0 B8R1.4 C1C(=CC=NC1=O)Br PB17828 [0,0,0,0,0,0|2,0,2]=4 1 B8R1.4 Cc1cc(ccn1)Br AB17599 [0,0,0,0,0,0|3,0,0]=3 2 B8R1.4 Cc1cc(ccn1)Br PB26077 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.4 Cc1cc(ccn1)Cl AB01756 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.4 Cc1cc(ccn1)F AB17919 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.4 Cc1cc(ccn1)O PB24839 [0,0,0,0,0,0|2,0,0]=2 6 B8R1.4 Cc1cc(cnc1)Br AB09597 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.4 Cc1cc(cnc1)Cl AB17994 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.4 Cc1cc(cnc1)F AB13643 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.4 Cc1cc(cnc1)N AB17573 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.4 Cc1cc(cnc1)O MB01362 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.4 Cc1cc(cnn1)N MB11385 [0,0,0,0,0,0|4,0,0]=4 12 B8R1.4 Cc1cc(ncn1)C PB24534 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.4 Cc1cc(ncn1)Cl PB29204 [0,0,0,0,0,0|4,0,0]=4 14 B8R1.4 Cc1cc(ncn1)N PB12118 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.4 Cc1cc(nnc1)Cl PB14716 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.4 Cc1cc(nnc1)N AB61142 [0,0,0,0,0,0|4,0,0]=4 17 B8R1.4 Cc1cc[nH]c(=O)n1 PB19074 [0,0,0,0,0,0|3,0,1]=4 18 B8R1.4 Cc1cccc(n1)Br AB01812 [0,0,0,0,0,0|3,0,0]=3 19 B8R1.4 Cc1cccc(n1)Cl AB00666 [0,0,0,0,0,0|3,0,0]=3 20 B8R1.4 Cc1cccc(n1)F AB01860 [0,0,0,0,0,0|3,0,0]=3 21 B8R1.4 Cc1cccc(n1)N AB00717 [0,0,0,0,0,0|3,0,0]=3 22 B8R1.4 Cc1cccc(n1)O AB00679 [0,0,0,0,0,0|2,0,0]=2 23 B8R1.4 Cc1cccc(n1)S AB25230 [0,0,0,0,0,0|2,1,0]=3 24 B8R1.4 Cc1ccnc(c1)Br AB03099 [0,0,0,0,0,0|3,0,0]=3 25 B8R1.4 Cc1ccnc(c1)Cl PB10051 [0,0,0,0,0,0|3,0,0]=3 26 B8R1.4 Cc1ccnc(c1)F AB01854 [0,0,0,0,0,0|3,0,0]=3 27 B8R1.4 Cc1ccnc(c1)N AB00703 [0,0,0,0,0,0|3,0,0]=3 28 B8R1.4 Cc1ccnc(c1)O AB03735 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.4 Cc1ccnc(n1)Cl PB14106 [0,0,0,0,0,0|4,0,0]=4 30 B8R1.4 Cc1ccnc(n1)N MB00179 [0,0,0,0,0,0|4,0,0]=4 31 B8R1.4 Cc1cncc(n1)Br AB48617 [0,0,0,0,0,0|4,0,0]=4 32 B8R1.4 Cc1cncc(n1)Cl AB02267 [0,0,0,0,0,0|4,0,0]=4 33 B8R1.4 Cc1cncc(n1)N AB43812 [0,0,0,0,0,0|4,0,0]=4 34 B8R1.4 Cc1nccc(n1)Cl PB30633 [0,0,0,0,0,0|4,0,0]=4 35 B8R1.4 Cc1nccc(n1)N AB06587 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.4 c1c(cncc1Br)Br AB01172 [0,0,0,0,0,0|3,0,0]=3 37 B8R1.4 c1c(cncc1Br)Cl AB18001 [0,0,0,0,0,0|3,0,0]=3 38 B8R1.4 c1c(cncc1Br)N PB12251 [0,0,0,0,0,0|3,0,0]=3 39 B8R1.4 c1c(cncc1Br)O PB30658 [0,0,0,0,0,0|2,0,0]=2 40 B8R1.4 c1c(cncc1Cl)Cl AB00743 [0,0,0,0,0,0|3,0,0]=3 41 B8R1.4 c1c(cncc1Cl)F AB21896 [0,0,0,0,0,0|3,0,0]=3 42 B8R1.4 c1c(cncc1Cl)N AB15758 [0,0,0,0,0,0|3,0,0]=3 43 B8R1.4 c1c(cncc1F)F AB14383 [0,0,0,0,0,0|3,0,0]=3 44 B8R1.4 c1c(cncc1F)N AB05123 [0,0,0,0,0,0|3,0,0]=3 45 B8R1.4 c1c(cncc1F)O AB13569 [0,0,0,0,0,0|2,0,0]=2 46 B8R1.4 c1c(cncc1I)Br AB13102 [0,0,0,0,0,0|3,0,0]=3 47 B8R1.4 c1c(cncc1I)Cl AB43784 [0,0,0,0,0,0|3,0,0]=3 48 B8R1.4 c1c(cncc1I)F AB45557 [0,0,0,0,0,0|3,0,0]=3 49 B8R1.4 c1c(cncc1I)I PB19957 [0,0,0,0,0,0|3,0,0]=3 50 B8R1.4 c1c(cncc1I)N AB43802 [0,0,0,0,0,0|3,0,0]=3 51 B8R1.4 c1c(cncc1N)N AB07746 [0,0,0,0,0,0|3,0,0]=3 52 B8R1.4 c1c(cncc1O)N AB17983 [0,0,0,0,0,0|2,0,0]=2 53 B8R1.4 c1c(cncc1O)O MB02073 [0,0,0,0,0,0|1,0,0]=1 54 B8R1.4 c1c(cnnc1Br)Br AB70143 [0,0,0,0,0,0|4,0,0]=4 55 B8R1.4 c1c(cnnc1Cl)Br AB70142 [0,0,0,0,0,0|4,0,0]=4 56 B8R1.4 c1c(cnnc1Cl)Cl AB61136 [0,0,0,0,0,0|4,0,0]=4 57 B8R1.4 c1c(cnnc1Cl)N PB20792 [0,0,0,0,0,0|4,0,0]=4 58 B8R1.4 c1c(cnnc1N)Cl PB15393 [0,0,0,0,0,0|4,0,0]=4 59 B8R1.4 c1c(cnnc1O)Cl AB61137 [0,0,0,0,0,0|3,0,0]=3 60 B8R1.4 c1c(nc(cn1)Br)Br AB52791 [0,0,0,0,0,0|4,0,0]=4 61 B8R1.4 c1c(nc(cn1)Br)Cl AB48957 [0,0,0,0,0,0|4,0,0]=4 62 B8R1.4 c1c(nc(cn1)Br)F MB14129 [0,0,0,0,0,0|4,0,0]=4 63 B8R1.4 c1c(nc(cn1)Br)N AB60541 [0,0,0,0,0,0|4,0,0]=4 64 B8R1.4 c1c(nc(cn1)Cl)Cl PB14072 [0,0,0,0,0,0|4,0,0]=4 65 B8R1.4 c1c(nc(cn1)Cl)F MB14158 [0,0,0,0,0,0|4,0,0]=4 66 B8R1.4 c1c(nc(cn1)Cl)N PB12992 [0,0,0,0,0,0|4,0,0]=4 67 B8R1.4 c1c(nc(cn1)Cl)O MB00903 [0,0,0,0,0,0|3,0,0]=3 68 B8R1.4 c1c(ncnc1Br)Br PB17157 [0,0,0,0,0,0|4,0,0]=4 69 B8R1.4 c1c(ncnc1Br)Cl AB48958 [0,0,0,0,0,0|4,0,0]=4 70 B8R1.4 c1c(ncnc1Br)F MB14209 [0,0,0,0,0,0|4,0,0]=4 71 B8R1.4 c1c(ncnc1Br)N MB00979 [0,0,0,0,0,0|4,0,0]=4 72 B8R1.4 c1c(ncnc1Cl)Cl AB00591 [0,0,0,0,0,0|4,0,0]=4 73 B8R1.4 c1c(ncnc1Cl)N PB24577 [0,0,0,0,0,0|4,0,0]=4 74 B8R1.4 c1c(ncnc1Cl)O AB05055 [0,0,0,0,0,0|3,0,0]=3 75 B8R1.4 c1c(ncnc1I)Cl AB66284 [0,0,0,0,0,0|4,0,0]=4 76 B8R1.4 c1c(ncnc1O)N AB02119 [0,0,0,0,0,0|3,0,0]=3 77 B8R1.4 c1cc(c[n+](c1)[O-])Br AB09548 [0,0,0,0,0,0|2,0,1]=3 78 B8R1.4 c1cc(nc(c1)Br)Br AB00637 [0,0,0,0,0,0|3,0,0]=3 79 B8R1.4 c1cc(nc(c1)Br)Cl PB33830 [0,0,0,0,0,0|3,0,0]=3 80 B8R1.4 c1cc(nc(c1)Br)F AB13626 [0,0,0,0,0,0|3,0,0]=3 81 B8R1.4 c1cc(nc(c1)Br)N PB32140 [0,0,0,0,0,0|3,0,0]=3 82 B8R1.4 c1cc(nc(c1)Br)O AB05100 [0,0,0,0,0,0|2,0,0]=2 83 B8R1.4 c1cc(nc(c1)Cl)Cl AB00664 [0,0,0,0,0,0|3,0,0]=3 84 B8R1.4 c1cc(nc(c1)Cl)F AB02970 [0,0,0,0,0,0|3,0,0]=3 85 B8R1.4 c1cc(nc(c1)Cl)N PB26011 [0,0,0,0,0,0|3,0,0]=3 86 B8R1.4 c1cc(nc(c1)F)N AB17974 [0,0,0,0,0,0|3,0,0]=3 87 B8R1.4 c1cc(nc(c1)I)Cl AB42915 [0,0,0,0,0,0|3,0,0]=3 88 B8R1.4 c1cc(nc(c1)I)I AB31088 [0,0,0,0,0,0|3,0,0]=3 89 B8R1.4 c1cc(nc(c1)I)N AB42508 [0,0,0,0,0,0|3,0,0]=3 90 B8R1.4 c1cnc(cc1Br)Br PB10210 [0,0,0,0,0,0|3,0,0]=3 91 B8R1.4 c1cnc(cc1Br)Cl AB16617 [0,0,0,0,0,0|3,0,0]=3 92 B8R1.4 c1cnc(cc1Br)F AB17567 [0,0,0,0,0,0|3,0,0]=3 93 B8R1.4 c1cnc(cc1Br)I AB31627 [0,0,0,0,0,0|3,0,0]=3 94 B8R1.4 c1cnc(cc1Br)N PB12936 [0,0,0,0,0,0|3,0,0]=3 95 B8R1.4 c1cnc(cc1Cl)Br PB23373 [0,0,0,0,0,0|3,0,0]=3 96 B8R1.4 c1cnc(cc1Cl)Cl AB07735 [0,0,0,0,0,0|3,0,0]=3 97 B8R1.4 c1cnc(cc1Cl)F AB17564 [0,0,0,0,0,0|3,0,0]=3 98 B8R1.4 c1cnc(cc1Cl)N PB32361 [0,0,0,0,0,0|3,0,0]=3 99 B8R1.4 c1cnc(cc1Cl)O AB13188 [0,0,0,0,0,0|2,0,0]=2 100 B8R1.4 c1cnc(cc1F)Br AB50032 [0,0,0,0,0,0|3,0,0]=3 101 B8R1.4 c1cnc(cc1F)Cl AB17349 [0,0,0,0,0,0|3,0,0]=3 102 B8R1.4 c1cnc(cc1F)F PB26122 [0,0,0,0,0,0|3,0,0]=3 103 B8R1.4 c1cnc(cc1F)N AB50025 [0,0,0,0,0,0|3,0,0]=3 104 B8R1.4 c1cnc(cc1I)Br PB29229 [0,0,0,0,0,0|3,0,0]=3 105 B8R1.4 c1cnc(cc1I)Cl PB17253 [0,0,0,0,0,0|3,0,0]=3 106 B8R1.4 c1cnc(cc1I)F PB12274 [0,0,0,0,0,0|3,0,0]=3 107 B8R1.4 c1cnc(cc1I)N PB10642 [0,0,0,0,0,0|3,0,0]=3 108 B8R1.4 c1cnc(cc1N)Br PB30686 [0,0,0,0,0,0|3,0,0]=3 109 B8R1.4 c1cnc(cc1N)Cl PB24583 [0,0,0,0,0,0|3,0,0]=3 110 B8R1.4 c1cnc(cc1N)F PB21208 [0,0,0,0,0,0|3,0,0]=3 111 B8R1.4 c1cnc(cc1N)O PB15716 [0,0,0,0,0,0|2,0,0]=2 112 B8R1.4 c1cnc(cc1O)Br AB05095 [0,0,0,0,0,0|2,0,0]=2 113 B8R1.4 c1cnc(cc1O)Cl AB09576 [0,0,0,0,0,0|2,0,0]=2 114 B8R1.4 c1cnc(cc1O)F AB17930 [0,0,0,0,0,0|2,0,0]=2 115 B8R1.4 c1cnc(cc1O)I MB26582 [0,0,0,0,0,0|2,0,0]=2 116 B8R1.4 c1cnc(cc1O)N AB17934 [0,0,0,0,0,0|2,0,0]=2 117 B8R1.4 c1cnc(nc1Br)Br PB17395 [0,0,0,0,0,0|4,0,0]=4 118 B8R1.4 c1cnc(nc1Br)F MB14189 [0,0,0,0,0,0|4,0,0]=4 119 B8R1.4 c1cnc(nc1Br)N PB13233 [0,0,0,0,0,0|4,0,0]=4 120 B8R1.4 c1cnc(nc1Cl)Br MB10108 [0,0,0,0,0,0|4,0,0]=4 121 B8R1.4 c1cnc(nc1Cl)Cl AB00576 [0,0,0,0,0,0|4,0,0]=4 122 B8R1.4 c1cnc(nc1Cl)N PB21638 [0,0,0,0,0,0|4,0,0]=4 123 B8R1.4 c1cnc(nc1Cl)O AB68453 [0,0,0,0,0,0|3,0,0]=3 124 B8R1.4 c1cnc(nc1F)Br MB14089 [0,0,0,0,0,0|4,0,0]=4 125 B8R1.4 c1cnc(nc1N)Br MB09311 [0,0,0,0,0,0|4,0,0]=4 126 B8R1.4 c1cnc(nc1N)Cl PB14147 [0,0,0,0,0,0|4,0,0]=4 127 B7R1.3 Cc1cccnn1 PB33649 [1,0,0,0,0,0|3,0,0]=4 128 B7R1.3 Cc1ccncn1 PB17038 [1,0,0,0,0,0|3,0,0]=4 129 B7R1.3 Cc1ccnnc1 PB24546 [1,0,0,0,0,0|3,0,0]=4 130 B7R1.3 c1c(cncn1)Br PB28945 [1,0,0,0,0,0|3,0,0]=4 131 B7R1.3 c1c(cncn1)Cl AB16528 [1,0,0,0,0,0|3,0,0]=4 132 B7R1.3 c1c(cncn1)N PB12745 [1,0,0,0,0,0|3,0,0]=4 133 B7R1.3 c1c(cncn1)O PB27730 [1,0,0,0,0,0|2,0,0]=3 134 B7R1.3 c1cc(cnc1)Br AB00739 [1,0,0,0,0,0|2,0,0]=3 135 B7R1.3 c1cc(cnc1)I AB01382 [1,0,0,0,0,0|2,0,0]=3 136 B7R1.3 c1cc(cnc1)[O-] MB00567 [1,0,0,0,0,0|1,0,1]=3 137 B7R1.3 c1cc(nnc1)Br MB08580 [1,0,0,0,0,0|3,0,0]=4 138 B7R1.3 c1cc(nnc1)Cl AB30021 [1,0,0,0,0,0|3,0,0]=4 139 B7R1.3 c1cc(nnc1)Cl PB34726 [1,0,0,0,0,0|3,0,0]=4 140 B7R1.3 c1cc(nnc1)N PB17217 [1,0,0,0,0,0|3,0,0]=4 141 B7R1.3 c1cc(nnc1)O PB32258 [1,0,0,0,0,0|2,0,0]=3 142 B7R1.3 c1ccnc(c1)Br AB00627 [1,0,0,0,0,0|2,0,0]=3 143 B7R1.3 c1cnc(cn1)Br MB06072 [1,0,0,0,0,0|3,0,0]=4 144 B7R1.3 c1cnc(cn1)I AB08841 [1,0,0,0,0,0|3,0,0]=4 145 B7R1.3 c1cnc(cn1)N PB30528 [1,0,0,0,0,0|3,0,0]=4 146 B7R1.3 c1cnc(cn1)O AB05056 [1,0,0,0,0,0|2,0,0]=3 147 B7R1.3 c1cnc(nc1)Cl AB00572 [1,0,0,0,0,0|3,0,0]=4 148 B7R1.3 c1cnc(nc1)N MB00175 [1,0,0,0,0,0|3,0,0]=4 149 B7R1.3 c1cnccc1Br AB05093 [1,0,0,0,0,0|2,0,0]=3 150 B7R1.3 c1cnccc1I AB10861 [1,0,0,0,0,0|2,0,0]=3 151 B7R1.3 c1cnccc1O PB17041 [1,0,0,0,0,0|1,0,0]=2 152 B7R1.3 c1cncnc1Br PB10690 [1,0,0,0,0,0|3,0,0]=4 153 B7R1.3 c1cncnc1Cl AB43600 [1,0,0,0,0,0|3,0,0]=4 154 B7R1.3 c1cncnc1Cl PB13479 [1,0,0,0,0,0|3,0,0]=4 155 B7R1.3 c1cncnc1N PB11581 [1,0,0,0,0,0|3,0,0]=4 156 B7R1.3 c1cncnc1O PB32093 [1,0,0,0,0,0|2,0,0]=3 157 B7R1.3 c1cnncc1Br AB48350 [1,0,0,0,0,0|3,0,0]=4 158 B7R1.3 c1cnncc1Cl AB50535 [1,0,0,0,0,0|3,0,0]=4 159 B7R1.3 c1cnncc1I AB70137 [1,0,0,0,0,0|3,0,0]=4 160 B7R1.3 c1cnncc1N PB29051 [1,0,0,0,0,0|3,0,0]=4 161 B7R1.3 c1cnncc1N PB39062 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.2 C#Cc1cc(ccn1)Br AB68985 [0,1,0,0,0,0|3,0,0]=4 163 B9R1.2 C#Cc1cc(ccn1)Cl AB68983 [0,1,0,0,0,0|3,0,0]=4 164 B9R1.2 C#Cc1cc(cnc1)Br AB61376 [0,1,0,0,0,0|3,0,0]=4 165 B9R1.2 C#Cc1cc(cnc1)Cl AB52703 [0,1,0,0,0,0|3,0,0]=4 166 B9R1.2 C#Cc1cc(cnc1)F AB66583 [0,1,0,0,0,0|3,0,0]=4 167 B9R1.2 C#Cc1cc(cnc1)N AB71894 [0,1,0,0,0,0|3,0,0]=4 168 B9R1.2 C#Cc1cccc(n1)Br AB68980 [0,1,0,0,0,0|3,0,0]=4 169 B9R1.2 C#Cc1cccc(n1)Cl AB68981 [0,1,0,0,0,0|3,0,0]=4 170 B9R1.2 C#Cc1ccnc(c1)Br AB69031 [0,1,0,0,0,0|3,0,0]=4 171 B9R1.2 C#Cc1ccnc(c1)Cl AB69028 [0,1,0,0,0,0|3,0,0]=4 172 B9R1.2 C#Cc1ccnc(c1)N AB69041 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.2 C#Cc1ccnc(c1)O AB69040 [0,1,0,0,0,0|2,0,0]=3 174 B9R1.2 C1C(=CC=NC1=O)CO PB31863 [0,1,0,0,0,0|1,0,2]=4 175 B9R1.2 C=Cc1cccc(n1)Br AB74634 [0,1,0,0,0,0|3,0,0]=4 176 B9R1.2 CCc1cc(ccn1)Br AB63995 [0,1,0,0,0,0|3,0,0]=4 177 B9R1.2 CCc1cc(ccn1)O MB11624 [0,1,0,0,0,0|2,0,0]=3 178 B9R1.2 CCc1cc(cnc1)Br PB34416 [0,1,0,0,0,0|3,0,0]=4 179 B9R1.2 CCc1cc(cnc1)O MB12329 [0,1,0,0,0,0|2,0,0]=3 180 B9R1.2 CCc1cc(ncn1)O AB54953 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.2 CCc1cccc(n1)Br MB10338 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.2 CNc1cc(ccn1)Br MB07801 [0,1,0,0,0,0|3,0,0]=4 183 B9R1.2 CNc1cc(ccn1)O MB29569 [0,1,0,0,0,0|2,0,0]=3 184 B9R1.2 CNc1cc(cnc1)Br MB13417 [0,1,0,0,0,0|3,0,0]=4 185 B9R1.2 CNc1cc(cnc1)O MB32689 [0,1,0,0,0,0|2,0,0]=3 186 B9R1.2 CNc1cccc(c1)O MB25493 [0,1,0,0,0,0|1,0,0]=2 187 B9R1.2 CNc1cccc(n1)Br AB50070 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.2 CNc1cccc(n1)Cl AB05190 [0,1,0,0,0,0|3,0,0]=4 189 B9R1.2 CNc1ccnc(c1)Cl AB60612 [0,1,0,0,0,0|3,0,0]=4 190 B9R1.2 COc1cc(ccn1)Br AB44876 [0,1,0,0,0,0|2,0,0]=3 191 B9R1.2 COc1cc(ccn1)Cl AB27571 [0,1,0,0,0,0|2,0,0]=3 192 B9R1.2 COc1cc(ccn1)F AB53299 [0,1,0,0,0,0|2,0,0]=3 193 B9R1.2 COc1cc(ccn1)I MB06098 [0,1,0,0,0,0|2,0,0]=3 194 B9R1.2 COc1cc(ccn1)N PB20942 [0,1,0,0,0,0|2,0,0]=3 195 B9R1.2 COc1cc(ccn1)O MB11972 [0,1,0,0,0,0|1,0,0]=2 196 B9R1.2 COc1cc(cnc1)Br PB24634 [0,1,0,0,0,0|2,0,0]=3 197 B9R1.2 COc1cc(cnc1)Cl AB55073 [0,1,0,0,0,0|2,0,0]=3 198 B9R1.2 COc1cc(cnc1)F AB66777 [0,1,0,0,0,0|2,0,0]=3 199 B9R1.2 COc1cc(cnc1)I AB43793 [0,1,0,0,0,0|2,0,0]=3 200 B9R1.2 COc1cc(cnc1)N PB12653 [0,1,0,0,0,0|2,0,0]=3 201 B9R1.2 COc1cc(cnc1)N PB25488 [0,1,0,0,0,0|2,0,0]=3 202 B9R1.2 COc1cc(cnc1)O AB29711 [0,1,0,0,0,0|1,0,0]=2 203 B9R1.2 COc1cc(cnn1)N AB76247 [0,1,0,0,0,0|3,0,0]=4 204 B9R1.2 COc1cc(ncn1)Br MB14215 [0,1,0,0,0,0|3,0,0]=4 205 B9R1.2 COc1cc(ncn1)Cl AB23017 [0,1,0,0,0,0|3,0,0]=4 206 B9R1.2 COc1cc(ncn1)N PB30606 [0,1,0,0,0,0|3,0,0]=4 207 B9R1.2 COc1cc(nnc1)Cl PB27887 [0,1,0,0,0,0|3,0,0]=4 208 B9R1.2 COc1cccc(n1)Cl AB00671 [0,1,0,0,0,0|2,0,0]=3 209 B9R1.2 COc1cccc(n1)F AB55818 [0,1,0,0,0,0|2,0,0]=3 210 B9R1.2 COc1cccc(n1)I AB31101 [0,1,0,0,0,0|2,0,0]=3 211 B9R1.2 COc1cccc(n1)N AB21183 [0,1,0,0,0,0|2,0,0]=3 212 B9R1.2 COc1cccc(n1)O AB31854 [0,1,0,0,0,0|1,0,0]=2 213 B9R1.2 COc1ccnc(c1)Br AB23696 [0,1,0,0,0,0|2,0,0]=3 214 B9R1.2 COc1ccnc(c1)Cl AB10868 [0,1,0,0,0,0|2,0,0]=3 215 B9R1.2 COc1ccnc(c1)F AB66367 [0,1,0,0,0,0|2,0,0]=3 216 B9R1.2 COc1ccnc(c1)N AB41933 [0,1,0,0,0,0|2,0,0]=3 217 B9R1.2 COc1ccnc(n1)Br MB07472 [0,1,0,0,0,0|3,0,0]=4 218 B9R1.2 COc1cncc(n1)Cl PB29367 [0,1,0,0,0,0|3,0,0]=4 219 B9R1.2 COc1cncc(n1)N AB54770 [0,1,0,0,0,0|3,0,0]=4 220 B9R1.2 COc1nccc(n1)Br AB54361 [0,1,0,0,0,0|3,0,0]=4 221 B9R1.2 COc1nccc(n1)Cl AB49109 [0,1,0,0,0,0|3,0,0]=4 222 B9R1.2 COc1nccc(n1)N PB29013 [0,1,0,0,0,0|3,0,0]=4 223 B9R1.2 CSc1cc(ccn1)Br MB09718 [0,1,0,0,0,0|2,1,0]=4 224 B9R1.2 CSc1cc(ccn1)O MB36936 [0,1,0,0,0,0|1,1,0]=3 225 B9R1.2 CSc1cc(cnc1)Br MB06469 [0,1,0,0,0,0|2,1,0]=4 226 B9R1.2 CSc1cc(cnc1)O MB28894 [0,1,0,0,0,0|1,1,0]=3 227 B9R1.2 CSc1cccc(n1)Br MB07302 [0,1,0,0,0,0|2,1,0]=4 228 B9R1.2 Cc1cc(ccn1)C#C AB66571 [0,1,0,0,0,0|3,0,0]=4 229 B9R1.2 Cc1cc(ccn1)C=O AB24827 [0,1,0,0,0,0|2,0,1]=4 230 B9R1.2 Cc1cc(ccn1)CCl AB59910 [0,1,0,0,0,0|3,0,0]=4 231 B9R1.2 Cc1cc(ccn1)CN AB25370 [0,1,0,0,0,0|3,0,0]=4 232 B9R1.2 Cc1cc(cnc1)C=O PB18860 [0,1,0,0,0,0|2,0,1]=4 233 B9R1.2 Cc1cc(cnc1)CCl AB55820 [0,1,0,0,0,0|3,0,0]=4 234 B9R1.2 Cc1cc(cnc1)CN AB23459 [0,1,0,0,0,0|3,0,0]=4 235 B9R1.2 Cc1cc(cnc1)CO PB10532 [0,1,0,0,0,0|2,0,0]=3 236 B9R1.2 Cc1cc(cnc1)OC AB64998 [0,1,0,0,0,0|2,0,0]=3 237 B9R1.2 Cc1cc(ncn1)CO PB11190 [0,1,0,0,0,0|3,0,0]=4 238 B9R1.2 Cc1cccc(n1)C#N AB04512 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.2 Cc1cccc(n1)C=O AB00683 [0,1,0,0,0,0|2,0,1]=4 240 B9R1.2 Cc1cccc(n1)CCl AB49651 [0,1,0,0,0,0|3,0,0]=4 241 B9R1.2 Cc1cccc(n1)CN AB22796 [0,1,0,0,0,0|3,0,0]=4 242 B9R1.2 Cc1cccc(n1)NC AB60602 [0,1,0,0,0,0|3,0,0]=4 243 B9R1.2 Cc1ccnc(c1)C#C AB66576 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.2 Cc1ccnc(c1)C#N AB03610 [0,1,0,0,0,0|3,0,0]=4 245 B9R1.2 Cc1ccnc(c1)CCl AB42303 [0,1,0,0,0,0|3,0,0]=4 246 B9R1.2 Cc1ccnc(c1)CN AB23452 [0,1,0,0,0,0|3,0,0]=4 247 B9R1.2 Cc1ccnc(n1)CO PB24151 [0,1,0,0,0,0|3,0,0]=4 248 B9R1.2 c1c(cncc1Br)C#N PB14142 [0,1,0,0,0,0|3,0,0]=4 249 B9R1.2 c1c(cncc1Br)C=O PB10234 [0,1,0,0,0,0|2,0,1]=4 250 B9R1.2 c1c(cncc1Br)CCl AB60029 [0,1,0,0,0,0|3,0,0]=4 251 B9R1.2 c1c(cncc1Br)CCl PB25120 [0,1,0,0,0,0|3,0,0]=4 252 B9R1.2 c1c(cncc1Br)CN PB23445 [0,1,0,0,0,0|3,0,0]=4 253 B9R1.2 c1c(cncc1Br)CO PB29242 [0,1,0,0,0,0|2,0,0]=3 254 B9R1.2 c1c(cncc1Cl)C#N AB14095 [0,1,0,0,0,0|3,0,0]=4 255 B9R1.2 c1c(cncc1Cl)C=O PB29540 [0,1,0,0,0,0|2,0,1]=4 256 B9R1.2 c1c(cncc1Cl)CCl AB60038 [0,1,0,0,0,0|3,0,0]=4 257 B9R1.2 c1c(cncc1Cl)CCl PB33259 [0,1,0,0,0,0|3,0,0]=4 258 B9R1.2 c1c(cncc1Cl)CN AB63152 [0,1,0,0,0,0|3,0,0]=4 259 B9R1.2 c1c(cncc1F)C#N AB49149 [0,1,0,0,0,0|3,0,0]=4 260 B9R1.2 c1c(cncc1F)C=O PB12469 [0,1,0,0,0,0|2,0,1]=4 261 B9R1.2 c1c(cncc1F)CCl PB35002 [0,1,0,0,0,0|3,0,0]=4 262 B9R1.2 c1c(cncc1F)CN PB29533 [0,1,0,0,0,0|3,0,0]=4 263 B9R1.2 c1c(cncc1F)CO PB12255 [0,1,0,0,0,0|2,0,0]=3 264 B9R1.2 c1c(cncc1I)C=O AB45533 [0,1,0,0,0,0|2,0,1]=4 265 B9R1.2 c1c(cncc1I)CCl AB45545 [0,1,0,0,0,0|3,0,0]=4 266 B9R1.2 c1c(cncc1I)CO AB45541 [0,1,0,0,0,0|2,0,0]=3 267 B9R1.2 c1c(cncc1N)C#N AB31378 [0,1,0,0,0,0|3,0,0]=4 268 B9R1.2 c1c(cncc1N)C=O AB67741 [0,1,0,0,0,0|2,0,1]=4 269 B9R1.2 c1c(cncc1N)CN AB31384 [0,1,0,0,0,0|3,0,0]=4 270 B9R1.2 c1c(cncc1N)CO AB31625 [0,1,0,0,0,0|2,0,0]=3 271 B9R1.2 c1c(cncc1O)C#N MB09110 [0,1,0,0,0,0|2,0,0]=3 272 B9R1.2 c1c(cncc1O)C=O AB67779 [0,1,0,0,0,0|1,0,1]=3 273 B9R1.2 c1c(cncc1O)CN MB28837 [0,1,0,0,0,0|2,0,0]=3 274 B9R1.2 c1c(nc(cn1)Br)CO MB14063 [0,1,0,0,0,0|3,0,0]=4 275 B9R1.2 c1c(nc(cn1)Cl)CO PB11152 [0,1,0,0,0,0|3,0,0]=4 276 B9R1.2 c1c(ncnc1Cl)CO PB11446 [0,1,0,0,0,0|3,0,0]=4 277 B9R1.2 c1c(ncnc1O)C=O AB58874 [0,1,0,0,0,0|2,0,1]=4 278 B9R1.2 c1c(ncnc1O)CCl AB59093 [0,1,0,0,0,0|3,0,0]=4 279 B9R1.2 c1cc(c[n+](c1)[O-])CCl AB59951 [0,1,0,0,0,0|2,0,1]=4 280 B9R1.2 c1cc(cc(c1)Br)CBr AB00107 [0,1,0,0,0,0|2,0,0]=3 281 B9R1.2 c1cc(cc(c1)Br)NN AB11945 [0,1,0,0,0,0|2,0,0]=3 282 B9R1.2 c1cc(cc(c1)O)CBr MB05606 [0,1,0,0,0,0|1,0,0]=2 283 B9R1.2 c1cc(nc(c1)Br)C#N PB24633 [0,1,0,0,0,0|3,0,0]=4 284 B9R1.2 c1cc(nc(c1)Br)C=O PB27582 [0,1,0,0,0,0|2,0,1]=4 285 B9R1.2 c1cc(nc(c1)Br)CCl AB59969 [0,1,0,0,0,0|3,0,0]=4 286 B9R1.2 c1cc(nc(c1)Br)CCl AB59992 [0,1,0,0,0,0|3,0,0]=4 287 B9R1.2 c1cc(nc(c1)Br)CN AB31432 [0,1,0,0,0,0|3,0,0]=4 288 B9R1.2 c1cc(nc(c1)Br)CO PB29304 [0,1,0,0,0,0|2,0,0]=3 289 B9R1.2 c1cc(nc(c1)Br)NN AB51209 [0,1,0,0,0,0|3,0,0]=4 290 B9R1.2 c1cc(nc(c1)Cl)C#N AB05877 [0,1,0,0,0,0|3,0,0]=4 291 B9R1.2 c1cc(nc(c1)Cl)C=O AB52723 [0,1,0,0,0,0|2,0,1]=4 292 B9R1.2 c1cc(nc(c1)Cl)CCl AB42311 [0,1,0,0,0,0|3,0,0]=4 293 B9R1.2 c1cc(nc(c1)Cl)CN AB62988 [0,1,0,0,0,0|3,0,0]=4 294 B9R1.2 c1cc(nc(c1)Cl)CO AB42312 [0,1,0,0,0,0|2,0,0]=3 295 B9R1.2 c1cc(nc(c1)F)C#N AB50189 [0,1,0,0,0,0|3,0,0]=4 296 B9R1.2 c1cc(nc(c1)F)C=O AB13533 [0,1,0,0,0,0|2,0,1]=4 297 B9R1.2 c1cc(nc(c1)F)CCl AB42316 [0,1,0,0,0,0|3,0,0]=4 298 B9R1.2 c1cc(nc(c1)F)CN AB66365 [0,1,0,0,0,0|3,0,0]=4 299 B9R1.2 c1cc(nc(c1)I)CO AB42511 [0,1,0,0,0,0|2,0,0]=3 300 B9R1.2 c1cc(nc(c1)N)C#N AB62904 [0,1,0,0,0,0|3,0,0]=4 301 B9R1.2 c1cc(nc(c1)N)CO AB53761 [0,1,0,0,0,0|2,0,0]=3 302 B9R1.2 c1cc(nc(c1)O)C#N AB62925 [0,1,0,0,0,0|2,0,0]=3 303 B9R1.2 c1cnc(cc1Br)C#N PB29307 [0,1,0,0,0,0|3,0,0]=4 304 B9R1.2 c1cnc(cc1Br)C=O PB10584 [0,1,0,0,0,0|2,0,1]=4 305 B9R1.2 c1cnc(cc1Br)CCl AB67964 [0,1,0,0,0,0|3,0,0]=4 306 B9R1.2 c1cnc(cc1Br)CN PB17414 [0,1,0,0,0,0|3,0,0]=4 307 B9R1.2 c1cnc(cc1Br)CO PB31388 [0,1,0,0,0,0|2,0,0]=3 308 B9R1.2 c1cnc(cc1C#N)Br AB31306 [0,1,0,0,0,0|3,0,0]=4 309 B9R1.2 c1cnc(cc1C#N)Cl AB04394 [0,1,0,0,0,0|3,0,0]=4 310 B9R1.2 c1cnc(cc1C#N)F AB49151 [0,1,0,0,0,0|3,0,0]=4 311 B9R1.2 c1cnc(cc1C#N)N PB17329 [0,1,0,0,0,0|3,0,0]=4 312 B9R1.2 c1cnc(cc1C#N)O PB20081 [0,1,0,0,0,0|2,0,0]=3 313 B9R1.2 c1cnc(cc1C=O)Br AB17326 [0,1,0,0,0,0|2,0,1]=4 314 B9R1.2 c1cnc(cc1C=O)Cl PB21899 [0,1,0,0,0,0|2,0,1]=4 315 B9R1.2 c1cnc(cc1C=O)F AB24818 [0,1,0,0,0,0|2,0,1]=4 316 B9R1.2 c1cnc(cc1CCl)Br AB65254 [0,1,0,0,0,0|3,0,0]=4 317 B9R1.2 c1cnc(cc1CCl)Cl AB55687 [0,1,0,0,0,0|3,0,0]=4 318 B9R1.2 c1cnc(cc1CCl)Cl AB59906 [0,1,0,0,0,0|3,0,0]=4 319 B9R1.2 c1cnc(cc1CCl)F AB59901 [0,1,0,0,0,0|3,0,0]=4 320 B9R1.2 c1cnc(cc1CN)Br AB31307 [0,1,0,0,0,0|3,0,0]=4 321 B9R1.2 c1cnc(cc1CN)Cl PB15828 [0,1,0,0,0,0|3,0,0]=4 322 B9R1.2 c1cnc(cc1CN)F AB63132 [0,1,0,0,0,0|3,0,0]=4 323 B9R1.2 c1cnc(cc1CN)F AB63135 [0,1,0,0,0,0|3,0,0]=4 324 B9R1.2 c1cnc(cc1CN)N AB23468 [0,1,0,0,0,0|3,0,0]=4 325 B9R1.2 c1cnc(cc1CO)Br AB17330 [0,1,0,0,0,0|2,0,0]=3 326 B9R1.2 c1cnc(cc1CO)Cl PB21002 [0,1,0,0,0,0|2,0,0]=3 327 B9R1.2 c1cnc(cc1CO)N PB33706 [0,1,0,0,0,0|2,0,0]=3 328 B9R1.2 c1cnc(cc1Cl)C#N PB32398 [0,1,0,0,0,0|3,0,0]=4 329 B9R1.2 c1cnc(cc1Cl)C=O PB32513 [0,1,0,0,0,0|2,0,1]=4 330 B9R1.2 c1cnc(cc1Cl)CCl AB42295 [0,1,0,0,0,0|3,0,0]=4 331 B9R1.2 c1cnc(cc1Cl)CCl MB05829 [0,1,0,0,0,0|3,0,0]=4 332 B9R1.2 c1cnc(cc1Cl)CN PB27784 [0,1,0,0,0,0|3,0,0]=4 333 B9R1.2 c1cnc(cc1Cl)CO PB23493 [0,1,0,0,0,0|2,0,0]=3 334 B9R1.2 c1cnc(cc1F)C#N AB52749 [0,1,0,0,0,0|3,0,0]=4 335 B9R1.2 c1cnc(cc1F)C=O AB68024 [0,1,0,0,0,0|2,0,1]=4 336 B9R1.2 c1cnc(cc1F)CCl AB68051 [0,1,0,0,0,0|3,0,0]=4 337 B9R1.2 c1cnc(cc1F)CN AB65162 [0,1,0,0,0,0|3,0,0]=4 338 B9R1.2 c1cnc(cc1N)C#N PB10426 [0,1,0,0,0,0|3,0,0]=4 339 B9R1.2 c1cnc(cc1N)C=O AB68102 [0,1,0,0,0,0|2,0,1]=4 340 B9R1.2 c1cnc(cc1O)C#N MB05241 [0,1,0,0,0,0|2,0,0]=3 341 B9R1.2 c1cnc(cc1O)C=O AB68125 [0,1,0,0,0,0|1,0,1]=3 342 B9R1.2 c1cnc(cc1O)CN MB14853 [0,1,0,0,0,0|2,0,0]=3 343 B9R1.2 c1cnc(nc1CN)O PB23029 [0,1,0,0,0,0|3,0,0]=4 344 B9R1.2 c1cnc(nc1Cl)CO AB64233 [0,1,0,0,0,0|3,0,0]=4 345 B9R1.2 c1cnc(nc1O)CCl AB59397 [0,1,0,0,0,0|3,0,0]=4 346 B9R1.2 c1cnc(nc1O)CN AB63186 [0,1,0,0,0,0|3,0,0]=4 347 B9R1.3 Cc1c(c(ccn1)Br)Cl AB63983 [0,1,0,0,0,0|3,0,0]=4 348 B9R1.3 Cc1c(c(ccn1)Cl)Br AB63984 [0,1,0,0,0,0|3,0,0]=4 349 B9R1.3 Cc1c(c(ccn1)Cl)Cl AB53567 [0,1,0,0,0,0|3,0,0]=4 350 B9R1.3 Cc1c(c(ccn1)Cl)N AB70877 [0,1,0,0,0,0|3,0,0]=4 351 B9R1.3 Cc1c(c(ccn1)Cl)O AB71205 [0,1,0,0,0,0|3,0,0]=4 352 B9R1.3 Cc1c(c(ccn1)F)Br AB71088 [0,1,0,0,0,0|3,0,0]=4 353 B9R1.3 Cc1c(c(ccn1)F)N AB70905 [0,1,0,0,0,0|3,0,0]=4 354 B9R1.3 Cc1c(c(ccn1)F)O AB71324 [0,1,0,0,0,0|3,0,0]=4 355 B9R1.3 Cc1c(c(ccn1)N)Cl AB51074 [0,1,0,0,0,0|3,0,0]=4 356 B9R1.3 Cc1c(c(ccn1)N)N AB55860 [0,1,0,0,0,0|3,0,0]=4 357 B9R1.3 Cc1c(c(ccn1)O)Cl AB71193 [0,1,0,0,0,0|2,0,0]=3 358 B9R1.3 Cc1c(c(ncn1)O)Br AB09553 [0,1,0,0,0,0|3,0,0]=4 359 B9R1.3 Cc1c(c(ncn1)O)Cl AB05118 [0,1,0,0,0,0|3,0,0]=4 360 B9R1.3 Cc1c(cccc1Br)O MB09253 [0,1,0,0,0,0|1,0,0]=2 361 B9R1.3 Cc1c(cccc1I)O MB23347 [0,1,0,0,0,0|1,0,0]=2 362 B9R1.3 Cc1c(ccnc1Br)Cl AB71053 [0,1,0,0,0,0|3,0,0]=4 363 B9R1.3 Cc1c(ccnc1Br)F AB71081 [0,1,0,0,0,0|3,0,0]=4 364 B9R1.3 Cc1c(ccnc1Cl)Br AB53555 [0,1,0,0,0,0|3,0,0]=4 365 B9R1.3 Cc1c(ccnc1Cl)I AB13660 [0,1,0,0,0,0|3,0,0]=4 366 B9R1.3 Cc1c(ccnc1Cl)N AB75729 [0,1,0,0,0,0|3,0,0]=4 367 B9R1.3 Cc1c(ccnc1Cl)O AB71179 [0,1,0,0,0,0|2,0,0]=3 368 B9R1.3 Cc1c(ccnc1F)Br AB53559 [0,1,0,0,0,0|3,0,0]=4 369 B9R1.3 Cc1c(ccnc1F)N AB82851 [0,1,0,0,0,0|3,0,0]=4 370 B9R1.3 Cc1c(ccnc1F)O AB71301 [0,1,0,0,0,0|2,0,0]=3 371 B9R1.3 Cc1c(ccnc1N)Cl AB70874 [0,1,0,0,0,0|3,0,0]=4 372 B9R1.3 Cc1c(ccnc1N)F AB70896 [0,1,0,0,0,0|3,0,0]=4 373 B9R1.3 Cc1c(ccnc1O)Cl AB71198 [0,1,0,0,0,0|2,0,0]=3 374 B9R1.3 Cc1c(ccnc1O)F AB71318 [0,1,0,0,0,0|2,0,0]=3 375 B9R1.3 Cc1c(cncc1Br)Br AB03597 [0,1,0,0,0,0|3,0,0]=4 376 B9R1.3 Cc1c(cncc1Br)Cl AB75733 [0,1,0,0,0,0|3,0,0]=4 377 B9R1.3 Cc1c(cncc1Br)F AB74995 [0,1,0,0,0,0|3,0,0]=4 378 B9R1.3 Cc1c(cncc1Br)N AB42002 [0,1,0,0,0,0|3,0,0]=4 379 B9R1.3 Cc1c(cncc1Cl)N AB41999 [0,1,0,0,0,0|3,0,0]=4 380 B9R1.3 Cc1c(cncc1Cl)O AB70586 [0,1,0,0,0,0|2,0,0]=3 381 B9R1.3 Cc1c(nccc1Br)C AB74548 [0,1,0,0,0,0|3,0,0]=4 382 B9R1.3 Cc1c(nccc1Cl)C AB72126 [0,1,0,0,0,0|3,0,0]=4 383 B9R1.3 Cc1c(nccc1N)C AB01511 [0,1,0,0,0,0|3,0,0]=4 384 B9R1.3 Cc1c(nccc1O)C AB75493 [0,1,0,0,0,0|2,0,0]=3 385 B9R1.3 Cc1c(ncnc1O)C AB05196 [0,1,0,0,0,0|3,0,0]=4 386 B9R1.3 Cc1cccc(c1Br)O MB08359 [0,1,0,0,0,0|1,0,0]=2 387 B9R1.3 Cc1cccc(c1Cl)O MB00390 [0,1,0,0,0,0|1,0,0]=2 388 B9R1.3 Cc1cccc(c1F)N AB25121 [0,1,0,0,0,0|2,0,0]=3 389 B9R1.3 Cc1cccc(c1I)O MB23494 [0,1,0,0,0,0|1,0,0]=2 390 B9R1.3 Cc1cccc(c1N)Br MB03160 [0,1,0,0,0,0|2,0,0]=3 391 B9R1.3 Cc1cccc(c1N)F MB03934 [0,1,0,0,0,0|2,0,0]=3 392 B9R1.3 Cc1cccc(c1O)F MB11516 [0,1,0,0,0,0|2,0,0]=3 393 B9R1.3 Cc1cccc(c1O)I MB23471 [0,1,0,0,0,0|2,0,0]=3 394 B9R1.3 Cc1cccc(c1O)N MB02950 [0,1,0,0,0,0|2,0,0]=3 395 B9R1.3 Cc1ccnc(c1Br)C AB53712 [0,1,0,0,0,0|3,0,0]=4 396 B9R1.3 Cc1ccnc(c1Br)Cl PB21837 [0,1,0,0,0,0|3,0,0]=4 397 B9R1.3 Cc1ccnc(c1Br)F AB44900 [0,1,0,0,0,0|3,0,0]=4 398 B9R1.3 Cc1ccnc(c1C)Br AB25365 [0,1,0,0,0,0|3,0,0]=4 399 B9R1.3 Cc1ccnc(c1C)N AB11611 [0,1,0,0,0,0|3,0,0]=4 400 B9R1.3 Cc1ccnc(c1C)O AB66577 [0,1,0,0,0,0|2,0,0]=3 401 B9R1.3 Cc1ccnc(c1Cl)Br AB44895 [0,1,0,0,0,0|3,0,0]=4 402 B9R1.3 Cc1ccnc(c1Cl)N AB53535 [0,1,0,0,0,0|3,0,0]=4 403 B9R1.3 Cc1ccnc(c1Cl)O AB71192 [0,1,0,0,0,0|2,0,0]=3 404 B9R1.3 Cc1ccnc(c1N)Br AB17559 [0,1,0,0,0,0|3,0,0]=4 405 B9R1.3 Cc1ccnc(c1N)C AB43810 [0,1,0,0,0,0|3,0,0]=4 406 B9R1.3 Cc1ccnc(c1N)Cl PB21708 [0,1,0,0,0,0|3,0,0]=4 407 B9R1.3 Cc1ccnc(c1N)F AB17625 [0,1,0,0,0,0|3,0,0]=4 408 B9R1.3 Cc1ccnc(c1N)N PB32179 [0,1,0,0,0,0|3,0,0]=4 409 B9R1.3 Cc1ccnc(c1O)C AB43831 [0,1,0,0,0,0|3,0,0]=4 410 B9R1.3 Cc1ccnc(c1O)Cl AB17632 [0,1,0,0,0,0|3,0,0]=4 411 B9R1.3 Cc1ccnc(c1O)F AB71297 [0,1,0,0,0,0|3,0,0]=4 412 B9R1.3 Cc1cncc(c1Br)C AB53717 [0,1,0,0,0,0|3,0,0]=4 413 B9R1.3 Cc1cncc(c1Br)Cl AB74973 [0,1,0,0,0,0|3,0,0]=4 414 B9R1.3 Cc1cncc(c1Br)F AB74996 [0,1,0,0,0,0|3,0,0]=4 415 B9R1.3 Cc1cncc(c1C)Br AB64494 [0,1,0,0,0,0|3,0,0]=4 416 B9R1.3 Cc1cncc(c1C)N AB76783 [0,1,0,0,0,0|3,0,0]=4 417 B9R1.3 Cc1cncc(c1C)O AB65620 [0,1,0,0,0,0|2,0,0]=3 418 B9R1.3 Cc1cncc(c1Cl)Br AB75732 [0,1,0,0,0,0|3,0,0]=4 419 B9R1.3 Cc1cncc(c1Cl)C AB50483 [0,1,0,0,0,0|3,0,0]=4 420 B9R1.3 Cc1cncc(c1Cl)N AB75728 [0,1,0,0,0,0|3,0,0]=4 421 B9R1.3 Cc1cncc(c1Cl)O AB71654 [0,1,0,0,0,0|2,0,0]=3 422 B9R1.3 Cc1cncc(c1F)Br AB74994 [0,1,0,0,0,0|3,0,0]=4 423 B9R1.3 Cc1cncc(c1F)N AB66587 [0,1,0,0,0,0|3,0,0]=4 424 B9R1.3 Cc1cncc(c1F)O AB82936 [0,1,0,0,0,0|2,0,0]=3 425 B9R1.3 Cc1cncc(c1N)C AB14443 [0,1,0,0,0,0|3,0,0]=4 426 B9R1.3 Cc1cncc(c1N)Cl AB44879 [0,1,0,0,0,0|3,0,0]=4 427 B9R1.3 Cc1cncc(c1N)F AB75360 [0,1,0,0,0,0|3,0,0]=4 428 B9R1.3 Cc1cncc(c1N)N AB60255 [0,1,0,0,0,0|3,0,0]=4 429 B9R1.3 Cc1cncc(c1O)C AB82550 [0,1,0,0,0,0|3,0,0]=4 430 B9R1.3 Cc1cncc(c1O)Cl AB75744 [0,1,0,0,0,0|3,0,0]=4 431 B9R1.3 Cc1cncc(c1O)F AB25961 [0,1,0,0,0,0|3,0,0]=4 432 B9R1.3 Cn1c(=O)cccc1Br MB01001 [0,1,0,0,0,0|2,0,1]=4 433 B9R1.3 Cn1cccc(c1=O)Br PB32951 [0,1,0,0,0,0|3,0,0]=4 434 B9R1.3 Cn1cccc(c1=O)N PB15071 [0,1,0,0,0,0|3,0,0]=4 435 B9R1.3 c1c(c(c(cn1)Br)Cl)Br PB24627 [0,1,0,0,0,0|3,0,0]=4 436 B9R1.3 c1c(c(c(cn1)Br)Cl)F AB74956 [0,1,0,0,0,0|3,0,0]=4 437 B9R1.3 c1c(c(c(cn1)Br)Cl)N AB66381 [0,1,0,0,0,0|3,0,0]=4 438 B9R1.3 c1c(c(c(cn1)Br)Cl)O AB74970 [0,1,0,0,0,0|2,0,0]=3 439 B9R1.3 c1c(c(c(cn1)Br)F)Cl AB82965 [0,1,0,0,0,0|3,0,0]=4 440 B9R1.3 c1c(c(c(cn1)Br)N)Cl AB56437 [0,1,0,0,0,0|3,0,0]=4 441 B9R1.3 c1c(c(c(cn1)Br)O)Cl AB66732 [0,1,0,0,0,0|3,0,0]=4 442 B9R1.3 c1c(c(c(cn1)Br)O)N AB48393 [0,1,0,0,0,0|3,0,0]=4 443 B9R1.3 c1c(c(c(cn1)Cl)Br)Cl MB04163 [0,1,0,0,0,0|3,0,0]=4 444 B9R1.3 c1c(c(c(cn1)Cl)Br)F AB70924 [0,1,0,0,0,0|3,0,0]=4 445 B9R1.3 c1c(c(c(cn1)Cl)Cl)N AB55065 [0,1,0,0,0,0|3,0,0]=4 446 B9R1.3 c1c(c(c(cn1)Cl)F)N AB75054 [0,1,0,0,0,0|3,0,0]=4 447 B9R1.3 c1c(c(c(cn1)Cl)F)O AB82968 [0,1,0,0,0,0|2,0,0]=3 448 B9R1.3 c1c(c(c(cn1)Cl)I)Cl CB10652 [0,1,0,0,0,0|3,0,0]=4 449 B9R1.3 c1c(c(c(cn1)Cl)N)Cl AB03509 [0,1,0,0,0,0|3,0,0]=4 450 B9R1.3 c1c(c(c(cn1)Cl)N)F AB70854 [0,1,0,0,0,0|3,0,0]=4 451 B9R1.3 c1c(c(c(cn1)Cl)N)N AB50200 [0,1,0,0,0,0|3,0,0]=4 452 B9R1.3 c1c(c(c(cn1)Cl)N)O AB83899 [0,1,0,0,0,0|2,0,0]=3 453 B9R1.3 c1c(c(c(cn1)Cl)O)Cl AB02053 [0,1,0,0,0,0|3,0,0]=4 454 B9R1.3 c1c(c(c(cn1)Cl)O)F AB66744 [0,1,0,0,0,0|3,0,0]=4 455 B9R1.3 c1c(c(c(cn1)Cl)O)N AB84022 [0,1,0,0,0,0|3,0,0]=4 456 B9R1.3 c1c(c(c(cn1)Cl)O)O AB84021 [0,1,0,0,0,0|2,0,0]=3 457 B9R1.3 c1c(c(c(cn1)F)Cl)N AB83146 [0,1,0,0,0,0|3,0,0]=4 458 B9R1.3 c1c(c(c(cn1)F)Cl)O AB83144 [0,1,0,0,0,0|2,0,0]=3 459 B9R1.3 c1c(c(c(cn1)F)N)F AB10209 [0,1,0,0,0,0|3,0,0]=4 460 B9R1.3 c1c(c(c(cn1)N)Cl)N AB71544 [0,1,0,0,0,0|3,0,0]=4 461 B9R1.3 c1c(c(c(cn1)O)Cl)N AB83874 [0,1,0,0,0,0|2,0,0]=3 462 B9R1.3 c1c(c(c(cn1)O)Cl)O AB83993 [0,1,0,0,0,0|1,0,0]=2 463 B9R1.3 c1cc(c(c(c1)Br)Br)O MB05354 [0,1,0,0,0,0|1,0,0]=2 464 B9R1.3 c1cc(c(c(c1)Br)Cl)Br CB11700 [0,1,0,0,0,0|2,0,0]=3 465 B9R1.3 c1cc(c(c(c1)Br)I)O MB05341 [0,1,0,0,0,0|1,0,0]=2 466 B9R1.3 c1cc(c(c(c1)Br)O)Cl MB08152 [0,1,0,0,0,0|2,0,0]=3 467 B9R1.3 c1cc(c(c(c1)Br)O)N AB44905 [0,1,0,0,0,0|2,0,0]=3 468 B9R1.3 c1cc(c(c(c1)Cl)Br)N MB08909 [0,1,0,0,0,0|2,0,0]=3 469 B9R1.3 c1cc(c(c(c1)Cl)Br)O MB03079 [0,1,0,0,0,0|1,0,0]=2 470 B9R1.3 c1cc(c(c(c1)Cl)I)N AB28280 [0,1,0,0,0,0|2,0,0]=3 471 B9R1.3 c1cc(c(c(c1)Cl)I)O MB05351 [0,1,0,0,0,0|1,0,0]=2 472 B9R1.3 c1cc(c(c(c1)Cl)N)N AB54530 [0,1,0,0,0,0|2,0,0]=3 473 B9R1.3 c1cc(c(c(c1)Cl)N)O MB10127 [0,1,0,0,0,0|1,0,0]=2 474 B9R1.3 c1cc(c(c(c1)F)Br)O MB03082 [0,1,0,0,0,0|1,0,0]=2 475 B9R1.3 c1cc(c(c(c1)F)Cl)N AB14054 [0,1,0,0,0,0|2,0,0]=3 476 B9R1.3 c1cc(c(c(c1)F)Cl)O MB05350 [0,1,0,0,0,0|1,0,0]=2 477 B9R1.3 c1cc(c(c(c1)F)I)O MB05358 [0,1,0,0,0,0|1,0,0]=2 478 B9R1.3 c1cc(c(c(c1)F)N)N MB00506 [0,1,0,0,0,0|2,0,0]=3 479 B9R1.3 c1cc(c(c(c1)F)O)N AB45742 [0,1,0,0,0,0|2,0,0]=3 480 B9R1.3 c1cc(c(c(c1)I)Br)F MB07001 [0,1,0,0,0,0|2,0,0]=3 481 B9R1.3 c1cc(c(c(c1)I)Br)O MB05348 [0,1,0,0,0,0|1,0,0]=2 482 B9R1.3 c1cc(c(c(c1)I)Cl)O MB05352 [0,1,0,0,0,0|1,0,0]=2 483 B9R1.3 c1cc(c(c(c1)I)F)O MB12056 [0,1,0,0,0,0|1,0,0]=2 484 B9R1.3 c1cc(c(c(c1)I)I)O MB05357 [0,1,0,0,0,0|1,0,0]=2 485 B9R1.3 c1cc(c(c(c1)I)N)O MB03004 [0,1,0,0,0,0|1,0,0]=2 486 B9R1.3 c1cc(c(c(c1)I)O)Br MB25662 [0,1,0,0,0,0|2,0,0]=3 487 B9R1.3 c1cc(c(c(c1)I)O)Cl MB14795 [0,1,0,0,0,0|2,0,0]=3 488 B9R1.3 c1cc(c(c(c1)I)O)F MB05032 [0,1,0,0,0,0|2,0,0]=3 489 B9R1.3 c1cc(c(c(c1)I)O)I MB25505 [0,1,0,0,0,0|2,0,0]=3 490 B9R1.3 c1cc(c(c(c1)I)O)N MB35855 [0,1,0,0,0,0|2,0,0]=3 491 B9R1.3 c1cc(c(c(c1)N)O)N MB01221 [0,1,0,0,0,0|2,0,0]=3 492 B9R1.3 c1cc(c(c(c1)O)Br)N MB10095 [0,1,0,0,0,0|1,0,0]=2 493 B9R1.3 c1cc(c(c(c1)O)Cl)N MB09140 [0,1,0,0,0,0|1,0,0]=2 494 B9R1.3 c1cc(c(c(c1)O)F)N MB25684 [0,1,0,0,0,0|1,0,0]=2 495 B9R1.3 c1cc(c(c(c1)O)I)N MB09919 [0,1,0,0,0,0|1,0,0]=2 496 B9R1.3 c1cnc(c(c1Br)Cl)F AB62814 [0,1,0,0,0,0|3,0,0]=4 497 B9R1.3 c1cnc(c(c1Br)Cl)N AB70625 [0,1,0,0,0,0|3,0,0]=4 498 B9R1.3 c1cnc(c(c1Br)Cl)O AB70927 [0,1,0,0,0,0|2,0,0]=3 499 B9R1.3 c1cnc(c(c1Br)F)Cl AB70923 [0,1,0,0,0,0|3,0,0]=4 500 B9R1.3 c1cnc(c(c1Br)N)Cl AB76588 [0,1,0,0,0,0|3,0,0]=4 501 B9R1.3 c1cnc(c(c1Br)N)N PB33239 [0,1,0,0,0,0|3,0,0]=4 502 B9R1.3 c1cnc(c(c1Br)O)Cl AB70925 [0,1,0,0,0,0|3,0,0]=4 503 B9R1.3 c1cnc(c(c1Cl)Br)F AB74960 [0,1,0,0,0,0|3,0,0]=4 504 B9R1.3 c1cnc(c(c1Cl)Cl)N AB44396 [0,1,0,0,0,0|3,0,0]=4 505 B9R1.3 c1cnc(c(c1Cl)Cl)O AB71282 [0,1,0,0,0,0|2,0,0]=3 506 B9R1.3 c1cnc(c(c1Cl)F)Br AB74959 [0,1,0,0,0,0|3,0,0]=4 507 B9R1.3 c1cnc(c(c1Cl)F)N AB83135 [0,1,0,0,0,0|3,0,0]=4 508 B9R1.3 c1cnc(c(c1Cl)F)O AB71156 [0,1,0,0,0,0|2,0,0]=3 509 B9R1.3 c1cnc(c(c1Cl)I)Cl CB11215 [0,1,0,0,0,0|3,0,0]=4 510 B9R1.3 c1cnc(c(c1Cl)I)N PB16074 [0,1,0,0,0,0|3,0,0]=4 511 B9R1.3 c1cnc(c(c1Cl)N)Br AB70423 [0,1,0,0,0,0|3,0,0]=4 512 B9R1.3 c1cnc(c(c1Cl)N)Cl AB51385 [0,1,0,0,0,0|3,0,0]=4 513 B9R1.3 c1cnc(c(c1Cl)N)F AB83198 [0,1,0,0,0,0|3,0,0]=4 514 B9R1.3 c1cnc(c(c1Cl)N)N PB28504 [0,1,0,0,0,0|3,0,0]=4 515 B9R1.3 c1cnc(c(c1Cl)N)O AB75026 [0,1,0,0,0,0|2,0,0]=3 516 B9R1.3 c1cnc(c(c1Cl)O)Br AB74968 [0,1,0,0,0,0|3,0,0]=4 517 B9R1.3 c1cnc(c(c1Cl)O)Cl AB70492 [0,1,0,0,0,0|3,0,0]=4 518 B9R1.3 c1cnc(c(c1Cl)O)F AB71148 [0,1,0,0,0,0|3,0,0]=4 519 B9R1.3 c1cnc(c(c1Cl)O)N AB53290 [0,1,0,0,0,0|3,0,0]=4 520 B9R1.3 c1cnc(c(c1Cl)O)O AB83983 [0,1,0,0,0,0|2,0,0]=3 521 B9R1.3 c1cnc(c(c1F)Cl)Br AB82998 [0,1,0,0,0,0|3,0,0]=4 522 B9R1.3 c1cnc(c(c1F)Cl)N AB83000 [0,1,0,0,0,0|3,0,0]=4 523 B9R1.3 c1cnc(c(c1F)Cl)O AB71146 [0,1,0,0,0,0|2,0,0]=3 524 B9R1.3 c1cnc(c(c1I)O)I MB09113 [0,1,0,0,0,0|3,0,0]=4 525 B9R1.3 c1cnc(c(c1N)Br)Cl PB34372 [0,1,0,0,0,0|3,0,0]=4 526 B9R1.3 c1cnc(c(c1N)Cl)Br AB09546 [0,1,0,0,0,0|3,0,0]=4 527 B9R1.3 c1cnc(c(c1N)Cl)Cl AB09580 [0,1,0,0,0,0|3,0,0]=4 528 B9R1.3 c1cnc(c(c1N)Cl)F AB70632 [0,1,0,0,0,0|3,0,0]=4 529 B9R1.3 c1cnc(c(c1N)Cl)N AB70628 [0,1,0,0,0,0|3,0,0]=4 530 B9R1.3 c1cnc(c(c1N)Cl)O AB51578 [0,1,0,0,0,0|2,0,0]=3 531 B9R1.3 c1cnc(c(c1N)F)Cl AB70858 [0,1,0,0,0,0|3,0,0]=4 532 B9R1.3 c1cnc(c(c1N)N)Br PB11027 [0,1,0,0,0,0|3,0,0]=4 533 B9R1.3 c1cnc(c(c1N)N)Cl PB12434 [0,1,0,0,0,0|3,0,0]=4 534 B9R1.3 c1cnc(c(c1N)N)F AB70620 [0,1,0,0,0,0|3,0,0]=4 535 B9R1.3 c1cnc(c(c1N)N)N AB52988 [0,1,0,0,0,0|3,0,0]=4 536 B9R1.3 c1cnc(c(c1N)O)Cl AB70863 [0,1,0,0,0,0|3,0,0]=4 537 B9R1.3 c1cnc(c(c1O)Cl)Br AB74964 [0,1,0,0,0,0|2,0,0]=3 538 B9R1.3 c1cnc(c(c1O)Cl)Cl AB71281 [0,1,0,0,0,0|2,0,0]=3 539 B9R1.3 c1cnc(c(c1O)Cl)F AB71141 [0,1,0,0,0,0|2,0,0]=3 540 B9R1.3 c1cnc(c(c1O)Cl)N AB74554 [0,1,0,0,0,0|2,0,0]=3 541 B9R1.3 c1cnc(c(c1O)Cl)O AB09579 [0,1,0,0,0,0|1,0,0]=2 542 B9R1.3 c1cnc(c(c1O)F)Cl AB69317 [0,1,0,0,0,0|2,0,0]=3 543 B9R1.3 c1cnc(c(c1O)N)Cl AB76250 [0,1,0,0,0,0|2,0,0]=3 544 B9R1.3 c1cnc(c(c1O)O)Cl AB70497 [0,1,0,0,0,0|2,0,0]=3 545 B9R1.3 c1nc(c(c(n1)Cl)Cl)O AB54896 [0,1,0,0,0,0|3,0,0]=4 546 B9R1.3 c1nc(c(c(n1)O)F)O PB25105 [0,1,0,0,0,0|2,0,0]=3 547 B9R1.3 c1nc(c(c(n1)O)I)N AB53178 [0,1,0,0,0,0|3,0,0]=4 548 B9R1.3 c1nc(c(c(n1)O)N)N MB00183 [0,1,0,0,0,0|3,0,0]=4 549 B9R1.34 Cc1cc([nH]c(=O)c1)O PB33379 [0,1,0,0,0,0|1,0,1]=3 550 B9R1.34 Cc1cc(cc(c1)Br)Cl AB45173 [0,1,0,0,0,0|2,0,0]=3 551 B9R1.34 Cc1cc(cc(c1)Br)F AB10112 [0,1,0,0,0,0|2,0,0]=3 552 B9R1.34 Cc1cc(cc(c1)Br)O MB06890 [0,1,0,0,0,0|1,0,0]=2 553 B9R1.34 Cc1cc(cc(c1)Cl)Cl MB00382 [0,1,0,0,0,0|2,0,0]=3 554 B9R1.34 Cc1cc(cc(c1)Cl)F AB13848 [0,1,0,0,0,0|2,0,0]=3 555 B9R1.34 Cc1cc(cc(c1)Cl)O MB05590 [0,1,0,0,0,0|1,0,0]=2 556 B9R1.34 Cc1cc(cc(c1)I)O MB11871 [0,1,0,0,0,0|1,0,0]=2 557 B9R1.34 Cc1cc(cc(c1)O)N MB00602 [0,1,0,0,0,0|1,0,0]=2 558 B9R1.34 Cc1cc(cc(n1)Br)Cl AB70506 [0,1,0,0,0,0|3,0,0]=4 559 B9R1.34 Cc1cc(cc(n1)Br)F AB71085 [0,1,0,0,0,0|3,0,0]=4 560 B9R1.34 Cc1cc(cc(n1)Br)N AB65433 [0,1,0,0,0,0|3,0,0]=4 561 B9R1.34 Cc1cc(cc(n1)C)Br AB06743 [0,1,0,0,0,0|3,0,0]=4 562 B9R1.34 Cc1cc(cc(n1)C)Cl AB09599 [0,1,0,0,0,0|3,0,0]=4 563 B9R1.34 Cc1cc(cc(n1)C)N AB03678 [0,1,0,0,0,0|3,0,0]=4 564 B9R1.34 Cc1cc(cc(n1)C)O AB07775 [0,1,0,0,0,0|2,0,0]=3 565 B9R1.34 Cc1cc(cc(n1)Cl)Cl AB46092 [0,1,0,0,0,0|3,0,0]=4 566 B9R1.34 Cc1cc(cc(n1)Cl)N AB05304 [0,1,0,0,0,0|3,0,0]=4 567 B9R1.34 Cc1cc(cc(n1)F)Br AB71093 [0,1,0,0,0,0|3,0,0]=4 568 B9R1.34 Cc1cc(cc(n1)N)Cl AB07298 [0,1,0,0,0,0|3,0,0]=4 569 B9R1.34 Cc1cc(cc(n1)N)F AB70902 [0,1,0,0,0,0|3,0,0]=4 570 B9R1.34 Cc1cc(cc(n1)O)Cl AB71203 [0,1,0,0,0,0|2,0,0]=3 571 B9R1.34 Cc1cc(cc(n1)O)F AB71321 [0,1,0,0,0,0|2,0,0]=3 572 B9R1.34 Cc1cc(cc(n1)O)O AB10075 [0,1,0,0,0,0|1,0,0]=2 573 B9R1.34 Cc1cc(nc(c1)Br)C AB03103 [0,1,0,0,0,0|3,0,0]=4 574 B9R1.34 Cc1cc(nc(c1)Br)Cl AB53549 [0,1,0,0,0,0|3,0,0]=4 575 B9R1.34 Cc1cc(nc(c1)Br)F AB53551 [0,1,0,0,0,0|3,0,0]=4 576 B9R1.34 Cc1cc(nc(c1)Cl)Cl PB31372 [0,1,0,0,0,0|3,0,0]=4 577 B9R1.34 Cc1cc(nc(c1)Cl)N AB53542 [0,1,0,0,0,0|3,0,0]=4 578 B9R1.34 Cc1cc(nc(c1)Cl)O AB71189 [0,1,0,0,0,0|2,0,0]=3 579 B9R1.34 Cc1cc(nc(c1)F)N AB83076 [0,1,0,0,0,0|3,0,0]=4 580 B9R1.34 Cc1cc(nc(c1)F)O AB71308 [0,1,0,0,0,0|2,0,0]=3 581 B9R1.34 Cc1cc(nc(c1)N)C AB00706 [0,1,0,0,0,0|3,0,0]=4 582 B9R1.34 Cc1cc(nc(c1)O)C AB07368 [0,1,0,0,0,0|2,0,0]=3 583 B9R1.34 Cc1cc(nc(n1)C)O AB00587 [0,1,0,0,0,0|3,0,0]=4 584 B9R1.34 c1c(cc(cc1Br)I)Cl AB42475 [0,1,0,0,0,0|2,0,0]=3 585 B9R1.34 c1c(cc(cc1Br)I)O MB11855 [0,1,0,0,0,0|1,0,0]=2 586 B9R1.34 c1c(cc(cc1Cl)Br)N AB29734 [0,1,0,0,0,0|2,0,0]=3 587 B9R1.34 c1c(cc(cc1Cl)Br)O AB42547 [0,1,0,0,0,0|1,0,0]=2 588 B9R1.34 c1c(cc(cc1Cl)I)O MB11857 [0,1,0,0,0,0|1,0,0]=2 589 B9R1.34 c1c(cc(cc1F)I)O MB26711 [0,1,0,0,0,0|1,0,0]=2 590 B9R1.34 c1c(cc(cc1I)I)O MB11867 [0,1,0,0,0,0|1,0,0]=2 591 B9R1.34 c1c(cc(cc1O)Br)N MB25497 [0,1,0,0,0,0|1,0,0]=2 592 B9R1.34 c1c(cc(cc1O)F)N MB11825 [0,1,0,0,0,0|1,0,0]=2 593 B9R1.34 c1c(cc(cc1O)I)N MB34300 [0,1,0,0,0,0|1,0,0]=2 594 B9R1.34 c1c(cc(nc1Br)Br)Cl AB68802 [0,1,0,0,0,0|3,0,0]=4 595 B9R1.34 c1c(cc(nc1Br)Br)N AB05102 [0,1,0,0,0,0|3,0,0]=4 596 B9R1.34 c1c(cc(nc1Cl)Br)Cl AB62525 [0,1,0,0,0,0|3,0,0]=4 597 B9R1.34 c1c(cc(nc1Cl)Br)F AB83211 [0,1,0,0,0,0|3,0,0]=4 598 B9R1.34 c1c(cc(nc1Cl)Br)N AB68218 [0,1,0,0,0,0|3,0,0]=4 599 B9R1.34 c1c(cc(nc1Cl)Cl)Br AB64829 [0,1,0,0,0,0|3,0,0]=4 600 B9R1.34 c1c(cc(nc1Cl)Cl)Cl PB19901 [0,1,0,0,0,0|3,0,0]=4 601 B9R1.34 c1c(cc(nc1Cl)Cl)F AB66757 [0,1,0,0,0,0|3,0,0]=4 602 B9R1.34 c1c(cc(nc1Cl)Cl)I AB32018 [0,1,0,0,0,0|3,0,0]=4 603 B9R1.34 c1c(cc(nc1Cl)Cl)N AB02218 [0,1,0,0,0,0|3,0,0]=4 604 B9R1.34 c1c(cc(nc1F)Br)Cl AB83180 [0,1,0,0,0,0|3,0,0]=4 605 B9R1.34 c1c(cc(nc1F)Cl)Cl AB72861 [0,1,0,0,0,0|3,0,0]=4 606 B9R1.34 c1c(cc(nc1F)F)F PB32320 [0,1,0,0,0,0|3,0,0]=4 607 B9R1.34 c1c(cc(nc1N)Cl)Cl AB17004 [0,1,0,0,0,0|3,0,0]=4 608 B9R1.34 c1c(cc(nc1N)Cl)F AB83213 [0,1,0,0,0,0|3,0,0]=4 609 B9R1.34 c1c(cc(nc1N)F)Cl AB83181 [0,1,0,0,0,0|3,0,0]=4 610 B9R1.34 c1c(cc(nc1N)N)Br CB10800 [0,1,0,0,0,0|3,0,0]=4 611 B9R1.34 c1c(cc(nc1O)Cl)Cl AB62522 [0,1,0,0,0,0|2,0,0]=3 612 B9R1.34 c1c(cc(nc1O)Cl)F AB71139 [0,1,0,0,0,0|2,0,0]=3 613 B9R1.34 c1c(cc(nc1O)F)Cl AB71154 [0,1,0,0,0,0|2,0,0]=3 614 B9R1.34 c1c(nc(nc1Cl)Cl)O MB10267 [0,1,0,0,0,0|3,0,0]=4 615 B9R1.34 c1c(nc(nc1Cl)O)Cl MB14179 [0,1,0,0,0,0|3,0,0]=4 616 B9R1.69 C1C(=C(C=NC1=O)Cl)O AB45636 [0,1,0,0,0,0|1,0,2]=4 617 B9R1.69 Cc1c(cc(cn1)Br)Br PB30636 [0,1,0,0,0,0|3,0,0]=4 618 B9R1.69 Cc1c(cc(cn1)Br)Cl PB25103 [0,1,0,0,0,0|3,0,0]=4 619 B9R1.69 Cc1c(cc(cn1)Br)F AB65410 [0,1,0,0,0,0|3,0,0]=4 620 B9R1.69 Cc1c(cc(cn1)Br)N PB18946 [0,1,0,0,0,0|3,0,0]=4 621 B9R1.69 Cc1c(cc(cn1)Cl)N PB22604 [0,1,0,0,0,0|3,0,0]=4 622 B9R1.69 Cc1c(cc(cn1)F)N AB73550 [0,1,0,0,0,0|3,0,0]=4 623 B9R1.69 Cc1c(cc(cn1)N)Br PB15954 [0,1,0,0,0,0|3,0,0]=4 624 B9R1.69 Cc1c(cc(cn1)N)Cl AB62794 [0,1,0,0,0,0|3,0,0]=4 625 B9R1.69 Cc1c(cc(cn1)N)F AB73533 [0,1,0,0,0,0|3,0,0]=4 626 B9R1.69 Cc1c(cc(cn1)O)Cl AB71195 [0,1,0,0,0,0|2,0,0]=3 627 B9R1.69 Cc1c(cc(cn1)O)F AB71314 [0,1,0,0,0,0|2,0,0]=3 628 B9R1.69 Cc1c(ccc(n1)Br)Cl AB63580 [0,1,0,0,0,0|3,0,0]=4 629 B9R1.69 Cc1c(ccc(n1)Br)F AB13446 [0,1,0,0,0,0|3,0,0]=4 630 B9R1.69 Cc1c(ccc(n1)Br)N PB20014 [0,1,0,0,0,0|3,0,0]=4 631 B9R1.69 Cc1c(ccc(n1)Cl)Br AB41208 [0,1,0,0,0,0|3,0,0]=4 632 B9R1.69 Cc1c(ccc(n1)Cl)N PB20018 [0,1,0,0,0,0|3,0,0]=4 633 B9R1.69 Cc1c(ccc(n1)F)Br AB13479 [0,1,0,0,0,0|3,0,0]=4 634 B9R1.69 Cc1c(ccc(n1)I)Br MB09866 [0,1,0,0,0,0|3,0,0]=4 635 B9R1.69 Cc1c(ccc(n1)N)Br AB02783 [0,1,0,0,0,0|3,0,0]=4 636 B9R1.69 Cc1c(ccc(n1)N)Cl AB50593 [0,1,0,0,0,0|3,0,0]=4 637 B9R1.69 Cc1c(ccc(n1)N)F AB53307 [0,1,0,0,0,0|3,0,0]=4 638 B9R1.69 Cc1c(ccc(n1)N)I AB20800 [0,1,0,0,0,0|3,0,0]=4 639 B9R1.69 Cc1c(ccc(n1)O)Br AB15079 [0,1,0,0,0,0|2,0,0]=3 640 B9R1.69 Cc1c(ccc(n1)O)Cl AB71196 [0,1,0,0,0,0|2,0,0]=3 641 B9R1.69 Cc1c(ccc(n1)O)F AB71316 [0,1,0,0,0,0|2,0,0]=3 642 B9R1.69 Cc1c(ccc(n1)O)N AB41212 [0,1,0,0,0,0|2,0,0]=3 643 B9R1.69 Cc1cc(c(cn1)Br)Cl PB25215 [0,1,0,0,0,0|3,0,0]=4 644 B9R1.69 Cc1cc(c(cn1)Br)F AB74992 [0,1,0,0,0,0|3,0,0]=4 645 B9R1.69 Cc1cc(c(cn1)Br)N PB10415 [0,1,0,0,0,0|3,0,0]=4 646 B9R1.69 Cc1cc(c(cn1)C)Br AB05202 [0,1,0,0,0,0|3,0,0]=4 647 B9R1.69 Cc1cc(c(cn1)C)N AB05308 [0,1,0,0,0,0|3,0,0]=4 648 B9R1.69 Cc1cc(c(cn1)C)O AB66580 [0,1,0,0,0,0|2,0,0]=3 649 B9R1.69 Cc1cc(c(cn1)Cl)Br AB71664 [0,1,0,0,0,0|3,0,0]=4 650 B9R1.69 Cc1cc(c(cn1)Cl)I AB71748 [0,1,0,0,0,0|3,0,0]=4 651 B9R1.69 Cc1cc(c(cn1)Cl)N AB40682 [0,1,0,0,0,0|3,0,0]=4 652 B9R1.69 Cc1cc(c(cn1)Cl)O AB69303 [0,1,0,0,0,0|2,0,0]=3 653 B9R1.69 Cc1cc(c(cn1)F)Br AB74121 [0,1,0,0,0,0|3,0,0]=4 654 B9R1.69 Cc1cc(c(cn1)F)N AB70850 [0,1,0,0,0,0|3,0,0]=4 655 B9R1.69 Cc1cc(c(cn1)N)Br AB68541 [0,1,0,0,0,0|3,0,0]=4 656 B9R1.69 Cc1cc(c(cn1)N)Cl AB64291 [0,1,0,0,0,0|3,0,0]=4 657 B9R1.69 Cc1cc(c(cn1)N)F AB73537 [0,1,0,0,0,0|3,0,0]=4 658 B9R1.69 Cc1cc(c(cn1)N)N AB51224 [0,1,0,0,0,0|3,0,0]=4 659 B9R1.69 Cc1cc(c(cn1)O)Cl AB75747 [0,1,0,0,0,0|3,0,0]=4 660 B9R1.69 Cc1cc(c(cn1)O)F AB74750 [0,1,0,0,0,0|3,0,0]=4 661 B9R1.69 Cc1cc(c(nc1)Br)C AB05204 [0,1,0,0,0,0|3,0,0]=4 662 B9R1.69 Cc1cc(c(nc1)Br)Cl AB53543 [0,1,0,0,0,0|3,0,0]=4 663 B9R1.69 Cc1cc(c(nc1)Br)F AB55034 [0,1,0,0,0,0|3,0,0]=4 664 B9R1.69 Cc1cc(c(nc1)C)Br AB05199 [0,1,0,0,0,0|3,0,0]=4 665 B9R1.69 Cc1cc(c(nc1)C)N AB66586 [0,1,0,0,0,0|3,0,0]=4 666 B9R1.69 Cc1cc(c(nc1)C)O AB65617 [0,1,0,0,0,0|2,0,0]=3 667 B9R1.69 Cc1cc(c(nc1)Cl)Br AB09970 [0,1,0,0,0,0|3,0,0]=4 668 B9R1.69 Cc1cc(c(nc1)Cl)N AB15085 [0,1,0,0,0,0|3,0,0]=4 669 B9R1.69 Cc1cc(c(nc1)Cl)O AB53552 [0,1,0,0,0,0|2,0,0]=3 670 B9R1.69 Cc1cc(c(nc1)F)Br AB13665 [0,1,0,0,0,0|3,0,0]=4 671 B9R1.69 Cc1cc(c(nc1)F)N AB66726 [0,1,0,0,0,0|3,0,0]=4 672 B9R1.69 Cc1cc(c(nc1)F)O AB71300 [0,1,0,0,0,0|2,0,0]=3 673 B9R1.69 Cc1cc(c(nc1)N)Br AB02784 [0,1,0,0,0,0|3,0,0]=4 674 B9R1.69 Cc1cc(c(nc1)N)C AB62796 [0,1,0,0,0,0|3,0,0]=4 675 B9R1.69 Cc1cc(c(nc1)N)Cl AB32106 [0,1,0,0,0,0|3,0,0]=4 676 B9R1.69 Cc1cc(c(nc1)N)F AB66724 [0,1,0,0,0,0|3,0,0]=4 677 B9R1.69 Cc1cc(c(nc1)N)N AB16874 [0,1,0,0,0,0|3,0,0]=4 678 B9R1.69 Cc1cc(c(nc1)O)Br AB16221 [0,1,0,0,0,0|3,0,0]=4 679 B9R1.69 Cc1cc(c(nc1)O)C AB71284 [0,1,0,0,0,0|3,0,0]=4 680 B9R1.69 Cc1cc(c(nc1)O)Cl AB70490 [0,1,0,0,0,0|3,0,0]=4 681 B9R1.69 Cc1cc(c(nc1)O)F AB71311 [0,1,0,0,0,0|3,0,0]=4 682 B9R1.69 Cc1cc(c(nc1)O)N AB53563 [0,1,0,0,0,0|3,0,0]=4 683 B9R1.69 Cc1cc(cc[n+]1[O-])Br AB70404 [0,1,0,0,0,0|3,0,0]=4 684 B9R1.69 Cc1cc(ccc1I)O MB06793 [0,1,0,0,0,0|1,0,0]=2 685 B9R1.69 Cc1cc(cnc1Br)Br AB10779 [0,1,0,0,0,0|3,0,0]=4 686 B9R1.69 Cc1cc(cnc1Br)Cl AB13444 [0,1,0,0,0,0|3,0,0]=4 687 B9R1.69 Cc1cc(cnc1Br)F AB53312 [0,1,0,0,0,0|3,0,0]=4 688 B9R1.69 Cc1cc(cnc1Br)N AB13464 [0,1,0,0,0,0|3,0,0]=4 689 B9R1.69 Cc1cc(cnc1Br)O AB53545 [0,1,0,0,0,0|2,0,0]=3 690 B9R1.69 Cc1cc(cnc1C)Br AB64498 [0,1,0,0,0,0|3,0,0]=4 691 B9R1.69 Cc1cc(cnc1C)Cl AB75734 [0,1,0,0,0,0|3,0,0]=4 692 B9R1.69 Cc1cc(cnc1C)N AB42833 [0,1,0,0,0,0|3,0,0]=4 693 B9R1.69 Cc1cc(cnc1C)O AB65534 [0,1,0,0,0,0|2,0,0]=3 694 B9R1.69 Cc1cc(cnc1Cl)Cl AB16614 [0,1,0,0,0,0|3,0,0]=4 695 B9R1.69 Cc1cc(cnc1Cl)F AB21234 [0,1,0,0,0,0|3,0,0]=4 696 B9R1.69 Cc1cc(cnc1Cl)I CB11216 [0,1,0,0,0,0|3,0,0]=4 697 B9R1.69 Cc1cc(cnc1Cl)N AB13470 [0,1,0,0,0,0|3,0,0]=4 698 B9R1.69 Cc1cc(cnc1Cl)O PB31577 [0,1,0,0,0,0|2,0,0]=3 699 B9R1.69 Cc1cc(cnc1F)Br AB13475 [0,1,0,0,0,0|3,0,0]=4 700 B9R1.69 Cc1cc(cnc1F)Cl AB13483 [0,1,0,0,0,0|3,0,0]=4 701 B9R1.69 Cc1cc(cnc1F)N AB13474 [0,1,0,0,0,0|3,0,0]=4 702 B9R1.69 Cc1cc(cnc1F)O AB53562 [0,1,0,0,0,0|2,0,0]=3 703 B9R1.69 Cc1cc(cnc1I)Br AB42361 [0,1,0,0,0,0|3,0,0]=4 704 B9R1.69 Cc1cc(cnc1I)Cl AB75751 [0,1,0,0,0,0|3,0,0]=4 705 B9R1.69 Cc1cc(cnc1N)Br AB02787 [0,1,0,0,0,0|3,0,0]=4 706 B9R1.69 Cc1cc(cnc1N)Cl AB03635 [0,1,0,0,0,0|3,0,0]=4 707 B9R1.69 Cc1cc(cnc1N)F AB41238 [0,1,0,0,0,0|3,0,0]=4 708 B9R1.69 Cc1cc(cnc1N)I AB10923 [0,1,0,0,0,0|3,0,0]=4 709 B9R1.69 Cc1cc(cnc1O)Br AB15087 [0,1,0,0,0,0|3,0,0]=4 710 B9R1.69 Cc1cc(cnc1O)Cl AB03537 [0,1,0,0,0,0|3,0,0]=4 711 B9R1.69 Cc1cc(cnc1O)F AB82901 [0,1,0,0,0,0|3,0,0]=4 712 B9R1.69 Cc1cc(cnc1O)I CB10781 [0,1,0,0,0,0|3,0,0]=4 713 B9R1.69 Cc1cc(cnc1O)N AB41215 [0,1,0,0,0,0|3,0,0]=4 714 B9R1.69 Cc1cc(ncc1Br)Br AB05276 [0,1,0,0,0,0|3,0,0]=4 715 B9R1.69 Cc1cc(ncc1Br)C AB53714 [0,1,0,0,0,0|3,0,0]=4 716 B9R1.69 Cc1cc(ncc1Br)Cl AB15095 [0,1,0,0,0,0|3,0,0]=4 717 B9R1.69 Cc1cc(ncc1Br)F AB53532 [0,1,0,0,0,0|3,0,0]=4 718 B9R1.69 Cc1cc(ncc1Br)I AB52611 [0,1,0,0,0,0|3,0,0]=4 719 B9R1.69 Cc1cc(ncc1Br)N AB15088 [0,1,0,0,0,0|3,0,0]=4 720 B9R1.69 Cc1cc(ncc1Br)O AB15096 [0,1,0,0,0,0|2,0,0]=3 721 B9R1.69 Cc1cc(ncc1C)Br AB64948 [0,1,0,0,0,0|3,0,0]=4 722 B9R1.69 Cc1cc(ncc1C)N AB49139 [0,1,0,0,0,0|3,0,0]=4 723 B9R1.69 Cc1cc(ncc1C)O AB71287 [0,1,0,0,0,0|2,0,0]=3 724 B9R1.69 Cc1cc(ncc1Cl)Br AB64601 [0,1,0,0,0,0|3,0,0]=4 725 B9R1.69 Cc1cc(ncc1Cl)Cl AB41172 [0,1,0,0,0,0|3,0,0]=4 726 B9R1.69 Cc1cc(ncc1Cl)N AB24850 [0,1,0,0,0,0|3,0,0]=4 727 B9R1.69 Cc1cc(ncc1Cl)O AB41155 [0,1,0,0,0,0|2,0,0]=3 728 B9R1.69 Cc1cc(ncc1F)Br AB44912 [0,1,0,0,0,0|3,0,0]=4 729 B9R1.69 Cc1cc(ncc1I)N AB25384 [0,1,0,0,0,0|3,0,0]=4 730 B9R1.69 Cc1cc(ncc1N)Br PB25040 [0,1,0,0,0,0|3,0,0]=4 731 B9R1.69 Cc1cc(ncc1N)C AB41994 [0,1,0,0,0,0|3,0,0]=4 732 B9R1.69 Cc1cc(ncc1N)F AB53863 [0,1,0,0,0,0|3,0,0]=4 733 B9R1.69 Cc1cc(ncc1O)C AB44457 [0,1,0,0,0,0|3,0,0]=4 734 B9R1.69 Cc1cc(ncc1O)Cl AB71184 [0,1,0,0,0,0|3,0,0]=4 735 B9R1.69 Cc1cc(ncc1O)F AB71303 [0,1,0,0,0,0|3,0,0]=4 736 B9R1.69 Cc1cc(nnc1O)O PB15638 [0,1,0,0,0,0|3,0,0]=4 737 B9R1.69 Cc1ccc(c(c1)Br)S AB16734 [0,1,0,0,0,0|2,0,0]=3 738 B9R1.69 Cc1ccc(c(c1)F)Br AB01835 [0,1,0,0,0,0|2,0,0]=3 739 B9R1.69 Cc1ccc(c(c1)I)O MB00839 [0,1,0,0,0,0|2,0,0]=3 740 B9R1.69 Cc1ccc(c(c1)N)Br AB09930 [0,1,0,0,0,0|2,0,0]=3 741 B9R1.69 Cc1ccc(c(c1)O)Br MB09252 [0,1,0,0,0,0|1,0,0]=2 742 B9R1.69 Cc1ccc(c(c1)O)I MB23426 [0,1,0,0,0,0|1,0,0]=2 743 B9R1.69 Cc1ccc(c(c1)O)N AB00890 [0,1,0,0,0,0|1,0,0]=2 744 B9R1.69 Cc1ccc(c(n1)Br)N AB13459 [0,1,0,0,0,0|3,0,0]=4 745 B9R1.69 Cc1ccc(c(n1)Br)O PB10360 [0,1,0,0,0,0|3,0,0]=4 746 B9R1.69 Cc1ccc(c(n1)C)Br AB05311 [0,1,0,0,0,0|3,0,0]=4 747 B9R1.69 Cc1ccc(c(n1)Cl)Br AB13590 [0,1,0,0,0,0|3,0,0]=4 748 B9R1.69 Cc1ccc(c(n1)Cl)N AB13580 [0,1,0,0,0,0|3,0,0]=4 749 B9R1.69 Cc1ccc(c(n1)Cl)O AB42392 [0,1,0,0,0,0|3,0,0]=4 750 B9R1.69 Cc1ccc(c(n1)F)N AB13597 [0,1,0,0,0,0|3,0,0]=4 751 B9R1.69 Cc1ccc(c(n1)N)Br AB13584 [0,1,0,0,0,0|3,0,0]=4 752 B9R1.69 Cc1ccc(c(n1)N)Cl AB41203 [0,1,0,0,0,0|3,0,0]=4 753 B9R1.69 Cc1ccc(c(n1)N)N AB15083 [0,1,0,0,0,0|3,0,0]=4 754 B9R1.69 Cc1ccc(c(n1)N)O AB53537 [0,1,0,0,0,0|3,0,0]=4 755 B9R1.69 Cc1ccc(c(n1)O)Br AB13586 [0,1,0,0,0,0|2,0,0]=3 756 B9R1.69 Cc1ccc(c(n1)O)Cl AB41205 [0,1,0,0,0,0|2,0,0]=3 757 B9R1.69 Cc1ccc(cc1I)O MB07177 [0,1,0,0,0,0|1,0,0]=2 758 B9R1.69 Cc1ccc(cc1O)Br MB05210 [0,1,0,0,0,0|1,0,0]=2 759 B9R1.69 Cc1ccc(cc1O)I MB12091 [0,1,0,0,0,0|1,0,0]=2 760 B9R1.69 Cc1ccc(nc1Br)Br AB16615 [0,1,0,0,0,0|3,0,0]=4 761 B9R1.69 Cc1ccc(nc1Br)C AB65454 [0,1,0,0,0,0|3,0,0]=4 762 B9R1.69 Cc1ccc(nc1Br)Cl AB62917 [0,1,0,0,0,0|3,0,0]=4 763 B9R1.69 Cc1ccc(nc1Br)F AB71569 [0,1,0,0,0,0|3,0,0]=4 764 B9R1.69 Cc1ccc(nc1C)Br AB64947 [0,1,0,0,0,0|3,0,0]=4 765 B9R1.69 Cc1ccc(nc1C)N AB23050 [0,1,0,0,0,0|3,0,0]=4 766 B9R1.69 Cc1ccc(nc1C)O AB54521 [0,1,0,0,0,0|2,0,0]=3 767 B9R1.69 Cc1ccc(nc1Cl)Br AB74690 [0,1,0,0,0,0|3,0,0]=4 768 B9R1.69 Cc1ccc(nc1Cl)N AB70428 [0,1,0,0,0,0|3,0,0]=4 769 B9R1.69 Cc1ccc(nc1Cl)O AB71186 [0,1,0,0,0,0|2,0,0]=3 770 B9R1.69 Cc1ccc(nc1F)Br AB74556 [0,1,0,0,0,0|3,0,0]=4 771 B9R1.69 Cc1ccc(nc1F)N AB83080 [0,1,0,0,0,0|3,0,0]=4 772 B9R1.69 Cc1ccc(nc1F)O AB71306 [0,1,0,0,0,0|2,0,0]=3 773 B9R1.69 Cc1ccc(nc1N)Br AB71668 [0,1,0,0,0,0|3,0,0]=4 774 B9R1.69 Cc1ccc(nc1N)C AB25382 [0,1,0,0,0,0|3,0,0]=4 775 B9R1.69 Cc1ccc(nc1N)Cl AB73562 [0,1,0,0,0,0|3,0,0]=4 776 B9R1.69 Cc1ccc(nc1N)F AB82883 [0,1,0,0,0,0|3,0,0]=4 777 B9R1.69 Cc1ccc(nc1N)N AB43423 [0,1,0,0,0,0|3,0,0]=4 778 B9R1.69 Cc1ccc(nc1O)C AB71286 [0,1,0,0,0,0|2,0,0]=3 779 B9R1.69 Cc1ccc(nc1O)Cl AB75750 [0,1,0,0,0,0|2,0,0]=3 780 B9R1.69 Cc1ccc(nc1O)F AB82880 [0,1,0,0,0,0|2,0,0]=3 781 B9R1.69 Cc1cnc(cc1Br)Cl AB63102 [0,1,0,0,0,0|3,0,0]=4 782 B9R1.69 Cc1cnc(cc1Br)F AB71091 [0,1,0,0,0,0|3,0,0]=4 783 B9R1.69 Cc1cnc(cc1Cl)Br AB63106 [0,1,0,0,0,0|3,0,0]=4 784 B9R1.69 Cc1cnc(cc1Cl)N AB63097 [0,1,0,0,0,0|3,0,0]=4 785 B9R1.69 Cc1cnc(cc1Cl)O AB71200 [0,1,0,0,0,0|2,0,0]=3 786 B9R1.69 Cc1cnc(cc1F)Br AB71082 [0,1,0,0,0,0|3,0,0]=4 787 B9R1.69 Cc1cnc(cc1F)N AB70899 [0,1,0,0,0,0|3,0,0]=4 788 B9R1.69 Cc1cnc(cc1F)O AB71320 [0,1,0,0,0,0|2,0,0]=3 789 B9R1.69 Cc1cnc(cc1N)Br AB63107 [0,1,0,0,0,0|3,0,0]=4 790 B9R1.69 Cc1cnc(cc1N)Cl AB65156 [0,1,0,0,0,0|3,0,0]=4 791 B9R1.69 Cc1cnc(cc1N)F AB82864 [0,1,0,0,0,0|3,0,0]=4 792 B9R1.69 Cc1cnc(cc1O)Cl AB71181 [0,1,0,0,0,0|2,0,0]=3 793 B9R1.69 Cc1cnc(cc1O)F AB71302 [0,1,0,0,0,0|2,0,0]=3 794 B9R1.69 Cc1cnc(nc1O)C AB21544 [0,1,0,0,0,0|3,0,0]=4 795 B9R1.69 Cc1ncc(c(n1)O)F AB04979 [0,1,0,0,0,0|3,0,0]=4 796 B9R1.69 Cn1cc(ccc1=O)Br PB32830 [0,1,0,0,0,0|3,0,0]=4 797 B9R1.69 Cn1cc(ccc1=O)N PB19693 [0,1,0,0,0,0|3,0,0]=4 798 B9R1.69 Cn1ccc(=O)c(c1)I MB19762 [0,1,0,0,0,0|3,0,0]=4 799 B9R1.69 Cn1ccc(cc1=O)Br PB26645 [0,1,0,0,0,0|2,0,1]=4 800 B9R1.69 Cn1ccc(cc1=O)Cl MB19760 [0,1,0,0,0,0|2,0,1]=4 801 B9R1.69 Cn1ccc(cc1=O)I MB14735 [0,1,0,0,0,0|2,0,1]=4 802 B9R1.69 Cn1ccc(cc1=O)N PB11442 [0,1,0,0,0,0|2,0,1]=4 803 B9R1.69 c1(c(nnc(n1)O)Br)O AB03586 [0,1,0,0,0,0|3,0,0]=4 804 B9R1.69 c1c(c(cnc1Br)Br)O AB63125 [0,1,0,0,0,0|2,0,0]=3 805 B9R1.69 c1c(c(cnc1Br)Cl)Cl AB63111 [0,1,0,0,0,0|3,0,0]=4 806 B9R1.69 c1c(c(cnc1Br)Cl)F AB63114 [0,1,0,0,0,0|3,0,0]=4 807 B9R1.69 c1c(c(cnc1Br)Cl)I AB70807 [0,1,0,0,0,0|3,0,0]=4 808 B9R1.69 c1c(c(cnc1Br)Cl)N AB65425 [0,1,0,0,0,0|3,0,0]=4 809 B9R1.69 c1c(c(cnc1Br)Cl)O AB69302 [0,1,0,0,0,0|2,0,0]=3 810 B9R1.69 c1c(c(cnc1Br)F)Cl AB63112 [0,1,0,0,0,0|3,0,0]=4 811 B9R1.69 c1c(c(cnc1Br)F)N AB05092 [0,1,0,0,0,0|3,0,0]=4 812 B9R1.69 c1c(c(cnc1Br)F)O AB69315 [0,1,0,0,0,0|2,0,0]=3 813 B9R1.69 c1c(c(cnc1Br)N)Cl AB75030 [0,1,0,0,0,0|3,0,0]=4 814 B9R1.69 c1c(c(cnc1Br)N)N AB63109 [0,1,0,0,0,0|3,0,0]=4 815 B9R1.69 c1c(c(cnc1Br)O)Cl AB74967 [0,1,0,0,0,0|3,0,0]=4 816 B9R1.69 c1c(c(cnc1Cl)Br)Cl AB49334 [0,1,0,0,0,0|3,0,0]=4 817 B9R1.69 c1c(c(cnc1Cl)Br)I AB55676 [0,1,0,0,0,0|3,0,0]=4 818 B9R1.69 c1c(c(cnc1Cl)Br)N PB26428 [0,1,0,0,0,0|3,0,0]=4 819 B9R1.69 c1c(c(cnc1Cl)Br)O AB69298 [0,1,0,0,0,0|2,0,0]=3 820 B9R1.69 c1c(c(cnc1Cl)Cl)I AB66762 [0,1,0,0,0,0|3,0,0]=4 821 B9R1.69 c1c(c(cnc1Cl)Cl)N AB62909 [0,1,0,0,0,0|3,0,0]=4 822 B9R1.69 c1c(c(cnc1Cl)Cl)O AB10186 [0,1,0,0,0,0|2,0,0]=3 823 B9R1.69 c1c(c(cnc1Cl)F)Br AB25947 [0,1,0,0,0,0|3,0,0]=4 824 B9R1.69 c1c(c(cnc1Cl)F)I AB13669 [0,1,0,0,0,0|3,0,0]=4 825 B9R1.69 c1c(c(cnc1Cl)F)N AB71414 [0,1,0,0,0,0|3,0,0]=4 826 B9R1.69 c1c(c(cnc1Cl)F)O AB69309 [0,1,0,0,0,0|2,0,0]=3 827 B9R1.69 c1c(c(cnc1Cl)I)N PB25202 [0,1,0,0,0,0|3,0,0]=4 828 B9R1.69 c1c(c(cnc1Cl)N)Cl AB05110 [0,1,0,0,0,0|3,0,0]=4 829 B9R1.69 c1c(c(cnc1Cl)N)N PB14373 [0,1,0,0,0,0|3,0,0]=4 830 B9R1.69 c1c(c(cnc1Cl)N)O AB69320 [0,1,0,0,0,0|2,0,0]=3 831 B9R1.69 c1c(c(cnc1Cl)O)Cl AB69698 [0,1,0,0,0,0|3,0,0]=4 832 B9R1.69 c1c(c(cnc1Cl)O)N AB69322 [0,1,0,0,0,0|3,0,0]=4 833 B9R1.69 c1c(c(cnc1Cl)O)O AB69329 [0,1,0,0,0,0|2,0,0]=3 834 B9R1.69 c1c(c(cnc1F)Br)Cl AB66391 [0,1,0,0,0,0|3,0,0]=4 835 B9R1.69 c1c(c(cnc1F)Br)N PB22736 [0,1,0,0,0,0|3,0,0]=4 836 B9R1.69 c1c(c(cnc1F)Cl)I AB17633 [0,1,0,0,0,0|3,0,0]=4 837 B9R1.69 c1c(c(cnc1F)N)Cl AB75066 [0,1,0,0,0,0|3,0,0]=4 838 B9R1.69 c1c(c(cnc1F)N)N AB51225 [0,1,0,0,0,0|3,0,0]=4 839 B9R1.69 c1c(c(cnc1F)O)Cl AB71151 [0,1,0,0,0,0|3,0,0]=4 840 B9R1.69 c1c(c(cnc1I)Br)Cl AB73519 [0,1,0,0,0,0|3,0,0]=4 841 B9R1.69 c1c(c(cnc1I)Br)F AB73522 [0,1,0,0,0,0|3,0,0]=4 842 B9R1.69 c1c(c(cnc1I)Cl)Cl AB70215 [0,1,0,0,0,0|3,0,0]=4 843 B9R1.69 c1c(c(cnc1N)Br)Cl PB17989 [0,1,0,0,0,0|3,0,0]=4 844 B9R1.69 c1c(c(cnc1N)Cl)Br AB70622 [0,1,0,0,0,0|3,0,0]=4 845 B9R1.69 c1c(c(cnc1N)Cl)Cl AB41930 [0,1,0,0,0,0|3,0,0]=4 846 B9R1.69 c1c(c(cnc1N)Cl)F AB82981 [0,1,0,0,0,0|3,0,0]=4 847 B9R1.69 c1c(c(cnc1N)Cl)I AB72299 [0,1,0,0,0,0|3,0,0]=4 848 B9R1.69 c1c(c(cnc1N)Cl)N AB70629 [0,1,0,0,0,0|3,0,0]=4 849 B9R1.69 c1c(c(cnc1N)Cl)O AB42978 [0,1,0,0,0,0|2,0,0]=3 850 B9R1.69 c1c(c(cnc1N)F)Cl AB83155 [0,1,0,0,0,0|3,0,0]=4 851 B9R1.69 c1c(c(cnc1N)N)Cl AB64825 [0,1,0,0,0,0|3,0,0]=4 852 B9R1.69 c1c(c(cnc1N)N)N AB60253 [0,1,0,0,0,0|3,0,0]=4 853 B9R1.69 c1c(c(cnc1N)O)Cl AB84009 [0,1,0,0,0,0|3,0,0]=4 854 B9R1.69 c1c(c(cnc1O)Cl)F AB71160 [0,1,0,0,0,0|2,0,0]=3 855 B9R1.69 c1c(c(cnc1O)Cl)N AB70866 [0,1,0,0,0,0|2,0,0]=3 856 B9R1.69 c1c(c(cnc1O)F)Cl AB71159 [0,1,0,0,0,0|2,0,0]=3 857 B9R1.69 c1c(c(cnc1O)N)Cl AB83889 [0,1,0,0,0,0|2,0,0]=3 858 B9R1.69 c1c(c(cnc1O)O)Cl AB84006 [0,1,0,0,0,0|2,0,0]=3 859 B9R1.69 c1c(cnc(c1Br)Cl)Cl AB25941 [0,1,0,0,0,0|3,0,0]=4 860 B9R1.69 c1c(cnc(c1Br)Cl)F AB13638 [0,1,0,0,0,0|3,0,0]=4 861 B9R1.69 c1c(cnc(c1Br)Cl)N CB10761 [0,1,0,0,0,0|3,0,0]=4 862 B9R1.69 c1c(cnc(c1Br)Cl)O CB11311 [0,1,0,0,0,0|2,0,0]=3 863 B9R1.69 c1c(cnc(c1Br)F)Cl AB20989 [0,1,0,0,0,0|3,0,0]=4 864 B9R1.69 c1c(cnc(c1Br)I)Cl AB64692 [0,1,0,0,0,0|3,0,0]=4 865 B9R1.69 c1c(cnc(c1Br)N)Br AB01699 [0,1,0,0,0,0|3,0,0]=4 866 B9R1.69 c1c(cnc(c1Br)N)Cl AB07737 [0,1,0,0,0,0|3,0,0]=4 867 B9R1.69 c1c(cnc(c1Br)N)I AB44276 [0,1,0,0,0,0|3,0,0]=4 868 B9R1.69 c1c(cnc(c1Br)O)Br AB01360 [0,1,0,0,0,0|3,0,0]=4 869 B9R1.69 c1c(cnc(c1Br)O)Cl AB09921 [0,1,0,0,0,0|3,0,0]=4 870 B9R1.69 c1c(cnc(c1Cl)Br)Br PB18868 [0,1,0,0,0,0|3,0,0]=4 871 B9R1.69 c1c(cnc(c1Cl)Br)Cl AB05062 [0,1,0,0,0,0|3,0,0]=4 872 B9R1.69 c1c(cnc(c1Cl)Br)F AB66730 [0,1,0,0,0,0|3,0,0]=4 873 B9R1.69 c1c(cnc(c1Cl)Cl)I PB23692 [0,1,0,0,0,0|3,0,0]=4 874 B9R1.69 c1c(cnc(c1Cl)F)Br AB52757 [0,1,0,0,0,0|3,0,0]=4 875 B9R1.69 c1c(cnc(c1Cl)F)N AB75047 [0,1,0,0,0,0|3,0,0]=4 876 B9R1.69 c1c(cnc(c1Cl)F)O AB43291 [0,1,0,0,0,0|2,0,0]=3 877 B9R1.69 c1c(cnc(c1Cl)N)Br AB63574 [0,1,0,0,0,0|3,0,0]=4 878 B9R1.69 c1c(cnc(c1Cl)N)Cl AB00689 [0,1,0,0,0,0|3,0,0]=4 879 B9R1.69 c1c(cnc(c1Cl)N)F AB50026 [0,1,0,0,0,0|3,0,0]=4 880 B9R1.69 c1c(cnc(c1Cl)N)N AB70626 [0,1,0,0,0,0|3,0,0]=4 881 B9R1.69 c1c(cnc(c1Cl)O)Br AB05076 [0,1,0,0,0,0|3,0,0]=4 882 B9R1.69 c1c(cnc(c1Cl)O)Cl AB03534 [0,1,0,0,0,0|3,0,0]=4 883 B9R1.69 c1c(cnc(c1Cl)O)F AB66743 [0,1,0,0,0,0|3,0,0]=4 884 B9R1.69 c1c(cnc(c1Cl)O)N AB76242 [0,1,0,0,0,0|3,0,0]=4 885 B9R1.69 c1c(cnc(c1Cl)O)O AB71133 [0,1,0,0,0,0|2,0,0]=3 886 B9R1.69 c1c(cnc(c1F)Br)Cl AB62913 [0,1,0,0,0,0|3,0,0]=4 887 B9R1.69 c1c(cnc(c1F)Cl)Br AB14161 [0,1,0,0,0,0|3,0,0]=4 888 B9R1.69 c1c(cnc(c1F)Cl)N AB75042 [0,1,0,0,0,0|3,0,0]=4 889 B9R1.69 c1c(cnc(c1F)Cl)O AB14157 [0,1,0,0,0,0|2,0,0]=3 890 B9R1.69 c1c(cnc(c1F)I)Br AB73520 [0,1,0,0,0,0|3,0,0]=4 891 B9R1.69 c1c(cnc(c1F)N)Cl AB53928 [0,1,0,0,0,0|3,0,0]=4 892 B9R1.69 c1c(cnc(c1F)O)Br AB40961 [0,1,0,0,0,0|3,0,0]=4 893 B9R1.69 c1c(cnc(c1F)O)Cl AB41032 [0,1,0,0,0,0|3,0,0]=4 894 B9R1.69 c1c(cnc(c1I)Cl)Br AB48194 [0,1,0,0,0,0|3,0,0]=4 895 B9R1.69 c1c(cnc(c1I)Cl)F AB13622 [0,1,0,0,0,0|3,0,0]=4 896 B9R1.69 c1c(cnc(c1I)N)Br AB25852 [0,1,0,0,0,0|3,0,0]=4 897 B9R1.69 c1c(cnc(c1I)N)Cl AB42079 [0,1,0,0,0,0|3,0,0]=4 898 B9R1.69 c1c(cnc(c1I)N)F AB48199 [0,1,0,0,0,0|3,0,0]=4 899 B9R1.69 c1c(cnc(c1I)O)Br AB48195 [0,1,0,0,0,0|3,0,0]=4 900 B9R1.69 c1c(cnc(c1N)Br)Br PB32717 [0,1,0,0,0,0|3,0,0]=4 901 B9R1.69 c1c(cnc(c1N)Br)F AB21745 [0,1,0,0,0,0|3,0,0]=4 902 B9R1.69 c1c(cnc(c1N)Cl)Br PB21183 [0,1,0,0,0,0|3,0,0]=4 903 B9R1.69 c1c(cnc(c1N)Cl)Cl AB04748 [0,1,0,0,0,0|3,0,0]=4 904 B9R1.69 c1c(cnc(c1N)Cl)F AB44890 [0,1,0,0,0,0|3,0,0]=4 905 B9R1.69 c1c(cnc(c1N)Cl)I AB17086 [0,1,0,0,0,0|3,0,0]=4 906 B9R1.69 c1c(cnc(c1N)Cl)N AB51565 [0,1,0,0,0,0|3,0,0]=4 907 B9R1.69 c1c(cnc(c1N)Cl)O AB70860 [0,1,0,0,0,0|2,0,0]=3 908 B9R1.69 c1c(cnc(c1N)F)Cl AB25964 [0,1,0,0,0,0|3,0,0]=4 909 B9R1.69 c1c(cnc(c1N)N)Br PB10156 [0,1,0,0,0,0|3,0,0]=4 910 B9R1.69 c1c(cnc(c1N)N)Cl AB08400 [0,1,0,0,0,0|3,0,0]=4 911 B9R1.69 c1c(cnc(c1N)N)I AB60257 [0,1,0,0,0,0|3,0,0]=4 912 B9R1.69 c1c(cnc(c1N)O)Br AB16428 [0,1,0,0,0,0|3,0,0]=4 913 B9R1.69 c1c(cnc(c1N)O)Cl AB40990 [0,1,0,0,0,0|3,0,0]=4 914 B9R1.69 c1c(cnc(c1N)O)N AB64414 [0,1,0,0,0,0|3,0,0]=4 915 B9R1.69 c1c(cnc(c1N)S)Br AB40982 [0,1,0,0,0,0|3,0,0]=4 916 B9R1.69 c1c(cnc(c1N)S)Cl AB41057 [0,1,0,0,0,0|3,0,0]=4 917 B9R1.69 c1c(cnc(c1O)Br)F MB09912 [0,1,0,0,0,0|2,0,0]=3 918 B9R1.69 c1c(cnc(c1O)Cl)Br PB17565 [0,1,0,0,0,0|2,0,0]=3 919 B9R1.69 c1c(cnc(c1O)Cl)Cl AB66760 [0,1,0,0,0,0|2,0,0]=3 920 B9R1.69 c1c(cnc(c1O)Cl)F AB13634 [0,1,0,0,0,0|2,0,0]=3 921 B9R1.69 c1c(cnc(c1O)Cl)N AB76704 [0,1,0,0,0,0|2,0,0]=3 922 B9R1.69 c1c(cnc(c1O)Cl)O AB71129 [0,1,0,0,0,0|1,0,0]=2 923 B9R1.69 c1cc([n+](cc1Br)[O-])Br AB23015 [0,1,0,0,0,0|2,0,1]=4 924 B9R1.69 c1cc(c(cc1Br)Br)I AB51495 [0,1,0,0,0,0|2,0,0]=3 925 B9R1.69 c1cc(c(cc1Br)Cl)O AB00210 [0,1,0,0,0,0|2,0,0]=3 926 B9R1.69 c1cc(c(cc1Br)I)N AB10839 [0,1,0,0,0,0|2,0,0]=3 927 B9R1.69 c1cc(c(cc1Br)I)O MB06781 [0,1,0,0,0,0|2,0,0]=3 928 B9R1.69 c1cc(c(cc1Br)N)I AB51497 [0,1,0,0,0,0|2,0,0]=3 929 B9R1.69 c1cc(c(cc1Br)N)N AB11949 [0,1,0,0,0,0|2,0,0]=3 930 B9R1.69 c1cc(c(cc1Br)N)O MB01067 [0,1,0,0,0,0|2,0,0]=3 931 B9R1.69 c1cc(c(cc1Br)N)S AB54823 [0,1,0,0,0,0|2,0,0]=3 932 B9R1.69 c1cc(c(cc1Br)O)I MB25447 [0,1,0,0,0,0|1,0,0]=2 933 B9R1.69 c1cc(c(cc1Br)O)N AB13424 [0,1,0,0,0,0|1,0,0]=2 934 B9R1.69 c1cc(c(cc1Br)S)N AB07437 [0,1,0,0,0,0|1,1,0]=3 935 B9R1.69 c1cc(c(cc1Cl)I)N PB21792 [0,1,0,0,0,0|2,0,0]=3 936 B9R1.69 c1cc(c(cc1Cl)I)O MB05977 [0,1,0,0,0,0|2,0,0]=3 937 B9R1.69 c1cc(c(cc1Cl)N)I AB28269 [0,1,0,0,0,0|2,0,0]=3 938 B9R1.69 c1cc(c(cc1Cl)O)F MB03336 [0,1,0,0,0,0|1,0,0]=2 939 B9R1.69 c1cc(c(cc1Cl)O)I MB07629 [0,1,0,0,0,0|1,0,0]=2 940 B9R1.69 c1cc(c(cc1Cl)S)N AB13353 [0,1,0,0,0,0|1,1,0]=3 941 B9R1.69 c1cc(c(cc1F)F)I MB00398 [0,1,0,0,0,0|2,0,0]=3 942 B9R1.69 c1cc(c(cc1F)I)N AB01932 [0,1,0,0,0,0|2,0,0]=3 943 B9R1.69 c1cc(c(cc1F)I)O MB14767 [0,1,0,0,0,0|2,0,0]=3 944 B9R1.69 c1cc(c(cc1F)N)N AB01910 [0,1,0,0,0,0|2,0,0]=3 945 B9R1.69 c1cc(c(cc1F)N)S AB54821 [0,1,0,0,0,0|2,0,0]=3 946 B9R1.69 c1cc(c(cc1F)O)I MB25431 [0,1,0,0,0,0|1,0,0]=2 947 B9R1.69 c1cc(c(cc1F)S)N AB54817 [0,1,0,0,0,0|1,1,0]=3 948 B9R1.69 c1cc(c(cc1I)Br)O MB10373 [0,1,0,0,0,0|2,0,0]=3 949 B9R1.69 c1cc(c(cc1I)Cl)O MB09341 [0,1,0,0,0,0|2,0,0]=3 950 B9R1.69 c1cc(c(cc1I)F)O MB09308 [0,1,0,0,0,0|2,0,0]=3 951 B9R1.69 c1cc(c(cc1I)I)O MB01999 [0,1,0,0,0,0|2,0,0]=3 952 B9R1.69 c1cc(c(cc1I)N)Cl AB64100 [0,1,0,0,0,0|2,0,0]=3 953 B9R1.69 c1cc(c(cc1I)N)O MB14432 [0,1,0,0,0,0|2,0,0]=3 954 B9R1.69 c1cc(c(cc1I)O)Br MB08154 [0,1,0,0,0,0|1,0,0]=2 955 B9R1.69 c1cc(c(cc1I)O)F MB14983 [0,1,0,0,0,0|1,0,0]=2 956 B9R1.69 c1cc(c(cc1I)O)I MB07529 [0,1,0,0,0,0|1,0,0]=2 957 B9R1.69 c1cc(c(cc1I)O)N MB14436 [0,1,0,0,0,0|1,0,0]=2 958 B9R1.69 c1cc(c(cc1N)Cl)I AB02146 [0,1,0,0,0,0|2,0,0]=3 959 B9R1.69 c1cc(c(cc1N)F)Cl AB08243 [0,1,0,0,0,0|2,0,0]=3 960 B9R1.69 c1cc(c(cc1N)F)I AB42340 [0,1,0,0,0,0|2,0,0]=3 961 B9R1.69 c1cc(c(cc1N)F)N MB08293 [0,1,0,0,0,0|2,0,0]=3 962 B9R1.69 c1cc(c(cc1N)I)Cl MB09944 [0,1,0,0,0,0|2,0,0]=3 963 B9R1.69 c1cc(c(cc1N)O)Br MB08323 [0,1,0,0,0,0|1,0,0]=2 964 B9R1.69 c1cc(c(cc1N)O)F MB13362 [0,1,0,0,0,0|1,0,0]=2 965 B9R1.69 c1cc(c(cc1N)O)I MB37209 [0,1,0,0,0,0|1,0,0]=2 966 B9R1.69 c1cc(c(cc1O)Br)Br MB00539 [0,1,0,0,0,0|1,0,0]=2 967 B9R1.69 c1cc(c(cc1O)Br)Cl MB00535 [0,1,0,0,0,0|1,0,0]=2 968 B9R1.69 c1cc(c(cc1O)Br)I MB26105 [0,1,0,0,0,0|1,0,0]=2 969 B9R1.69 c1cc(c(cc1O)Br)N MB08329 [0,1,0,0,0,0|1,0,0]=2 970 B9R1.69 c1cc(c(cc1O)Cl)I MB25466 [0,1,0,0,0,0|1,0,0]=2 971 B9R1.69 c1cc(c(cc1O)Cl)N MB01478 [0,1,0,0,0,0|1,0,0]=2 972 B9R1.69 c1cc(c(cc1O)F)I MB11930 [0,1,0,0,0,0|1,0,0]=2 973 B9R1.69 c1cc(c(cc1O)F)N AB09438 [0,1,0,0,0,0|1,0,0]=2 974 B9R1.69 c1cc(c(cc1O)I)Br MB00538 [0,1,0,0,0,0|1,0,0]=2 975 B9R1.69 c1cc(c(cc1O)I)F MB25606 [0,1,0,0,0,0|1,0,0]=2 976 B9R1.69 c1cc(c(cc1O)I)I MB25449 [0,1,0,0,0,0|1,0,0]=2 977 B9R1.69 c1cc(c(cc1O)I)N MB25412 [0,1,0,0,0,0|1,0,0]=2 978 B9R1.69 c1cc(c(cc1O)N)Br MB07114 [0,1,0,0,0,0|1,0,0]=2 979 B9R1.69 c1cc(c(cc1O)N)I MB13452 [0,1,0,0,0,0|1,0,0]=2 980 B9R1.69 c1cc(c(cc1O)N)N MB04238 [0,1,0,0,0,0|1,0,0]=2 981 B9R1.69 c1cc(nc(c1Br)Cl)I AB73525 [0,1,0,0,0,0|3,0,0]=4 982 B9R1.69 c1cc(nc(c1Br)F)I AB73526 [0,1,0,0,0,0|3,0,0]=4 983 B9R1.69 c1cc(nc(c1Br)I)N CB11794 [0,1,0,0,0,0|3,0,0]=4 984 B9R1.69 c1cc(nc(c1Br)N)Br AB13816 [0,1,0,0,0,0|3,0,0]=4 985 B9R1.69 c1cc(nc(c1Br)N)Cl AB68223 [0,1,0,0,0,0|3,0,0]=4 986 B9R1.69 c1cc(nc(c1Br)N)N PB14375 [0,1,0,0,0,0|3,0,0]=4 987 B9R1.69 c1cc(nc(c1Cl)F)Br AB74962 [0,1,0,0,0,0|3,0,0]=4 988 B9R1.69 c1cc(nc(c1Cl)F)N AB74549 [0,1,0,0,0,0|3,0,0]=4 989 B9R1.69 c1cc(nc(c1Cl)F)O AB71143 [0,1,0,0,0,0|2,0,0]=3 990 B9R1.69 c1cc(nc(c1Cl)N)Br AB68234 [0,1,0,0,0,0|3,0,0]=4 991 B9R1.69 c1cc(nc(c1Cl)N)Cl AB06148 [0,1,0,0,0,0|3,0,0]=4 992 B9R1.69 c1cc(nc(c1Cl)N)N AB03196 [0,1,0,0,0,0|3,0,0]=4 993 B9R1.69 c1cc(nc(c1Cl)N)O AB83953 [0,1,0,0,0,0|2,0,0]=3 994 B9R1.69 c1cc(nc(c1Cl)O)Br AB84077 [0,1,0,0,0,0|2,0,0]=3 995 B9R1.69 c1cc(nc(c1Cl)O)Cl AB10185 [0,1,0,0,0,0|2,0,0]=3 996 B9R1.69 c1cc(nc(c1Cl)O)N AB84080 [0,1,0,0,0,0|2,0,0]=3 997 B9R1.69 c1cc(nc(c1Cl)O)O AB84078 [0,1,0,0,0,0|1,0,0]=2 998 B9R1.69 c1cc(nc(c1F)Br)Cl AB74954 [0,1,0,0,0,0|3,0,0]=4 999 B9R1.69 c1cc(nc(c1F)Cl)Br AB74951 [0,1,0,0,0,0|3,0,0]=4 1000 B9R1.69 c1cc(nc(c1F)Cl)N AB75035 [0,1,0,0,0,0|3,0,0]=4 1001 B9R1.69 c1cc(nc(c1F)Cl)O AB71136 [0,1,0,0,0,0|2,0,0]=3 1002 B9R1.69 c1cc(nc(c1F)N)Cl AB73059 [0,1,0,0,0,0|3,0,0]=4 1003 B9R1.69 c1cc(nc(c1F)O)Cl AB83102 [0,1,0,0,0,0|2,0,0]=3 1004 B9R1.69 c1cc(nc(c1N)Br)Br PB17118 [0,1,0,0,0,0|3,0,0]=4 1005 B9R1.69 c1cc(nc(c1N)Br)Cl PB34600 [0,1,0,0,0,0|3,0,0]=4 1006 B9R1.69 c1cc(nc(c1N)Cl)Br AB20901 [0,1,0,0,0,0|3,0,0]=4 1007 B9R1.69 c1cc(nc(c1N)Cl)Cl AB01354 [0,1,0,0,0,0|3,0,0]=4 1008 B9R1.69 c1cc(nc(c1N)Cl)N AB83963 [0,1,0,0,0,0|3,0,0]=4 1009 B9R1.69 c1cc(nc(c1N)Cl)O AB70861 [0,1,0,0,0,0|2,0,0]=3 1010 B9R1.69 c1cc(nc(c1N)N)Br AB60264 [0,1,0,0,0,0|3,0,0]=4 1011 B9R1.69 c1cc(nc(c1N)N)Cl PB14154 [0,1,0,0,0,0|3,0,0]=4 1012 B9R1.69 c1cc(nc(c1N)N)F AB66676 [0,1,0,0,0,0|3,0,0]=4 1013 B9R1.69 c1cc(nc(c1N)N)N AB03630 [0,1,0,0,0,0|3,0,0]=4 1014 B9R1.69 c1cc(nc(c1N)O)Br AB26870 [0,1,0,0,0,0|2,0,0]=3 1015 B9R1.69 c1cc(nc(c1O)Cl)Br AB64867 [0,1,0,0,0,0|3,0,0]=4 1016 B9R1.69 c1cc(nc(c1O)Cl)Cl AB62926 [0,1,0,0,0,0|3,0,0]=4 1017 B9R1.69 c1cc(nc(c1O)Cl)N AB84093 [0,1,0,0,0,0|3,0,0]=4 1018 B9R1.69 c1cc(nc(c1O)Cl)O AB71131 [0,1,0,0,0,0|2,0,0]=3 1019 B9R1.69 c1cc(nc(c1O)N)Br AB63559 [0,1,0,0,0,0|3,0,0]=4 1020 B9R1.69 c1cc(nc(c1O)N)Cl AB69334 [0,1,0,0,0,0|3,0,0]=4 1021 B7R1.2 Cc1cc(cs1)Br AB20690 [0,0,0,0,1,0|3,0,0]=4 1022 B7R1.2 Cc1cc(sc1)C CB10250 [0,0,0,0,1,0|3,0,0]=4 1023 B7R1.2 Cc1ccc(o1)Br AB64979 [0,0,0,0,1,0|3,0,0]=4 1024 B7R1.2 Cc1cnc(o1)O AB53086 [0,0,0,0,1,0|3,0,0]=4 1025 B7R1.2 Cc1cnc(s1)O AB53102 [0,0,0,0,1,0|3,0,0]=4 1026 B7R1.2 Cn1ccc(c1)Br AB63663 [0,0,0,0,1,0|3,0,0]=4 1027 B7R1.2 c1c(csc1Cl)N PB15475 [0,0,0,0,1,0|3,0,0]=4 1028 B7R1.4 Cc1c(cco1)N AB71442 [0,0,0,0,1,0|3,0,0]=4 1029 B7R1.4 Cc1ccsc1Br PB25943 [0,0,0,0,1,0|3,0,0]=4 1030 B7R1.4 c1c(c(cs1)Br)Br AB00432 [0,0,0,0,1,0|3,0,0]=4 1031 B7R1.4 c1coc(c1N)Br AB71394 [0,0,0,0,1,0|3,0,0]=4 1032 B8R1.2 C#Cc1ccccn1 PB17077 [1,1,0,0,0,0|2,0,0]=4 1033 B8R1.2 C#Cc1cccnc1 PB29186 [1,1,0,0,0,0|2,0,0]=4 1034 B8R1.2 C#Cc1ccncc1 PB29291 [1,1,0,0,0,0|2,0,0]=4 1035 B8R1.2 CNc1cccnc1 AB09114 [1,1,0,0,0,0|2,0,0]=4 1036 B8R1.2 COc1cccnc1 AB06864 [1,1,0,0,0,0|1,0,0]=3 1037 B8R1.2 COc1cccnn1 AB05130 [1,1,0,0,0,0|2,0,0]=4 1038 B8R1.2 COc1ccnnc1 AB44150 [1,1,0,0,0,0|2,0,0]=4 1039 B8R1.2 c1c(cncn1)CO PB18631 [1,1,0,0,0,0|2,0,0]=4 1040 B8R1.2 c1cc(cnc1)C=O AB00744 [1,1,0,0,0,0|1,0,1]=4 1041 B8R1.2 c1cc(cnc1)CCl AB01984 [1,1,0,0,0,0|2,0,0]=4 1042 B8R1.2 c1cc(cnc1)CN AB00752 [1,1,0,0,0,0|2,0,0]=4 1043 B8R1.2 c1cc(cnc1)NN AB42924 [1,1,0,0,0,0|2,0,0]=4 1044 B8R1.2 c1cc(cnc1)NN PB18886 [1,1,0,0,0,0|2,0,0]=4 1045 B8R1.2 c1cc(nnc1)CO PB30818 [1,1,0,0,0,0|2,0,0]=4 1046 B8R1.2 c1ccnc(c1)C=O AB00680 [1,1,0,0,0,0|1,0,1]=4 1047 B8R1.2 c1ccnc(c1)CBr MB02148 [1,1,0,0,0,0|2,0,0]=4 1048 B8R1.2 c1ccnc(c1)CCl AB22495 [1,1,0,0,0,0|2,0,0]=4 1049 B8R1.2 c1ccnc(c1)CN AB00731 [1,1,0,0,0,0|2,0,0]=4 1050 B8R1.2 c1cnc(cn1)CO PB21779 [1,1,0,0,0,0|2,0,0]=4 1051 B8R1.2 c1cnc(nc1)CO PB12410 [1,1,0,0,0,0|2,0,0]=4 1052 B8R1.2 c1cnccc1C=O AB00754 [1,1,0,0,0,0|1,0,1]=4 1053 B8R1.2 c1cnccc1CCl AB15539 [1,1,0,0,0,0|2,0,0]=4 1054 B8R1.2 c1cnccc1CN AB00767 [1,1,0,0,0,0|2,0,0]=4 1055 B8R1.2 c1cnccc1NN PB27392 [1,1,0,0,0,0|2,0,0]=4 1056 B8R1.2 c1cnccc1ON AB31585 [1,1,0,0,0,0|1,0,0]=3 1057 B8R1.2 c1cncnc1CO PB12296 [1,1,0,0,0,0|2,0,0]=4 1058 B8R1.2 c1cnncc1CO PB26178 [1,1,0,0,0,0|2,0,0]=4 1059 B8R1.3 Cc1ccc(cn1)Br AB06624 [1,1,0,0,0,0|2,0,0]=4 1060 B8R1.3 Cc1ccc(cn1)Cl AB17956 [1,1,0,0,0,0|2,0,0]=4 1061 B8R1.3 Cc1ccc(cn1)F PB18589 [1,1,0,0,0,0|2,0,0]=4 1062 B8R1.3 Cc1ccc(cn1)N PB32227 [1,1,0,0,0,0|2,0,0]=4 1063 B8R1.3 Cc1ccc(cn1)O PB30543 [1,1,0,0,0,0|1,0,0]=3 1064 B8R1.3 Cc1ccc(nc1)Br PB17145 [1,1,0,0,0,0|2,0,0]=4 1065 B8R1.3 Cc1ccc(nc1)Cl AB07104 [1,1,0,0,0,0|2,0,0]=4 1066 B8R1.3 Cc1ccc(nc1)F AB01857 [1,1,0,0,0,0|2,0,0]=4 1067 B8R1.3 Cc1ccc(nc1)N AB17938 [1,1,0,0,0,0|2,0,0]=4 1068 B8R1.3 Cc1ccc(nc1)O AB13138 [1,1,0,0,0,0|1,0,0]=3 1069 B8R1.3 Cc1ncc(cn1)O AB54467 [1,1,0,0,0,0|2,0,0]=4 1070 B8R1.3 c1c(cnc(n1)Br)O PB31459 [1,1,0,0,0,0|2,0,0]=4 1071 B8R1.3 c1c(cnc(n1)Cl)O PB12674 [1,1,0,0,0,0|2,0,0]=4 1072 B8R1.3 c1c(cnc(n1)N)O PB32565 [1,1,0,0,0,0|2,0,0]=4 1073 B8R1.3 c1c(cnc(n1)O)Br AB05049 [1,1,0,0,0,0|2,0,0]=4 1074 B8R1.3 c1c(cnc(n1)O)Cl AB03656 [1,1,0,0,0,0|2,0,0]=4 1075 B8R1.3 c1c(ncc(n1)Br)O PB26179 [1,1,0,0,0,0|2,0,0]=4 1076 B8R1.3 c1c(ncc(n1)Cl)O MB09316 [1,1,0,0,0,0|2,0,0]=4 1077 B8R1.3 c1c(ncc(n1)O)O AB44015 [1,1,0,0,0,0|2,0,0]=4 1078 B8R1.3 c1c[n+](ccc1F)[O-] PB19565 [1,1,0,0,0,0|1,0,1]=4 1079 B8R1.3 c1cc(ncc1Br)Br AB00634 [1,1,0,0,0,0|2,0,0]=4 1080 B8R1.3 c1cc(ncc1Br)Cl AB08767 [1,1,0,0,0,0|2,0,0]=4 1081 B8R1.3 c1cc(ncc1Br)F PB30707 [1,1,0,0,0,0|2,0,0]=4 1082 B8R1.3 c1cc(ncc1Br)N PB30536 [1,1,0,0,0,0|2,0,0]=4 1083 B8R1.3 c1cc(ncc1Br)O AB05097 [1,1,0,0,0,0|1,0,0]=3 1084 B8R1.3 c1cc(ncc1Br)S AB51097 [1,1,0,0,0,0|1,1,0]=4 1085 B8R1.3 c1cc(ncc1Cl)Br AB05069 [1,1,0,0,0,0|2,0,0]=4 1086 B8R1.3 c1cc(ncc1Cl)Cl AB00654 [1,1,0,0,0,0|2,0,0]=4 1087 B8R1.3 c1cc(ncc1Cl)F AB17577 [1,1,0,0,0,0|2,0,0]=4 1088 B8R1.3 c1cc(ncc1Cl)I AB32114 [1,1,0,0,0,0|2,0,0]=4 1089 B8R1.3 c1cc(ncc1Cl)N AB00712 [1,1,0,0,0,0|2,0,0]=4 1090 B8R1.3 c1cc(ncc1F)Br PB17160 [1,1,0,0,0,0|2,0,0]=4 1091 B8R1.3 c1cc(ncc1F)I AB42989 [1,1,0,0,0,0|2,0,0]=4 1092 B8R1.3 c1cc(ncc1F)N AB10107 [1,1,0,0,0,0|2,0,0]=4 1093 B8R1.3 c1cc(ncc1I)Br PB14333 [1,1,0,0,0,0|2,0,0]=4 1094 B8R1.3 c1cc(ncc1I)Cl AB10394 [1,1,0,0,0,0|2,0,0]=4 1095 B8R1.3 c1cc(ncc1I)N PB25985 [1,1,0,0,0,0|2,0,0]=4 1096 B8R1.3 c1cc(ncc1I)O AB05112 [1,1,0,0,0,0|1,0,0]=3 1097 B8R1.3 c1cc(ncc1N)Br PB17224 [1,1,0,0,0,0|2,0,0]=4 1098 B8R1.3 c1cc(ncc1N)Cl AB00661 [1,1,0,0,0,0|2,0,0]=4 1099 B8R1.3 c1cc(ncc1N)F PB33962 [1,1,0,0,0,0|2,0,0]=4 1100 B8R1.3 c1cc(ncc1N)O AB15078 [1,1,0,0,0,0|1,0,0]=3 1101 B8R1.3 c1cc(ncc1O)Br PB15771 [1,1,0,0,0,0|1,0,0]=3 1102 B8R1.3 c1cc(ncc1O)Cl PB32188 [1,1,0,0,0,0|1,0,0]=3 1103 B8R1.3 c1cc(ncc1O)F AB08123 [1,1,0,0,0,0|1,0,0]=3 1104 B8R1.3 c1cc(ncc1O)I AB50021 [1,1,0,0,0,0|1,0,0]=3 1105 B8R1.3 c1cc(ncc1O)N AB15563 [1,1,0,0,0,0|1,0,0]=3 1106 B8R1.3 c1cc(nnc1O)Cl PB29050 [1,1,0,0,0,0|2,0,0]=4 1107 B8R1.5 C1CC=C(C(=C1)O)Cl AB31829 [1,1,0,0,0,0|0,0,2]=4 1108 B8R1.5 Cc1c(cccn1)Br PB27472 [1,1,0,0,0,0|2,0,0]=4 1109 B8R1.5 Cc1c(cccn1)Cl AB17903 [1,1,0,0,0,0|2,0,0]=4 1110 B8R1.5 Cc1c(cccn1)F AB48604 [1,1,0,0,0,0|2,0,0]=4 1111 B8R1.5 Cc1c(cccn1)N PB33695 [1,1,0,0,0,0|2,0,0]=4 1112 B8R1.5 Cc1c(cccn1)O PB18442 [1,1,0,0,0,0|1,0,0]=3 1113 B8R1.5 Cc1c(nccn1)O PB12942 [1,1,0,0,0,0|2,0,0]=4 1114 B8R1.5 Cc1cccnc1Br AB05448 [1,1,0,0,0,0|2,0,0]=4 1115 B8R1.5 Cc1cccnc1Cl AB05179 [1,1,0,0,0,0|2,0,0]=4 1116 B8R1.5 Cc1cccnc1N AB17908 [1,1,0,0,0,0|2,0,0]=4 1117 B8R1.5 Cc1cccnc1O AB03538 [1,1,0,0,0,0|1,0,0]=3 1118 B8R1.5 Cc1ccncc1Br AB03104 [1,1,0,0,0,0|2,0,0]=4 1119 B8R1.5 Cc1ccncc1Cl AB18019 [1,1,0,0,0,0|2,0,0]=4 1120 B8R1.5 Cc1ccncc1F AB18002 [1,1,0,0,0,0|2,0,0]=4 1121 B8R1.5 Cc1ccncc1N PB14127 [1,1,0,0,0,0|2,0,0]=4 1122 B8R1.5 Cc1ccncc1O PB23391 [1,1,0,0,0,0|1,0,0]=3 1123 B8R1.5 Cc1cnccc1Br AB20846 [1,1,0,0,0,0|2,0,0]=4 1124 B8R1.5 Cc1cnccc1Br PB23248 [1,1,0,0,0,0|2,0,0]=4 1125 B8R1.5 Cc1cnccc1Cl AB11511 [1,1,0,0,0,0|2,0,0]=4 1126 B8R1.5 Cc1cnccc1F AB18013 [1,1,0,0,0,0|2,0,0]=4 1127 B8R1.5 Cc1cnccc1N PB17234 [1,1,0,0,0,0|2,0,0]=4 1128 B8R1.5 Cc1cncnc1O AB09558 [1,1,0,0,0,0|2,0,0]=4 1129 B8R1.5 c1c(c(ncn1)O)Br PB32183 [1,1,0,0,0,0|2,0,0]=4 1130 B8R1.5 c1c(c(ncn1)O)Cl PB14718 [1,1,0,0,0,0|2,0,0]=4 1131 B8R1.5 c1c(c(ncn1)O)I PB34035 [1,1,0,0,0,0|2,0,0]=4 1132 B8R1.5 c1cc(c(nc1)Br)Br AB05083 [1,1,0,0,0,0|2,0,0]=4 1133 B8R1.5 c1cc(c(nc1)Br)Cl AB17348 [1,1,0,0,0,0|2,0,0]=4 1134 B8R1.5 c1cc(c(nc1)Br)F PB14380 [1,1,0,0,0,0|2,0,0]=4 1135 B8R1.5 c1cc(c(nc1)Br)I MB06974 [1,1,0,0,0,0|2,0,0]=4 1136 B8R1.5 c1cc(c(nc1)Br)N AB17900 [1,1,0,0,0,0|2,0,0]=4 1137 B8R1.5 c1cc(c(nc1)Br)N PB26005 [1,1,0,0,0,0|2,0,0]=4 1138 B8R1.5 c1cc(c(nc1)Br)O PB28951 [1,1,0,0,0,0|1,0,0]=3 1139 B8R1.5 c1cc(c(nc1)Cl)Br PB33875 [1,1,0,0,0,0|2,0,0]=4 1140 B8R1.5 c1cc(c(nc1)Cl)Cl AB00641 [1,1,0,0,0,0|2,0,0]=4 1141 B8R1.5 c1cc(c(nc1)Cl)F AB13662 [1,1,0,0,0,0|2,0,0]=4 1142 B8R1.5 c1cc(c(nc1)Cl)I AB06631 [1,1,0,0,0,0|2,0,0]=4 1143 B8R1.5 c1cc(c(nc1)Cl)N PB23167 [1,1,0,0,0,0|2,0,0]=4 1144 B8R1.5 c1cc(c(nc1)Cl)O PB21615 [1,1,0,0,0,0|1,0,0]=3 1145 B8R1.5 c1cc(c(nc1)F)I AB13652 [1,1,0,0,0,0|2,0,0]=4 1146 B8R1.5 c1cc(c(nc1)F)N AB17917 [1,1,0,0,0,0|2,0,0]=4 1147 B8R1.5 c1cc(c(nc1)I)Br AB45745 [1,1,0,0,0,0|2,0,0]=4 1148 B8R1.5 c1cc(c(nc1)I)F AB13656 [1,1,0,0,0,0|2,0,0]=4 1149 B8R1.5 c1cc(c(nc1)I)I AB25846 [1,1,0,0,0,0|2,0,0]=4 1150 B8R1.5 c1cc(c(nc1)I)O MB00322 [1,1,0,0,0,0|1,0,0]=3 1151 B8R1.5 c1cc(c(nc1)N)Br PB20016 [1,1,0,0,0,0|2,0,0]=4 1152 B8R1.5 c1cc(c(nc1)N)Cl AB15555 [1,1,0,0,0,0|2,0,0]=4 1153 B8R1.5 c1cc(c(nc1)N)F AB17912 [1,1,0,0,0,0|2,0,0]=4 1154 B8R1.5 c1cc(c(nc1)N)I PB12756 [1,1,0,0,0,0|2,0,0]=4 1155 B8R1.5 c1cc(c(nc1)N)O AB00700 [1,1,0,0,0,0|1,0,0]=3 1156 B8R1.5 c1cc(c(nc1)N)O AB17906 [1,1,0,0,0,0|1,0,0]=3 1157 B8R1.5 c1cc(c(nc1)N)S AB64540 [1,1,0,0,0,0|1,1,0]=4 1158 B8R1.5 c1cc(c(nc1)O)Br PB12284 [1,1,0,0,0,0|1,0,0]=3 1159 B8R1.5 c1cc(c(nc1)O)F AB13427 [1,1,0,0,0,0|1,0,0]=3 1160 B8R1.5 c1cc(c(nc1)O)I AB53303 [1,1,0,0,0,0|1,0,0]=3 1161 B8R1.5 c1cc(c(nc1)O)N PB30752 [1,1,0,0,0,0|1,0,0]=3 1162 B8R1.5 c1cc[n+](c(c1)S)[O-] AB00615 [1,1,0,0,0,0|1,0,1]=4 1163 B8R1.5 c1cncc(c1Br)Br AB05087 [1,1,0,0,0,0|2,0,0]=4 1164 B8R1.5 c1cncc(c1Br)Cl AB17643 [1,1,0,0,0,0|2,0,0]=4 1165 B8R1.5 c1cncc(c1Br)F PB23387 [1,1,0,0,0,0|2,0,0]=4 1166 B8R1.5 c1cncc(c1Br)N AB17638 [1,1,0,0,0,0|2,0,0]=4 1167 B8R1.5 c1cncc(c1Br)O AB13187 [1,1,0,0,0,0|1,0,0]=3 1168 B8R1.5 c1cncc(c1Cl)Br AB05074 [1,1,0,0,0,0|2,0,0]=4 1169 B8R1.5 c1cncc(c1Cl)Cl AB10192 [1,1,0,0,0,0|2,0,0]=4 1170 B8R1.5 c1cncc(c1Cl)F AB15511 [1,1,0,0,0,0|2,0,0]=4 1171 B8R1.5 c1cncc(c1Cl)I AB05089 [1,1,0,0,0,0|2,0,0]=4 1172 B8R1.5 c1cncc(c1Cl)N AB05299 [1,1,0,0,0,0|2,0,0]=4 1173 B8R1.5 c1cncc(c1Cl)O AB12281 [1,1,0,0,0,0|1,0,0]=3 1174 B8R1.5 c1cncc(c1F)Br AB17892 [1,1,0,0,0,0|2,0,0]=4 1175 B8R1.5 c1cncc(c1F)Cl AB21349 [1,1,0,0,0,0|2,0,0]=4 1176 B8R1.5 c1cncc(c1F)F AB18023 [1,1,0,0,0,0|2,0,0]=4 1177 B8R1.5 c1cncc(c1F)N AB50028 [1,1,0,0,0,0|2,0,0]=4 1178 B8R1.5 c1cncc(c1F)O AB64515 [1,1,0,0,0,0|1,0,0]=3 1179 B8R1.5 c1cncc(c1I)F PB21191 [1,1,0,0,0,0|2,0,0]=4 1180 B8R1.5 c1cncc(c1I)N PB23406 [1,1,0,0,0,0|2,0,0]=4 1181 B8R1.5 c1cncc(c1I)O MB06807 [1,1,0,0,0,0|1,0,0]=3 1182 B8R1.5 c1cncc(c1N)Br AB28611 [1,1,0,0,0,0|2,0,0]=4 1183 B8R1.5 c1cncc(c1N)Cl AB16891 [1,1,0,0,0,0|2,0,0]=4 1184 B8R1.5 c1cncc(c1N)F PB33879 [1,1,0,0,0,0|2,0,0]=4 1185 B8R1.5 c1cncc(c1N)I AB12095 [1,1,0,0,0,0|2,0,0]=4 1186 B8R1.5 c1cncc(c1O)Br AB09574 [1,1,0,0,0,0|1,0,0]=3 1187 B8R1.5 c1cncc(c1O)F AB18011 [1,1,0,0,0,0|1,0,0]=3 1188 B8R1.5 c1cnnc(c1Br)O AB77052 [1,1,0,0,0,0|2,0,0]=4 1189 B8R1.1 Cn1ccc(c1)CO AB09760 [0,1,0,0,1,0|2,0,0]=4 1190 B8R1.1 c1c(csc1CO)Br PB12803 [0,1,0,0,1,0|2,0,0]=4 1191 B8R1.1 c1c(csc1CO)Cl PB24317 [0,1,0,0,1,0|2,0,0]=4 1192 B8R1.1 c1c(csc1Cl)CO PB13604 [0,1,0,0,1,0|2,0,0]=4 1193 B8R1.1 c1cc(sc1CO)Br PB23435 [0,1,0,0,1,0|2,0,0]=4 1194 B8R1.1 c1cc(sc1CO)Cl PB23436 [0,1,0,0,1,0|2,0,0]=4 1195 B8R1.1 c1cc(sc1CO)F PB31763 [0,1,0,0,1,0|2,0,0]=4 1196 B8R1.11 c1csc(c1Br)CO PB27714 [0,1,0,0,1,0|2,0,0]=4 1197 B8R1.11 c1csc(c1Cl)CO PB23440 [0,1,0,0,1,0|2,0,0]=4 1198 B10R1.2 CCc1cccc(c1Br)O MB24080 [0,2,0,0,0,0|1,0,0]=3 1199 B10R1.2 CCc1cccc(c1C)O MB24030 [0,2,0,0,0,0|1,0,0]=3 1200 B10R1.2 CCc1cccc(c1Cl)O MB24081 [0,2,0,0,0,0|1,0,0]=3 1201 B10R1.2 CCc1cccc(c1F)O MB24054 [0,2,0,0,0,0|1,0,0]=3 1202 B10R1.2 CCc1cccc(c1I)O MB24055 [0,2,0,0,0,0|1,0,0]=3 1203 B10R1.2 CCc1cccc(c1N)O MB24059 [0,2,0,0,0,0|1,0,0]=3 1204 B10R1.2 CCc1cccc(c1O)Br MB02008 [0,2,0,0,0,0|2,0,0]=4 1205 B10R1.2 CCc1cccc(c1O)Cl MB02005 [0,2,0,0,0,0|2,0,0]=4 1206 B10R1.2 CCc1cccc(c1O)F MB24014 [0,2,0,0,0,0|2,0,0]=4 1207 B10R1.2 CCc1cccc(c1O)I MB24016 [0,2,0,0,0,0|2,0,0]=4 1208 B10R1.2 CCc1cccc(c1O)N MB24022 [0,2,0,0,0,0|2,0,0]=4 1209 B10R1.2 CNc1cccc(c1Br)O MB28270 [0,2,0,0,0,0|1,0,0]=3 1210 B10R1.2 CNc1cccc(c1Cl)O MB26964 [0,2,0,0,0,0|1,0,0]=3 1211 B10R1.2 CNc1cccc(c1F)O MB34647 [0,2,0,0,0,0|1,0,0]=3 1212 B10R1.2 CNc1cccc(c1I)O MB29498 [0,2,0,0,0,0|1,0,0]=3 1213 B10R1.2 CNc1cccc(c1N)O MB33054 [0,2,0,0,0,0|1,0,0]=3 1214 B10R1.2 CNc1cccc(c1O)Br MB26263 [0,2,0,0,0,0|2,0,0]=4 1215 B10R1.2 CNc1cccc(c1O)Cl MB33654 [0,2,0,0,0,0|2,0,0]=4 1216 B10R1.2 CNc1cccc(c1O)F MB28274 [0,2,0,0,0,0|2,0,0]=4 1217 B10R1.2 CNc1cccc(c1O)I MB32214 [0,2,0,0,0,0|2,0,0]=4 1218 B10R1.2 CNc1cccc(c1O)N MB33525 [0,2,0,0,0,0|2,0,0]=4 1219 B10R1.2 COc1c(c(ccn1)Br)F AB71080 [0,2,0,0,0,0|2,0,0]=4 1220 B10R1.2 COc1c(c(ccn1)Cl)N AB71673 [0,2,0,0,0,0|2,0,0]=4 1221 B10R1.2 COc1c(c(ccn1)Cl)O AB75738 [0,2,0,0,0,0|2,0,0]=4 1222 B10R1.2 COc1c(c(ccn1)I)F AB71332 [0,2,0,0,0,0|2,0,0]=4 1223 B10R1.2 COc1c(c(ccn1)N)Br PB32978 [0,2,0,0,0,0|2,0,0]=4 1224 B10R1.2 COc1c(c(ccn1)N)Cl AB65262 [0,2,0,0,0,0|2,0,0]=4 1225 B10R1.2 COc1c(c(ccn1)N)F AB70892 [0,2,0,0,0,0|2,0,0]=4 1226 B10R1.2 COc1c(c(ccn1)N)N AB56399 [0,2,0,0,0,0|2,0,0]=4 1227 B10R1.2 COc1c(c(ccn1)O)Cl AB71177 [0,2,0,0,0,0|1,0,0]=3 1228 B10R1.2 COc1cccc(c1Br)O MB06929 [0,2,0,0,0,0|0,0,0]=2 1229 B10R1.2 COc1cccc(c1Cl)N PB11874 [0,2,0,0,0,0|1,0,0]=3 1230 B10R1.2 COc1cccc(c1Cl)O MB06074 [0,2,0,0,0,0|0,0,0]=2 1231 B10R1.2 COc1cccc(c1F)O MB09318 [0,2,0,0,0,0|0,0,0]=2 1232 B10R1.2 COc1cccc(c1I)O MB14766 [0,2,0,0,0,0|0,0,0]=2 1233 B10R1.2 COc1cccc(c1N)O MB12204 [0,2,0,0,0,0|0,0,0]=2 1234 B10R1.2 COc1cccc(c1O)Br PB18847 [0,2,0,0,0,0|1,0,0]=3 1235 B10R1.2 COc1cccc(c1O)Cl MB25402 [0,2,0,0,0,0|1,0,0]=3 1236 B10R1.2 COc1cccc(c1O)I MB09225 [0,2,0,0,0,0|1,0,0]=3 1237 B10R1.2 COc1cccc(c1O)N MB25613 [0,2,0,0,0,0|1,0,0]=3 1238 B10R1.2 COc1ccnc(c1Cl)N AB70635 [0,2,0,0,0,0|2,0,0]=4 1239 B10R1.2 COc1ccnc(c1Cl)O AB71172 [0,2,0,0,0,0|1,0,0]=3 1240 B10R1.2 COc1ccnc(c1I)N AB48785 [0,2,0,0,0,0|2,0,0]=4 1241 B10R1.2 COc1ccnc(c1N)Cl AB62572 [0,2,0,0,0,0|2,0,0]=4 1242 B10R1.2 COc1ccnc(c1O)Cl AB71167 [0,2,0,0,0,0|2,0,0]=4 1243 B10R1.2 COc1cncc(c1Cl)N AB64859 [0,2,0,0,0,0|2,0,0]=4 1244 B10R1.2 COc1cncc(c1Cl)O AB75741 [0,2,0,0,0,0|1,0,0]=3 1245 B10R1.2 COc1cncc(c1N)Cl AB75723 [0,2,0,0,0,0|2,0,0]=4 1246 B10R1.2 COc1cncc(c1O)Cl AB75737 [0,2,0,0,0,0|2,0,0]=4 1247 B10R1.2 CSc1cccc(c1Br)O MB26789 [0,2,0,0,0,0|0,1,0]=3 1248 B10R1.2 CSc1cccc(c1Cl)O MB33312 [0,2,0,0,0,0|0,1,0]=3 1249 B10R1.2 CSc1cccc(c1F)O MB25404 [0,2,0,0,0,0|0,1,0]=3 1250 B10R1.2 CSc1cccc(c1I)O MB31760 [0,2,0,0,0,0|0,1,0]=3 1251 B10R1.2 CSc1cccc(c1N)O MB32351 [0,2,0,0,0,0|0,1,0]=3 1252 B10R1.2 CSc1cccc(c1O)Cl MB27718 [0,2,0,0,0,0|1,1,0]=4 1253 B10R1.2 CSc1cccc(c1O)F MB25614 [0,2,0,0,0,0|1,1,0]=4 1254 B10R1.2 CSc1cccc(c1O)I MB28360 [0,2,0,0,0,0|1,1,0]=4 1255 B10R1.2 CSc1cccc(c1O)N MB28757 [0,2,0,0,0,0|1,1,0]=4 1256 B10R1.2 Cc1c(cccc1Br)C#N CB11199 [0,2,0,0,0,0|2,0,0]=4 1257 B10R1.2 Cc1c(cccc1O)C#N MB02463 [0,2,0,0,0,0|1,0,0]=3 1258 B10R1.2 Cc1c(cccc1O)C=O MB08410 [0,2,0,0,0,0|0,0,1]=3 1259 B10R1.2 Cc1c(cccc1O)NC MB37053 [0,2,0,0,0,0|1,0,0]=3 1260 B10R1.2 Cc1c(cccc1OC)O MB09432 [0,2,0,0,0,0|0,0,0]=2 1261 B10R1.2 Cc1c(cccc1SC)O MB35924 [0,2,0,0,0,0|0,1,0]=3 1262 B10R1.2 Cc1c(ccnc1CO)Br AB53756 [0,2,0,0,0,0|2,0,0]=4 1263 B10R1.2 Cc1c(cncc1OC)N CB11797 [0,2,0,0,0,0|2,0,0]=4 1264 B10R1.2 Cc1c(nccc1CO)C AB62891 [0,2,0,0,0,0|2,0,0]=4 1265 B10R1.2 Cc1cccc(c1N)C#N MB08131 [0,2,0,0,0,0|2,0,0]=4 1266 B10R1.2 Cc1cccc(c1N)CN MB08906 [0,2,0,0,0,0|2,0,0]=4 1267 B10R1.2 Cc1cccc(c1N)OC AB02877 [0,2,0,0,0,0|1,0,0]=3 1268 B10R1.2 Cc1cccc(c1O)C#N MB07838 [0,2,0,0,0,0|2,0,0]=4 1269 B10R1.2 Cc1cccc(c1O)CN MB05058 [0,2,0,0,0,0|2,0,0]=4 1270 B10R1.2 Cc1cccc(c1O)NC MB31993 [0,2,0,0,0,0|2,0,0]=4 1271 B10R1.2 Cc1cccc(c1O)SC MB31066 [0,2,0,0,0,0|1,1,0]=4 1272 B10R1.2 Cc1ccnc(c1Br)OC PB25008 [0,2,0,0,0,0|2,0,0]=4 1273 B10R1.2 Cn1cccc(c1=O)CO PB13713 [0,2,0,0,0,0|2,0,0]=4 1274 B10R1.2 c1c(c(c(cn1)O)Cl)C=O AB67784 [0,2,0,0,0,0|1,0,1]=4 1275 B10R1.2 c1c(c(c(cn1)O)Cl)CCl AB83999 [0,2,0,0,0,0|2,0,0]=4 1276 B10R1.2 c1c(c(c(cn1)O)Cl)CN AB84000 [0,2,0,0,0,0|2,0,0]=4 1277 B10R1.2 c1cc(c(c(c1)Br)Cl)C#N CB11304 [0,2,0,0,0,0|2,0,0]=4 1278 B10R1.2 c1cc(c(c(c1)Br)O)C#N PB14860 [0,2,0,0,0,0|2,0,0]=4 1279 B10R1.2 c1cc(c(c(c1)Br)O)C=O AB01203 [0,2,0,0,0,0|1,0,1]=4 1280 B10R1.2 c1cc(c(c(c1)Br)O)CN MB05060 [0,2,0,0,0,0|2,0,0]=4 1281 B10R1.2 c1cc(c(c(c1)Cl)Br)C#N MB08912 [0,2,0,0,0,0|2,0,0]=4 1282 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O MB08895 [0,2,0,0,0,0|1,0,1]=4 1283 B10R1.2 c1cc(c(c(c1)Cl)F)C=O AB09379 [0,2,0,0,0,0|1,0,1]=4 1284 B10R1.2 c1cc(c(c(c1)Cl)I)C#N AB72108 [0,2,0,0,0,0|2,0,0]=4 1285 B10R1.2 c1cc(c(c(c1)Cl)O)C#N MB08412 [0,2,0,0,0,0|2,0,0]=4 1286 B10R1.2 c1cc(c(c(c1)Cl)O)C=O AB21383 [0,2,0,0,0,0|1,0,1]=4 1287 B10R1.2 c1cc(c(c(c1)Cl)O)CN MB34616 [0,2,0,0,0,0|2,0,0]=4 1288 B10R1.2 c1cc(c(c(c1)F)Br)C#N AB32074 [0,2,0,0,0,0|2,0,0]=4 1289 B10R1.2 c1cc(c(c(c1)F)F)CCl AB13673 [0,2,0,0,0,0|2,0,0]=4 1290 B10R1.2 c1cc(c(c(c1)F)O)C#N MB11932 [0,2,0,0,0,0|2,0,0]=4 1291 B10R1.2 c1cc(c(c(c1)F)O)C=O AB00313 [0,2,0,0,0,0|1,0,1]=4 1292 B10R1.2 c1cc(c(c(c1)F)O)CN MB05070 [0,2,0,0,0,0|2,0,0]=4 1293 B10R1.2 c1cc(c(c(c1)I)O)C#N MB14863 [0,2,0,0,0,0|2,0,0]=4 1294 B10R1.2 c1cc(c(c(c1)I)O)C=O MB12368 [0,2,0,0,0,0|1,0,1]=4 1295 B10R1.2 c1cc(c(c(c1)I)O)CN MB29107 [0,2,0,0,0,0|2,0,0]=4 1296 B10R1.2 c1cc(c(c(c1)N)F)C#N AB43380 [0,2,0,0,0,0|2,0,0]=4 1297 B10R1.2 c1cc(c(c(c1)N)F)CN AB65760 [0,2,0,0,0,0|2,0,0]=4 1298 B10R1.2 c1cc(c(c(c1)N)O)C#N MB02411 [0,2,0,0,0,0|2,0,0]=4 1299 B10R1.2 c1cc(c(c(c1)N)O)CN MB34782 [0,2,0,0,0,0|2,0,0]=4 1300 B10R1.2 c1cc(c(c(c1)O)Br)C#N MB07308 [0,2,0,0,0,0|1,0,0]=3 1301 B10R1.2 c1cc(c(c(c1)O)Br)C=O AB03304 [0,2,0,0,0,0|0,0,1]=3 1302 B10R1.2 c1cc(c(c(c1)O)Br)CN MB08516 [0,2,0,0,0,0|1,0,0]=3 1303 B10R1.2 c1cc(c(c(c1)O)Cl)C#N MB10145 [0,2,0,0,0,0|1,0,0]=3 1304 B10R1.2 c1cc(c(c(c1)O)F)C=O AB63446 [0,2,0,0,0,0|0,0,1]=3 1305 B10R1.2 c1cc(c(c(c1)O)F)CN MB25461 [0,2,0,0,0,0|1,0,0]=3 1306 B10R1.2 c1cc(c(c(c1)O)I)C#N MB28827 [0,2,0,0,0,0|1,0,0]=3 1307 B10R1.2 c1cc(c(c(c1)O)I)C=O MB07518 [0,2,0,0,0,0|0,0,1]=3 1308 B10R1.2 c1cc(c(c(c1)O)I)CN MB34403 [0,2,0,0,0,0|1,0,0]=3 1309 B10R1.2 c1cc(c(c(c1)O)N)C#N MB09969 [0,2,0,0,0,0|1,0,0]=3 1310 B10R1.2 c1cc(c(c(c1)O)N)C=O MB38000 [0,2,0,0,0,0|0,0,1]=3 1311 B10R1.2 c1cc(c(c(c1)O)N)CN MB35261 [0,2,0,0,0,0|1,0,0]=3 1312 B10R1.2 c1cnc(c(c1C=O)Cl)O AB70959 [0,2,0,0,0,0|1,0,1]=4 1313 B10R1.2 c1cnc(c(c1CCl)Cl)O AB71003 [0,2,0,0,0,0|2,0,0]=4 1314 B10R1.2 c1cnc(c(c1O)Cl)C=O AB75006 [0,2,0,0,0,0|1,0,1]=4 1315 B10R1.2 c1cnc(c(c1O)Cl)CCl AB84054 [0,2,0,0,0,0|2,0,0]=4 1316 B10R1.2 c1cnc(c(c1O)Cl)CN AB84056 [0,2,0,0,0,0|2,0,0]=4 1317 B10R1.8 C#Cc1cc(cc(c1)F)F AB17470 [0,2,0,0,0,0|2,0,0]=4 1318 B10R1.8 CCc1cc(cc(c1)Br)O MB23717 [0,2,0,0,0,0|1,0,0]=3 1319 B10R1.8 CCc1cc(cc(c1)Cl)O MB23719 [0,2,0,0,0,0|1,0,0]=3 1320 B10R1.8 CCc1cc(cc(c1)F)O MB23700 [0,2,0,0,0,0|1,0,0]=3 1321 B10R1.8 CCc1cc(cc(c1)I)O MB23702 [0,2,0,0,0,0|1,0,0]=3 1322 B10R1.8 CCc1cc(cc(c1)O)N MB23659 [0,2,0,0,0,0|1,0,0]=3 1323 B10R1.8 CNc1cc(cc(c1)Cl)O MB29202 [0,2,0,0,0,0|1,0,0]=3 1324 B10R1.8 CNc1cc(cc(c1)F)O MB30811 [0,2,0,0,0,0|1,0,0]=3 1325 B10R1.8 CNc1cc(cc(c1)O)N MB33447 [0,2,0,0,0,0|1,0,0]=3 1326 B10R1.8 COc1cc(cc(c1)Br)Cl AB62692 [0,2,0,0,0,0|1,0,0]=3 1327 B10R1.8 COc1cc(cc(c1)Br)N AB65032 [0,2,0,0,0,0|1,0,0]=3 1328 B10R1.8 COc1cc(cc(c1)Br)O AB65533 [0,2,0,0,0,0|0,0,0]=2 1329 B10R1.8 COc1cc(cc(c1)Cl)O MB00121 [0,2,0,0,0,0|0,0,0]=2 1330 B10R1.8 COc1cc(cc(c1)F)O MB10146 [0,2,0,0,0,0|0,0,0]=2 1331 B10R1.8 COc1cc(cc(c1)I)O MB11865 [0,2,0,0,0,0|0,0,0]=2 1332 B10R1.8 COc1cc(cc(c1)O)N MB25612 [0,2,0,0,0,0|0,0,0]=2 1333 B10R1.8 COc1cc(cc(n1)Br)Cl AB69575 [0,2,0,0,0,0|2,0,0]=4 1334 B10R1.8 COc1cc(cc(n1)Br)N AB62723 [0,2,0,0,0,0|2,0,0]=4 1335 B10R1.8 COc1cc(cc(n1)Cl)Br AB69577 [0,2,0,0,0,0|2,0,0]=4 1336 B10R1.8 COc1cc(cc(n1)Cl)N AB68188 [0,2,0,0,0,0|2,0,0]=4 1337 B10R1.8 COc1cc(nc(c1)Cl)Cl AB07752 [0,2,0,0,0,0|2,0,0]=4 1338 B10R1.8 CSc1cc(cc(c1)Br)O MB36767 [0,2,0,0,0,0|0,1,0]=3 1339 B10R1.8 CSc1cc(cc(c1)Cl)O MB28354 [0,2,0,0,0,0|0,1,0]=3 1340 B10R1.8 CSc1cc(cc(c1)F)O MB34115 [0,2,0,0,0,0|0,1,0]=3 1341 B10R1.8 CSc1cc(cc(c1)I)O MB32212 [0,2,0,0,0,0|0,1,0]=3 1342 B10R1.8 CSc1cc(cc(c1)O)N MB38338 [0,2,0,0,0,0|0,1,0]=3 1343 B10R1.8 Cc1cc(cc(c1)Br)C=O AB53369 [0,2,0,0,0,0|1,0,1]=4 1344 B10R1.8 Cc1cc(cc(c1)Br)CCl AB71866 [0,2,0,0,0,0|2,0,0]=4 1345 B10R1.8 Cc1cc(cc(c1)Br)CN AB75545 [0,2,0,0,0,0|2,0,0]=4 1346 B10R1.8 Cc1cc(cc(c1)Br)OC AB43364 [0,2,0,0,0,0|1,0,0]=3 1347 B10R1.8 Cc1cc(cc(c1)C=O)C AB03134 [0,2,0,0,0,0|1,0,1]=4 1348 B10R1.8 Cc1cc(cc(c1)CCl)C AB56154 [0,2,0,0,0,0|2,0,0]=4 1349 B10R1.8 Cc1cc(cc(c1)CN)C AB01824 [0,2,0,0,0,0|2,0,0]=4 1350 B10R1.8 Cc1cc(cc(c1)Cl)C=O AB64288 [0,2,0,0,0,0|1,0,1]=4 1351 B10R1.8 Cc1cc(cc(c1)Cl)CCl AB75575 [0,2,0,0,0,0|2,0,0]=4 1352 B10R1.8 Cc1cc(cc(c1)Cl)CN AB75470 [0,2,0,0,0,0|2,0,0]=4 1353 B10R1.8 Cc1cc(cc(c1)Cl)OC MB05593 [0,2,0,0,0,0|1,0,0]=3 1354 B10R1.8 Cc1cc(cc(c1)F)C=O AB13319 [0,2,0,0,0,0|1,0,1]=4 1355 B10R1.8 Cc1cc(cc(c1)F)CCl AB66782 [0,2,0,0,0,0|2,0,0]=4 1356 B10R1.8 Cc1cc(cc(c1)F)CN AB23427 [0,2,0,0,0,0|2,0,0]=4 1357 B10R1.8 Cc1cc(cc(c1)I)C=O AB75646 [0,2,0,0,0,0|1,0,1]=4 1358 B10R1.8 Cc1cc(cc(c1)I)CCl AB75649 [0,2,0,0,0,0|2,0,0]=4 1359 B10R1.8 Cc1cc(cc(c1)I)CN AB75648 [0,2,0,0,0,0|2,0,0]=4 1360 B10R1.8 Cc1cc(cc(c1)N)CN AB75515 [0,2,0,0,0,0|2,0,0]=4 1361 B10R1.8 Cc1cc(cc(c1)O)C#N MB25636 [0,2,0,0,0,0|1,0,0]=3 1362 B10R1.8 Cc1cc(cc(c1)O)C=O AB71633 [0,2,0,0,0,0|0,0,1]=3 1363 B10R1.8 Cc1cc(cc(c1)O)CN AB71617 [0,2,0,0,0,0|1,0,0]=3 1364 B10R1.8 Cc1cc(cc(c1)O)NC MB25938 [0,2,0,0,0,0|1,0,0]=3 1365 B10R1.8 Cc1cc(cc(c1)SC)O MB37868 [0,2,0,0,0,0|0,1,0]=3 1366 B10R1.8 Cc1cc(cc(n1)C=O)O AB78936 [0,2,0,0,0,0|1,0,1]=4 1367 B10R1.8 Cc1cc(cc(n1)CCl)O AB78458 [0,2,0,0,0,0|2,0,0]=4 1368 B10R1.8 Cc1cc(cc(n1)CN)O AB80150 [0,2,0,0,0,0|2,0,0]=4 1369 B10R1.8 Cc1cc(cc(n1)CO)Br AB40787 [0,2,0,0,0,0|2,0,0]=4 1370 B10R1.8 Cc1cc(cc(n1)CO)Cl AB40801 [0,2,0,0,0,0|2,0,0]=4 1371 B10R1.8 Cc1cc(cc(n1)O)C=O AB71363 [0,2,0,0,0,0|1,0,1]=4 1372 B10R1.8 Cc1cc(cc(n1)O)CN AB80512 [0,2,0,0,0,0|2,0,0]=4 1373 B10R1.8 Cc1cc(nc(c1)O)C#N AB65668 [0,2,0,0,0,0|2,0,0]=4 1374 B10R1.8 Cc1cc(nc(c1)O)C=O AB79065 [0,2,0,0,0,0|1,0,1]=4 1375 B10R1.8 Cc1cc(nc(c1)O)CN AB80331 [0,2,0,0,0,0|2,0,0]=4 1376 B10R1.8 c1c(cc(cc1Br)Br)C=O AB04160 [0,2,0,0,0,0|1,0,1]=4 1377 B10R1.8 c1c(cc(cc1Br)Br)CCl AB64268 [0,2,0,0,0,0|2,0,0]=4 1378 B10R1.8 c1c(cc(cc1Br)Br)CN AB14081 [0,2,0,0,0,0|2,0,0]=4 1379 B10R1.8 c1c(cc(cc1Br)I)C=O AB42478 [0,2,0,0,0,0|1,0,1]=4 1380 B10R1.8 c1c(cc(cc1Br)I)CCl AB75535 [0,2,0,0,0,0|2,0,0]=4 1381 B10R1.8 c1c(cc(cc1Br)I)CN AB75533 [0,2,0,0,0,0|2,0,0]=4 1382 B10R1.8 c1c(cc(cc1Cl)Br)C#N AB23056 [0,2,0,0,0,0|2,0,0]=4 1383 B10R1.8 c1c(cc(cc1Cl)Br)C=O AB29574 [0,2,0,0,0,0|1,0,1]=4 1384 B10R1.8 c1c(cc(cc1Cl)Br)CN AB65611 [0,2,0,0,0,0|2,0,0]=4 1385 B10R1.8 c1c(cc(cc1Cl)Cl)C=O AB00316 [0,2,0,0,0,0|1,0,1]=4 1386 B10R1.8 c1c(cc(cc1Cl)Cl)CBr MB08756 [0,2,0,0,0,0|2,0,0]=4 1387 B10R1.8 c1c(cc(cc1Cl)Cl)CCl AB02384 [0,2,0,0,0,0|2,0,0]=4 1388 B10R1.8 c1c(cc(cc1Cl)Cl)CN AB02207 [0,2,0,0,0,0|2,0,0]=4 1389 B10R1.8 c1c(cc(cc1Cl)I)C=O AB65246 [0,2,0,0,0,0|1,0,1]=4 1390 B10R1.8 c1c(cc(cc1Cl)I)CCl AB75567 [0,2,0,0,0,0|2,0,0]=4 1391 B10R1.8 c1c(cc(cc1Cl)I)CN AB66525 [0,2,0,0,0,0|2,0,0]=4 1392 B10R1.8 c1c(cc(cc1F)Br)C#N AB17049 [0,2,0,0,0,0|2,0,0]=4 1393 B10R1.8 c1c(cc(cc1F)Br)C=O AB20677 [0,2,0,0,0,0|1,0,1]=4 1394 B10R1.8 c1c(cc(cc1F)Br)CCl AB64454 [0,2,0,0,0,0|2,0,0]=4 1395 B10R1.8 c1c(cc(cc1F)Br)CN AB64453 [0,2,0,0,0,0|2,0,0]=4 1396 B10R1.8 c1c(cc(cc1F)Br)CO AB20678 [0,2,0,0,0,0|1,0,0]=3 1397 B10R1.8 c1c(cc(cc1F)Cl)C=O AB11796 [0,2,0,0,0,0|1,0,1]=4 1398 B10R1.8 c1c(cc(cc1F)Cl)CCl AB63445 [0,2,0,0,0,0|2,0,0]=4 1399 B10R1.8 c1c(cc(cc1F)Cl)CN AB23446 [0,2,0,0,0,0|2,0,0]=4 1400 B10R1.8 c1c(cc(cc1F)F)C=O AB01034 [0,2,0,0,0,0|1,0,1]=4 1401 B10R1.8 c1c(cc(cc1F)F)CCl AB08246 [0,2,0,0,0,0|2,0,0]=4 1402 B10R1.8 c1c(cc(cc1F)F)CN AB02411 [0,2,0,0,0,0|2,0,0]=4 1403 B10R1.8 c1c(cc(cc1F)I)C=O AB42482 [0,2,0,0,0,0|1,0,1]=4 1404 B10R1.8 c1c(cc(cc1F)I)CCl AB75628 [0,2,0,0,0,0|2,0,0]=4 1405 B10R1.8 c1c(cc(cc1F)I)CN AB23372 [0,2,0,0,0,0|2,0,0]=4 1406 B10R1.8 c1c(cc(cc1I)I)C=O AB42481 [0,2,0,0,0,0|1,0,1]=4 1407 B10R1.8 c1c(cc(cc1I)I)CCl AB76608 [0,2,0,0,0,0|2,0,0]=4 1408 B10R1.8 c1c(cc(cc1I)I)CN AB77860 [0,2,0,0,0,0|2,0,0]=4 1409 B10R1.8 c1c(cc(cc1N)Br)CN AB75504 [0,2,0,0,0,0|2,0,0]=4 1410 B10R1.8 c1c(cc(cc1N)Cl)CN AB48602 [0,2,0,0,0,0|2,0,0]=4 1411 B10R1.8 c1c(cc(cc1N)Cl)CO AB63846 [0,2,0,0,0,0|1,0,0]=3 1412 B10R1.8 c1c(cc(cc1N)F)CN AB65614 [0,2,0,0,0,0|2,0,0]=4 1413 B10R1.8 c1c(cc(cc1N)I)CN AB75507 [0,2,0,0,0,0|2,0,0]=4 1414 B10R1.8 c1c(cc(cc1N)N)CN AB77912 [0,2,0,0,0,0|2,0,0]=4 1415 B10R1.8 c1c(cc(cc1N)O)C#N MB37280 [0,2,0,0,0,0|1,0,0]=3 1416 B10R1.8 c1c(cc(cc1N)O)C=O MB35596 [0,2,0,0,0,0|0,0,1]=3 1417 B10R1.8 c1c(cc(cc1N)O)CN AB71618 [0,2,0,0,0,0|1,0,0]=3 1418 B10R1.8 c1c(cc(cc1O)Br)C#N MB14979 [0,2,0,0,0,0|1,0,0]=3 1419 B10R1.8 c1c(cc(cc1O)Br)C=O AB29745 [0,2,0,0,0,0|0,0,1]=3 1420 B10R1.8 c1c(cc(cc1O)Br)CN AB71630 [0,2,0,0,0,0|1,0,0]=3 1421 B10R1.8 c1c(cc(cc1O)Cl)C=O AB43616 [0,2,0,0,0,0|0,0,1]=3 1422 B10R1.8 c1c(cc(cc1O)Cl)CN AB64548 [0,2,0,0,0,0|1,0,0]=3 1423 B10R1.8 c1c(cc(cc1O)Cl)CO AB43614 [0,2,0,0,0,0|0,0,0]=2 1424 B10R1.8 c1c(cc(cc1O)F)C=O AB66765 [0,2,0,0,0,0|0,0,1]=3 1425 B10R1.8 c1c(cc(cc1O)F)CN AB70799 [0,2,0,0,0,0|1,0,0]=3 1426 B10R1.8 c1c(cc(cc1O)I)C=O AB71641 [0,2,0,0,0,0|0,0,1]=3 1427 B10R1.8 c1c(cc(cc1O)I)CN AB71624 [0,2,0,0,0,0|1,0,0]=3 1428 B10R1.8 c1c(cc(cc1O)O)C=O AB01206 [0,2,0,0,0,0|0,0,0]=2 1429 B10R1.8 c1c(cc(cc1O)O)CN AB14084 [0,2,0,0,0,0|0,0,0]=2 1430 B10R1.8 c1c(cc(nc1Br)Br)CO PB29704 [0,2,0,0,0,0|2,0,0]=4 1431 B10R1.8 c1c(cc(nc1C=O)Br)O AB78887 [0,2,0,0,0,0|1,0,1]=4 1432 B10R1.8 c1c(cc(nc1C=O)Cl)O AB74846 [0,2,0,0,0,0|1,0,1]=4 1433 B10R1.8 c1c(cc(nc1C=O)F)O AB78862 [0,2,0,0,0,0|1,0,1]=4 1434 B10R1.8 c1c(cc(nc1C=O)I)O AB78911 [0,2,0,0,0,0|1,0,1]=4 1435 B10R1.8 c1c(cc(nc1C=O)O)Br AB79027 [0,2,0,0,0,0|1,0,1]=4 1436 B10R1.8 c1c(cc(nc1C=O)O)Cl AB79017 [0,2,0,0,0,0|1,0,1]=4 1437 B10R1.8 c1c(cc(nc1C=O)O)F AB79005 [0,2,0,0,0,0|1,0,1]=4 1438 B10R1.8 c1c(cc(nc1C=O)O)I AB79041 [0,2,0,0,0,0|1,0,1]=4 1439 B10R1.8 c1c(cc(nc1C=O)O)O AB78985 [0,2,0,0,0,0|1,0,0]=3 1440 B10R1.8 c1c(cc(nc1CCl)Br)O AB78405 [0,2,0,0,0,0|2,0,0]=4 1441 B10R1.8 c1c(cc(nc1CCl)Cl)O AB78384 [0,2,0,0,0,0|2,0,0]=4 1442 B10R1.8 c1c(cc(nc1CCl)F)O AB78366 [0,2,0,0,0,0|2,0,0]=4 1443 B10R1.8 c1c(cc(nc1CCl)I)O AB78424 [0,2,0,0,0,0|2,0,0]=4 1444 B10R1.8 c1c(cc(nc1CN)Br)O AB80093 [0,2,0,0,0,0|2,0,0]=4 1445 B10R1.8 c1c(cc(nc1CN)Cl)O AB80068 [0,2,0,0,0,0|2,0,0]=4 1446 B10R1.8 c1c(cc(nc1CN)F)O AB80053 [0,2,0,0,0,0|2,0,0]=4 1447 B10R1.8 c1c(cc(nc1CN)I)O AB80112 [0,2,0,0,0,0|2,0,0]=4 1448 B10R1.8 c1c(cc(nc1CN)N)O AB80194 [0,2,0,0,0,0|2,0,0]=4 1449 B10R1.8 c1c(cc(nc1CN)O)Br AB80276 [0,2,0,0,0,0|2,0,0]=4 1450 B10R1.8 c1c(cc(nc1CN)O)Cl AB80258 [0,2,0,0,0,0|2,0,0]=4 1451 B10R1.8 c1c(cc(nc1CN)O)F AB80245 [0,2,0,0,0,0|2,0,0]=4 1452 B10R1.8 c1c(cc(nc1CN)O)I AB80296 [0,2,0,0,0,0|2,0,0]=4 1453 B10R1.8 c1c(cc(nc1CN)O)N AB80381 [0,2,0,0,0,0|2,0,0]=4 1454 B10R1.8 c1c(cc(nc1CN)O)O AB80216 [0,2,0,0,0,0|1,0,0]=3 1455 B10R1.8 c1c(cc(nc1N)O)CCl AB78820 [0,2,0,0,0,0|2,0,0]=4 1456 B10R1.8 c1c(cc(nc1N)O)CN AB80546 [0,2,0,0,0,0|2,0,0]=4 1457 B10R1.8 c1c(cc(nc1O)Br)C=O AB79149 [0,2,0,0,0,0|1,0,1]=4 1458 B10R1.8 c1c(cc(nc1O)Br)CCl AB78733 [0,2,0,0,0,0|2,0,0]=4 1459 B10R1.8 c1c(cc(nc1O)Br)CN AB80459 [0,2,0,0,0,0|2,0,0]=4 1460 B10R1.8 c1c(cc(nc1O)Cl)C=O AB70932 [0,2,0,0,0,0|1,0,1]=4 1461 B10R1.8 c1c(cc(nc1O)Cl)CCl AB70974 [0,2,0,0,0,0|2,0,0]=4 1462 B10R1.8 c1c(cc(nc1O)Cl)CN AB80436 [0,2,0,0,0,0|2,0,0]=4 1463 B10R1.8 c1c(cc(nc1O)F)C=O AB71295 [0,2,0,0,0,0|1,0,1]=4 1464 B10R1.8 c1c(cc(nc1O)F)CCl AB71234 [0,2,0,0,0,0|2,0,0]=4 1465 B10R1.8 c1c(cc(nc1O)F)CN AB80417 [0,2,0,0,0,0|2,0,0]=4 1466 B10R1.8 c1c(cc(nc1O)I)C=O AB79167 [0,2,0,0,0,0|1,0,1]=4 1467 B10R1.8 c1c(cc(nc1O)I)CCl AB78754 [0,2,0,0,0,0|2,0,0]=4 1468 B10R1.8 c1c(cc(nc1O)I)CN AB80476 [0,2,0,0,0,0|2,0,0]=4 1469 B10R1.8 c1c(cc(nc1O)O)C=O AB79223 [0,2,0,0,0,0|1,0,0]=3 1470 B10R1.8 c1c(cc(nc1O)O)CCl AB78842 [0,2,0,0,0,0|1,0,0]=3 1471 B10R1.8 c1c(cc(nc1O)O)CN AB80567 [0,2,0,0,0,0|1,0,0]=3 1472 B10R1.10 C#CCc1cccc(c1)Br AB61399 [0,2,0,0,0,0|2,0,0]=4 1473 B10R1.10 C#CCc1cccc(c1)Cl AB61396 [0,2,0,0,0,0|2,0,0]=4 1474 B10R1.10 C#CCc1cccc(c1)I AB73228 [0,2,0,0,0,0|2,0,0]=4 1475 B10R1.10 CCOc1cc(ccn1)Br AB05209 [0,2,0,0,0,0|2,0,0]=4 1476 B10R1.10 CCOc1cc(ccn1)N AB05301 [0,2,0,0,0,0|2,0,0]=4 1477 B10R1.10 CCOc1cc(cnc1)Br AB05134 [0,2,0,0,0,0|2,0,0]=4 1478 B10R1.10 CCOc1cccc(n1)Br AB05279 [0,2,0,0,0,0|2,0,0]=4 1479 B10R1.10 CCOc1cccc(n1)N AB05302 [0,2,0,0,0,0|2,0,0]=4 1480 B10R1.10 CCOc1ccnc(c1)N AB09620 [0,2,0,0,0,0|2,0,0]=4 1481 B10R1.10 Cc1cc(ccn1)\C=N\O AB72010 [0,2,0,0,0,0|2,0,0]=4 1482 B10R1.10 Cc1cccc(c1)CC=O AB11815 [0,2,0,0,0,0|1,0,1]=4 1483 B10R1.10 c1cc(cc(c1)Br)CC#N AB00173 [0,2,0,0,0,0|2,0,0]=4 1484 B10R1.10 c1cc(cc(c1)Br)CC=O AB11787 [0,2,0,0,0,0|1,0,1]=4 1485 B10R1.10 c1cc(cc(c1)Br)CCN AB08439 [0,2,0,0,0,0|2,0,0]=4 1486 B10R1.10 c1cc(cc(c1)Br)CNN PB10474 [0,2,0,0,0,0|2,0,0]=4 1487 B10R1.10 c1cc(cc(c1)Br)\C=C\Br AB73510 [0,2,0,0,0,0|2,0,0]=4 1488 B10R1.10 c1cc(cc(c1)Br)\C=N\O AB03839 [0,2,0,0,0,0|1,0,0]=3 1489 B10R1.10 c1cc(cc(c1)Cl)CC=O AB11792 [0,2,0,0,0,0|1,0,1]=4 1490 B10R1.10 c1cc(cc(c1)Cl)CCN AB02072 [0,2,0,0,0,0|2,0,0]=4 1491 B10R1.10 c1cc(cc(c1)Cl)CNN PB23504 [0,2,0,0,0,0|2,0,0]=4 1492 B10R1.10 c1cc(cc(c1)F)CC=O AB11802 [0,2,0,0,0,0|1,0,1]=4 1493 B10R1.10 c1cc(cc(c1)F)CNN PB22082 [0,2,0,0,0,0|2,0,0]=4 1494 B10R1.10 c1cc(cc(c1)N)CC#N AB13852 [0,2,0,0,0,0|2,0,0]=4 1495 B10R1.10 c1cc(cc(c1)N)CCN AB22060 [0,2,0,0,0,0|2,0,0]=4 1496 B10R1.10 c1cc(cc(c1)O)CC#N AB13855 [0,2,0,0,0,0|1,0,0]=3 1497 B10R1.10 c1cc(nc(c1)Br)CCO CB11431 [0,2,0,0,0,0|2,0,0]=4 1498 B10R1.10 c1cc(nc(c1)F)CCO AB55227 [0,2,0,0,0,0|2,0,0]=4 1499 B10R1.30 CCc1cc(ccc1Br)O MB23770 [0,2,0,0,0,0|1,0,0]=3 1500 B10R1.30 CCc1cc(ccc1C)O MB23722 [0,2,0,0,0,0|1,0,0]=3 1501 B10R1.30 CCc1cc(ccc1F)O MB23754 [0,2,0,0,0,0|1,0,0]=3 1502 B10R1.30 CCc1cc(ccc1I)O MB09270 [0,2,0,0,0,0|1,0,0]=3 1503 B10R1.30 CCc1cc(ccc1N)O MB23757 [0,2,0,0,0,0|1,0,0]=3 1504 B10R1.30 CCc1cc(ccc1O)Br MB00480 [0,2,0,0,0,0|2,0,0]=4 1505 B10R1.30 CCc1cc(ccc1O)C MB23622 [0,2,0,0,0,0|2,0,0]=4 1506 B10R1.30 CCc1cc(ccc1O)Cl MB00701 [0,2,0,0,0,0|2,0,0]=4 1507 B10R1.30 CCc1cc(ccc1O)I MB23657 [0,2,0,0,0,0|2,0,0]=4 1508 B10R1.30 CCc1cc(ccc1O)N MB23663 [0,2,0,0,0,0|2,0,0]=4 1509 B10R1.30 CNc1cc(ccc1Cl)O MB30361 [0,2,0,0,0,0|1,0,0]=3 1510 B10R1.30 CNc1cc(ccc1F)O MB28645 [0,2,0,0,0,0|1,0,0]=3 1511 B10R1.30 CNc1cc(ccc1I)O MB33108 [0,2,0,0,0,0|1,0,0]=3 1512 B10R1.30 CNc1cc(ccc1N)O MB33092 [0,2,0,0,0,0|1,0,0]=3 1513 B10R1.30 CNc1cc(ccc1O)Br MB32072 [0,2,0,0,0,0|2,0,0]=4 1514 B10R1.30 CNc1cc(ccc1O)F MB26737 [0,2,0,0,0,0|2,0,0]=4 1515 B10R1.30 CNc1cc(ccc1O)I MB35760 [0,2,0,0,0,0|2,0,0]=4 1516 B10R1.30 CNc1cc(ccc1O)N MB28647 [0,2,0,0,0,0|2,0,0]=4 1517 B10R1.30 COc1c(ccc(n1)Br)F AB74998 [0,2,0,0,0,0|2,0,0]=4 1518 B10R1.30 COc1c(ccc(n1)Cl)O AB69331 [0,2,0,0,0,0|2,0,0]=4 1519 B10R1.30 COc1c(ccc(n1)I)Br AB73529 [0,2,0,0,0,0|2,0,0]=4 1520 B10R1.30 COc1c(ccc(n1)N)F AB76983 [0,2,0,0,0,0|2,0,0]=4 1521 B10R1.30 COc1cc(ccc1Br)O MB00359 [0,2,0,0,0,0|0,0,0]=2 1522 B10R1.30 COc1cc(ccc1Cl)O MB25434 [0,2,0,0,0,0|0,0,0]=2 1523 B10R1.30 COc1cc(ccc1F)O MB08744 [0,2,0,0,0,0|0,0,0]=2 1524 B10R1.30 COc1cc(ccc1I)Br CB11560 [0,2,0,0,0,0|1,0,0]=3 1525 B10R1.30 COc1cc(ccc1I)O MB29625 [0,2,0,0,0,0|0,0,0]=2 1526 B10R1.30 COc1cc(ccc1N)F MB00562 [0,2,0,0,0,0|1,0,0]=3 1527 B10R1.30 COc1cc(ccc1N)O MB01122 [0,2,0,0,0,0|0,0,0]=2 1528 B10R1.30 COc1cc(ccc1O)Br PB30583 [0,2,0,0,0,0|1,0,0]=3 1529 B10R1.30 COc1cc(ccc1O)I MB05217 [0,2,0,0,0,0|1,0,0]=3 1530 B10R1.30 COc1cc(cnc1Cl)Br AB43719 [0,2,0,0,0,0|2,0,0]=4 1531 B10R1.30 COc1cc(cnc1Cl)F AB74801 [0,2,0,0,0,0|2,0,0]=4 1532 B10R1.30 COc1cc(ncc1Cl)N AB70478 [0,2,0,0,0,0|2,0,0]=4 1533 B10R1.30 CSc1cc(ccc1Br)O MB38334 [0,2,0,0,0,0|0,1,0]=3 1534 B10R1.30 CSc1cc(ccc1Cl)O MB38239 [0,2,0,0,0,0|0,1,0]=3 1535 B10R1.30 CSc1cc(ccc1F)O MB25679 [0,2,0,0,0,0|0,1,0]=3 1536 B10R1.30 CSc1cc(ccc1I)O MB30001 [0,2,0,0,0,0|0,1,0]=3 1537 B10R1.30 CSc1cc(ccc1N)O MB25516 [0,2,0,0,0,0|0,1,0]=3 1538 B10R1.30 CSc1cc(ccc1O)Br MB28713 [0,2,0,0,0,0|1,1,0]=4 1539 B10R1.30 CSc1cc(ccc1O)Cl MB35043 [0,2,0,0,0,0|1,1,0]=4 1540 B10R1.30 CSc1cc(ccc1O)F MB35476 [0,2,0,0,0,0|1,1,0]=4 1541 B10R1.30 CSc1cc(ccc1O)N MB29519 [0,2,0,0,0,0|1,1,0]=4 1542 B10R1.30 Cc1cc(c(cn1)Br)OC AB40816 [0,2,0,0,0,0|2,0,0]=4 1543 B10R1.30 Cc1ccc(c(c1)C#N)O MB36141 [0,2,0,0,0,0|2,0,0]=4 1544 B10R1.30 Cc1ccc(c(c1)C=O)N AB58438 [0,2,0,0,0,0|1,0,1]=4 1545 B10R1.30 Cc1ccc(c(c1)SC)O MB34646 [0,2,0,0,0,0|1,1,0]=4 1546 B10R1.30 Cc1ccc(cc1C#N)O MB23451 [0,2,0,0,0,0|1,0,0]=3 1547 B10R1.30 Cc1ccc(cc1C=O)Cl AB63586 [0,2,0,0,0,0|1,0,1]=4 1548 B10R1.30 Cc1ccc(cc1C=O)O MB23457 [0,2,0,0,0,0|0,0,1]=3 1549 B10R1.30 Cc1ccc(cc1CBr)Cl CB11653 [0,2,0,0,0,0|2,0,0]=4 1550 B10R1.30 Cc1ccc(cc1CN)O MB26411 [0,2,0,0,0,0|1,0,0]=3 1551 B10R1.30 Cc1ccc(cc1NC)O MB36159 [0,2,0,0,0,0|1,0,0]=3 1552 B10R1.30 Cc1ccc(cc1OC)Br MB04159 [0,2,0,0,0,0|1,0,0]=3 1553 B10R1.30 Cc1ccc(cc1OC)O MB25418 [0,2,0,0,0,0|0,0,0]=2 1554 B10R1.30 c1c(cnc(c1C#N)Cl)O PB30313 [0,2,0,0,0,0|2,0,0]=4 1555 B10R1.30 c1c(cnc(c1CO)Cl)Br PB17569 [0,2,0,0,0,0|2,0,0]=4 1556 B10R1.30 c1c(cnc(c1CO)Cl)F AB13672 [0,2,0,0,0,0|2,0,0]=4 1557 B10R1.30 c1c(cnc(c1CO)F)Br PB34780 [0,2,0,0,0,0|2,0,0]=4 1558 B10R1.30 c1c(cnc(c1CO)N)Br AB22233 [0,2,0,0,0,0|2,0,0]=4 1559 B10R1.30 c1c(cnc(c1CO)N)Br AB44376 [0,2,0,0,0,0|2,0,0]=4 1560 B10R1.30 c1c(cnc(c1CO)N)I AB21855 [0,2,0,0,0,0|2,0,0]=4 1561 B10R1.30 c1cc(c(cc1Br)C#N)N MB00791 [0,2,0,0,0,0|2,0,0]=4 1562 B10R1.30 c1cc(c(cc1Br)C=O)Br MB01225 [0,2,0,0,0,0|1,0,1]=4 1563 B10R1.30 c1cc(c(cc1Br)C=O)N AB58429 [0,2,0,0,0,0|1,0,1]=4 1564 B10R1.30 c1cc(c(cc1Br)CN)N AB23393 [0,2,0,0,0,0|2,0,0]=4 1565 B10R1.30 c1cc(c(cc1Br)CN)O AB10938 [0,2,0,0,0,0|2,0,0]=4 1566 B10R1.30 c1cc(c(cc1Br)CO)Cl MB02484 [0,2,0,0,0,0|1,0,0]=3 1567 B10R1.30 c1cc(c(cc1Br)CO)N MB05459 [0,2,0,0,0,0|1,0,0]=3 1568 B10R1.30 c1cc(c(cc1Br)NN)F AB13329 [0,2,0,0,0,0|2,0,0]=4 1569 B10R1.30 c1cc(c(cc1Cl)C#N)Br AB45293 [0,2,0,0,0,0|2,0,0]=4 1570 B10R1.30 c1cc(c(cc1Cl)C=O)O AB00314 [0,2,0,0,0,0|1,0,1]=4 1571 B10R1.30 c1cc(c(cc1Cl)CN)N AB23303 [0,2,0,0,0,0|2,0,0]=4 1572 B10R1.30 c1cc(c(cc1Cl)CN)O AB23336 [0,2,0,0,0,0|2,0,0]=4 1573 B10R1.30 c1cc(c(cc1Cl)CO)N MB00550 [0,2,0,0,0,0|1,0,0]=3 1574 B10R1.30 c1cc(c(cc1F)C#N)O MB10100 [0,2,0,0,0,0|2,0,0]=4 1575 B10R1.30 c1cc(c(cc1F)C=O)Br AB03821 [0,2,0,0,0,0|1,0,1]=4 1576 B10R1.30 c1cc(c(cc1F)C=O)N AB58443 [0,2,0,0,0,0|1,0,1]=4 1577 B10R1.30 c1cc(c(cc1F)CN)N AB23426 [0,2,0,0,0,0|2,0,0]=4 1578 B10R1.30 c1cc(c(cc1F)CN)O MB12059 [0,2,0,0,0,0|2,0,0]=4 1579 B10R1.30 c1cc(c(cc1F)CO)N MB05463 [0,2,0,0,0,0|1,0,0]=3 1580 B10R1.30 c1cc(c(cc1I)C#N)O MB02487 [0,2,0,0,0,0|2,0,0]=4 1581 B10R1.30 c1cc(c(cc1I)CBr)Cl AB43862 [0,2,0,0,0,0|2,0,0]=4 1582 B10R1.30 c1cc(c(cc1I)CN)Cl AB44524 [0,2,0,0,0,0|2,0,0]=4 1583 B10R1.30 c1cc(c(cc1I)CN)O MB08421 [0,2,0,0,0,0|2,0,0]=4 1584 B10R1.30 c1cc(c(cc1N)C#N)Cl AB07265 [0,2,0,0,0,0|2,0,0]=4 1585 B10R1.30 c1cc(c(cc1N)C#N)O MB01949 [0,2,0,0,0,0|2,0,0]=4 1586 B10R1.30 c1cc(c(cc1N)C=O)O MB01352 [0,2,0,0,0,0|1,0,1]=4 1587 B10R1.30 c1cc(c(cc1N)CN)F AB23413 [0,2,0,0,0,0|2,0,0]=4 1588 B10R1.30 c1cc(c(cc1N)CN)O MB10073 [0,2,0,0,0,0|2,0,0]=4 1589 B10R1.30 c1cc(c(cc1O)C#N)Br MB05213 [0,2,0,0,0,0|1,0,0]=3 1590 B10R1.30 c1cc(c(cc1O)C#N)Cl MB07522 [0,2,0,0,0,0|1,0,0]=3 1591 B10R1.30 c1cc(c(cc1O)C#N)I MB27967 [0,2,0,0,0,0|1,0,0]=3 1592 B10R1.30 c1cc(c(cc1O)C#N)N MB03902 [0,2,0,0,0,0|1,0,0]=3 1593 B10R1.30 c1cc(c(cc1O)C=O)Br AB13035 [0,2,0,0,0,0|0,0,1]=3 1594 B10R1.30 c1cc(c(cc1O)C=O)Cl MB05036 [0,2,0,0,0,0|0,0,1]=3 1595 B10R1.30 c1cc(c(cc1O)C=O)F MB06891 [0,2,0,0,0,0|0,0,1]=3 1596 B10R1.30 c1cc(c(cc1O)C=O)N MB29975 [0,2,0,0,0,0|0,0,1]=3 1597 B10R1.30 c1cc(c(cc1O)CN)Br MB08427 [0,2,0,0,0,0|1,0,0]=3 1598 B10R1.30 c1cc(c(cc1O)CN)Cl MB37155 [0,2,0,0,0,0|1,0,0]=3 1599 B10R1.30 c1cc(c(cc1O)CN)F MB12208 [0,2,0,0,0,0|1,0,0]=3 1600 B10R1.30 c1cc(c(cc1O)CN)I MB36844 [0,2,0,0,0,0|1,0,0]=3 1601 B10R1.113 B(c1cc(ccn1)C)(O)O AB13221 [0,2,0,0,0,0|2,0,0]=4 1602 B10R1.113 B(c1cc(ccn1)F)(O)O AB43303 [0,2,0,0,0,0|2,0,0]=4 1603 B10R1.113 B(c1cc(cnc1)Br)(O)O AB12651 [0,2,0,0,0,0|2,0,0]=4 1604 B10R1.113 B(c1cc(cnc1)Cl)(O)O AB29845 [0,2,0,0,0,0|2,0,0]=4 1605 B10R1.113 B(c1cc(cnc1)F)(O)O AB31983 [0,2,0,0,0,0|2,0,0]=4 1606 B10R1.113 B(c1cc(cnc1)N)(O)O AB40635 [0,2,0,0,0,0|2,0,0]=4 1607 B10R1.113 B(c1cc(cnc1)O)(O)O AB67806 [0,2,0,0,0,0|1,0,0]=3 1608 B10R1.113 B(c1cccc(c1)Br)(O)O AB05452 [0,2,0,0,0,0|1,0,0]=3 1609 B10R1.113 B(c1cccc(c1)C)(O)O AB01795 [0,2,0,0,0,0|1,0,0]=3 1610 B10R1.113 B(c1cccc(c1)Cl)(O)O AB04228 [0,2,0,0,0,0|1,0,0]=3 1611 B10R1.113 B(c1cccc(c1)F)(O)O AB05340 [0,2,0,0,0,0|1,0,0]=3 1612 B10R1.113 B(c1cccc(c1)I)(O)O AB08836 [0,2,0,0,0,0|1,0,0]=3 1613 B10R1.113 B(c1cccc(c1)N)(O)O AB00895 [0,2,0,0,0,0|1,0,0]=3 1614 B10R1.113 B(c1cccc(c1)N)(O)O AB01122 [0,2,0,0,0,0|1,0,0]=3 1615 B10R1.113 B(c1cccc(c1)O)(O)O AB08061 [0,2,0,0,0,0|0,0,0]=2 1616 B10R1.113 B(c1cccc(c1)S)(O)O AB13509 [0,2,0,0,0,0|0,1,0]=3 1617 B10R1.113 B(c1cccc(n1)Br)(O)O AB18040 [0,2,0,0,0,0|2,0,0]=4 1618 B10R1.113 B(c1cccc(n1)C)(O)O AB13224 [0,2,0,0,0,0|2,0,0]=4 1619 B10R1.113 B(c1cccc(n1)Cl)(O)O AB43435 [0,2,0,0,0,0|2,0,0]=4 1620 B10R1.113 B(c1cccc(n1)F)(O)O AB48607 [0,2,0,0,0,0|2,0,0]=4 1621 B10R1.113 B(c1cccc(n1)O)(O)O AB45591 [0,2,0,0,0,0|1,0,0]=3 1622 B10R1.113 B(c1ccnc(c1)Br)(O)O AB29847 [0,2,0,0,0,0|2,0,0]=4 1623 B10R1.113 B(c1ccnc(c1)C)(O)O AB13715 [0,2,0,0,0,0|2,0,0]=4 1624 B10R1.113 B(c1ccnc(c1)Cl)(O)O AB15988 [0,2,0,0,0,0|2,0,0]=4 1625 B10R1.113 B(c1ccnc(c1)F)(O)O AB17600 [0,2,0,0,0,0|2,0,0]=4 1626 B10R1.113 CC(=O)c1cc(ccn1)O AB69730 [0,2,0,0,0,0|1,0,1]=4 1627 B10R1.113 CC(C)c1cc(ccn1)O MB11626 [0,2,0,0,0,0|2,0,0]=4 1628 B10R1.113 CC(C)c1cc(cnc1)O MB22682 [0,2,0,0,0,0|2,0,0]=4 1629 B10R1.113 CN(C)c1cc(ccn1)O MB15076 [0,2,0,0,0,0|2,0,0]=4 1630 B10R1.113 CN(C)c1cc(cnc1)O MB24985 [0,2,0,0,0,0|2,0,0]=4 1631 B10R1.113 C[C@@H](c1cccc(c1)N)N AB29091 [0,2,0,0,0,0|2,0,0]=4 1632 B10R1.113 C[C@H](c1cccc(c1)O)N AB21156 [0,2,0,0,0,0|1,0,0]=3 1633 B10R1.113 Cc1cc(ccn1)C(=O)O AB06393 [0,2,0,0,0,0|2,0,0]=4 1634 B10R1.113 Cc1cc(cnc1)C(=O)O PB12710 [0,2,0,0,0,0|2,0,0]=4 1635 B10R1.113 Cc1cccc(c1)C(=N)N AB11452 [0,2,0,0,0,0|2,0,0]=4 1636 B10R1.113 Cc1cccc(c1)C(=S)N AB08506 [0,2,0,0,0,0|1,1,0]=4 1637 B10R1.113 Cc1cccc(n1)C(=O)O AB01368 [0,2,0,0,0,0|2,0,0]=4 1638 B10R1.113 Cc1ccnc(c1)C(=O)O AB15851 [0,2,0,0,0,0|2,0,0]=4 1639 B10R1.113 c1c(cncc1Cl)C(=O)O PB25983 [0,2,0,0,0,0|2,0,0]=4 1640 B10R1.113 c1c(cncc1F)C(=O)O PB23226 [0,2,0,0,0,0|2,0,0]=4 1641 B10R1.113 c1c(cncc1N)C(=O)O PB13029 [0,2,0,0,0,0|2,0,0]=4 1642 B10R1.113 c1c(cncc1O)C(=O)N MB01725 [0,2,0,0,0,0|1,0,1]=4 1643 B10R1.113 c1c(cncc1O)C(=O)O PB33816 [0,2,0,0,0,0|1,0,0]=3 1644 B10R1.113 c1c(cncc1O)C(F)F AB85525 [0,2,0,0,0,0|2,0,0]=4 1645 B10R1.113 c1cc(cc(c1)Br)C(=N)N AB18330 [0,2,0,0,0,0|2,0,0]=4 1646 B10R1.113 c1cc(cc(c1)Br)C(=O)N MB00265 [0,2,0,0,0,0|1,0,1]=4 1647 B10R1.113 c1cc(cc(c1)Br)C(=S)N AB21268 [0,2,0,0,0,0|1,1,0]=4 1648 B10R1.113 c1cc(cc(c1)Cl)C(=S)N AB05898 [0,2,0,0,0,0|1,1,0]=4 1649 B10R1.113 c1cc(cc(c1)F)C(=N)N AB18313 [0,2,0,0,0,0|2,0,0]=4 1650 B10R1.113 c1cc(cc(c1)F)C(=S)N AB21276 [0,2,0,0,0,0|1,1,0]=4 1651 B10R1.113 c1cc(cc(c1)N)C(=N)N AB01115 [0,2,0,0,0,0|2,0,0]=4 1652 B10R1.113 c1cc(cc(c1)N)C(=S)N AB21283 [0,2,0,0,0,0|1,1,0]=4 1653 B10R1.113 c1cc(cc(c1)O)C(=N)N AB55570 [0,2,0,0,0,0|1,0,0]=3 1654 B10R1.113 c1cc(cc(c1)O)C(=O)N MB00281 [0,2,0,0,0,0|0,0,1]=3 1655 B10R1.113 c1cc(nc(c1)Br)C(=O)O AB03328 [0,2,0,0,0,0|2,0,0]=4 1656 B10R1.113 c1cc(nc(c1)Cl)C(=O)O AB04138 [0,2,0,0,0,0|2,0,0]=4 1657 B10R1.113 c1cc(nc(c1)F)C(=O)O AB11487 [0,2,0,0,0,0|2,0,0]=4 1658 B10R1.113 c1cc(nc(c1)I)C(=O)O AB42497 [0,2,0,0,0,0|2,0,0]=4 1659 B10R1.113 c1cc(nc(c1)N)C(=O)O PB23179 [0,2,0,0,0,0|2,0,0]=4 1660 B10R1.113 c1cnc(cc1Br)C(=O)O PB21234 [0,2,0,0,0,0|2,0,0]=4 1661 B10R1.113 c1cnc(cc1C(=O)O)Br AB09563 [0,2,0,0,0,0|2,0,0]=4 1662 B10R1.113 c1cnc(cc1C(=O)O)Cl PB12125 [0,2,0,0,0,0|2,0,0]=4 1663 B10R1.113 c1cnc(cc1C(=O)O)F AB11490 [0,2,0,0,0,0|2,0,0]=4 1664 B10R1.113 c1cnc(cc1C(=O)O)I AB29977 [0,2,0,0,0,0|2,0,0]=4 1665 B10R1.113 c1cnc(cc1C(=O)O)N PB19872 [0,2,0,0,0,0|2,0,0]=4 1666 B10R1.113 c1cnc(cc1C(=O)O)O PB29144 [0,2,0,0,0,0|1,0,0]=3 1667 B10R1.113 c1cnc(cc1Cl)C(=O)O AB04585 [0,2,0,0,0,0|2,0,0]=4 1668 B10R1.113 c1cnc(cc1F)C(=O)O AB40659 [0,2,0,0,0,0|2,0,0]=4 1669 B10R1.113 c1cnc(cc1I)C(=O)O AB28008 [0,2,0,0,0,0|2,0,0]=4 1670 B10R1.113 c1cnc(cc1I)C(=O)O PB20818 [0,2,0,0,0,0|2,0,0]=4 1671 B10R1.113 c1cnc(cc1N)C(=O)O PB23313 [0,2,0,0,0,0|2,0,0]=4 1672 B10R1.113 c1cnc(cc1O)C(=O)N MB05243 [0,2,0,0,0,0|1,0,1]=4 1673 B10R1.113 c1cnc(cc1O)C(=O)O AB06407 [0,2,0,0,0,0|1,0,0]=3 1674 B10R1.172 C#Cc1cccc(c1)C#N AB45854 [0,2,0,0,0,0|2,0,0]=4 1675 B10R1.172 C#Cc1cccc(c1)C=O AB23573 [0,2,0,0,0,0|1,0,1]=4 1676 B10R1.172 C#Cc1cccc(c1)CN AB61367 [0,2,0,0,0,0|2,0,0]=4 1677 B10R1.172 CCc1cccc(c1)NN AB27881 [0,2,0,0,0,0|2,0,0]=4 1678 B10R1.172 CNc1ccnc(c1)OC AB60615 [0,2,0,0,0,0|2,0,0]=4 1679 B10R1.172 COc1cc(ccn1)C#C AB68333 [0,2,0,0,0,0|2,0,0]=4 1680 B10R1.172 COc1cc(ccn1)C#N PB24932 [0,2,0,0,0,0|2,0,0]=4 1681 B10R1.172 COc1cc(ccn1)C=O PB32415 [0,2,0,0,0,0|1,0,1]=4 1682 B10R1.172 COc1cc(ccn1)CCl AB59894 [0,2,0,0,0,0|2,0,0]=4 1683 B10R1.172 COc1cc(ccn1)CN PB12590 [0,2,0,0,0,0|2,0,0]=4 1684 B10R1.172 COc1cc(ccn1)CO PB12206 [0,2,0,0,0,0|1,0,0]=3 1685 B10R1.172 COc1cc(cnc1)C#C AB63414 [0,2,0,0,0,0|2,0,0]=4 1686 B10R1.172 COc1cc(cnc1)C=O PB23495 [0,2,0,0,0,0|1,0,1]=4 1687 B10R1.172 COc1cc(cnc1)CCl AB67553 [0,2,0,0,0,0|2,0,0]=4 1688 B10R1.172 COc1cc(cnc1)CN PB36726 [0,2,0,0,0,0|2,0,0]=4 1689 B10R1.172 COc1cc(cnc1)CO PB11991 [0,2,0,0,0,0|1,0,0]=3 1690 B10R1.172 COc1cccc(c1)C#C AB04227 [0,2,0,0,0,0|1,0,0]=3 1691 B10R1.172 COc1cccc(c1)C#N AB00159 [0,2,0,0,0,0|1,0,0]=3 1692 B10R1.172 COc1cccc(c1)C=O AB00318 [0,2,0,0,0,0|0,0,1]=3 1693 B10R1.172 COc1cccc(n1)C=O AB22243 [0,2,0,0,0,0|1,0,1]=4 1694 B10R1.172 COc1cccc(n1)CCl AB59984 [0,2,0,0,0,0|2,0,0]=4 1695 B10R1.172 COc1cccc(n1)CN AB64449 [0,2,0,0,0,0|2,0,0]=4 1696 B10R1.172 COc1cccc(n1)CO AB43774 [0,2,0,0,0,0|1,0,0]=3 1697 B10R1.172 COc1ccnc(c1)C=O AB43663 [0,2,0,0,0,0|1,0,1]=4 1698 B10R1.172 COc1ccnc(c1)CCl AB42302 [0,2,0,0,0,0|2,0,0]=4 1699 B10R1.172 COc1ccnc(c1)CCl MB05825 [0,2,0,0,0,0|2,0,0]=4 1700 B10R1.172 COc1ccnc(c1)CN AB63680 [0,2,0,0,0,0|2,0,0]=4 1701 B10R1.172 COc1ccnc(c1)CO AB42298 [0,2,0,0,0,0|1,0,0]=3 1702 B10R1.172 COc1nccc(n1)CO PB24420 [0,2,0,0,0,0|2,0,0]=4 1703 B10R1.172 c1c(cncc1C#N)CO AB31356 [0,2,0,0,0,0|2,0,0]=4 1704 B10R1.172 c1cc(cc(c1)C#N)CO CB10501 [0,2,0,0,0,0|1,0,0]=3 1705 B10R1.172 c1cc(nc(c1)C#N)CO AB31421 [0,2,0,0,0,0|2,0,0]=4 1706 B10R1.172 c1cc(nc(c1)CO)CN AB31423 [0,2,0,0,0,0|2,0,0]=4 1707 B10R1.172 c1cnc(cc1CO)C#N AB31352 [0,2,0,0,0,0|2,0,0]=4 1708 B10R1.176 CCc1ccc(c(c1)C)O MB23862 [0,2,0,0,0,0|2,0,0]=4 1709 B10R1.176 CCc1ccc(c(c1)Cl)O MB23911 [0,2,0,0,0,0|2,0,0]=4 1710 B10R1.176 CCc1ccc(c(c1)F)O MB23895 [0,2,0,0,0,0|2,0,0]=4 1711 B10R1.176 CCc1ccc(c(c1)I)O MB23898 [0,2,0,0,0,0|2,0,0]=4 1712 B10R1.176 CCc1ccc(c(c1)N)O MB00456 [0,2,0,0,0,0|2,0,0]=4 1713 B10R1.176 CCc1ccc(c(c1)O)Br MB09100 [0,2,0,0,0,0|1,0,0]=3 1714 B10R1.176 CCc1ccc(c(c1)O)Cl MB01396 [0,2,0,0,0,0|1,0,0]=3 1715 B10R1.176 CCc1ccc(c(c1)O)F MB23840 [0,2,0,0,0,0|1,0,0]=3 1716 B10R1.176 CCc1ccc(c(c1)O)I MB23844 [0,2,0,0,0,0|1,0,0]=3 1717 B10R1.176 CCc1ccc(c(c1)O)N MB03784 [0,2,0,0,0,0|1,0,0]=3 1718 B10R1.176 CNc1ccc(c(c1)Br)O MB30977 [0,2,0,0,0,0|2,0,0]=4 1719 B10R1.176 CNc1ccc(c(c1)Cl)O MB15061 [0,2,0,0,0,0|2,0,0]=4 1720 B10R1.176 CNc1ccc(c(c1)F)O MB33460 [0,2,0,0,0,0|2,0,0]=4 1721 B10R1.176 CNc1ccc(c(c1)I)O MB28237 [0,2,0,0,0,0|2,0,0]=4 1722 B10R1.176 CNc1ccc(c(c1)N)O MB27818 [0,2,0,0,0,0|2,0,0]=4 1723 B10R1.176 CNc1ccc(c(c1)O)Br MB32226 [0,2,0,0,0,0|1,0,0]=3 1724 B10R1.176 CNc1ccc(c(c1)O)Cl MB28131 [0,2,0,0,0,0|1,0,0]=3 1725 B10R1.176 CNc1ccc(c(c1)O)F MB37912 [0,2,0,0,0,0|1,0,0]=3 1726 B10R1.176 CNc1ccc(c(c1)O)I MB26459 [0,2,0,0,0,0|1,0,0]=3 1727 B10R1.176 CNc1ccc(c(c1)O)N MB25952 [0,2,0,0,0,0|1,0,0]=3 1728 B10R1.176 COc1cc(c(cn1)Br)N PB16472 [0,2,0,0,0,0|2,0,0]=4 1729 B10R1.176 COc1cc(c(cn1)Cl)I AB71228 [0,2,0,0,0,0|2,0,0]=4 1730 B10R1.176 COc1cc(c(cn1)Cl)N AB68191 [0,2,0,0,0,0|2,0,0]=4 1731 B10R1.176 COc1cc(c(cn1)Cl)O AB69300 [0,2,0,0,0,0|1,0,0]=3 1732 B10R1.176 COc1cc(c(cn1)F)N AB70895 [0,2,0,0,0,0|2,0,0]=4 1733 B10R1.176 COc1cc(c(cn1)F)O AB69312 [0,2,0,0,0,0|1,0,0]=3 1734 B10R1.176 COc1cc(c(cn1)N)Cl AB75726 [0,2,0,0,0,0|2,0,0]=4 1735 B10R1.176 COc1cc(c(cn1)N)N AB51235 [0,2,0,0,0,0|2,0,0]=4 1736 B10R1.176 COc1cc(c(cn1)O)Cl AB70292 [0,2,0,0,0,0|2,0,0]=4 1737 B10R1.176 COc1cc(c(nc1)Cl)N AB62900 [0,2,0,0,0,0|2,0,0]=4 1738 B10R1.176 COc1cc(c(nc1)Cl)O AB71170 [0,2,0,0,0,0|1,0,0]=3 1739 B10R1.176 COc1cc(c(nc1)N)Cl AB70867 [0,2,0,0,0,0|2,0,0]=4 1740 B10R1.176 COc1cc(c(nc1)O)Cl AB71174 [0,2,0,0,0,0|2,0,0]=4 1741 B10R1.176 COc1ccc(c(c1)Br)I CB11658 [0,2,0,0,0,0|1,0,0]=3 1742 B10R1.176 COc1ccc(c(c1)Br)N AB49251 [0,2,0,0,0,0|1,0,0]=3 1743 B10R1.176 COc1ccc(c(c1)Br)O AB10935 [0,2,0,0,0,0|1,0,0]=3 1744 B10R1.176 COc1ccc(c(c1)F)N AB09440 [0,2,0,0,0,0|1,0,0]=3 1745 B10R1.176 COc1ccc(c(c1)I)N AB42374 [0,2,0,0,0,0|1,0,0]=3 1746 B10R1.176 COc1ccc(c(c1)I)O MB07821 [0,2,0,0,0,0|1,0,0]=3 1747 B10R1.176 COc1ccc(c(c1)N)I AB45640 [0,2,0,0,0,0|1,0,0]=3 1748 B10R1.176 COc1ccc(c(c1)N)N AB02069 [0,2,0,0,0,0|1,0,0]=3 1749 B10R1.176 COc1ccc(c(c1)N)O AB25358 [0,2,0,0,0,0|1,0,0]=3 1750 B10R1.176 COc1ccc(c(c1)O)Br MB02872 [0,2,0,0,0,0|0,0,0]=2 1751 B10R1.176 COc1ccc(c(c1)O)F MB25573 [0,2,0,0,0,0|0,0,0]=2 1752 B10R1.176 COc1ccc(c(c1)O)I MB12203 [0,2,0,0,0,0|0,0,0]=2 1753 B10R1.176 COc1ccc(c(n1)Br)N AB21737 [0,2,0,0,0,0|2,0,0]=4 1754 B10R1.176 COc1ccc(c(n1)Cl)N AB49773 [0,2,0,0,0,0|2,0,0]=4 1755 B10R1.176 COc1ccc(c(n1)Cl)O AB69288 [0,2,0,0,0,0|2,0,0]=4 1756 B10R1.176 COc1ccc(c(n1)N)Br AB43426 [0,2,0,0,0,0|2,0,0]=4 1757 B10R1.176 COc1ccc(c(n1)N)Cl AB62898 [0,2,0,0,0,0|2,0,0]=4 1758 B10R1.176 COc1ccc(c(n1)N)N AB25773 [0,2,0,0,0,0|2,0,0]=4 1759 B10R1.176 COc1ccc(c(n1)O)Cl AB75736 [0,2,0,0,0,0|1,0,0]=3 1760 B10R1.176 CSc1ccc(c(c1)Br)O MB09158 [0,2,0,0,0,0|1,1,0]=4 1761 B10R1.176 CSc1ccc(c(c1)Cl)O MB31036 [0,2,0,0,0,0|1,1,0]=4 1762 B10R1.176 CSc1ccc(c(c1)F)O MB25631 [0,2,0,0,0,0|1,1,0]=4 1763 B10R1.176 CSc1ccc(c(c1)I)O MB38361 [0,2,0,0,0,0|1,1,0]=4 1764 B10R1.176 CSc1ccc(c(c1)N)O MB34167 [0,2,0,0,0,0|1,1,0]=4 1765 B10R1.176 CSc1ccc(c(c1)O)Cl MB33637 [0,2,0,0,0,0|0,1,0]=3 1766 B10R1.176 CSc1ccc(c(c1)O)F MB25520 [0,2,0,0,0,0|0,1,0]=3 1767 B10R1.176 CSc1ccc(c(c1)O)I MB38424 [0,2,0,0,0,0|0,1,0]=3 1768 B10R1.176 Cc1c(cc(cn1)OC)N AB73554 [0,2,0,0,0,0|2,0,0]=4 1769 B10R1.176 Cc1c(ccc(n1)OC)Br AB13393 [0,2,0,0,0,0|2,0,0]=4 1770 B10R1.176 Cc1cc(ccc1Br)C#N AB01529 [0,2,0,0,0,0|2,0,0]=4 1771 B10R1.176 Cc1cc(ccc1Br)C=O AB42951 [0,2,0,0,0,0|1,0,1]=4 1772 B10R1.176 Cc1cc(ccc1Br)CO AB50387 [0,2,0,0,0,0|1,0,0]=3 1773 B10R1.176 Cc1cc(ccc1Br)NN AB12016 [0,2,0,0,0,0|2,0,0]=4 1774 B10R1.176 Cc1cc(ccc1Cl)C=O AB11800 [0,2,0,0,0,0|1,0,1]=4 1775 B10R1.176 Cc1cc(ccc1Cl)NN AB13351 [0,2,0,0,0,0|2,0,0]=4 1776 B10R1.176 Cc1cc(ccc1O)C#N MB10144 [0,2,0,0,0,0|2,0,0]=4 1777 B10R1.176 Cc1cc(ccc1O)CN MB05062 [0,2,0,0,0,0|2,0,0]=4 1778 B10R1.176 Cc1cc(ccc1O)NC MB07546 [0,2,0,0,0,0|2,0,0]=4 1779 B10R1.176 Cc1cc(cnc1Br)OC AB74660 [0,2,0,0,0,0|2,0,0]=4 1780 B10R1.176 Cc1cc(cnc1C)OC AB85300 [0,2,0,0,0,0|2,0,0]=4 1781 B10R1.176 Cc1cc(cnc1Cl)OC AB71233 [0,2,0,0,0,0|2,0,0]=4 1782 B10R1.176 Cc1cc(cnc1N)OC AB73557 [0,2,0,0,0,0|2,0,0]=4 1783 B10R1.176 Cc1cc(ncc1Br)OC AB17469 [0,2,0,0,0,0|2,0,0]=4 1784 B10R1.176 Cc1cc(ncc1N)OC AB44888 [0,2,0,0,0,0|2,0,0]=4 1785 B10R1.176 Cc1ccc(cc1Br)C#N AB29736 [0,2,0,0,0,0|2,0,0]=4 1786 B10R1.176 Cc1ccc(cc1O)C#N MB06106 [0,2,0,0,0,0|1,0,0]=3 1787 B10R1.176 Cc1ccc(cc1O)C=O MB01933 [0,2,0,0,0,0|0,0,1]=3 1788 B10R1.176 Cc1ccc(cc1O)NC MB25401 [0,2,0,0,0,0|1,0,0]=3 1789 B10R1.176 Cc1ccc(cc1O)OC MB11905 [0,2,0,0,0,0|0,0,0]=2 1790 B10R1.176 Cc1ccc(cc1O)SC MB25438 [0,2,0,0,0,0|0,1,0]=3 1791 B10R1.176 Cc1ccc(nc1N)OC AB73563 [0,2,0,0,0,0|2,0,0]=4 1792 B10R1.176 Cc1cnc(cc1N)OC AB73589 [0,2,0,0,0,0|2,0,0]=4 1793 B10R1.176 Cn1cc(ccc1=O)CO PB22835 [0,2,0,0,0,0|2,0,0]=4 1794 B10R1.176 Cn1ccc(cc1=O)CO PB18199 [0,2,0,0,0,0|1,0,1]=4 1795 B10R1.176 c1c(cnc(c1O)Cl)C=O AB62785 [0,2,0,0,0,0|1,0,1]=4 1796 B10R1.176 c1c(cnc(c1O)Cl)CCl AB84103 [0,2,0,0,0,0|2,0,0]=4 1797 B10R1.176 c1c(cnc(c1O)Cl)CN AB84104 [0,2,0,0,0,0|2,0,0]=4 1798 B10R1.176 c1c(ncc(c1Cl)F)CO PB22370 [0,2,0,0,0,0|2,0,0]=4 1799 B10R1.176 c1c(ncc(c1O)Cl)C=O AB75002 [0,2,0,0,0,0|1,0,1]=4 1800 B10R1.176 c1c(ncc(c1O)Cl)CCl AB84042 [0,2,0,0,0,0|2,0,0]=4 1801 B10R1.176 c1c(ncc(c1O)Cl)CN AB84044 [0,2,0,0,0,0|2,0,0]=4 1802 B10R1.176 c1cc(c(cc1C#N)F)N AB02282 [0,2,0,0,0,0|2,0,0]=4 1803 B10R1.176 c1cc(c(cc1C#N)I)N AB17464 [0,2,0,0,0,0|2,0,0]=4 1804 B10R1.176 c1cc(c(cc1C#N)I)O MB09222 [0,2,0,0,0,0|2,0,0]=4 1805 B10R1.176 c1cc(c(cc1C#N)O)Br MB25476 [0,2,0,0,0,0|1,0,0]=3 1806 B10R1.176 c1cc(c(cc1C#N)O)Cl MB25577 [0,2,0,0,0,0|1,0,0]=3 1807 B10R1.176 c1cc(c(cc1C#N)O)I MB12046 [0,2,0,0,0,0|1,0,0]=3 1808 B10R1.176 c1cc(c(cc1C#N)O)N MB03898 [0,2,0,0,0,0|1,0,0]=3 1809 B10R1.176 c1cc(c(cc1C=O)Cl)Br AB43050 [0,2,0,0,0,0|1,0,1]=4 1810 B10R1.176 c1cc(c(cc1C=O)I)F AB44172 [0,2,0,0,0,0|1,0,1]=4 1811 B10R1.176 c1cc(c(cc1C=O)I)O MB00259 [0,2,0,0,0,0|1,0,1]=4 1812 B10R1.176 c1cc(c(cc1C=O)N)O MB13575 [0,2,0,0,0,0|1,0,1]=4 1813 B10R1.176 c1cc(c(cc1C=O)O)Br MB09255 [0,2,0,0,0,0|0,0,1]=3 1814 B10R1.176 c1cc(c(cc1C=O)O)Cl MB25536 [0,2,0,0,0,0|0,0,1]=3 1815 B10R1.176 c1cc(c(cc1C=O)O)F MB09319 [0,2,0,0,0,0|0,0,1]=3 1816 B10R1.176 c1cc(c(cc1C=O)O)N MB34962 [0,2,0,0,0,0|0,0,1]=3 1817 B10R1.176 c1cc(c(cc1CBr)I)F AB44169 [0,2,0,0,0,0|2,0,0]=4 1818 B10R1.176 c1cc(c(cc1CN)Br)O MB02719 [0,2,0,0,0,0|2,0,0]=4 1819 B10R1.176 c1cc(c(cc1CN)Cl)O MB03734 [0,2,0,0,0,0|2,0,0]=4 1820 B10R1.176 c1cc(c(cc1CN)F)N AB50278 [0,2,0,0,0,0|2,0,0]=4 1821 B10R1.176 c1cc(c(cc1CN)F)O MB03723 [0,2,0,0,0,0|2,0,0]=4 1822 B10R1.176 c1cc(c(cc1CN)I)O MB27028 [0,2,0,0,0,0|2,0,0]=4 1823 B10R1.176 c1cc(c(cc1CN)N)O MB37291 [0,2,0,0,0,0|2,0,0]=4 1824 B10R1.176 c1cc(c(cc1CN)O)Br MB27292 [0,2,0,0,0,0|1,0,0]=3 1825 B10R1.176 c1cc(c(cc1CN)O)Cl MB25545 [0,2,0,0,0,0|1,0,0]=3 1826 B10R1.176 c1cc(c(cc1CN)O)F MB35973 [0,2,0,0,0,0|1,0,0]=3 1827 B10R1.176 c1cc(c(cc1CN)O)I MB25685 [0,2,0,0,0,0|1,0,0]=3 1828 B10R1.176 c1cc(c(cc1CN)O)N MB29053 [0,2,0,0,0,0|1,0,0]=3 1829 B10R1.176 c1cc(c(cc1CO)F)Br AB44195 [0,2,0,0,0,0|1,0,0]=3 1830 B10R1.176 c1cc(c(cc1NN)F)F AB13306 [0,2,0,0,0,0|2,0,0]=4 1831 B10R1.176 c1cc(c(nc1C=O)O)Cl AB70962 [0,2,0,0,0,0|1,0,1]=4 1832 B10R1.176 c1cc(c(nc1CCl)O)Cl AB71004 [0,2,0,0,0,0|2,0,0]=4 1833 B10R1.176 c1cc(c(nc1CN)O)Cl AB84086 [0,2,0,0,0,0|2,0,0]=4 1834 B10R1.22 Cc1cc(nc(c1C)C)O AB82587 [0,2,0,0,0,0|2,0,0]=4 1835 B10R1.22 Cc1cc(nc(c1C)O)O AB21779 [0,2,0,0,0,0|1,0,0]=3 1836 B10R1.22 c1c(cc(c(c1Br)Br)Br)N AB11948 [0,2,0,0,0,0|2,0,0]=4 1837 B10R1.22 c1c(cc(c(c1Br)Br)Br)S AB65762 [0,2,0,0,0,0|1,1,0]=4 1838 B10R1.22 c1c(cc(c(c1Cl)Br)Cl)F CB11555 [0,2,0,0,0,0|2,0,0]=4 1839 B10R1.22 c1c(cc(c(c1F)F)Cl)Br AB64596 [0,2,0,0,0,0|2,0,0]=4 1840 B10R1.22 c1c(cc(c(c1F)N)F)Br MB00220 [0,2,0,0,0,0|2,0,0]=4 1841 B10R1.119 Cc1c(ccc(c1Cl)Br)N CB10999 [0,2,0,0,0,0|2,0,0]=4 1842 B10R1.119 Cc1c(ccc(c1F)F)Br AB42398 [0,2,0,0,0,0|2,0,0]=4 1843 B10R1.119 Cc1c(cnc(c1Br)O)Br AB23695 [0,2,0,0,0,0|2,0,0]=4 1844 B10R1.119 Cc1ccc(c(c1O)C)O AB24905 [0,2,0,0,0,0|0,0,0]=2 1845 B10R1.119 Cc1ccc(c(c1O)Cl)N AB13339 [0,2,0,0,0,0|1,0,0]=3 1846 B10R1.119 c1cc(c(c(c1Cl)N)Cl)Br PB16810 [0,2,0,0,0,0|2,0,0]=4 1847 B10R1.119 c1cc(c(c(c1N)F)F)Br CB11209 [0,2,0,0,0,0|2,0,0]=4 1848 B10R1.119 c1cc(c(c(c1N)I)F)Cl AB73418 [0,2,0,0,0,0|2,0,0]=4 1849 B10R1.245 CCc1c(cccc1Br)O MB23614 [0,2,0,0,0,0|1,0,0]=3 1850 B10R1.245 CCc1c(cccc1Cl)O MB23615 [0,2,0,0,0,0|1,0,0]=3 1851 B10R1.245 CCc1c(cccc1F)O MB23585 [0,2,0,0,0,0|1,0,0]=3 1852 B10R1.245 CCc1c(cccc1I)O MB23587 [0,2,0,0,0,0|1,0,0]=3 1853 B10R1.245 CCc1c(cccc1O)C MB23554 [0,2,0,0,0,0|1,0,0]=3 1854 B10R1.245 CCc1c(cccc1O)N MB23558 [0,2,0,0,0,0|1,0,0]=3 1855 B10R1.245 CNc1c(cccc1Br)O MB31500 [0,2,0,0,0,0|1,0,0]=3 1856 B10R1.245 CNc1c(cccc1Cl)O MB33359 [0,2,0,0,0,0|1,0,0]=3 1857 B10R1.245 CNc1c(cccc1F)O MB29137 [0,2,0,0,0,0|1,0,0]=3 1858 B10R1.245 CNc1c(cccc1I)O MB30346 [0,2,0,0,0,0|1,0,0]=3 1859 B10R1.245 CNc1c(cccc1O)N MB01610 [0,2,0,0,0,0|1,0,0]=3 1860 B10R1.245 COc1c(cccc1Br)F AB21504 [0,2,0,0,0,0|2,0,0]=4 1861 B10R1.245 COc1c(cccc1Br)O MB09199 [0,2,0,0,0,0|1,0,0]=3 1862 B10R1.245 COc1c(cccc1Cl)O MB34190 [0,2,0,0,0,0|1,0,0]=3 1863 B10R1.245 COc1c(cccc1F)N MB00204 [0,2,0,0,0,0|2,0,0]=4 1864 B10R1.245 COc1c(cccc1I)O MB33689 [0,2,0,0,0,0|1,0,0]=3 1865 B10R1.245 COc1c(cccc1O)N MB14425 [0,2,0,0,0,0|1,0,0]=3 1866 B10R1.245 CSc1c(cccc1Br)O MB32344 [0,2,0,0,0,0|1,0,0]=3 1867 B10R1.245 CSc1c(cccc1Cl)O MB25403 [0,2,0,0,0,0|1,0,0]=3 1868 B10R1.245 CSc1c(cccc1I)O MB36697 [0,2,0,0,0,0|1,0,0]=3 1869 B10R1.245 CSc1c(cccc1O)N MB26572 [0,2,0,0,0,0|1,0,0]=3 1870 B10R1.245 Cc1c(c(ccn1)O)C=O AB84477 [0,2,0,0,0,0|2,0,0]=4 1871 B10R1.245 Cc1cccc(c1C#N)O MB02406 [0,2,0,0,0,0|1,0,0]=3 1872 B10R1.245 Cc1cccc(c1C=O)O MB14829 [0,2,0,0,0,0|1,0,0]=3 1873 B10R1.245 Cc1cccc(c1CCl)C AB08451 [0,2,0,0,0,0|2,0,0]=4 1874 B10R1.245 Cc1cccc(c1CN)O MB25667 [0,2,0,0,0,0|1,0,0]=3 1875 B10R1.245 Cc1cccc(c1CO)C AB03562 [0,2,0,0,0,0|2,0,0]=4 1876 B10R1.245 Cc1cccc(c1OC)O MB33579 [0,2,0,0,0,0|1,0,0]=3 1877 B10R1.245 Cc1cccc(c1SC)O MB08534 [0,2,0,0,0,0|1,0,0]=3 1878 B10R1.245 Cc1ccnc(c1C=O)O AB71364 [0,2,0,0,0,0|2,0,0]=4 1879 B10R1.245 Cc1cncc(c1C=O)O AB75255 [0,2,0,0,0,0|2,0,0]=4 1880 B10R1.245 c1c(c(c(cn1)Br)C=O)O AB84381 [0,2,0,0,0,0|2,0,0]=4 1881 B10R1.245 c1c(c(c(cn1)Cl)C=O)O AB75024 [0,2,0,0,0,0|2,0,0]=4 1882 B10R1.245 c1c(c(c(cn1)O)C=O)N AB84386 [0,2,0,0,0,0|2,0,0]=4 1883 B10R1.245 c1cc(c(c(c1)Br)C#N)Cl MB03774 [0,2,0,0,0,0|2,0,0]=4 1884 B10R1.245 c1cc(c(c(c1)Br)C#N)O MB12048 [0,2,0,0,0,0|1,0,0]=3 1885 B10R1.245 c1cc(c(c(c1)Br)C=O)Br CB11474 [0,2,0,0,0,0|2,0,0]=4 1886 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl MB01095 [0,2,0,0,0,0|2,0,0]=4 1887 B10R1.245 c1cc(c(c(c1)Br)C=O)F AB14028 [0,2,0,0,0,0|2,0,0]=4 1888 B10R1.245 c1cc(c(c(c1)Br)C=O)N PB34549 [0,2,0,0,0,0|2,0,0]=4 1889 B10R1.245 c1cc(c(c(c1)Br)C=O)O AB43626 [0,2,0,0,0,0|1,0,0]=3 1890 B10R1.245 c1cc(c(c(c1)Br)CN)O MB12052 [0,2,0,0,0,0|1,0,0]=3 1891 B10R1.245 c1cc(c(c(c1)Br)CO)F AB50340 [0,2,0,0,0,0|2,0,0]=4 1892 B10R1.245 c1cc(c(c(c1)Cl)C#N)O PB19932 [0,2,0,0,0,0|1,0,0]=3 1893 B10R1.245 c1cc(c(c(c1)Cl)C=O)N AB58431 [0,2,0,0,0,0|2,0,0]=4 1894 B10R1.245 c1cc(c(c(c1)Cl)C=O)O MB01945 [0,2,0,0,0,0|1,0,0]=3 1895 B10R1.245 c1cc(c(c(c1)Cl)CN)O MB15041 [0,2,0,0,0,0|1,0,0]=3 1896 B10R1.245 c1cc(c(c(c1)F)C=O)O MB01694 [0,2,0,0,0,0|1,0,0]=3 1897 B10R1.245 c1cc(c(c(c1)F)CN)O MB03739 [0,2,0,0,0,0|1,0,0]=3 1898 B10R1.245 c1cc(c(c(c1)I)C#N)F AB01183 [0,2,0,0,0,0|2,0,0]=4 1899 B10R1.245 c1cc(c(c(c1)I)C#N)O MB37282 [0,2,0,0,0,0|1,0,0]=3 1900 B10R1.245 c1cc(c(c(c1)I)C=O)O MB14699 [0,2,0,0,0,0|1,0,0]=3 1901 B10R1.245 c1cc(c(c(c1)I)CN)O MB31821 [0,2,0,0,0,0|1,0,0]=3 1902 B10R1.245 c1cc(c(c(c1)O)C#N)N MB34868 [0,2,0,0,0,0|1,0,0]=3 1903 B10R1.245 c1cc(c(c(c1)O)C=O)N MB27161 [0,2,0,0,0,0|1,0,0]=3 1904 B10R1.245 c1cc(c(c(c1)O)CN)N MB31845 [0,2,0,0,0,0|1,0,0]=3 1905 B10R1.245 c1cnc(c(c1Br)C=O)O AB84479 [0,2,0,0,0,0|2,0,0]=4 1906 B10R1.245 c1cnc(c(c1Cl)C=O)O AB84482 [0,2,0,0,0,0|2,0,0]=4 1907 B10R1.245 c1cnc(c(c1N)C=O)O AB84486 [0,2,0,0,0,0|2,0,0]=4 1908 B10R1.245 c1cnc(c(c1O)C=O)Br AB84458 [0,2,0,0,0,0|2,0,0]=4 1909 B10R1.245 c1cnc(c(c1O)C=O)Cl AB66422 [0,2,0,0,0,0|2,0,0]=4 1910 B10R1.245 c1cnc(c(c1O)C=O)N AB84460 [0,2,0,0,0,0|2,0,0]=4 1911 B10R1.25 CCc1ccc(cc1Br)O MB23966 [0,2,0,0,0,0|1,0,0]=3 1912 B10R1.25 CCc1ccc(cc1C)O MB23913 [0,2,0,0,0,0|1,0,0]=3 1913 B10R1.25 CCc1ccc(cc1Cl)O MB23969 [0,2,0,0,0,0|1,0,0]=3 1914 B10R1.25 CCc1ccc(cc1F)O MB14963 [0,2,0,0,0,0|1,0,0]=3 1915 B10R1.25 CCc1ccc(cc1I)O MB23946 [0,2,0,0,0,0|1,0,0]=3 1916 B10R1.25 CCc1ccc(cc1N)O MB23949 [0,2,0,0,0,0|1,0,0]=3 1917 B10R1.25 CCc1ccc(cc1O)Br MB23992 [0,2,0,0,0,0|1,0,0]=3 1918 B10R1.25 CCc1ccc(cc1O)Cl MB23993 [0,2,0,0,0,0|1,0,0]=3 1919 B10R1.25 CCc1ccc(cc1O)F MB23841 [0,2,0,0,0,0|1,0,0]=3 1920 B10R1.25 CCc1ccc(cc1O)I MB23846 [0,2,0,0,0,0|1,0,0]=3 1921 B10R1.25 CCc1ccc(cc1O)N MB23852 [0,2,0,0,0,0|1,0,0]=3 1922 B10R1.25 CNc1ccc(cc1F)O MB31256 [0,2,0,0,0,0|1,0,0]=3 1923 B10R1.25 CNc1ccc(cc1I)O MB37121 [0,2,0,0,0,0|1,0,0]=3 1924 B10R1.25 CNc1ccc(cc1N)O MB30558 [0,2,0,0,0,0|1,0,0]=3 1925 B10R1.25 CNc1ccc(cc1O)Cl MB25839 [0,2,0,0,0,0|1,0,0]=3 1926 B10R1.25 CNc1ccc(cc1O)N MB33015 [0,2,0,0,0,0|1,0,0]=3 1927 B10R1.25 COc1c(cc(cn1)Br)O PB15354 [0,2,0,0,0,0|2,0,0]=4 1928 B10R1.25 COc1c(cc(cn1)O)Cl AB70289 [0,2,0,0,0,0|2,0,0]=4 1929 B10R1.25 COc1c(cc(cn1)O)F AB70291 [0,2,0,0,0,0|2,0,0]=4 1930 B10R1.25 COc1ccc(cc1Cl)Br AB03565 [0,2,0,0,0,0|2,0,0]=4 1931 B10R1.25 COc1ccc(cc1Cl)O MB13556 [0,2,0,0,0,0|1,0,0]=3 1932 B10R1.25 COc1ccc(cc1F)Br AB01075 [0,2,0,0,0,0|2,0,0]=4 1933 B10R1.25 COc1ccc(cc1I)O MB26647 [0,2,0,0,0,0|1,0,0]=3 1934 B10R1.25 COc1ccc(cc1N)O MB34521 [0,2,0,0,0,0|1,0,0]=3 1935 B10R1.25 COc1ccc(cc1O)Cl MB09234 [0,2,0,0,0,0|1,0,0]=3 1936 B10R1.25 COc1ccc(cc1O)I MB38179 [0,2,0,0,0,0|1,0,0]=3 1937 B10R1.25 COc1cnc(cc1O)Cl AB69306 [0,2,0,0,0,0|2,0,0]=4 1938 B10R1.25 CSc1ccc(cc1Br)O MB25524 [0,2,0,0,0,0|1,0,0]=3 1939 B10R1.25 CSc1ccc(cc1Cl)O MB38487 [0,2,0,0,0,0|1,0,0]=3 1940 B10R1.25 CSc1ccc(cc1F)O MB25544 [0,2,0,0,0,0|1,0,0]=3 1941 B10R1.25 CSc1ccc(cc1N)O MB34593 [0,2,0,0,0,0|1,0,0]=3 1942 B10R1.25 CSc1ccc(cc1O)Br MB35434 [0,2,0,0,0,0|1,0,0]=3 1943 B10R1.25 CSc1ccc(cc1O)F MB25440 [0,2,0,0,0,0|1,0,0]=3 1944 B10R1.25 CSc1ccc(cc1O)I MB29501 [0,2,0,0,0,0|1,0,0]=3 1945 B10R1.25 CSc1ccc(cc1O)N MB36502 [0,2,0,0,0,0|1,0,0]=3 1946 B10R1.25 Cc1c(ccc(n1)O)C#N AB55004 [0,2,0,0,0,0|2,0,0]=4 1947 B10R1.25 Cc1c(ccc(n1)O)OC AB63862 [0,2,0,0,0,0|2,0,0]=4 1948 B10R1.25 Cc1cc(c(cn1)C=O)O AB75249 [0,2,0,0,0,0|2,0,0]=4 1949 B10R1.25 Cc1cc(c(nc1)C=O)O AB75242 [0,2,0,0,0,0|2,0,0]=4 1950 B10R1.25 Cc1cc(ccc1C#N)Cl MB00421 [0,2,0,0,0,0|2,0,0]=4 1951 B10R1.25 Cc1cc(ccc1C#N)O MB23389 [0,2,0,0,0,0|1,0,0]=3 1952 B10R1.25 Cc1cc(ccc1NC)O MB05083 [0,2,0,0,0,0|1,0,0]=3 1953 B10R1.25 Cc1cc(ccc1OC)O MB07842 [0,2,0,0,0,0|1,0,0]=3 1954 B10R1.25 Cc1ccc(c(c1)F)NN AB27888 [0,2,0,0,0,0|2,0,0]=4 1955 B10R1.25 Cc1ccc(c(c1)N)C#N AB04357 [0,2,0,0,0,0|2,0,0]=4 1956 B10R1.25 Cc1ccc(c(c1)N)C=O AB58436 [0,2,0,0,0,0|2,0,0]=4 1957 B10R1.25 Cc1ccc(c(c1)O)C#N AB11820 [0,2,0,0,0,0|1,0,0]=3 1958 B10R1.25 Cc1ccc(c(c1)O)CN MB15038 [0,2,0,0,0,0|1,0,0]=3 1959 B10R1.25 Cc1ccc(c(c1)O)NC MB33283 [0,2,0,0,0,0|1,0,0]=3 1960 B10R1.25 Cc1ccc(c(c1)O)SC MB02032 [0,2,0,0,0,0|1,0,0]=3 1961 B10R1.25 Cc1ccc(c(n1)O)C=O AB42321 [0,2,0,0,0,0|2,0,0]=4 1962 B10R1.25 c1c(c(cnc1Br)C=O)O AB72645 [0,2,0,0,0,0|2,0,0]=4 1963 B10R1.25 c1c(c(cnc1Cl)C=O)O AB69327 [0,2,0,0,0,0|2,0,0]=4 1964 B10R1.25 c1c(c(cnc1N)C=O)O AB84438 [0,2,0,0,0,0|2,0,0]=4 1965 B10R1.25 c1c(c(cnc1O)C=O)O AB69704 [0,2,0,0,0,0|1,0,0]=3 1966 B10R1.25 c1c(cnc(c1O)C=O)Br AB70969 [0,2,0,0,0,0|2,0,0]=4 1967 B10R1.25 c1c(cnc(c1O)C=O)Cl AB75009 [0,2,0,0,0,0|2,0,0]=4 1968 B10R1.25 c1c(cnc(c1O)C=O)N AB84581 [0,2,0,0,0,0|2,0,0]=4 1969 B10R1.25 c1cc(c(cc1Br)Br)C#N AB66754 [0,2,0,0,0,0|2,0,0]=4 1970 B10R1.25 c1cc(c(cc1Br)Br)C=O AB66752 [0,2,0,0,0,0|2,0,0]=4 1971 B10R1.25 c1cc(c(cc1Br)F)C#N AB03862 [0,2,0,0,0,0|2,0,0]=4 1972 B10R1.25 c1cc(c(cc1Br)N)C=O AB45657 [0,2,0,0,0,0|2,0,0]=4 1973 B10R1.25 c1cc(c(cc1Br)N)CO AB42495 [0,2,0,0,0,0|2,0,0]=4 1974 B10R1.25 c1cc(c(cc1Br)O)C=O AB23661 [0,2,0,0,0,0|1,0,0]=3 1975 B10R1.25 c1cc(c(cc1Br)O)CN MB08429 [0,2,0,0,0,0|1,0,0]=3 1976 B10R1.25 c1cc(c(cc1Cl)Br)C=O MB06997 [0,2,0,0,0,0|2,0,0]=4 1977 B10R1.25 c1cc(c(cc1Cl)Br)CO MB06939 [0,2,0,0,0,0|2,0,0]=4 1978 B10R1.25 c1cc(c(cc1Cl)N)C=O AB58432 [0,2,0,0,0,0|2,0,0]=4 1979 B10R1.25 c1cc(c(cc1Cl)O)C#N MB01011 [0,2,0,0,0,0|1,0,0]=3 1980 B10R1.25 c1cc(c(cc1Cl)O)C=O AB23660 [0,2,0,0,0,0|1,0,0]=3 1981 B10R1.25 c1cc(c(cc1Cl)O)CN MB26819 [0,2,0,0,0,0|1,0,0]=3 1982 B10R1.25 c1cc(c(cc1F)Br)C#N AB06855 [0,2,0,0,0,0|2,0,0]=4 1983 B10R1.25 c1cc(c(cc1F)Br)C=O AB06851 [0,2,0,0,0,0|2,0,0]=4 1984 B10R1.25 c1cc(c(cc1F)Br)CO AB06857 [0,2,0,0,0,0|2,0,0]=4 1985 B10R1.25 c1cc(c(cc1F)N)C=O AB55874 [0,2,0,0,0,0|2,0,0]=4 1986 B10R1.25 c1cc(c(cc1F)N)CN AB50268 [0,2,0,0,0,0|2,0,0]=4 1987 B10R1.25 c1cc(c(cc1F)O)C#N MB13366 [0,2,0,0,0,0|1,0,0]=3 1988 B10R1.25 c1cc(c(cc1F)O)CN MB14866 [0,2,0,0,0,0|1,0,0]=3 1989 B10R1.25 c1cc(c(cc1I)O)C#N MB11881 [0,2,0,0,0,0|1,0,0]=3 1990 B10R1.25 c1cc(c(cc1I)O)C=O MB06220 [0,2,0,0,0,0|1,0,0]=3 1991 B10R1.25 c1cc(c(cc1I)O)CN MB10252 [0,2,0,0,0,0|1,0,0]=3 1992 B10R1.25 c1cc(c(cc1N)F)C#N AB32067 [0,2,0,0,0,0|2,0,0]=4 1993 B10R1.25 c1cc(c(cc1N)F)CBr AB56061 [0,2,0,0,0,0|2,0,0]=4 1994 B10R1.25 c1cc(c(cc1N)F)CN AB50282 [0,2,0,0,0,0|2,0,0]=4 1995 B10R1.25 c1cc(c(cc1N)O)C#N AB53481 [0,2,0,0,0,0|1,0,0]=3 1996 B10R1.25 c1cc(c(cc1N)O)C=O MB09039 [0,2,0,0,0,0|1,0,0]=3 1997 B10R1.25 c1cc(c(cc1N)O)CN MB10253 [0,2,0,0,0,0|1,0,0]=3 1998 B10R1.25 c1cc(c(cc1O)Br)C#N MB14756 [0,2,0,0,0,0|1,0,0]=3 1999 B10R1.25 c1cc(c(cc1O)Br)C=O MB25584 [0,2,0,0,0,0|1,0,0]=3 2000 B10R1.25 c1cc(c(cc1O)Cl)CN MB02722 [0,2,0,0,0,0|1,0,0]=3 2001 B10R1.25 c1cc(c(cc1O)F)C#N AB04647 [0,2,0,0,0,0|1,0,0]=3 2002 B10R1.25 c1cc(c(cc1O)F)CN MB02723 [0,2,0,0,0,0|1,0,0]=3 2003 B10R1.25 c1cc(c(cc1O)I)C#N MB14759 [0,2,0,0,0,0|1,0,0]=3 2004 B10R1.25 c1cc(c(cc1O)I)C=O MB25658 [0,2,0,0,0,0|1,0,0]=3 2005 B10R1.25 c1cc(c(cc1O)N)C#N MB14762 [0,2,0,0,0,0|1,0,0]=3 2006 B10R1.25 c1cc(c(cc1O)N)C=O MB38477 [0,2,0,0,0,0|1,0,0]=3 2007 B10R1.25 c1cc(c(cc1O)N)CN MB29325 [0,2,0,0,0,0|1,0,0]=3 2008 B10R1.25 c1cc(nc(c1C=O)O)Br AB84532 [0,2,0,0,0,0|2,0,0]=4 2009 B10R1.25 c1cc(nc(c1C=O)O)Cl AB84535 [0,2,0,0,0,0|2,0,0]=4 2010 B10R1.25 c1cc(nc(c1C=O)O)N AB84539 [0,2,0,0,0,0|2,0,0]=4 2011 B10R1.118 Cc1cc(c(cc1Cl)Cl)N CB11300 [0,2,0,0,0,0|2,0,0]=4 2012 B10R1.118 Cc1cc(c(cc1N)Cl)Br CB11038 [0,2,0,0,0,0|2,0,0]=4 2013 B10R1.118 c1c(c(cc(c1F)Cl)Cl)N AB16109 [0,2,0,0,0,0|2,0,0]=4 2014 B10R1.118 c1c(c(cc(c1I)Br)I)Br AB03145 [0,2,0,0,0,0|2,0,0]=4 2015 B8R1.7 B(c1ccco1)(O)O AB07247 [0,0,1,1,0,0|2,0,0]=4 2016 B8R1.7 c1c(ocn1)C(=O)O AB19293 [0,0,1,1,0,0|2,0,0]=4 2017 B8R1.7 c1cc(oc1)C(=N)N AB07706 [0,0,1,1,0,0|2,0,0]=4 2018 B8R1.7 c1coc(n1)C(=O)O AB19305 [0,0,1,1,0,0|2,0,0]=4 2019 B6R1.2 c1cc(oc1)Br AB04890 [1,0,0,0,1,0|2,0,0]=4 2020 B6R1.2 c1cc(sc1)N AB08372 [1,0,0,0,1,0|2,0,0]=4 2021 B6R1.2 c1ccn(c1)N PB33802 [1,0,0,0,1,0|2,0,0]=4 2022 B6R1.2 c1conc1O MB20248 [1,0,0,0,1,0|2,0,0]=4 2023 B6R1.2 c1csc(n1)O AB10887 [1,0,0,0,1,0|2,0,0]=4 2024 B6R1.2 c1cscc1N MB09694 [1,0,0,0,1,0|2,0,0]=4 2025 B6R1.2 c1cscc1N PB23357 [1,0,0,0,1,0|2,0,0]=4