,0|1,0,0]=3 1222 B10R1.8 Cc1cc(cc(n1)Cl)C=O AB24805 [0,2,0,0,0,0|2,0,0]=4 1223 B10R1.8 Cc1cc(cc(n1)Cl)CCl AB70698 [0,2,0,0,0,0|2,0,0]=4 1224 B10R1.8 Cc1cc(cc(n1)Cl)CN AB68142 [0,2,0,0,0,0|2,0,0]=4 1225 B10R1.8 Cc1cc(cc(n1)F)C=O AB70701 [0,2,0,0,0,0|2,0,0]=4 1226 B10R1.8 Cc1cc(cc(n1)F)CCl AB70706 [0,2,0,0,0,0|2,0,0]=4 1227 B10R1.8 Cc1cc(cc(n1)F)CN AB80402 [0,2,0,0,0,0|2,0,0]=4 1228 B10R1.8 Cc1cc(cc(n1)I)C=O AB79154 [0,2,0,0,0,0|2,0,0]=4 1229 B10R1.8 Cc1cc(cc(n1)I)CCl AB78738 [0,2,0,0,0,0|2,0,0]=4 1230 B10R1.8 Cc1cc(cc(n1)I)CN AB80462 [0,2,0,0,0,0|2,0,0]=4 1231 B10R1.8 Cc1cc(cc(n1)N)CCl AB70871 [0,2,0,0,0,0|2,0,0]=4 1232 B10R1.8 Cc1cc(cc(n1)N)CN AB80499 [0,2,0,0,0,0|2,0,0]=4 1233 B10R1.8 Cc1cc(cc(n1)O)C=O AB71363 [0,2,0,0,0,0|2,0,0]=4 1234 B10R1.8 Cc1cc(cc(n1)O)CN AB80512 [0,2,0,0,0,0|2,0,0]=4 1235 B10R1.8 Cc1cc(nc(c1)Br)CCl AB78392 [0,2,0,0,0,0|2,0,0]=4 1236 B10R1.8 Cc1cc(nc(c1)Br)CN AB80078 [0,2,0,0,0,0|2,0,0]=4 1237 B10R1.8 Cc1cc(nc(c1)C=O)C AB04218 [0,2,0,0,0,0|1,0,1]=4 1238 B10R1.8 Cc1cc(nc(c1)CCl)C AB64959 [0,2,0,0,0,0|1,0,0]=3 1239 B10R1.8 Cc1cc(nc(c1)CN)C AB62613 [0,2,0,0,0,0|1,0,0]=3 1240 B10R1.8 Cc1cc(nc(c1)Cl)CCl AB71015 [0,2,0,0,0,0|2,0,0]=4 1241 B10R1.8 Cc1cc(nc(c1)Cl)CN AB75106 [0,2,0,0,0,0|2,0,0]=4 1242 B10R1.8 Cc1cc(nc(c1)F)CCl AB78353 [0,2,0,0,0,0|2,0,0]=4 1243 B10R1.8 Cc1cc(nc(c1)F)CN AB80035 [0,2,0,0,0,0|2,0,0]=4 1244 B10R1.8 Cc1cc(nc(c1)I)CCl AB78408 [0,2,0,0,0,0|2,0,0]=4 1245 B10R1.8 Cc1cc(nc(c1)I)CN AB80096 [0,2,0,0,0,0|2,0,0]=4 1246 B10R1.8 Cc1cc(nc(c1)N)CN AB76142 [0,2,0,0,0,0|2,0,0]=4 1247 B10R1.8 Cc1cc(nc(c1)O)CN AB80331 [0,2,0,0,0,0|2,0,0]=4 1248 B10R1.8 Cc1cc(nc(n1)C)C=O AB58698 [0,2,0,0,0,0|2,0,0]=4 1249 B10R1.8 Cc1cc(nc(n1)CCl)C AB53816 [0,2,0,0,0,0|2,0,0]=4 1250 B10R1.8 Cc1cc(nc(n1)CCl)Cl AB59423 [0,2,0,0,0,0|2,0,0]=4 1251 B10R1.8 Cc1cc(nc(n1)CCl)O AB03648 [0,2,0,0,0,0|2,0,0]=4 1252 B10R1.8 Cc1cc(nc(n1)CN)C AB12971 [0,2,0,0,0,0|2,0,0]=4 1253 B10R1.8 Cc1cc(nc(n1)CN)Cl AB62683 [0,2,0,0,0,0|2,0,0]=4 1254 B10R1.8 Cc1cc(nc(n1)CN)O AB63185 [0,2,0,0,0,0|2,0,0]=4 1255 B10R1.8 Cc1cc(nc(n1)NC)Cl AB44237 [0,2,0,0,0,0|2,0,0]=4 1256 B10R1.8 Cc1cc(nc(n1)NC)O AB43850 [0,2,0,0,0,0|2,0,0]=4 1257 B10R1.8 Cc1cc(nc(n1)OC)Cl AB71553 [0,2,0,0,0,0|2,0,0]=4 1258 B10R1.8 Cc1nc(cc(n1)Cl)SC PB19483 [0,2,0,0,0,0|2,0,0]=4 1259 B10R1.8 c1c(cc(nc1CCl)Br)Br AB78385 [0,2,0,0,0,0|2,0,0]=4 1260 B10R1.8 c1c(cc(nc1CCl)Br)Cl AB78552 [0,2,0,0,0,0|2,0,0]=4 1261 B10R1.8 c1c(cc(nc1CCl)Br)F AB78526 [0,2,0,0,0,0|2,0,0]=4 1262 B10R1.8 c1c(cc(nc1CCl)Br)I AB78387 [0,2,0,0,0,0|2,0,0]=4 1263 B10R1.8 c1c(cc(nc1CCl)Br)O AB78405 [0,2,0,0,0,0|2,0,0]=4 1264 B10R1.8 c1c(cc(nc1CCl)Cl)Br AB78369 [0,2,0,0,0,0|2,0,0]=4 1265 B10R1.8 c1c(cc(nc1CCl)Cl)Cl AB74558 [0,2,0,0,0,0|2,0,0]=4 1266 B10R1.8 c1c(cc(nc1CCl)Cl)F AB78523 [0,2,0,0,0,0|2,0,0]=4 1267 B10R1.8 c1c(cc(nc1CCl)Cl)I AB78371 [0,2,0,0,0,0|2,0,0]=4 1268 B10R1.8 c1c(cc(nc1CCl)Cl)O AB78384 [0,2,0,0,0,0|2,0,0]=4 1269 B10R1.8 c1c(cc(nc1CCl)F)Br AB72841 [0,2,0,0,0,0|2,0,0]=4 1270 B10R1.8 c1c(cc(nc1CCl)F)Cl AB78349 [0,2,0,0,0,0|2,0,0]=4 1271 B10R1.8 c1c(cc(nc1CCl)F)F AB78346 [0,2,0,0,0,0|2,0,0]=4 1272 B10R1.8 c1c(cc(nc1CCl)F)I AB78352 [0,2,0,0,0,0|2,0,0]=4 1273 B10R1.8 c1c(cc(nc1CCl)F)O AB78366 [0,2,0,0,0,0|2,0,0]=4 1274 B10R1.8 c1c(cc(nc1CCl)I)Br AB78567 [0,2,0,0,0,0|2,0,0]=4 1275 B10R1.8 c1c(cc(nc1CCl)I)Cl AB78555 [0,2,0,0,0,0|2,0,0]=4 1276 B10R1.8 c1c(cc(nc1CCl)I)F AB78529 [0,2,0,0,0,0|2,0,0]=4 1277 B10R1.8 c1c(cc(nc1CCl)I)O AB78424 [0,2,0,0,0,0|2,0,0]=4 1278 B10R1.8 c1c(cc(nc1CCl)N)F AB78536 [0,2,0,0,0,0|2,0,0]=4 1279 B10R1.8 c1c(cc(nc1CN)Br)Br AB80071 [0,2,0,0,0,0|2,0,0]=4 1280 B10R1.8 c1c(cc(nc1CN)Br)Cl AB75027 [0,2,0,0,0,0|2,0,0]=4 1281 B10R1.8 c1c(cc(nc1CN)Br)F AB80221 [0,2,0,0,0,0|2,0,0]=4 1282 B10R1.8 c1c(cc(nc1CN)Br)I AB80074 [0,2,0,0,0,0|2,0,0]=4 1283 B10R1.8 c1c(cc(nc1CN)Br)N AB74598 [0,2,0,0,0,0|2,0,0]=4 1284 B10R1.8 c1c(cc(nc1CN)Br)O AB80093 [0,2,0,0,0,0|2,0,0]=4 1285 B10R1.8 c1c(cc(nc1CN)Cl)Br AB80055 [0,2,0,0,0,0|2,0,0]=4 1286 B10R1.8 c1c(cc(nc1CN)Cl)Cl AB62527 [0,2,0,0,0,0|2,0,0]=4 1287 B10R1.8 c1c(cc(nc1CN)Cl)F AB80218 [0,2,0,0,0,0|2,0,0]=4 1288 B10R1.8 c1c(cc(nc1CN)Cl)I AB80057 [0,2,0,0,0,0|2,0,0]=4 1289 B10R1.8 c1c(cc(nc1CN)Cl)N AB80061 [0,2,0,0,0,0|2,0,0]=4 1290 B10R1.8 c1c(cc(nc1CN)Cl)O AB80068 [0,2,0,0,0,0|2,0,0]=4 1291 B10R1.8 c1c(cc(nc1CN)F)Br AB72834 [0,2,0,0,0,0|2,0,0]=4 1292 B10R1.8 c1c(cc(nc1CN)F)Cl AB80030 [0,2,0,0,0,0|2,0,0]=4 1293 B10R1.8 c1c(cc(nc1CN)F)F AB80027 [0,2,0,0,0,0|2,0,0]=4 1294 B10R1.8 c1c(cc(nc1CN)F)I AB80031 [0,2,0,0,0,0|2,0,0]=4 1295 B10R1.8 c1c(cc(nc1CN)F)N AB80039 [0,2,0,0,0,0|2,0,0]=4 1296 B10R1.8 c1c(cc(nc1CN)F)O AB80053 [0,2,0,0,0,0|2,0,0]=4 1297 B10R1.8 c1c(cc(nc1CN)I)Br AB80260 [0,2,0,0,0,0|2,0,0]=4 1298 B10R1.8 c1c(cc(nc1CN)I)Cl AB80246 [0,2,0,0,0,0|2,0,0]=4 1299 B10R1.8 c1c(cc(nc1CN)I)F AB80222 [0,2,0,0,0,0|2,0,0]=4 1300 B10R1.8 c1c(cc(nc1CN)I)N AB80101 [0,2,0,0,0,0|2,0,0]=4 1301 B10R1.8 c1c(cc(nc1CN)I)O AB80112 [0,2,0,0,0,0|2,0,0]=4 1302 B10R1.8 c1c(cc(nc1CN)N)Br AB80266 [0,2,0,0,0,0|2,0,0]=4 1303 B10R1.8 c1c(cc(nc1CN)N)Cl AB80252 [0,2,0,0,0,0|2,0,0]=4 1304 B10R1.8 c1c(cc(nc1CN)N)F AB80230 [0,2,0,0,0,0|2,0,0]=4 1305 B10R1.8 c1c(cc(nc1CN)N)I AB80282 [0,2,0,0,0,0|2,0,0]=4 1306 B10R1.8 c1c(cc(nc1CN)N)N AB80197 [0,2,0,0,0,0|2,0,0]=4 1307 B10R1.8 c1c(cc(nc1CN)N)O AB80194 [0,2,0,0,0,0|2,0,0]=4 1308 B10R1.8 c1c(cc(nc1CN)O)Br AB80276 [0,2,0,0,0,0|2,0,0]=4 1309 B10R1.8 c1c(cc(nc1CN)O)Cl AB80258 [0,2,0,0,0,0|2,0,0]=4 1310 B10R1.8 c1c(cc(nc1CN)O)F AB80245 [0,2,0,0,0,0|2,0,0]=4 1311 B10R1.8 c1c(cc(nc1CN)O)I AB80296 [0,2,0,0,0,0|2,0,0]=4 1312 B10R1.8 c1c(cc(nc1CN)O)N AB80381 [0,2,0,0,0,0|2,0,0]=4 1313 B10R1.8 c1c(cc(nc1CN)O)O AB80216 [0,2,0,0,0,0|2,0,0]=4 1314 B10R1.10 CCCc1cccc(n1)N AB03673 [0,2,0,0,0,0|2,0,0]=4 1315 B10R1.10 CCOc1cc(cnc1)Br AB05134 [0,2,0,0,0,0|2,0,0]=4 1316 B10R1.10 CCOc1cccc(n1)Br AB05279 [0,2,0,0,0,0|2,0,0]=4 1317 B10R1.10 CCOc1cccc(n1)N AB05302 [0,2,0,0,0,0|2,0,0]=4 1318 B10R1.10 CCOc1cncc(n1)Cl AB52638 [0,2,0,0,0,0|1,0,0]=3 1319 B10R1.10 CNCc1cc(cnc1)Br AB41067 [0,2,0,0,0,0|2,0,0]=4 1320 B10R1.10 CNCc1cc(cnc1)Cl AB67611 [0,2,0,0,0,0|2,0,0]=4 1321 B10R1.10 CNCc1cc(cnc1)F AB67670 [0,2,0,0,0,0|2,0,0]=4 1322 B10R1.10 CNCc1cc(cnc1)N AB67751 [0,2,0,0,0,0|2,0,0]=4 1323 B10R1.10 CNCc1cccc(n1)Br AB48344 [0,2,0,0,0,0|2,0,0]=4 1324 B10R1.10 CNCc1cccc(n1)Cl AB67315 [0,2,0,0,0,0|2,0,0]=4 1325 B10R1.10 CNCc1cccc(n1)F AB72833 [0,2,0,0,0,0|2,0,0]=4 1326 B10R1.10 Cc1cc(cnc1)CCN AB55190 [0,2,0,0,0,0|1,0,0]=3 1327 B10R1.10 Cc1cc(cnc1)CNC AB67507 [0,2,0,0,0,0|1,0,0]=3 1328 B10R1.10 Cc1cc(cnc1)N=C=O AB74220 [0,2,0,0,0,0|1,0,1]=4 1329 B10R1.10 Cc1cccc(c1)CC=O AB11815 [0,2,0,0,0,0|2,0,0]=4 1330 B10R1.10 Cc1cccc(n1)CCN AB17067 [0,2,0,0,0,0|1,0,0]=3 1331 B10R1.10 Cc1cccc(n1)CNC AB01381 [0,2,0,0,0,0|1,0,0]=3 1332 B10R1.10 Cc1ccnc(n1)CCN AB59280 [0,2,0,0,0,0|2,0,0]=4 1333 B10R1.10 c1c(cncc1Br)CC#N PB14457 [0,2,0,0,0,0|2,0,0]=4 1334 B10R1.10 c1c(cncc1Br)CCN AB41071 [0,2,0,0,0,0|2,0,0]=4 1335 B10R1.10 c1c(cncc1Br)CNN PB37854 [0,2,0,0,0,0|2,0,0]=4 1336 B10R1.10 c1c(cncc1Cl)CCN AB67621 [0,2,0,0,0,0|2,0,0]=4 1337 B10R1.10 c1c(cncc1F)CC#N PB29755 [0,2,0,0,0,0|2,0,0]=4 1338 B10R1.10 c1c(cncc1F)CCN AB55166 [0,2,0,0,0,0|2,0,0]=4 1339 B10R1.10 c1c(cncc1N)CCN AB67760 [0,2,0,0,0,0|2,0,0]=4 1340 B10R1.10 c1c(nc(cn1)Cl)CCN AB69954 [0,2,0,0,0,0|1,0,0]=3 1341 B10R1.10 c1cc(nc(c1)Br)CC#N AB48704 [0,2,0,0,0,0|2,0,0]=4 1342 B10R1.10 c1cc(nc(c1)Br)CCN AB45432 [0,2,0,0,0,0|2,0,0]=4 1343 B10R1.10 c1cc(nc(c1)Br)CCO CB11431 [0,2,0,0,0,0|2,0,0]=4 1344 B10R1.10 c1cc(nc(c1)Cl)CC#N AB51195 [0,2,0,0,0,0|2,0,0]=4 1345 B10R1.10 c1cc(nc(c1)Cl)CCN AB67354 [0,2,0,0,0,0|2,0,0]=4 1346 B10R1.10 c1cc(nc(c1)F)CC#N AB55154 [0,2,0,0,0,0|2,0,0]=4 1347 B10R1.10 c1cc(nc(c1)F)CCN AB45492 [0,2,0,0,0,0|2,0,0]=4 1348 B10R1.10 c1cc(nc(c1)F)CCO AB55227 [0,2,0,0,0,0|2,0,0]=4 1349 B10R1.10 c1cc(nc(c1)N)CCN AB55667 [0,2,0,0,0,0|2,0,0]=4 1350 B10R1.30 CCc1cc(ccc1O)C MB23622 [0,2,0,0,0,0|2,0,0]=4 1351 B10R1.30 CNc1cc(cnc1Cl)Br AB40833 [0,2,0,0,0,0|2,0,0]=4 1352 B10R1.30 CNc1cc(cnc1Cl)Cl AB41028 [0,2,0,0,0,0|2,0,0]=4 1353 B10R1.30 COc1c(ccc(n1)Br)F AB74998 [0,2,0,0,0,0|2,0,0]=4 1354 B10R1.30 COc1c(ccc(n1)Cl)O AB69331 [0,2,0,0,0,0|2,0,0]=4 1355 B10R1.30 COc1c(ccc(n1)I)Br AB73529 [0,2,0,0,0,0|2,0,0]=4 1356 B10R1.30 COc1c(ccc(n1)N)F AB76983 [0,2,0,0,0,0|2,0,0]=4 1357 B10R1.30 COc1c(ncc(n1)Br)Br AB54782 [0,2,0,0,0,0|1,0,0]=3 1358 B10R1.30 COc1c(ncc(n1)Br)Cl AB72501 [0,2,0,0,0,0|1,0,0]=3 1359 B10R1.30 COc1c(ncc(n1)Br)N AB44806 [0,2,0,0,0,0|1,0,0]=3 1360 B10R1.30 COc1c(ncc(n1)Cl)N AB64255 [0,2,0,0,0,0|1,0,0]=3 1361 B10R1.30 COc1c(nnc(n1)Cl)Cl AB72424 [0,2,0,0,0,0|2,0,0]=4 1362 B10R1.30 COc1cc(cnc1Cl)Br AB43719 [0,2,0,0,0,0|2,0,0]=4 1363 B10R1.30 COc1cc(cnc1Cl)F AB74801 [0,2,0,0,0,0|2,0,0]=4 1364 B10R1.30 Cc1c(cc(cn1)Cl)CN AB62431 [0,2,0,0,0,0|2,0,0]=4 1365 B10R1.30 Cc1cc(c(nc1)Br)C=O AB71097 [0,2,0,0,0,0|1,0,1]=4 1366 B10R1.30 Cc1cc(c(nc1)Br)CCl AB71047 [0,2,0,0,0,0|1,0,0]=3 1367 B10R1.30 Cc1cc(c(nc1)C)C=O AB71657 [0,2,0,0,0,0|1,0,1]=4 1368 B10R1.30 Cc1cc(c(nc1)C)CCl AB75394 [0,2,0,0,0,0|1,0,0]=3 1369 B10R1.30 Cc1cc(c(nc1)C)CN AB76781 [0,2,0,0,0,0|1,0,0]=3 1370 B10R1.30 Cc1cc(c(nc1)Cl)C#N AB41821 [0,2,0,0,0,0|1,0,1]=4 1371 B10R1.30 Cc1cc(c(nc1)Cl)C=O AB41813 [0,2,0,0,0,0|1,0,1]=4 1372 B10R1.30 Cc1cc(c(nc1)Cl)CCl AB71113 [0,2,0,0,0,0|1,0,0]=3 1373 B10R1.30 Cc1cc(c(nc1)Cl)CN AB41819 [0,2,0,0,0,0|1,0,0]=3 1374 B10R1.30 Cc1cc(c(nc1)F)C=O AB65261 [0,2,0,0,0,0|1,0,1]=4 1375 B10R1.30 Cc1cc(c(nc1)F)CCl AB71237 [0,2,0,0,0,0|1,0,0]=3 1376 B10R1.30 Cc1cc(c(nc1)F)CN AB65158 [0,2,0,0,0,0|1,0,0]=3 1377 B10R1.30 Cc1cc(c(nc1)N)C=O AB51533 [0,2,0,0,0,0|1,0,1]=4 1378 B10R1.30 Cc1cc(c(nc1)N)CCl AB70870 [0,2,0,0,0,0|1,0,0]=3 1379 B10R1.30 Cc1cc(c(nc1)O)C#N AB64064 [0,2,0,0,0,0|1,0,1]=4 1380 B10R1.30 Cc1cc(c(nc1)O)C=O AB71365 [0,2,0,0,0,0|1,0,1]=4 1381 B10R1.30 Cc1cc(c(nn1)O)CN PB23030 [0,2,0,0,0,0|2,0,0]=4 1382 B10R1.30 Cc1ccc(c(c1)SC)O MB34646 [0,2,0,0,0,0|2,0,0]=4 1383 B10R1.30 Cc1ccc(c(n1)C#N)Br PB15947 [0,2,0,0,0,0|1,0,1]=4 1384 B10R1.30 Cc1ccc(c(n1)C=O)Br AB68163 [0,2,0,0,0,0|1,0,1]=4 1385 B10R1.30 Cc1ccc(c(n1)C=O)Cl AB68143 [0,2,0,0,0,0|1,0,1]=4 1386 B10R1.30 Cc1ccc(c(n1)C=O)N AB76244 [0,2,0,0,0,0|1,0,1]=4 1387 B10R1.30 Cc1ccc(c(n1)C=O)O AB62933 [0,2,0,0,0,0|1,0,1]=4 1388 B10R1.30 Cc1ccc(c(n1)CN)Br AB68170 [0,2,0,0,0,0|1,0,0]=3 1389 B10R1.30 Cc1ccc(c(n1)CN)Cl AB68153 [0,2,0,0,0,0|1,0,0]=3 1390 B10R1.30 Cc1ccc(nc1C#N)C AB25377 [0,2,0,0,0,0|1,0,1]=4 1391 B10R1.30 Cc1ccc(nc1C=O)C AB75403 [0,2,0,0,0,0|1,0,1]=4 1392 B10R1.30 Cc1ccc(nc1CCl)C AB75390 [0,2,0,0,0,0|1,0,0]=3 1393 B10R1.30 Cc1ccc(nc1CCl)Cl AB75115 [0,2,0,0,0,0|2,0,0]=4 1394 B10R1.30 Cc1ccc(nc1CCl)F AB82887 [0,2,0,0,0,0|2,0,0]=4 1395 B10R1.30 Cc1ccc(nc1CN)C AB65466 [0,2,0,0,0,0|1,0,0]=3 1396 B10R1.30 Cc1ccc(nc1CN)Cl AB75112 [0,2,0,0,0,0|2,0,0]=4 1397 B10R1.30 Cc1ccc(nc1CN)F AB82890 [0,2,0,0,0,0|2,0,0]=4 1398 B10R1.30 Cc1cnc(c(n1)C=O)C AB77040 [0,2,0,0,0,0|0,0,1]=3 1399 B10R1.30 Cc1cnc(c(n1)CCl)C AB76280 [0,2,0,0,0,0|0,0,0]=2 1400 B10R1.30 Cc1cnc(c(n1)CN)C AB77043 [0,2,0,0,0,0|0,0,0]=2 1401 B10R1.30 c1c(cnc(c1CBr)N)Br AB44379 [0,2,0,0,0,0|2,0,0]=4 1402 B10R1.30 c1c(cnc(c1CCl)Cl)F AB70662 [0,2,0,0,0,0|2,0,0]=4 1403 B10R1.30 c1c(cnc(c1CCl)N)Br AB71006 [0,2,0,0,0,0|2,0,0]=4 1404 B10R1.30 c1c(cnc(c1CCl)N)Cl AB75385 [0,2,0,0,0,0|2,0,0]=4 1405 B10R1.30 c1c(cnc(c1CN)Cl)F AB65094 [0,2,0,0,0,0|2,0,0]=4 1406 B10R1.30 c1c(cnc(c1CN)F)Br PB16767 [0,2,0,0,0,0|2,0,0]=4 1407 B10R1.30 c1c(cnc(c1CO)Cl)Br PB17569 [0,2,0,0,0,0|2,0,0]=4 1408 B10R1.30 c1c(cnc(c1CO)Cl)F AB13672 [0,2,0,0,0,0|2,0,0]=4 1409 B10R1.30 c1c(cnc(c1CO)F)Br PB34780 [0,2,0,0,0,0|2,0,0]=4 1410 B10R1.30 c1c(cnc(c1CO)N)Br AB22233 [0,2,0,0,0,0|2,0,0]=4 1411 B10R1.30 c1c(cnc(c1CO)N)Br AB44376 [0,2,0,0,0,0|2,0,0]=4 1412 B10R1.30 c1c(cnc(c1CO)N)I AB21855 [0,2,0,0,0,0|2,0,0]=4 1413 B10R1.30 c1c(nc(c(n1)Br)C#N)Br PB27296 [0,2,0,0,0,0|1,0,1]=4 1414 B10R1.30 c1c(nc(c(n1)Cl)C=O)Cl AB85727 [0,2,0,0,0,0|1,0,1]=4 1415 B10R1.30 c1c(nc(c(n1)N)C#N)Cl AB60487 [0,2,0,0,0,0|1,0,1]=4 1416 B10R1.30 c1c(nc(c(n1)N)C=O)Br AB69711 [0,2,0,0,0,0|1,0,1]=4 1417 B10R1.30 c1c(nc(c(n1)N)C=O)Cl AB60422 [0,2,0,0,0,0|1,0,1]=4 1418 B10R1.30 c1c(nc(c(n1)N)CCl)Cl AB85695 [0,2,0,0,0,0|1,0,0]=3 1419 B10R1.30 c1cc(nc(c1Br)CN)Cl AB73060 [0,2,0,0,0,0|2,0,0]=4 1420 B10R1.30 c1cc(nc(c1Cl)CN)Cl AB68215 [0,2,0,0,0,0|2,0,0]=4 1421 B10R1.30 c1cc(nc(c1F)CCl)Cl AB71000 [0,2,0,0,0,0|2,0,0]=4 1422 B10R1.30 c1cc(nc(c1F)CN)Cl AB74839 [0,2,0,0,0,0|2,0,0]=4 1423 B10R1.113 B(c1cccc(n1)C)(O)O AB13224 [0,2,0,0,0,0|2,0,0]=4 1424 B10R1.113 B(c1cncc(n1)C)(O)O AB54283 [0,2,0,0,0,0|1,0,0]=3 1425 B10R1.113 B(c1cncc(n1)Cl)(O)O AB43319 [0,2,0,0,0,0|2,0,0]=4 1426 B10R1.113 B(c1cncc(n1)N)(O)O AB45590 [0,2,0,0,0,0|2,0,0]=4 1427 B10R1.113 CC(=O)c1cc(cnc1)Br PB20794 [0,2,0,0,0,0|2,0,0]=4 1428 B10R1.113 CC(=O)c1cc(cnc1)F AB41114 [0,2,0,0,0,0|2,0,0]=4 1429 B10R1.113 CC(=O)c1cc(cnc1)N AB30920 [0,2,0,0,0,0|2,0,0]=4 1430 B10R1.113 CC(=O)c1cccc(n1)Br AB05570 [0,2,0,0,0,0|2,0,0]=4 1431 B10R1.113 CC(=O)c1cccc(n1)Cl AB41100 [0,2,0,0,0,0|2,0,0]=4 1432 B10R1.113 CC(=O)c1cccc(n1)F AB50226 [0,2,0,0,0,0|2,0,0]=4 1433 B10R1.113 CC(=O)c1cccc(n1)N AB67452 [0,2,0,0,0,0|2,0,0]=4 1434 B10R1.113 CC(C)c1cc(cnc1)Br MB14162 [0,2,0,0,0,0|2,0,0]=4 1435 B10R1.113 CC(C)c1cc(cnc1)O MB22682 [0,2,0,0,0,0|2,0,0]=4 1436 B10R1.113 CC(C)c1cccc(n1)Br MB09496 [0,2,0,0,0,0|2,0,0]=4 1437 B10R1.113 CC(c1cc(cnc1)Br)N AB41075 [0,2,0,0,0,0|2,0,0]=4 1438 B10R1.113 CC(c1cccc(n1)Br)N AB67302 [0,2,0,0,0,0|2,0,0]=4 1439 B10R1.113 CC(c1cccc(n1)Cl)N AB67350 [0,2,0,0,0,0|2,0,0]=4 1440 B10R1.113 CN(C)c1cc(cnc1)Br MB12044 [0,2,0,0,0,0|2,0,0]=4 1441 B10R1.113 CN(C)c1cc(cnc1)O MB24985 [0,2,0,0,0,0|2,0,0]=4 1442 B10R1.113 CN(C)c1cccc(n1)Br AB54123 [0,2,0,0,0,0|2,0,0]=4 1443 B10R1.113 CN(C)c1cccc(n1)Cl AB67484 [0,2,0,0,0,0|2,0,0]=4 1444 B10R1.113 CN(C)c1cncc(n1)Cl AB65245 [0,2,0,0,0,0|1,0,0]=3 1445 B10R1.113 CN(C)c1cnnc(n1)Cl AB71505 [0,2,0,0,0,0|2,0,0]=4 1446 B10R1.113 Cc1cc(cnc1)C(=O)O PB12710 [0,2,0,0,0,0|1,0,1]=4 1447 B10R1.113 Cc1cc(cnc1)[N+](=O)[O-] AB17987 [0,2,0,0,0,0|2,0,0]=4 1448 B10R1.113 Cc1cccc(n1)C(=O)C AB25782 [0,2,0,0,0,0|1,0,0]=3 1449 B10R1.113 Cc1cccc(n1)C(=O)O AB01368 [0,2,0,0,0,0|1,0,1]=4 1450 B10R1.113 Cc1cccc(n1)C(C)N AB25816 [0,2,0,0,0,0|1,0,0]=3 1451 B10R1.113 Cc1ccnc(n1)C(C)N AB59470 [0,2,0,0,0,0|2,0,0]=4 1452 B10R1.113 Cc1cncc(n1)C(=O)O AB48615 [0,2,0,0,0,0|0,0,1]=3 1453 B10R1.113 Cc1nccc(n1)C(=O)C AB04788 [0,2,0,0,0,0|2,0,0]=4 1454 B10R1.113 c1c(cncc1Br)C(F)F AB70752 [0,2,0,0,0,0|2,0,0]=4 1455 B10R1.113 c1c(cncc1N)C(F)F AB75499 [0,2,0,0,0,0|2,0,0]=4 1456 B10R1.113 c1c(cncc1O)C(F)F AB85525 [0,2,0,0,0,0|2,0,0]=4 1457 B10R1.113 c1c(nc(cn1)Br)C(=O)N MB14307 [0,2,0,0,0,0|1,0,1]=4 1458 B10R1.113 c1c(nc(cn1)Br)C(=O)O AB69955 [0,2,0,0,0,0|1,0,1]=4 1459 B10R1.113 c1c(nc(cn1)Cl)C(=O)O PB21720 [0,2,0,0,0,0|1,0,1]=4 1460 B10R1.113 c1c(nc(cn1)Cl)[N+](=O)[O-] AB60515 [0,2,0,0,0,0|2,0,0]=4 1461 B10R1.113 c1c(nc(cn1)N)C(=O)O AB60537 [0,2,0,0,0,0|1,0,1]=4 1462 B10R1.113 c1cc(nc(c1)Br)C(F)F AB70747 [0,2,0,0,0,0|2,0,0]=4 1463 B10R1.172 CNc1ccnc(n1)NC AB63464 [0,2,0,0,0,0|2,0,0]=4 1464 B10R1.172 COc1cc(cnc1)C#C AB63414 [0,2,0,0,0,0|1,0,1]=4 1465 B10R1.172 COc1cc(cnc1)C=O PB23495 [0,2,0,0,0,0|1,0,1]=4 1466 B10R1.172 COc1cc(cnc1)CCl AB67553 [0,2,0,0,0,0|1,0,0]=3 1467 B10R1.172 COc1cc(cnc1)CN PB36726 [0,2,0,0,0,0|1,0,0]=3 1468 B10R1.172 COc1cc(cnc1)CO PB11991 [0,2,0,0,0,0|1,0,0]=3 1469 B10R1.172 COc1cccc(n1)C=O AB22243 [0,2,0,0,0,0|1,0,1]=4 1470 B10R1.172 COc1cccc(n1)CCl AB59984 [0,2,0,0,0,0|1,0,0]=3 1471 B10R1.172 COc1cccc(n1)CN AB64449 [0,2,0,0,0,0|1,0,0]=3 1472 B10R1.172 COc1cccc(n1)CO AB43774 [0,2,0,0,0,0|1,0,0]=3 1473 B10R1.172 COc1ccnc(n1)CCl AB59089 [0,2,0,0,0,0|2,0,0]=4 1474 B10R1.172 COc1ccnc(n1)CN AB63192 [0,2,0,0,0,0|2,0,0]=4 1475 B10R1.172 COc1cncc(n1)C#C AB69157 [0,2,0,0,0,0|0,0,1]=3 1476 B10R1.172 COc1cncc(n1)C#N AB60489 [0,2,0,0,0,0|0,0,1]=3 1477 B10R1.172 COc1cncc(n1)C=O AB73162 [0,2,0,0,0,0|0,0,1]=3 1478 B10R1.172 COc1cncc(n1)CCl AB73154 [0,2,0,0,0,0|0,0,0]=2 1479 B10R1.172 COc1cncc(n1)CN AB73157 [0,2,0,0,0,0|0,0,0]=2 1480 B10R1.172 COc1nccc(n1)CCl AB58943 [0,2,0,0,0,0|2,0,0]=4 1481 B10R1.172 COc1nccc(n1)CN PB16289 [0,2,0,0,0,0|2,0,0]=4 1482 B10R1.172 COc1nccc(n1)CO PB24420 [0,2,0,0,0,0|2,0,0]=4 1483 B10R1.172 CSc1nccc(n1)CCl AB58948 [0,2,0,0,0,0|2,0,0]=4 1484 B10R1.172 c1c(cncc1C#N)CCl AB60036 [0,2,0,0,0,0|1,0,1]=4 1485 B10R1.172 c1c(cncc1C#N)CN AB67696 [0,2,0,0,0,0|1,0,1]=4 1486 B10R1.172 c1c(cncc1C#N)CO AB31356 [0,2,0,0,0,0|1,0,1]=4 1487 B10R1.172 c1c(cncc1C=O)CCl AB69676 [0,2,0,0,0,0|1,0,1]=4 1488 B10R1.172 c1c(cncc1C=O)CN AB31382 [0,2,0,0,0,0|1,0,1]=4 1489 B10R1.172 c1c(nc(cn1)C=O)C=O AB74048 [0,2,0,0,0,0|0,0,2]=4 1490 B10R1.172 c1cc(nc(c1)C#N)CBr MB08544 [0,2,0,0,0,0|1,0,1]=4 1491 B10R1.172 c1cc(nc(c1)C#N)CCl AB55701 [0,2,0,0,0,0|1,0,1]=4 1492 B10R1.172 c1cc(nc(c1)C#N)CN AB29677 [0,2,0,0,0,0|1,0,1]=4 1493 B10R1.172 c1cc(nc(c1)C#N)CO AB31421 [0,2,0,0,0,0|1,0,1]=4 1494 B10R1.172 c1cc(nc(c1)C=O)CCl AB54693 [0,2,0,0,0,0|1,0,1]=4 1495 B10R1.172 c1cc(nc(c1)CO)CN AB31423 [0,2,0,0,0,0|1,0,0]=3 1496 B10R1.176 CCc1ccc(c(c1)C)O MB23862 [0,2,0,0,0,0|2,0,0]=4 1497 B10R1.176 COc1cc(c(nc1)Cl)N AB62900 [0,2,0,0,0,0|2,0,0]=4 1498 B10R1.176 COc1cc(c(nc1)Cl)O AB71170 [0,2,0,0,0,0|2,0,0]=4 1499 B10R1.176 COc1cc(c(nc1)N)Cl AB70867 [0,2,0,0,0,0|2,0,0]=4 1500 B10R1.176 COc1cc(c(nc1)O)Cl AB71174 [0,2,0,0,0,0|2,0,0]=4 1501 B10R1.176 COc1ccc(c(n1)Br)N AB21737 [0,2,0,0,0,0|2,0,0]=4 1502 B10R1.176 COc1ccc(c(n1)Cl)N AB49773 [0,2,0,0,0,0|2,0,0]=4 1503 B10R1.176 COc1ccc(c(n1)Cl)O AB69288 [0,2,0,0,0,0|2,0,0]=4 1504 B10R1.176 COc1ccc(c(n1)N)Br AB43426 [0,2,0,0,0,0|2,0,0]=4 1505 B10R1.176 COc1ccc(c(n1)N)Cl AB62898 [0,2,0,0,0,0|2,0,0]=4 1506 B10R1.176 COc1ccc(c(n1)N)N AB25773 [0,2,0,0,0,0|2,0,0]=4 1507 B10R1.176 COc1ccc(c(n1)O)Cl AB75736 [0,2,0,0,0,0|2,0,0]=4 1508 B10R1.176 CSc1nc(c(nn1)Cl)N AB72435 [0,2,0,0,0,0|2,0,0]=4 1509 B10R1.176 Cc1c(cc(cn1)CCl)Cl AB74647 [0,2,0,0,0,0|2,0,0]=4 1510 B10R1.176 Cc1c(cc(cn1)CCl)F AB76305 [0,2,0,0,0,0|2,0,0]=4 1511 B10R1.176 Cc1c(cc(cn1)CN)Cl AB74649 [0,2,0,0,0,0|2,0,0]=4 1512 B10R1.176 Cc1c(cc(cn1)CN)F AB76308 [0,2,0,0,0,0|2,0,0]=4 1513 B10R1.176 Cc1c(cc(cn1)OC)N AB73554 [0,2,0,0,0,0|2,0,0]=4 1514 B10R1.176 Cc1c(ccc(n1)C#N)N AB43410 [0,2,0,0,0,0|1,0,1]=4 1515 B10R1.176 Cc1c(ccc(n1)C=O)Br MB09863 [0,2,0,0,0,0|1,0,1]=4 1516 B10R1.176 Cc1c(ccc(n1)C=O)Cl AB70731 [0,2,0,0,0,0|1,0,1]=4 1517 B10R1.176 Cc1c(ccc(n1)C=O)F AB44884 [0,2,0,0,0,0|1,0,1]=4 1518 B10R1.176 Cc1c(ccc(n1)CCl)Cl AB83321 [0,2,0,0,0,0|1,0,0]=3 1519 B10R1.176 Cc1c(ccc(n1)CCl)F AB83035 [0,2,0,0,0,0|1,0,0]=3 1520 B10R1.176 Cc1c(ccc(n1)CN)Cl AB75079 [0,2,0,0,0,0|1,0,0]=3 1521 B10R1.176 Cc1c(ccc(n1)CN)F AB75158 [0,2,0,0,0,0|1,0,0]=3 1522 B10R1.176 Cc1c(ccc(n1)OC)Br AB13393 [0,2,0,0,0,0|1,0,0]=3 1523 B10R1.176 Cc1c(nc(cn1)C=O)C AB77048 [0,2,0,0,0,0|0,0,1]=3 1524 B10R1.176 Cc1c(nc(cn1)CCl)C AB76287 [0,2,0,0,0,0|0,0,0]=2 1525 B10R1.176 Cc1c(nc(cn1)CN)C AB77049 [0,2,0,0,0,0|0,0,0]=2 1526 B10R1.176 Cc1c(ncc(n1)C#N)Br AB72509 [0,2,0,0,0,0|0,0,1]=3 1527 B10R1.176 Cc1c(ncc(n1)C#N)Cl AB72508 [0,2,0,0,0,0|0,0,1]=3 1528 B10R1.176 Cc1c(ncc(n1)CCl)Cl AB72511 [0,2,0,0,0,0|0,0,0]=2 1529 B10R1.176 Cc1c(ncc(n1)CN)Cl AB72510 [0,2,0,0,0,0|0,0,0]=2 1530 B10R1.176 Cc1c(ncc(n1)OC)Br AB85658 [0,2,0,0,0,0|0,0,0]=2 1531 B10R1.176 Cc1c(ncc(n1)OC)Cl AB85661 [0,2,0,0,0,0|0,0,0]=2 1532 B10R1.176 Cc1cc(ccc1Br)CO AB50387 [0,2,0,0,0,0|2,0,0]=4 1533 B10R1.176 Cc1cc(ccc1O)CN MB05062 [0,2,0,0,0,0|2,0,0]=4 1534 B10R1.176 Cc1cc(ccc1O)NC MB07546 [0,2,0,0,0,0|2,0,0]=4 1535 B10R1.176 Cc1cc(cnc1Br)C=O AB44906 [0,2,0,0,0,0|1,0,1]=4 1536 B10R1.176 Cc1cc(cnc1Br)OC AB74660 [0,2,0,0,0,0|1,0,0]=3 1537 B10R1.176 Cc1cc(cnc1C)C=O AB75407 [0,2,0,0,0,0|1,0,1]=4 1538 B10R1.176 Cc1cc(cnc1C)CCl AB75391 [0,2,0,0,0,0|1,0,0]=3 1539 B10R1.176 Cc1cc(cnc1C)CN AB70585 [0,2,0,0,0,0|1,0,0]=3 1540 B10R1.176 Cc1cc(cnc1C)OC AB85300 [0,2,0,0,0,0|1,0,0]=3 1541 B10R1.176 Cc1cc(cnc1Cl)C#N AB50049 [0,2,0,0,0,0|1,0,1]=4 1542 B10R1.176 Cc1cc(cnc1Cl)C=O AB64236 [0,2,0,0,0,0|1,0,1]=4 1543 B10R1.176 Cc1cc(cnc1Cl)CCl AB50053 [0,2,0,0,0,0|1,0,0]=3 1544 B10R1.176 Cc1cc(cnc1Cl)CN AB74569 [0,2,0,0,0,0|1,0,0]=3 1545 B10R1.176 Cc1cc(cnc1Cl)OC AB71233 [0,2,0,0,0,0|1,0,0]=3 1546 B10R1.176 Cc1cc(cnc1F)C=O AB25943 [0,2,0,0,0,0|1,0,1]=4 1547 B10R1.176 Cc1cc(cnc1F)CCl AB64242 [0,2,0,0,0,0|1,0,0]=3 1548 B10R1.176 Cc1cc(cnc1F)CN AB83087 [0,2,0,0,0,0|1,0,0]=3 1549 B10R1.176 Cc1cc(cnc1N)C#N AB25364 [0,2,0,0,0,0|1,0,1]=4 1550 B10R1.176 Cc1cc(cnc1N)OC AB73557 [0,2,0,0,0,0|1,0,0]=3 1551 B10R1.176 Cc1ccc(nc1C)C=O AB74104 [0,2,0,0,0,0|1,0,1]=4 1552 B10R1.176 Cc1ccc(nc1C)CCl AB64955 [0,2,0,0,0,0|1,0,0]=3 1553 B10R1.176 Cc1ccc(nc1C)CN AB65463 [0,2,0,0,0,0|1,0,0]=3 1554 B10R1.176 Cc1ccc(nc1Cl)CCl AB75101 [0,2,0,0,0,0|2,0,0]=4 1555 B10R1.176 Cc1ccc(nc1Cl)CN AB75099 [0,2,0,0,0,0|2,0,0]=4 1556 B10R1.176 Cc1ccc(nc1F)CCl AB72849 [0,2,0,0,0,0|2,0,0]=4 1557 B10R1.176 Cc1ccc(nc1F)CN AB72850 [0,2,0,0,0,0|2,0,0]=4 1558 B10R1.176 Cc1ccc(nc1N)OC AB73563 [0,2,0,0,0,0|2,0,0]=4 1559 B10R1.176 c1c(cnc(c1Cl)F)CCl AB70972 [0,2,0,0,0,0|2,0,0]=4 1560 B10R1.176 c1c(cnc(c1Cl)F)CN AB75050 [0,2,0,0,0,0|2,0,0]=4 1561 B10R1.176 c1c(cnc(c1Cl)N)CN AB83951 [0,2,0,0,0,0|2,0,0]=4 1562 B10R1.176 c1c(cnc(c1Cl)O)CCl AB70975 [0,2,0,0,0,0|2,0,0]=4 1563 B10R1.176 c1c(cnc(c1Cl)O)CN AB84069 [0,2,0,0,0,0|2,0,0]=4 1564 B10R1.176 c1c(cnc(c1F)Br)CCl AB70984 [0,2,0,0,0,0|2,0,0]=4 1565 B10R1.176 c1c(cnc(c1F)Br)CN AB76972 [0,2,0,0,0,0|2,0,0]=4 1566 B10R1.176 c1c(cnc(c1F)Cl)CCl AB70665 [0,2,0,0,0,0|2,0,0]=4 1567 B10R1.176 c1c(cnc(c1F)Cl)CN AB74576 [0,2,0,0,0,0|2,0,0]=4 1568 B10R1.176 c1c(cnc(c1O)Cl)CCl AB84103 [0,2,0,0,0,0|2,0,0]=4 1569 B10R1.176 c1c(cnc(c1O)Cl)CN AB84104 [0,2,0,0,0,0|2,0,0]=4 1570 B10R1.176 c1cc(c(nc1CCl)Cl)F AB70988 [0,2,0,0,0,0|2,0,0]=4 1571 B10R1.176 c1cc(c(nc1CCl)Cl)O AB76573 [0,2,0,0,0,0|2,0,0]=4 1572 B10R1.176 c1cc(c(nc1CCl)F)Cl AB70993 [0,2,0,0,0,0|2,0,0]=4 1573 B10R1.176 c1cc(c(nc1CCl)O)Cl AB71004 [0,2,0,0,0,0|2,0,0]=4 1574 B10R1.176 c1cc(c(nc1CN)Cl)F AB75033 [0,2,0,0,0,0|2,0,0]=4 1575 B10R1.176 c1cc(c(nc1CN)Cl)O AB84096 [0,2,0,0,0,0|2,0,0]=4 1576 B10R1.176 c1cc(c(nc1CN)F)Cl AB72853 [0,2,0,0,0,0|2,0,0]=4 1577 B10R1.176 c1cc(c(nc1CN)F)F AB72858 [0,2,0,0,0,0|2,0,0]=4 1578 B10R1.176 c1cc(c(nc1CN)O)Cl AB84086 [0,2,0,0,0,0|2,0,0]=4 1579 B10R1.22 Cc1c(c(nc(n1)C)C)Br AB72378 [0,2,0,0,0,0|2,0,0]=4 1580 B10R1.22 Cc1cc(c(c(n1)Cl)N)Cl CB11028 [0,2,0,0,0,0|2,0,0]=4 1581 B10R1.22 Cc1cc(nc(c1C)C)Br AB82584 [0,2,0,0,0,0|2,0,0]=4 1582 B10R1.22 Cc1cc(nc(c1C)C)N AB76138 [0,2,0,0,0,0|2,0,0]=4 1583 B10R1.22 Cc1cc(nc(c1C)C)O AB82587 [0,2,0,0,0,0|2,0,0]=4 1584 B10R1.22 Cc1cc(nc(c1N)N)C AB44982 [0,2,0,0,0,0|2,0,0]=4 1585 B10R1.119 Cc1ccc(c(c1O)C)O AB24905 [0,2,0,0,0,0|2,0,0]=4 1586 B10R1.245 Cc1cccc(c1CCl)C AB08451 [0,2,0,0,0,0|2,0,0]=4 1587 B10R1.245 Cc1cccc(c1CO)C AB03562 [0,2,0,0,0,0|2,0,0]=4 1588 B10R1.245 Cc1cncc(c1C#N)C AB63049 [0,2,0,0,0,0|1,0,0]=3 1589 B10R1.245 Cc1cncc(c1C=O)C AB24811 [0,2,0,0,0,0|1,0,0]=3 1590 B10R1.245 Cc1cncc(c1C=O)Cl AB75138 [0,2,0,0,0,0|2,0,0]=4 1591 B10R1.245 Cc1cncc(c1C=O)F AB75180 [0,2,0,0,0,0|2,0,0]=4 1592 B10R1.245 Cc1cncc(c1C=O)N AB83619 [0,2,0,0,0,0|2,0,0]=4 1593 B10R1.245 Cc1cncc(c1C=O)O AB75255 [0,2,0,0,0,0|2,0,0]=4 1594 B10R1.245 Cc1cncc(c1CCl)C AB75400 [0,2,0,0,0,0|1,0,0]=3 1595 B10R1.245 Cc1cncc(c1CCl)Cl AB83249 [0,2,0,0,0,0|2,0,0]=4 1596 B10R1.245 Cc1cncc(c1CCl)F AB82911 [0,2,0,0,0,0|2,0,0]=4 1597 B10R1.245 Cc1cncc(c1CN)C AB65429 [0,2,0,0,0,0|1,0,0]=3 1598 B10R1.245 Cc1cncc(c1CN)Cl AB83251 [0,2,0,0,0,0|2,0,0]=4 1599 B10R1.245 Cc1cncc(c1CN)F AB82914 [0,2,0,0,0,0|2,0,0]=4 1600 B10R1.25 CCc1ccc(nc1N)C AB03677 [0,2,0,0,0,0|2,0,0]=4 1601 B10R1.25 Cc1c(ccc(n1)Br)C=O AB66856 [0,2,0,0,0,0|2,0,0]=4 1602 B10R1.25 Cc1c(ccc(n1)Br)CCl AB69339 [0,2,0,0,0,0|2,0,0]=4 1603 B10R1.25 Cc1c(ccc(n1)Br)CN AB69340 [0,2,0,0,0,0|2,0,0]=4 1604 B10R1.25 Cc1c(ccc(n1)Cl)C#N AB30550 [0,2,0,0,0,0|2,0,0]=4 1605 B10R1.25 Cc1c(ccc(n1)Cl)C=O AB32133 [0,2,0,0,0,0|2,0,0]=4 1606 B10R1.25 Cc1c(ccc(n1)Cl)CN AB74568 [0,2,0,0,0,0|2,0,0]=4 1607 B10R1.25 Cc1c(ccc(n1)Cl)OC AB63867 [0,2,0,0,0,0|2,0,0]=4 1608 B10R1.25 Cc1c(ccc(n1)N)OC AB53570 [0,2,0,0,0,0|2,0,0]=4 1609 B10R1.25 Cc1c(ccc(n1)O)C#N AB55004 [0,2,0,0,0,0|2,0,0]=4 1610 B10R1.25 Cc1c(ccc(n1)O)OC AB63862 [0,2,0,0,0,0|2,0,0]=4 1611 B10R1.25 Cc1c(ncc(n1)Br)C#N AB72506 [0,2,0,0,0,0|1,0,0]=3 1612 B10R1.25 Cc1c(ncc(n1)Br)C=O AB85714 [0,2,0,0,0,0|1,0,0]=3 1613 B10R1.25 Cc1c(ncc(n1)Br)OC AB85717 [0,2,0,0,0,0|1,0,0]=3 1614 B10R1.25 Cc1c(ncc(n1)Cl)C#N AB72505 [0,2,0,0,0,0|1,0,0]=3 1615 B10R1.25 Cc1c(ncc(n1)Cl)C=O AB85687 [0,2,0,0,0,0|1,0,0]=3 1616 B10R1.25 Cc1c(ncc(n1)Cl)CCl AB76483 [0,2,0,0,0,0|1,0,0]=3 1617 B10R1.25 Cc1c(ncc(n1)Cl)CN AB85686 [0,2,0,0,0,0|1,0,0]=3 1618 B10R1.25 Cc1cc(c(nc1)C#N)C AB22974 [0,2,0,0,0,0|1,0,0]=3 1619 B10R1.25 Cc1cc(c(nc1)C#N)N AB64065 [0,2,0,0,0,0|2,0,0]=4 1620 B10R1.25 Cc1cc(c(nc1)C=O)C AB53525 [0,2,0,0,0,0|1,0,0]=3 1621 B10R1.25 Cc1cc(c(nc1)C=O)Cl AB75087 [0,2,0,0,0,0|2,0,0]=4 1622 B10R1.25 Cc1cc(c(nc1)C=O)F AB75163 [0,2,0,0,0,0|2,0,0]=4 1623 B10R1.25 Cc1cc(c(nc1)C=O)N AB83746 [0,2,0,0,0,0|2,0,0]=4 1624 B10R1.25 Cc1cc(c(nc1)C=O)O AB75242 [0,2,0,0,0,0|2,0,0]=4 1625 B10R1.25 Cc1cc(c(nc1)CCl)C AB44395 [0,2,0,0,0,0|1,0,0]=3 1626 B10R1.25 Cc1cc(c(nc1)CCl)Cl AB75094 [0,2,0,0,0,0|2,0,0]=4 1627 B10R1.25 Cc1cc(c(nc1)CCl)F AB76356 [0,2,0,0,0,0|2,0,0]=4 1628 B10R1.25 Cc1cc(c(nc1)CN)C AB53521 [0,2,0,0,0,0|1,0,0]=3 1629 B10R1.25 Cc1cc(c(nc1)CN)Cl AB75093 [0,2,0,0,0,0|2,0,0]=4 1630 B10R1.25 Cc1cc(c(nc1)CN)F AB75165 [0,2,0,0,0,0|2,0,0]=4 1631 B10R1.25 Cc1cc(c(nc1)CO)C AB53524 [0,2,0,0,0,0|1,0,0]=3 1632 B10R1.25 Cc1cc(c(nc1)OC)N AB66728 [0,2,0,0,0,0|2,0,0]=4 1633 B10R1.25 Cc1cc(cnc1C#N)Br AB65088 [0,2,0,0,0,0|2,0,0]=4 1634 B10R1.25 Cc1cc(cnc1C#N)Cl AB71756 [0,2,0,0,0,0|2,0,0]=4 1635 B10R1.25 Cc1cc(cnc1C#N)N AB41218 [0,2,0,0,0,0|2,0,0]=4 1636 B10R1.25 Cc1cc(cnc1C=O)Br AB42359 [0,2,0,0,0,0|2,0,0]=4 1637 B10R1.25 Cc1cc(cnc1C=O)Cl AB75118 [0,2,0,0,0,0|2,0,0]=4 1638 B10R1.25 Cc1cc(cnc1C=O)F AB74798 [0,2,0,0,0,0|2,0,0]=4 1639 B10R1.25 Cc1cc(cnc1CCl)Cl AB75121 [0,2,0,0,0,0|2,0,0]=4 1640 B10R1.25 Cc1cc(cnc1CCl)F AB74796 [0,2,0,0,0,0|2,0,0]=4 1641 B10R1.25 Cc1cc(cnc1CN)Br AB41237 [0,2,0,0,0,0|2,0,0]=4 1642 B10R1.25 Cc1cc(cnc1CN)Cl AB75120 [0,2,0,0,0,0|2,0,0]=4 1643 B10R1.25 Cc1cc(cnc1CN)F AB41242 [0,2,0,0,0,0|2,0,0]=4 1644 B10R1.25 Cc1cc(cnc1OC)Br AB41223 [0,2,0,0,0,0|2,0,0]=4 1645 B10R1.25 Cc1cc(cnc1OC)Cl AB75754 [0,2,0,0,0,0|2,0,0]=4 1646 B10R1.25 Cc1cc(cnc1OC)N AB20996 [0,2,0,0,0,0|2,0,0]=4 1647 B10R1.25 Cc1ccc(c(n1)Br)C#N PB29361 [0,2,0,0,0,0|2,0,0]=4 1648 B10R1.25 Cc1ccc(c(n1)Br)C=O AB55809 [0,2,0,0,0,0|2,0,0]=4 1649 B10R1.25 Cc1ccc(c(n1)Br)CN AB68158 [0,2,0,0,0,0|2,0,0]=4 1650 B10R1.25 Cc1ccc(c(n1)Br)OC AB25427 [0,2,0,0,0,0|2,0,0]=4 1651 B10R1.25 Cc1ccc(c(n1)C)C=O AB13970 [0,2,0,0,0,0|1,0,0]=3 1652 B10R1.25 Cc1ccc(c(n1)Cl)C#N PB12067 [0,2,0,0,0,0|2,0,0]=4 1653 B10R1.25 Cc1ccc(c(n1)Cl)C=O AB32135 [0,2,0,0,0,0|2,0,0]=4 1654 B10R1.25 Cc1ccc(c(n1)Cl)CN AB23323 [0,2,0,0,0,0|2,0,0]=4 1655 B10R1.25 Cc1ccc(c(n1)N)C=O AB27631 [0,2,0,0,0,0|2,0,0]=4 1656 B10R1.25 Cc1ccc(c(n1)N)CCl AB76121 [0,2,0,0,0,0|2,0,0]=4 1657 B10R1.25 Cc1ccc(c(n1)O)C=O AB42321 [0,2,0,0,0,0|2,0,0]=4 1658 B10R1.25 Cc1cnc(c(n1)C)C=O AB73104 [0,2,0,0,0,0|0,0,0]=2 1659 B10R1.25 Cc1cnc(c(n1)C)CN AB73102 [0,2,0,0,0,0|0,0,0]=2 1660 B10R1.25 Cc1cnc(c(n1)Cl)C#N AB60457 [0,2,0,0,0,0|1,0,0]=3 1661 B10R1.25 c1c(nc(c(n1)C#N)Cl)Cl PB31130 [0,2,0,0,0,0|2,0,0]=4 1662 B10R1.25 c1c(nc(c(n1)C#N)Cl)N AB60469 [0,2,0,0,0,0|2,0,0]=4 1663 B10R1.25 c1c(nc(c(n1)C#N)N)Cl AB60474 [0,2,0,0,0,0|2,0,0]=4 1664 B10R1.25 c1c(nc(c(n1)C=O)Cl)Cl PB10747 [0,2,0,0,0,0|2,0,0]=4 1665 B10R1.25 c1c(nc(c(n1)C=O)N)Br AB72512 [0,2,0,0,0,0|2,0,0]=4 1666 B10R1.25 c1c(nc(c(n1)C=O)N)Cl AB72515 [0,2,0,0,0,0|2,0,0]=4 1667 B10R1.25 c1c(nc(c(n1)CCl)N)Cl AB85693 [0,2,0,0,0,0|2,0,0]=4 1668 B10R1.118 Cc1c(cc(c(n1)N)Br)Br AB02781 [0,2,0,0,0,0|2,0,0]=4 1669 B10R1.118 Cc1c(nc(c(n1)Cl)C)Cl AB44019 [0,2,0,0,0,0|1,0,0]=3 1670 B10R1.118 Cc1c(nc(c(n1)N)Br)Br AB48622 [0,2,0,0,0,0|1,0,0]=3 1671 B10R1.118 Cc1c(nc(c(n1)N)Br)C AB53115 [0,2,0,0,0,0|1,0,0]=3 1672 B10R1.118 Cc1c(nc(c(n1)O)C)O AB44017 [0,2,0,0,0,0|1,0,0]=3 1673 B10R1.118 Cc1cc(c(nc1Br)Br)Br AB13867 [0,2,0,0,0,0|2,0,0]=4 1674 B10R1.118 Cc1cc(c(nc1C)N)N AB66679 [0,2,0,0,0,0|2,0,0]=4 1675 B8R1.7 CC(=O)c1ncco1 AB42105 [0,0,1,1,0,0|2,0,0]=4 1676 B8R1.7 c1csc(n1)C(=N)N PB24428 [0,0,1,1,0,0|2,0,0]=4 1677 B6R1.2 C1=NC(=O)N=C1 AB01798 [1,0,0,0,1,0|1,0,0]=3 1678 B6R1.2 C1=NC=NC1Br AB02015 [1,0,0,0,1,0|1,0,1]=4 1679 B6R1.2 C1=NC=NC1I AB09493 [1,0,0,0,1,0|1,0,1]=4 1680 B6R1.2 C1=NC=NC1N MB08721 [1,0,0,0,1,0|1,0,1]=4 1681 B6R1.2 C1C=NC(=N1)Br AB11316 [1,0,0,0,1,0|1,0,1]=4 1682 B6R1.2 C1C=NC(=N1)Cl AB11323 [1,0,0,0,1,0|1,0,1]=4 1683 B6R1.2 C1C=NC(=N1)I AB04195 [1,0,0,0,1,0|1,0,1]=4 1684 B6R1.2 C1C=NC(=N1)N AB07116 [1,0,0,0,1,0|1,0,1]=4 1685 B6R1.2 C1C=NC(=N1)N AB29274 [1,0,0,0,1,0|1,0,1]=4 1686 B6R1.2 C1C=NC(=N1)O AB52896 [1,0,0,0,1,0|1,0,1]=4 1687 B6R1.2 C1C=NC(=N1)S AB00386 [1,0,0,0,1,0|1,0,1]=4 1688 B6R1.2 CC1=CN=CC1 PB12076 [1,0,0,0,1,0|0,0,1]=3 1689 B6R1.2 CC1=CN=NC1 AB00390 [1,0,0,0,1,0|1,0,1]=4 1690 B6R1.2 CC1=NC=CC1 AB12705 [1,0,0,0,1,0|0,0,1]=3 1691 B6R1.2 CC1=NN=NC1 AB70603 [1,0,0,0,1,0|1,0,1]=4 1692 B6R1.2 Cc1ccon1 AB01288 [1,0,0,0,1,0|1,0,0]=3 1693 B6R1.2 Cc1cocn1 AB63545 [1,0,0,0,1,0|1,0,0]=3 1694 B6R1.2 Cn1cccn1 PB33818 [1,0,0,0,1,0|1,0,0]=3 1695 B6R1.2 Cn1ccnn1 AB51214 [1,0,0,0,1,0|2,0,0]=4 1696 B6R1.2 Cn1cnnc1 AB06345 [1,0,0,0,1,0|2,0,0]=4 1697 B6R1.2 c1[nH]nc(n1)Br AB09118 [1,0,0,0,1,0|2,0,0]=4 1698 B6R1.2 c1c(con1)Br AB11359 [1,0,0,0,1,0|2,0,0]=4 1699 B6R1.2 c1c(con1)F AB68759 [1,0,0,0,1,0|2,0,0]=4 1700 B6R1.2 c1c(con1)N AB43605 [1,0,0,0,1,0|2,0,0]=4 1701 B6R1.2 c1c(csn1)Br AB25618 [1,0,0,0,1,0|2,0,0]=4 1702 B6R1.2 c1c(csn1)N AB11898 [1,0,0,0,1,0|2,0,0]=4 1703 B6R1.2 c1c(nco1)Br AB71589 [1,0,0,0,1,0|2,0,0]=4 1704 B6R1.2 c1c(nco1)Cl AB71588 [1,0,0,0,1,0|2,0,0]=4 1705 B6R1.2 c1c(nco1)N AB65031 [1,0,0,0,1,0|2,0,0]=4 1706 B6R1.2 c1c(nsn1)Br AB65649 [1,0,0,0,1,0|2,0,0]=4 1707 B6R1.2 c1c(ocn1)Br AB68491 [1,0,0,0,1,0|2,0,0]=4 1708 B6R1.2 c1c(ocn1)N MB10132 [1,0,0,0,1,0|2,0,0]=4 1709 B6R1.2 c1c(scn1)Br AB42975 [1,0,0,0,1,0|2,0,0]=4 1710 B6R1.2 c1cc(oc1)Br AB04890 [1,0,0,0,1,0|2,0,0]=4 1711 B6R1.2 c1cc(sc1)N AB08372 [1,0,0,0,1,0|2,0,0]=4 1712 B6R1.2 c1cn(cn1)N AB53511 [1,0,0,0,1,0|2,0,0]=4 1713 B6R1.2 c1cnoc1N MB00706 [1,0,0,0,1,0|2,0,0]=4 1714 B6R1.2 c1coc(n1)Br AB53255 [1,0,0,0,1,0|2,0,0]=4 1715 B6R1.2 c1coc(n1)I PB15201 [1,0,0,0,1,0|2,0,0]=4 1716 B6R1.2 c1coc(n1)N MB04324 [1,0,0,0,1,0|2,0,0]=4 1717 B6R1.2 c1conc1N PB33787 [1,0,0,0,1,0|2,0,0]=4 1718 B6R1.2 c1conc1O MB20248 [1,0,0,0,1,0|2,0,0]=4 1719 B6R1.2 c1csc(n1)Br AB00399 [1,0,0,0,1,0|2,0,0]=4 1720 B6R1.2 c1csc(n1)Cl CB10295 [1,0,0,0,1,0|2,0,0]=4 1721 B6R1.2 c1csc(n1)O AB10887 [1,0,0,0,1,0|2,0,0]=4 1722 B6R1.2 c1cscc1N MB09694 [1,0,0,0,1,0|2,0,0]=4 1723 B6R1.2 c1cscc1N PB23357 [1,0,0,0,1,0|2,0,0]=4 1724 B6R1.2 c1nc(sn1)N AB08270 [1,0,0,0,1,0|2,0,0]=4