0 B8R1.5 C1CC=C(C(=C1)O)Cl AB31829 [0,0,0,0,0,0|1,0,2]=3 1 B8R1.5 CC1C=CN=NC1=O PB32620 [0,0,0,0,0,0|2,0,2]=4 2 B8R1.5 Cc1c(cccn1)Br PB27472 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.5 Cc1c(cccn1)Cl AB17903 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.5 Cc1c(cccn1)F AB48604 [0,0,0,0,0,0|2,0,0]=2 5 B8R1.5 Cc1c(cccn1)N PB33695 [0,0,0,0,0,0|2,0,0]=2 6 B8R1.5 Cc1c(cccn1)O PB18442 [0,0,0,0,0,0|1,0,0]=1 7 B8R1.5 Cc1c(ccnn1)N MB11382 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.5 Cc1c(cncn1)Br PB26552 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.5 Cc1c(cncn1)N PB26435 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.5 Cc1c(nccn1)Br PB10597 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.5 Cc1c(nccn1)Cl PB18413 [0,0,0,0,0,0|3,0,0]=3 12 B8R1.5 Cc1c(nccn1)I PB26409 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.5 Cc1c(nccn1)N PB32667 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.5 Cc1c(nccn1)O PB12942 [0,0,0,0,0,0|2,0,0]=2 15 B8R1.5 Cc1cccnc1Br AB05448 [0,0,0,0,0,0|2,0,0]=2 16 B8R1.5 Cc1cccnc1Cl AB05179 [0,0,0,0,0,0|2,0,0]=2 17 B8R1.5 Cc1cccnc1N AB17908 [0,0,0,0,0,0|2,0,0]=2 18 B8R1.5 Cc1cccnc1O AB03538 [0,0,0,0,0,0|1,0,0]=1 19 B8R1.5 Cc1ccncc1Br AB03104 [0,0,0,0,0,0|2,0,0]=2 20 B8R1.5 Cc1ccncc1Cl AB18019 [0,0,0,0,0,0|2,0,0]=2 21 B8R1.5 Cc1ccncc1F AB18002 [0,0,0,0,0,0|2,0,0]=2 22 B8R1.5 Cc1ccncc1N PB14127 [0,0,0,0,0,0|2,0,0]=2 23 B8R1.5 Cc1ccncc1O PB23391 [0,0,0,0,0,0|1,0,0]=1 24 B8R1.5 Cc1ccnnc1Cl PB34304 [0,0,0,0,0,0|3,0,0]=3 25 B8R1.5 Cc1ccnnc1N MB06298 [0,0,0,0,0,0|3,0,0]=3 26 B8R1.5 Cc1cnccc1Br AB20846 [0,0,0,0,0,0|2,0,0]=2 27 B8R1.5 Cc1cnccc1Br PB23248 [0,0,0,0,0,0|2,0,0]=2 28 B8R1.5 Cc1cnccc1Cl AB11511 [0,0,0,0,0,0|2,0,0]=2 29 B8R1.5 Cc1cnccc1F AB18013 [0,0,0,0,0,0|2,0,0]=2 30 B8R1.5 Cc1cnccc1N PB17234 [0,0,0,0,0,0|2,0,0]=2 31 B8R1.5 Cc1cncnc1Cl AB44072 [0,0,0,0,0,0|3,0,0]=3 32 B8R1.5 Cc1cncnc1N AB54983 [0,0,0,0,0,0|3,0,0]=3 33 B8R1.5 Cc1cncnc1O AB09558 [0,0,0,0,0,0|2,0,0]=2 34 B8R1.5 Cc1cnncc1N MB11384 [0,0,0,0,0,0|3,0,0]=3 35 B8R1.5 c1c(c(ncn1)Br)N MB08406 [0,0,0,0,0,0|4,0,0]=4 36 B8R1.5 c1c(c(ncn1)Cl)Br PB14722 [0,0,0,0,0,0|4,0,0]=4 37 B8R1.5 c1c(c(ncn1)Cl)Cl PB28007 [0,0,0,0,0,0|4,0,0]=4 38 B8R1.5 c1c(c(ncn1)Cl)F AB51357 [0,0,0,0,0,0|4,0,0]=4 39 B8R1.5 c1c(c(ncn1)Cl)I PB23589 [0,0,0,0,0,0|4,0,0]=4 40 B8R1.5 c1c(c(ncn1)I)Br PB11068 [0,0,0,0,0,0|4,0,0]=4 41 B8R1.5 c1c(c(ncn1)N)Br MB00976 [0,0,0,0,0,0|4,0,0]=4 42 B8R1.5 c1c(c(ncn1)N)N AB00594 [0,0,0,0,0,0|4,0,0]=4 43 B8R1.5 c1c(c(ncn1)O)Br PB32183 [0,0,0,0,0,0|3,0,0]=3 44 B8R1.5 c1c(c(ncn1)O)Cl PB14718 [0,0,0,0,0,0|3,0,0]=3 45 B8R1.5 c1c(c(ncn1)O)I PB34035 [0,0,0,0,0,0|3,0,0]=3 46 B8R1.5 c1cc(c(nc1)Br)Br AB05083 [0,0,0,0,0,0|3,0,0]=3 47 B8R1.5 c1cc(c(nc1)Br)Cl AB17348 [0,0,0,0,0,0|3,0,0]=3 48 B8R1.5 c1cc(c(nc1)Br)F PB14380 [0,0,0,0,0,0|3,0,0]=3 49 B8R1.5 c1cc(c(nc1)Br)I MB06974 [0,0,0,0,0,0|3,0,0]=3 50 B8R1.5 c1cc(c(nc1)Br)N AB17900 [0,0,0,0,0,0|3,0,0]=3 51 B8R1.5 c1cc(c(nc1)Br)N PB26005 [0,0,0,0,0,0|3,0,0]=3 52 B8R1.5 c1cc(c(nc1)Br)O PB28951 [0,0,0,0,0,0|2,0,0]=2 53 B8R1.5 c1cc(c(nc1)Cl)Br PB33875 [0,0,0,0,0,0|3,0,0]=3 54 B8R1.5 c1cc(c(nc1)Cl)Cl AB00641 [0,0,0,0,0,0|3,0,0]=3 55 B8R1.5 c1cc(c(nc1)Cl)F AB13662 [0,0,0,0,0,0|3,0,0]=3 56 B8R1.5 c1cc(c(nc1)Cl)I AB06631 [0,0,0,0,0,0|3,0,0]=3 57 B8R1.5 c1cc(c(nc1)Cl)N PB23167 [0,0,0,0,0,0|3,0,0]=3 58 B8R1.5 c1cc(c(nc1)Cl)O PB21615 [0,0,0,0,0,0|2,0,0]=2 59 B8R1.5 c1cc(c(nc1)F)I AB13652 [0,0,0,0,0,0|3,0,0]=3 60 B8R1.5 c1cc(c(nc1)F)N AB17917 [0,0,0,0,0,0|3,0,0]=3 61 B8R1.5 c1cc(c(nc1)I)Br AB45745 [0,0,0,0,0,0|3,0,0]=3 62 B8R1.5 c1cc(c(nc1)I)F AB13656 [0,0,0,0,0,0|3,0,0]=3 63 B8R1.5 c1cc(c(nc1)I)I AB25846 [0,0,0,0,0,0|3,0,0]=3 64 B8R1.5 c1cc(c(nc1)I)O MB00322 [0,0,0,0,0,0|2,0,0]=2 65 B8R1.5 c1cc(c(nc1)N)Br PB20016 [0,0,0,0,0,0|3,0,0]=3 66 B8R1.5 c1cc(c(nc1)N)Cl AB15555 [0,0,0,0,0,0|3,0,0]=3 67 B8R1.5 c1cc(c(nc1)N)F AB17912 [0,0,0,0,0,0|3,0,0]=3 68 B8R1.5 c1cc(c(nc1)N)I PB12756 [0,0,0,0,0,0|3,0,0]=3 69 B8R1.5 c1cc(c(nc1)N)O AB00700 [0,0,0,0,0,0|2,0,0]=2 70 B8R1.5 c1cc(c(nc1)N)O AB17906 [0,0,0,0,0,0|2,0,0]=2 71 B8R1.5 c1cc(c(nc1)N)S AB64540 [0,0,0,0,0,0|2,1,0]=3 72 B8R1.5 c1cc(c(nc1)O)Br PB12284 [0,0,0,0,0,0|2,0,0]=2 73 B8R1.5 c1cc(c(nc1)O)F AB13427 [0,0,0,0,0,0|2,0,0]=2 74 B8R1.5 c1cc(c(nc1)O)I AB53303 [0,0,0,0,0,0|2,0,0]=2 75 B8R1.5 c1cc(c(nc1)O)N PB30752 [0,0,0,0,0,0|2,0,0]=2 76 B8R1.5 c1cc[n+](c(c1)S)[O-] AB00615 [0,0,0,0,0,0|2,0,1]=3 77 B8R1.5 c1cn[nH]c(=O)c1Cl PB31005 [0,0,0,0,0,0|3,0,1]=4 78 B8R1.5 c1cnc(c(n1)Cl)Cl PB15620 [0,0,0,0,0,0|4,0,0]=4 79 B8R1.5 c1cnc(c(n1)N)Br MB08183 [0,0,0,0,0,0|4,0,0]=4 80 B8R1.5 c1cnc(c(n1)N)Cl PB24841 [0,0,0,0,0,0|4,0,0]=4 81 B8R1.5 c1cnc(c(n1)N)N PB10452 [0,0,0,0,0,0|4,0,0]=4 82 B8R1.5 c1cncc(c1Br)Br AB05087 [0,0,0,0,0,0|3,0,0]=3 83 B8R1.5 c1cncc(c1Br)Cl AB17643 [0,0,0,0,0,0|3,0,0]=3 84 B8R1.5 c1cncc(c1Br)F PB23387 [0,0,0,0,0,0|3,0,0]=3 85 B8R1.5 c1cncc(c1Br)N AB17638 [0,0,0,0,0,0|3,0,0]=3 86 B8R1.5 c1cncc(c1Br)O AB13187 [0,0,0,0,0,0|2,0,0]=2 87 B8R1.5 c1cncc(c1Cl)Br AB05074 [0,0,0,0,0,0|3,0,0]=3 88 B8R1.5 c1cncc(c1Cl)Cl AB10192 [0,0,0,0,0,0|3,0,0]=3 89 B8R1.5 c1cncc(c1Cl)F AB15511 [0,0,0,0,0,0|3,0,0]=3 90 B8R1.5 c1cncc(c1Cl)I AB05089 [0,0,0,0,0,0|3,0,0]=3 91 B8R1.5 c1cncc(c1Cl)N AB05299 [0,0,0,0,0,0|3,0,0]=3 92 B8R1.5 c1cncc(c1Cl)O AB12281 [0,0,0,0,0,0|2,0,0]=2 93 B8R1.5 c1cncc(c1F)Br AB17892 [0,0,0,0,0,0|3,0,0]=3 94 B8R1.5 c1cncc(c1F)Cl AB21349 [0,0,0,0,0,0|3,0,0]=3 95 B8R1.5 c1cncc(c1F)F AB18023 [0,0,0,0,0,0|3,0,0]=3 96 B8R1.5 c1cncc(c1F)N AB50028 [0,0,0,0,0,0|3,0,0]=3 97 B8R1.5 c1cncc(c1F)O AB64515 [0,0,0,0,0,0|2,0,0]=2 98 B8R1.5 c1cncc(c1I)F PB21191 [0,0,0,0,0,0|3,0,0]=3 99 B8R1.5 c1cncc(c1I)N PB23406 [0,0,0,0,0,0|3,0,0]=3 100 B8R1.5 c1cncc(c1I)O MB06807 [0,0,0,0,0,0|2,0,0]=2 101 B8R1.5 c1cncc(c1N)Br AB28611 [0,0,0,0,0,0|3,0,0]=3 102 B8R1.5 c1cncc(c1N)Cl AB16891 [0,0,0,0,0,0|3,0,0]=3 103 B8R1.5 c1cncc(c1N)F PB33879 [0,0,0,0,0,0|3,0,0]=3 104 B8R1.5 c1cncc(c1N)I AB12095 [0,0,0,0,0,0|3,0,0]=3 105 B8R1.5 c1cncc(c1O)Br AB09574 [0,0,0,0,0,0|2,0,0]=2 106 B8R1.5 c1cncc(c1O)F AB18011 [0,0,0,0,0,0|2,0,0]=2 107 B8R1.5 c1cnnc(c1Br)Cl AB77054 [0,0,0,0,0,0|4,0,0]=4 108 B8R1.5 c1cnnc(c1Br)O AB77052 [0,0,0,0,0,0|3,0,0]=3 109 B8R1.5 c1cnnc(c1Cl)Cl PB30392 [0,0,0,0,0,0|4,0,0]=4 110 B7R1.3 Cc1cccnn1 PB33649 [1,0,0,0,0,0|2,0,0]=3 111 B7R1.3 Cc1ccncn1 PB17038 [1,0,0,0,0,0|2,0,0]=3 112 B7R1.3 Cc1ccnnc1 PB24546 [1,0,0,0,0,0|2,0,0]=3 113 B7R1.3 Cc1nccnn1 AB55984 [1,0,0,0,0,0|3,0,0]=4 114 B7R1.3 c1c(cncn1)Br PB28945 [1,0,0,0,0,0|3,0,0]=4 115 B7R1.3 c1c(cncn1)Cl AB16528 [1,0,0,0,0,0|3,0,0]=4 116 B7R1.3 c1c(cncn1)N PB12745 [1,0,0,0,0,0|3,0,0]=4 117 B7R1.3 c1c(cncn1)O PB27730 [1,0,0,0,0,0|2,0,0]=3 118 B7R1.3 c1cc(cnc1)Br AB00739 [1,0,0,0,0,0|2,0,0]=3 119 B7R1.3 c1cc(cnc1)I AB01382 [1,0,0,0,0,0|2,0,0]=3 120 B7R1.3 c1cc(cnc1)[O-] MB00567 [1,0,0,0,0,0|1,0,1]=3 121 B7R1.3 c1cc(nnc1)Br MB08580 [1,0,0,0,0,0|3,0,0]=4 122 B7R1.3 c1cc(nnc1)Cl AB30021 [1,0,0,0,0,0|3,0,0]=4 123 B7R1.3 c1cc(nnc1)Cl PB34726 [1,0,0,0,0,0|3,0,0]=4 124 B7R1.3 c1cc(nnc1)N PB17217 [1,0,0,0,0,0|3,0,0]=4 125 B7R1.3 c1cc(nnc1)O PB32258 [1,0,0,0,0,0|2,0,0]=3 126 B7R1.3 c1ccnc(c1)Br AB00627 [1,0,0,0,0,0|2,0,0]=3 127 B7R1.3 c1cnc(cn1)Br MB06072 [1,0,0,0,0,0|3,0,0]=4 128 B7R1.3 c1cnc(cn1)I AB08841 [1,0,0,0,0,0|3,0,0]=4 129 B7R1.3 c1cnc(cn1)N PB30528 [1,0,0,0,0,0|3,0,0]=4 130 B7R1.3 c1cnc(cn1)O AB05056 [1,0,0,0,0,0|2,0,0]=3 131 B7R1.3 c1cnc(nc1)Cl AB00572 [1,0,0,0,0,0|3,0,0]=4 132 B7R1.3 c1cnc(nc1)N MB00175 [1,0,0,0,0,0|3,0,0]=4 133 B7R1.3 c1cnccc1Br AB05093 [1,0,0,0,0,0|2,0,0]=3 134 B7R1.3 c1cnccc1I AB10861 [1,0,0,0,0,0|2,0,0]=3 135 B7R1.3 c1cnccc1O PB17041 [1,0,0,0,0,0|1,0,0]=2 136 B7R1.3 c1cncnc1Br PB10690 [1,0,0,0,0,0|3,0,0]=4 137 B7R1.3 c1cncnc1Cl AB43600 [1,0,0,0,0,0|3,0,0]=4 138 B7R1.3 c1cncnc1Cl PB13479 [1,0,0,0,0,0|3,0,0]=4 139 B7R1.3 c1cncnc1N PB11581 [1,0,0,0,0,0|3,0,0]=4 140 B7R1.3 c1cncnc1O PB32093 [1,0,0,0,0,0|2,0,0]=3 141 B7R1.3 c1cnncc1Br AB48350 [1,0,0,0,0,0|3,0,0]=4 142 B7R1.3 c1cnncc1Cl AB50535 [1,0,0,0,0,0|3,0,0]=4 143 B7R1.3 c1cnncc1I AB70137 [1,0,0,0,0,0|3,0,0]=4 144 B7R1.3 c1cnncc1N PB29051 [1,0,0,0,0,0|3,0,0]=4 145 B7R1.3 c1cnncc1N PB39062 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.3 Cc1c(c(ccn1)Br)Cl AB63983 [0,1,0,0,0,0|2,0,0]=3 147 B9R1.3 Cc1c(c(ccn1)Cl)Br AB63984 [0,1,0,0,0,0|2,0,0]=3 148 B9R1.3 Cc1c(c(ccn1)Cl)Cl AB53567 [0,1,0,0,0,0|2,0,0]=3 149 B9R1.3 Cc1c(c(ccn1)Cl)N AB70877 [0,1,0,0,0,0|2,0,0]=3 150 B9R1.3 Cc1c(c(ccn1)Cl)O AB71205 [0,1,0,0,0,0|1,0,0]=2 151 B9R1.3 Cc1c(c(ccn1)F)Br AB71088 [0,1,0,0,0,0|2,0,0]=3 152 B9R1.3 Cc1c(c(ccn1)F)N AB70905 [0,1,0,0,0,0|2,0,0]=3 153 B9R1.3 Cc1c(c(ccn1)F)O AB71324 [0,1,0,0,0,0|1,0,0]=2 154 B9R1.3 Cc1c(c(ccn1)N)Cl AB51074 [0,1,0,0,0,0|2,0,0]=3 155 B9R1.3 Cc1c(c(ccn1)N)N AB55860 [0,1,0,0,0,0|2,0,0]=3 156 B9R1.3 Cc1c(c(ccn1)O)Cl AB71193 [0,1,0,0,0,0|2,0,0]=3 157 B9R1.3 Cc1c(c(ncn1)C)Br PB26303 [0,1,0,0,0,0|3,0,0]=4 158 B9R1.3 Cc1c(c(ncn1)Cl)Cl AB54870 [0,1,0,0,0,0|3,0,0]=4 159 B9R1.3 Cc1c(c(ncn1)N)Cl AB53379 [0,1,0,0,0,0|3,0,0]=4 160 B9R1.3 Cc1c(c(ncn1)O)Br AB09553 [0,1,0,0,0,0|3,0,0]=4 161 B9R1.3 Cc1c(c(ncn1)O)Cl AB05118 [0,1,0,0,0,0|3,0,0]=4 162 B9R1.3 Cc1c(cccc1Br)O MB09253 [0,1,0,0,0,0|0,0,0]=1 163 B9R1.3 Cc1c(cccc1I)O MB23347 [0,1,0,0,0,0|0,0,0]=1 164 B9R1.3 Cc1c(ccnc1Br)Cl AB71053 [0,1,0,0,0,0|2,0,0]=3 165 B9R1.3 Cc1c(ccnc1Br)F AB71081 [0,1,0,0,0,0|2,0,0]=3 166 B9R1.3 Cc1c(ccnc1Cl)Br AB53555 [0,1,0,0,0,0|2,0,0]=3 167 B9R1.3 Cc1c(ccnc1Cl)I AB13660 [0,1,0,0,0,0|2,0,0]=3 168 B9R1.3 Cc1c(ccnc1Cl)N AB75729 [0,1,0,0,0,0|2,0,0]=3 169 B9R1.3 Cc1c(ccnc1Cl)O AB71179 [0,1,0,0,0,0|1,0,0]=2 170 B9R1.3 Cc1c(ccnc1F)Br AB53559 [0,1,0,0,0,0|2,0,0]=3 171 B9R1.3 Cc1c(ccnc1F)N AB82851 [0,1,0,0,0,0|2,0,0]=3 172 B9R1.3 Cc1c(ccnc1F)O AB71301 [0,1,0,0,0,0|1,0,0]=2 173 B9R1.3 Cc1c(ccnc1N)Cl AB70874 [0,1,0,0,0,0|2,0,0]=3 174 B9R1.3 Cc1c(ccnc1N)F AB70896 [0,1,0,0,0,0|2,0,0]=3 175 B9R1.3 Cc1c(ccnc1O)Cl AB71198 [0,1,0,0,0,0|1,0,0]=2 176 B9R1.3 Cc1c(ccnc1O)F AB71318 [0,1,0,0,0,0|1,0,0]=2 177 B9R1.3 Cc1c(cncc1Br)Br AB03597 [0,1,0,0,0,0|2,0,0]=3 178 B9R1.3 Cc1c(cncc1Br)Cl AB75733 [0,1,0,0,0,0|2,0,0]=3 179 B9R1.3 Cc1c(cncc1Br)F AB74995 [0,1,0,0,0,0|2,0,0]=3 180 B9R1.3 Cc1c(cncc1Br)N AB42002 [0,1,0,0,0,0|2,0,0]=3 181 B9R1.3 Cc1c(cncc1Cl)N AB41999 [0,1,0,0,0,0|2,0,0]=3 182 B9R1.3 Cc1c(cncc1Cl)O AB70586 [0,1,0,0,0,0|1,0,0]=2 183 B9R1.3 Cc1c(nccc1Br)C AB74548 [0,1,0,0,0,0|2,0,0]=3 184 B9R1.3 Cc1c(nccc1Cl)C AB72126 [0,1,0,0,0,0|2,0,0]=3 185 B9R1.3 Cc1c(nccc1N)C AB01511 [0,1,0,0,0,0|2,0,0]=3 186 B9R1.3 Cc1c(nccc1O)C AB75493 [0,1,0,0,0,0|1,0,0]=2 187 B9R1.3 Cc1c(ncnc1Cl)C AB54898 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.3 Cc1c(ncnc1N)C AB54984 [0,1,0,0,0,0|3,0,0]=4 189 B9R1.3 Cc1c(ncnc1O)C AB05196 [0,1,0,0,0,0|2,0,0]=3 190 B9R1.3 Cc1cccc(c1Br)O MB08359 [0,1,0,0,0,0|1,0,0]=2 191 B9R1.3 Cc1cccc(c1Cl)O MB00390 [0,1,0,0,0,0|1,0,0]=2 192 B9R1.3 Cc1cccc(c1F)N AB25121 [0,1,0,0,0,0|1,0,0]=2 193 B9R1.3 Cc1cccc(c1I)O MB23494 [0,1,0,0,0,0|1,0,0]=2 194 B9R1.3 Cc1cccc(c1N)Br MB03160 [0,1,0,0,0,0|1,0,0]=2 195 B9R1.3 Cc1cccc(c1N)F MB03934 [0,1,0,0,0,0|1,0,0]=2 196 B9R1.3 Cc1cccc(c1O)F MB11516 [0,1,0,0,0,0|0,0,0]=1 197 B9R1.3 Cc1cccc(c1O)I MB23471 [0,1,0,0,0,0|0,0,0]=1 198 B9R1.3 Cc1cccc(c1O)N MB02950 [0,1,0,0,0,0|0,0,0]=1 199 B9R1.3 Cc1ccnc(c1Br)C AB53712 [0,1,0,0,0,0|2,0,0]=3 200 B9R1.3 Cc1ccnc(c1Br)Cl PB21837 [0,1,0,0,0,0|2,0,0]=3 201 B9R1.3 Cc1ccnc(c1Br)F AB44900 [0,1,0,0,0,0|2,0,0]=3 202 B9R1.3 Cc1ccnc(c1C)Br AB25365 [0,1,0,0,0,0|2,0,0]=3 203 B9R1.3 Cc1ccnc(c1C)N AB11611 [0,1,0,0,0,0|2,0,0]=3 204 B9R1.3 Cc1ccnc(c1C)O AB66577 [0,1,0,0,0,0|1,0,0]=2 205 B9R1.3 Cc1ccnc(c1Cl)Br AB44895 [0,1,0,0,0,0|2,0,0]=3 206 B9R1.3 Cc1ccnc(c1Cl)N AB53535 [0,1,0,0,0,0|2,0,0]=3 207 B9R1.3 Cc1ccnc(c1Cl)O AB71192 [0,1,0,0,0,0|2,0,0]=3 208 B9R1.3 Cc1ccnc(c1N)Br AB17559 [0,1,0,0,0,0|2,0,0]=3 209 B9R1.3 Cc1ccnc(c1N)C AB43810 [0,1,0,0,0,0|2,0,0]=3 210 B9R1.3 Cc1ccnc(c1N)Cl PB21708 [0,1,0,0,0,0|2,0,0]=3 211 B9R1.3 Cc1ccnc(c1N)F AB17625 [0,1,0,0,0,0|2,0,0]=3 212 B9R1.3 Cc1ccnc(c1N)N PB32179 [0,1,0,0,0,0|2,0,0]=3 213 B9R1.3 Cc1ccnc(c1O)C AB43831 [0,1,0,0,0,0|1,0,0]=2 214 B9R1.3 Cc1ccnc(c1O)Cl AB17632 [0,1,0,0,0,0|1,0,0]=2 215 B9R1.3 Cc1ccnc(c1O)F AB71297 [0,1,0,0,0,0|1,0,0]=2 216 B9R1.3 Cc1cncc(c1Br)C AB53717 [0,1,0,0,0,0|2,0,0]=3 217 B9R1.3 Cc1cncc(c1Br)Cl AB74973 [0,1,0,0,0,0|2,0,0]=3 218 B9R1.3 Cc1cncc(c1Br)F AB74996 [0,1,0,0,0,0|2,0,0]=3 219 B9R1.3 Cc1cncc(c1C)Br AB64494 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.3 Cc1cncc(c1C)N AB76783 [0,1,0,0,0,0|2,0,0]=3 221 B9R1.3 Cc1cncc(c1C)O AB65620 [0,1,0,0,0,0|1,0,0]=2 222 B9R1.3 Cc1cncc(c1Cl)Br AB75732 [0,1,0,0,0,0|2,0,0]=3 223 B9R1.3 Cc1cncc(c1Cl)C AB50483 [0,1,0,0,0,0|2,0,0]=3 224 B9R1.3 Cc1cncc(c1Cl)N AB75728 [0,1,0,0,0,0|2,0,0]=3 225 B9R1.3 Cc1cncc(c1Cl)O AB71654 [0,1,0,0,0,0|2,0,0]=3 226 B9R1.3 Cc1cncc(c1F)Br AB74994 [0,1,0,0,0,0|2,0,0]=3 227 B9R1.3 Cc1cncc(c1F)N AB66587 [0,1,0,0,0,0|2,0,0]=3 228 B9R1.3 Cc1cncc(c1F)O AB82936 [0,1,0,0,0,0|2,0,0]=3 229 B9R1.3 Cc1cncc(c1N)C AB14443 [0,1,0,0,0,0|2,0,0]=3 230 B9R1.3 Cc1cncc(c1N)Cl AB44879 [0,1,0,0,0,0|2,0,0]=3 231 B9R1.3 Cc1cncc(c1N)F AB75360 [0,1,0,0,0,0|2,0,0]=3 232 B9R1.3 Cc1cncc(c1N)N AB60255 [0,1,0,0,0,0|2,0,0]=3 233 B9R1.3 Cc1cncc(c1O)C AB82550 [0,1,0,0,0,0|1,0,0]=2 234 B9R1.3 Cc1cncc(c1O)Cl AB75744 [0,1,0,0,0,0|1,0,0]=2 235 B9R1.3 Cc1cncc(c1O)F AB25961 [0,1,0,0,0,0|1,0,0]=2 236 B9R1.3 Cn1c(=O)cccc1Br MB01001 [0,1,0,0,0,0|1,0,1]=3 237 B9R1.3 Cn1c(ccnc1=O)Cl MB19859 [0,1,0,0,0,0|2,0,1]=4 238 B9R1.3 Cn1ccc[n+](c1=O)C AB09988 [0,1,0,0,0,0|2,0,1]=4 239 B9R1.3 Cn1cccc(c1=O)Br PB32951 [0,1,0,0,0,0|1,0,1]=3 240 B9R1.3 Cn1cccc(c1=O)N PB15071 [0,1,0,0,0,0|1,0,1]=3 241 B9R1.3 c1c(c(c(cn1)Br)Cl)Br PB24627 [0,1,0,0,0,0|3,0,0]=4 242 B9R1.3 c1c(c(c(cn1)Br)Cl)F AB74956 [0,1,0,0,0,0|3,0,0]=4 243 B9R1.3 c1c(c(c(cn1)Br)Cl)N AB66381 [0,1,0,0,0,0|3,0,0]=4 244 B9R1.3 c1c(c(c(cn1)Br)Cl)O AB74970 [0,1,0,0,0,0|2,0,0]=3 245 B9R1.3 c1c(c(c(cn1)Br)F)Cl AB82965 [0,1,0,0,0,0|3,0,0]=4 246 B9R1.3 c1c(c(c(cn1)Br)N)Cl AB56437 [0,1,0,0,0,0|3,0,0]=4 247 B9R1.3 c1c(c(c(cn1)Br)O)Cl AB66732 [0,1,0,0,0,0|2,0,0]=3 248 B9R1.3 c1c(c(c(cn1)Br)O)N AB48393 [0,1,0,0,0,0|2,0,0]=3 249 B9R1.3 c1c(c(c(cn1)Cl)Br)Cl MB04163 [0,1,0,0,0,0|3,0,0]=4 250 B9R1.3 c1c(c(c(cn1)Cl)Br)F AB70924 [0,1,0,0,0,0|3,0,0]=4 251 B9R1.3 c1c(c(c(cn1)Cl)Cl)N AB55065 [0,1,0,0,0,0|3,0,0]=4 252 B9R1.3 c1c(c(c(cn1)Cl)F)N AB75054 [0,1,0,0,0,0|3,0,0]=4 253 B9R1.3 c1c(c(c(cn1)Cl)F)O AB82968 [0,1,0,0,0,0|2,0,0]=3 254 B9R1.3 c1c(c(c(cn1)Cl)I)Cl CB10652 [0,1,0,0,0,0|3,0,0]=4 255 B9R1.3 c1c(c(c(cn1)Cl)N)Cl AB03509 [0,1,0,0,0,0|3,0,0]=4 256 B9R1.3 c1c(c(c(cn1)Cl)N)F AB70854 [0,1,0,0,0,0|3,0,0]=4 257 B9R1.3 c1c(c(c(cn1)Cl)N)N AB50200 [0,1,0,0,0,0|3,0,0]=4 258 B9R1.3 c1c(c(c(cn1)Cl)N)O AB83899 [0,1,0,0,0,0|2,0,0]=3 259 B9R1.3 c1c(c(c(cn1)Cl)O)Cl AB02053 [0,1,0,0,0,0|2,0,0]=3 260 B9R1.3 c1c(c(c(cn1)Cl)O)F AB66744 [0,1,0,0,0,0|2,0,0]=3 261 B9R1.3 c1c(c(c(cn1)Cl)O)N AB84022 [0,1,0,0,0,0|2,0,0]=3 262 B9R1.3 c1c(c(c(cn1)Cl)O)O AB84021 [0,1,0,0,0,0|2,0,0]=3 263 B9R1.3 c1c(c(c(cn1)F)Cl)N AB83146 [0,1,0,0,0,0|3,0,0]=4 264 B9R1.3 c1c(c(c(cn1)F)Cl)O AB83144 [0,1,0,0,0,0|2,0,0]=3 265 B9R1.3 c1c(c(c(cn1)F)N)F AB10209 [0,1,0,0,0,0|3,0,0]=4 266 B9R1.3 c1c(c(c(cn1)N)Cl)N AB71544 [0,1,0,0,0,0|3,0,0]=4 267 B9R1.3 c1c(c(c(cn1)O)Cl)N AB83874 [0,1,0,0,0,0|2,0,0]=3 268 B9R1.3 c1c(c(c(cn1)O)Cl)O AB83993 [0,1,0,0,0,0|2,0,0]=3 269 B9R1.3 c1cc(c(c(c1)Br)Br)O MB05354 [0,1,0,0,0,0|1,0,0]=2 270 B9R1.3 c1cc(c(c(c1)Br)Cl)Br CB11700 [0,1,0,0,0,0|2,0,0]=3 271 B9R1.3 c1cc(c(c(c1)Br)I)O MB05341 [0,1,0,0,0,0|1,0,0]=2 272 B9R1.3 c1cc(c(c(c1)Br)O)Cl MB08152 [0,1,0,0,0,0|1,0,0]=2 273 B9R1.3 c1cc(c(c(c1)Br)O)N AB44905 [0,1,0,0,0,0|1,0,0]=2 274 B9R1.3 c1cc(c(c(c1)Cl)Br)N MB08909 [0,1,0,0,0,0|2,0,0]=3 275 B9R1.3 c1cc(c(c(c1)Cl)Br)O MB03079 [0,1,0,0,0,0|1,0,0]=2 276 B9R1.3 c1cc(c(c(c1)Cl)I)N AB28280 [0,1,0,0,0,0|2,0,0]=3 277 B9R1.3 c1cc(c(c(c1)Cl)I)O MB05351 [0,1,0,0,0,0|1,0,0]=2 278 B9R1.3 c1cc(c(c(c1)Cl)N)N AB54530 [0,1,0,0,0,0|2,0,0]=3 279 B9R1.3 c1cc(c(c(c1)Cl)N)O MB10127 [0,1,0,0,0,0|1,0,0]=2 280 B9R1.3 c1cc(c(c(c1)F)Br)O MB03082 [0,1,0,0,0,0|1,0,0]=2 281 B9R1.3 c1cc(c(c(c1)F)Cl)N AB14054 [0,1,0,0,0,0|2,0,0]=3 282 B9R1.3 c1cc(c(c(c1)F)Cl)O MB05350 [0,1,0,0,0,0|1,0,0]=2 283 B9R1.3 c1cc(c(c(c1)F)I)O MB05358 [0,1,0,0,0,0|1,0,0]=2 284 B9R1.3 c1cc(c(c(c1)F)N)N MB00506 [0,1,0,0,0,0|2,0,0]=3 285 B9R1.3 c1cc(c(c(c1)F)O)N AB45742 [0,1,0,0,0,0|1,0,0]=2 286 B9R1.3 c1cc(c(c(c1)I)Br)F MB07001 [0,1,0,0,0,0|2,0,0]=3 287 B9R1.3 c1cc(c(c(c1)I)Br)O MB05348 [0,1,0,0,0,0|1,0,0]=2 288 B9R1.3 c1cc(c(c(c1)I)Cl)O MB05352 [0,1,0,0,0,0|1,0,0]=2 289 B9R1.3 c1cc(c(c(c1)I)F)O MB12056 [0,1,0,0,0,0|1,0,0]=2 290 B9R1.3 c1cc(c(c(c1)I)I)O MB05357 [0,1,0,0,0,0|1,0,0]=2 291 B9R1.3 c1cc(c(c(c1)I)N)O MB03004 [0,1,0,0,0,0|1,0,0]=2 292 B9R1.3 c1cc(c(c(c1)I)O)Br MB25662 [0,1,0,0,0,0|1,0,0]=2 293 B9R1.3 c1cc(c(c(c1)I)O)Cl MB14795 [0,1,0,0,0,0|1,0,0]=2 294 B9R1.3 c1cc(c(c(c1)I)O)F MB05032 [0,1,0,0,0,0|1,0,0]=2 295 B9R1.3 c1cc(c(c(c1)I)O)I MB25505 [0,1,0,0,0,0|1,0,0]=2 296 B9R1.3 c1cc(c(c(c1)I)O)N MB35855 [0,1,0,0,0,0|1,0,0]=2 297 B9R1.3 c1cc(c(c(c1)N)O)N MB01221 [0,1,0,0,0,0|1,0,0]=2 298 B9R1.3 c1cc(c(c(c1)O)Br)N MB10095 [0,1,0,0,0,0|1,0,0]=2 299 B9R1.3 c1cc(c(c(c1)O)Cl)N MB09140 [0,1,0,0,0,0|1,0,0]=2 300 B9R1.3 c1cc(c(c(c1)O)F)N MB25684 [0,1,0,0,0,0|1,0,0]=2 301 B9R1.3 c1cc(c(c(c1)O)I)N MB09919 [0,1,0,0,0,0|1,0,0]=2 302 B9R1.3 c1cnc(c(c1Br)Cl)F AB62814 [0,1,0,0,0,0|3,0,0]=4 303 B9R1.3 c1cnc(c(c1Br)Cl)N AB70625 [0,1,0,0,0,0|3,0,0]=4 304 B9R1.3 c1cnc(c(c1Br)Cl)O AB70927 [0,1,0,0,0,0|2,0,0]=3 305 B9R1.3 c1cnc(c(c1Br)F)Cl AB70923 [0,1,0,0,0,0|3,0,0]=4 306 B9R1.3 c1cnc(c(c1Br)N)Cl AB76588 [0,1,0,0,0,0|3,0,0]=4 307 B9R1.3 c1cnc(c(c1Br)N)N PB33239 [0,1,0,0,0,0|3,0,0]=4 308 B9R1.3 c1cnc(c(c1Br)O)Cl AB70925 [0,1,0,0,0,0|2,0,0]=3 309 B9R1.3 c1cnc(c(c1Cl)Br)F AB74960 [0,1,0,0,0,0|3,0,0]=4 310 B9R1.3 c1cnc(c(c1Cl)Cl)N AB44396 [0,1,0,0,0,0|3,0,0]=4 311 B9R1.3 c1cnc(c(c1Cl)Cl)O AB71282 [0,1,0,0,0,0|2,0,0]=3 312 B9R1.3 c1cnc(c(c1Cl)F)Br AB74959 [0,1,0,0,0,0|3,0,0]=4 313 B9R1.3 c1cnc(c(c1Cl)F)N AB83135 [0,1,0,0,0,0|3,0,0]=4 314 B9R1.3 c1cnc(c(c1Cl)F)O AB71156 [0,1,0,0,0,0|2,0,0]=3 315 B9R1.3 c1cnc(c(c1Cl)I)Cl CB11215 [0,1,0,0,0,0|3,0,0]=4 316 B9R1.3 c1cnc(c(c1Cl)I)N PB16074 [0,1,0,0,0,0|3,0,0]=4 317 B9R1.3 c1cnc(c(c1Cl)N)Br AB70423 [0,1,0,0,0,0|3,0,0]=4 318 B9R1.3 c1cnc(c(c1Cl)N)Cl AB51385 [0,1,0,0,0,0|3,0,0]=4 319 B9R1.3 c1cnc(c(c1Cl)N)F AB83198 [0,1,0,0,0,0|3,0,0]=4 320 B9R1.3 c1cnc(c(c1Cl)N)N PB28504 [0,1,0,0,0,0|3,0,0]=4 321 B9R1.3 c1cnc(c(c1Cl)N)O AB75026 [0,1,0,0,0,0|2,0,0]=3 322 B9R1.3 c1cnc(c(c1Cl)O)Br AB74968 [0,1,0,0,0,0|2,0,0]=3 323 B9R1.3 c1cnc(c(c1Cl)O)Cl AB70492 [0,1,0,0,0,0|2,0,0]=3 324 B9R1.3 c1cnc(c(c1Cl)O)F AB71148 [0,1,0,0,0,0|2,0,0]=3 325 B9R1.3 c1cnc(c(c1Cl)O)N AB53290 [0,1,0,0,0,0|2,0,0]=3 326 B9R1.3 c1cnc(c(c1Cl)O)O AB83983 [0,1,0,0,0,0|2,0,0]=3 327 B9R1.3 c1cnc(c(c1F)Cl)Br AB82998 [0,1,0,0,0,0|3,0,0]=4 328 B9R1.3 c1cnc(c(c1F)Cl)N AB83000 [0,1,0,0,0,0|3,0,0]=4 329 B9R1.3 c1cnc(c(c1F)Cl)O AB71146 [0,1,0,0,0,0|2,0,0]=3 330 B9R1.3 c1cnc(c(c1I)O)I MB09113 [0,1,0,0,0,0|2,0,0]=3 331 B9R1.3 c1cnc(c(c1N)Br)Cl PB34372 [0,1,0,0,0,0|3,0,0]=4 332 B9R1.3 c1cnc(c(c1N)Cl)Br AB09546 [0,1,0,0,0,0|3,0,0]=4 333 B9R1.3 c1cnc(c(c1N)Cl)Cl AB09580 [0,1,0,0,0,0|3,0,0]=4 334 B9R1.3 c1cnc(c(c1N)Cl)F AB70632 [0,1,0,0,0,0|3,0,0]=4 335 B9R1.3 c1cnc(c(c1N)Cl)N AB70628 [0,1,0,0,0,0|3,0,0]=4 336 B9R1.3 c1cnc(c(c1N)Cl)O AB51578 [0,1,0,0,0,0|2,0,0]=3 337 B9R1.3 c1cnc(c(c1N)F)Cl AB70858 [0,1,0,0,0,0|3,0,0]=4 338 B9R1.3 c1cnc(c(c1N)N)Br PB11027 [0,1,0,0,0,0|3,0,0]=4 339 B9R1.3 c1cnc(c(c1N)N)Cl PB12434 [0,1,0,0,0,0|3,0,0]=4 340 B9R1.3 c1cnc(c(c1N)N)F AB70620 [0,1,0,0,0,0|3,0,0]=4 341 B9R1.3 c1cnc(c(c1N)N)N AB52988 [0,1,0,0,0,0|3,0,0]=4 342 B9R1.3 c1cnc(c(c1N)O)Cl AB70863 [0,1,0,0,0,0|2,0,0]=3 343 B9R1.3 c1cnc(c(c1O)Cl)Br AB74964 [0,1,0,0,0,0|2,0,0]=3 344 B9R1.3 c1cnc(c(c1O)Cl)Cl AB71281 [0,1,0,0,0,0|2,0,0]=3 345 B9R1.3 c1cnc(c(c1O)Cl)F AB71141 [0,1,0,0,0,0|2,0,0]=3 346 B9R1.3 c1cnc(c(c1O)Cl)N AB74554 [0,1,0,0,0,0|2,0,0]=3 347 B9R1.3 c1cnc(c(c1O)Cl)O AB09579 [0,1,0,0,0,0|2,0,0]=3 348 B9R1.3 c1cnc(c(c1O)F)Cl AB69317 [0,1,0,0,0,0|2,0,0]=3 349 B9R1.3 c1cnc(c(c1O)N)Cl AB76250 [0,1,0,0,0,0|2,0,0]=3 350 B9R1.3 c1cnc(c(c1O)O)Cl AB70497 [0,1,0,0,0,0|2,0,0]=3 351 B9R1.3 c1nc(c(c(n1)Cl)Cl)O AB54896 [0,1,0,0,0,0|3,0,0]=4 352 B9R1.3 c1nc(c(c(n1)O)F)O PB25105 [0,1,0,0,0,0|3,0,0]=4 353 B9R1.3 c1nc(c(c(n1)O)I)N AB53178 [0,1,0,0,0,0|3,0,0]=4 354 B9R1.3 c1nc(c(c(n1)O)N)N MB00183 [0,1,0,0,0,0|3,0,0]=4 355 B9R1.15 C#Cc1ccccc1Br AB10375 [0,1,0,0,0,0|1,0,1]=3 356 B9R1.15 C#Cc1cccnc1Br AB69072 [0,1,0,0,0,0|2,0,1]=4 357 B9R1.15 C#Cc1cccnc1Cl AB69069 [0,1,0,0,0,0|2,0,1]=4 358 B9R1.15 C#Cc1cccnc1N AB66567 [0,1,0,0,0,0|2,0,1]=4 359 B9R1.15 C#Cc1cccnc1O AB69073 [0,1,0,0,0,0|1,0,1]=3 360 B9R1.15 C#Cc1ccncc1Cl AB69087 [0,1,0,0,0,0|2,0,1]=4 361 B9R1.15 C#Cc1ccncc1F AB69094 [0,1,0,0,0,0|2,0,1]=4 362 B9R1.15 C#Cc1ccncc1N AB69092 [0,1,0,0,0,0|2,0,1]=4 363 B9R1.15 C#Cc1cnccc1Br AB69055 [0,1,0,0,0,0|2,0,1]=4 364 B9R1.15 C#Cc1cnccc1Cl AB69058 [0,1,0,0,0,0|2,0,1]=4 365 B9R1.15 CCc1c(cccn1)Br AB68544 [0,1,0,0,0,0|2,0,0]=3 366 B9R1.15 CCc1c(cccn1)O MB01433 [0,1,0,0,0,0|1,0,0]=2 367 B9R1.15 CCc1c(cncn1)F PB21906 [0,1,0,0,0,0|3,0,0]=4 368 B9R1.15 CCc1ccncc1O MB12325 [0,1,0,0,0,0|1,0,0]=2 369 B9R1.15 CCc1cnccc1Br PB37149 [0,1,0,0,0,0|2,0,0]=3 370 B9R1.15 CCc1cnccc1O MB24095 [0,1,0,0,0,0|1,0,0]=2 371 B9R1.15 CCc1cncnc1Cl AB62552 [0,1,0,0,0,0|3,0,0]=4 372 B9R1.15 CNc1c(nccn1)Cl MB13992 [0,1,0,0,0,0|3,0,0]=4 373 B9R1.15 CNc1cccnc1Br AB39252 [0,1,0,0,0,0|2,0,0]=3 374 B9R1.15 CNc1ccncc1O MB27525 [0,1,0,0,0,0|1,0,0]=2 375 B9R1.15 CNc1cnccc1O MB29366 [0,1,0,0,0,0|1,0,0]=2 376 B9R1.15 CNc1cncnc1Cl AB65907 [0,1,0,0,0,0|3,0,0]=4 377 B9R1.15 COc1c(cccn1)Br PB20024 [0,1,0,0,0,0|2,0,0]=3 378 B9R1.15 COc1c(cccn1)Cl AB13603 [0,1,0,0,0,0|2,0,0]=3 379 B9R1.15 COc1c(cccn1)F AB13397 [0,1,0,0,0,0|2,0,0]=3 380 B9R1.15 COc1c(cccn1)I AB13400 [0,1,0,0,0,0|2,0,0]=3 381 B9R1.15 COc1c(cccn1)N AB07386 [0,1,0,0,0,0|2,0,0]=3 382 B9R1.15 COc1c(cccn1)O AB06074 [0,1,0,0,0,0|1,0,0]=2 383 B9R1.15 COc1c(nccn1)Cl MB02506 [0,1,0,0,0,0|3,0,0]=4 384 B9R1.15 COc1c(nccn1)N AB22450 [0,1,0,0,0,0|3,0,0]=4 385 B9R1.15 COc1cccnc1Br PB29151 [0,1,0,0,0,0|2,0,0]=3 386 B9R1.15 COc1cccnc1Cl AB14749 [0,1,0,0,0,0|2,0,0]=3 387 B9R1.15 COc1cccnc1I AB05182 [0,1,0,0,0,0|2,0,0]=3 388 B9R1.15 COc1cccnc1N AB40614 [0,1,0,0,0,0|2,0,0]=3 389 B9R1.15 COc1cccnc1O AB43293 [0,1,0,0,0,0|1,0,0]=2 390 B9R1.15 COc1ccncc1Br AB22230 [0,1,0,0,0,0|2,0,0]=3 391 B9R1.15 COc1ccncc1Cl AB51203 [0,1,0,0,0,0|2,0,0]=3 392 B9R1.15 COc1ccncc1F AB66775 [0,1,0,0,0,0|2,0,0]=3 393 B9R1.15 COc1ccncc1I AB09106 [0,1,0,0,0,0|2,0,0]=3 394 B9R1.15 COc1ccncc1N AB40817 [0,1,0,0,0,0|2,0,0]=3 395 B9R1.15 COc1ccncc1O MB09117 [0,1,0,0,0,0|1,0,0]=2 396 B9R1.15 COc1cnccc1Br AB43705 [0,1,0,0,0,0|2,0,0]=3 397 B9R1.15 COc1cnccc1Br MB09674 [0,1,0,0,0,0|2,0,0]=3 398 B9R1.15 COc1cnccc1Cl AB66368 [0,1,0,0,0,0|2,0,0]=3 399 B9R1.15 COc1cnccc1F AB66590 [0,1,0,0,0,0|2,0,0]=3 400 B9R1.15 COc1cnccc1N AB55709 [0,1,0,0,0,0|2,0,0]=3 401 B9R1.15 COc1cnccc1O MB25455 [0,1,0,0,0,0|1,0,0]=2 402 B9R1.15 CSc1c(cccn1)O MB01598 [0,1,0,0,0,0|1,0,0]=2 403 B9R1.15 CSc1cccnc1Br MB13966 [0,1,0,0,0,0|2,0,0]=3 404 B9R1.15 CSc1ccncc1O MB25632 [0,1,0,0,0,0|1,0,0]=2 405 B9R1.15 CSc1cnccc1O MB31499 [0,1,0,0,0,0|1,0,0]=2 406 B9R1.15 Cc1c(cccn1)C#C AB66573 [0,1,0,0,0,0|2,0,0]=3 407 B9R1.15 Cc1c(cccn1)C#N PB23449 [0,1,0,0,0,0|2,0,0]=3 408 B9R1.15 Cc1c(cccn1)C=O PB27878 [0,1,0,0,0,0|1,0,1]=3 409 B9R1.15 Cc1c(cccn1)CBr PB19196 [0,1,0,0,0,0|2,0,0]=3 410 B9R1.15 Cc1c(cccn1)CCl AB51469 [0,1,0,0,0,0|2,0,0]=3 411 B9R1.15 Cc1c(cccn1)CCl PB28159 [0,1,0,0,0,0|2,0,0]=3 412 B9R1.15 Cc1c(cccn1)CN AB14093 [0,1,0,0,0,0|2,0,0]=3 413 B9R1.15 Cc1c(cccn1)CO AB01512 [0,1,0,0,0,0|1,0,0]=2 414 B9R1.15 Cc1c(cccn1)OC AB03569 [0,1,0,0,0,0|1,0,0]=2 415 B9R1.15 Cc1c(nccn1)C#N AB48635 [0,1,0,0,0,0|3,0,0]=4 416 B9R1.15 Cc1c(nccn1)C=O PB13166 [0,1,0,0,0,0|2,0,1]=4 417 B9R1.15 Cc1c(nccn1)CCl PB22746 [0,1,0,0,0,0|3,0,0]=4 418 B9R1.15 Cc1c(nccn1)CN PB38635 [0,1,0,0,0,0|3,0,0]=4 419 B9R1.15 Cc1c(nccn1)CO PB22269 [0,1,0,0,0,0|2,0,0]=3 420 B9R1.15 Cc1cccnc1C=O PB14292 [0,1,0,0,0,0|1,0,1]=3 421 B9R1.15 Cc1cccnc1CCl PB32645 [0,1,0,0,0,0|2,0,0]=3 422 B9R1.15 Cc1cccnc1CN AB20671 [0,1,0,0,0,0|2,0,0]=3 423 B9R1.15 Cc1cccnc1CO AB12590 [0,1,0,0,0,0|1,0,0]=2 424 B9R1.15 Cc1cccnc1OC AB31414 [0,1,0,0,0,0|1,0,0]=2 425 B9R1.15 Cc1ccncc1C#C AB66569 [0,1,0,0,0,0|2,0,0]=3 426 B9R1.15 Cc1ccncc1C#N PB24636 [0,1,0,0,0,0|2,0,0]=3 427 B9R1.15 Cc1ccncc1C=O PB23498 [0,1,0,0,0,0|1,0,1]=3 428 B9R1.15 Cc1ccncc1CCl PB22427 [0,1,0,0,0,0|2,0,0]=3 429 B9R1.15 Cc1ccncc1CN PB14440 [0,1,0,0,0,0|2,0,0]=3 430 B9R1.15 Cc1ccncc1CO PB21746 [0,1,0,0,0,0|1,0,0]=2 431 B9R1.15 Cc1ccnnc1C#N PB21475 [0,1,0,0,0,0|3,0,0]=4 432 B9R1.15 Cc1ccnnc1CN PB36913 [0,1,0,0,0,0|3,0,0]=4 433 B9R1.15 Cc1cnccc1C#C AB66570 [0,1,0,0,0,0|2,0,0]=3 434 B9R1.15 Cc1cnccc1C#N PB23623 [0,1,0,0,0,0|2,0,0]=3 435 B9R1.15 Cc1cnccc1C=O AB11481 [0,1,0,0,0,0|1,0,1]=3 436 B9R1.15 Cc1cnccc1CCl PB24122 [0,1,0,0,0,0|2,0,0]=3 437 B9R1.15 Cc1cnccc1CN AB17090 [0,1,0,0,0,0|2,0,0]=3 438 B9R1.15 Cc1cnccc1CO PB32359 [0,1,0,0,0,0|1,0,0]=2 439 B9R1.15 Cc1cnncc1CN PB36093 [0,1,0,0,0,0|3,0,0]=4 440 B9R1.15 c1c(c(ncn1)N)CCl AB85293 [0,1,0,0,0,0|3,0,0]=4 441 B9R1.15 c1c(c(ncn1)O)C#N AB03209 [0,1,0,0,0,0|2,0,1]=4 442 B9R1.15 c1cc(c(nc1)Br)C#N AB05139 [0,1,0,0,0,0|2,0,1]=4 443 B9R1.15 c1cc(c(nc1)Br)C=O AB20862 [0,1,0,0,0,0|2,0,1]=4 444 B9R1.15 c1cc(c(nc1)Br)CBr MB06085 [0,1,0,0,0,0|2,0,0]=3 445 B9R1.15 c1cc(c(nc1)Br)CCl AB60077 [0,1,0,0,0,0|2,0,0]=3 446 B9R1.15 c1cc(c(nc1)Br)CN AB41824 [0,1,0,0,0,0|2,0,0]=3 447 B9R1.15 c1cc(c(nc1)Br)CO AB44846 [0,1,0,0,0,0|2,0,0]=3 448 B9R1.15 c1cc(c(nc1)C#N)Br PB24769 [0,1,0,0,0,0|2,0,1]=4 449 B9R1.15 c1cc(c(nc1)C#N)Cl PB17324 [0,1,0,0,0,0|2,0,1]=4 450 B9R1.15 c1cc(c(nc1)C#N)F PB17393 [0,1,0,0,0,0|2,0,1]=4 451 B9R1.15 c1cc(c(nc1)C#N)N PB18562 [0,1,0,0,0,0|2,0,1]=4 452 B9R1.15 c1cc(c(nc1)C=O)Br AB42598 [0,1,0,0,0,0|2,0,1]=4 453 B9R1.15 c1cc(c(nc1)C=O)F PB22063 [0,1,0,0,0,0|2,0,1]=4 454 B9R1.15 c1cc(c(nc1)C=O)N AB42378 [0,1,0,0,0,0|2,0,1]=4 455 B9R1.15 c1cc(c(nc1)C=O)O PB12355 [0,1,0,0,0,0|1,0,1]=3 456 B9R1.15 c1cc(c(nc1)CBr)F PB10918 [0,1,0,0,0,0|2,0,0]=3 457 B9R1.15 c1cc(c(nc1)CCl)Br AB67649 [0,1,0,0,0,0|2,0,0]=3 458 B9R1.15 c1cc(c(nc1)CCl)Cl AB60061 [0,1,0,0,0,0|2,0,0]=3 459 B9R1.15 c1cc(c(nc1)CCl)F PB14946 [0,1,0,0,0,0|2,0,0]=3 460 B9R1.15 c1cc(c(nc1)CCl)N AB31890 [0,1,0,0,0,0|2,0,0]=3 461 B9R1.15 c1cc(c(nc1)CN)Br AB67637 [0,1,0,0,0,0|2,0,0]=3 462 B9R1.15 c1cc(c(nc1)CN)Cl PB26156 [0,1,0,0,0,0|2,0,0]=3 463 B9R1.15 c1cc(c(nc1)CN)F AB55320 [0,1,0,0,0,0|2,0,0]=3 464 B9R1.15 c1cc(c(nc1)CN)F PB13118 [0,1,0,0,0,0|2,0,0]=3 465 B9R1.15 c1cc(c(nc1)CN)N AB48448 [0,1,0,0,0,0|2,0,0]=3 466 B9R1.15 c1cc(c(nc1)CN)O MB01728 [0,1,0,0,0,0|1,0,0]=2 467 B9R1.15 c1cc(c(nc1)CO)Cl AB63515 [0,1,0,0,0,0|2,0,0]=3 468 B9R1.15 c1cc(c(nc1)CO)F PB22208 [0,1,0,0,0,0|2,0,0]=3 469 B9R1.15 c1cc(c(nc1)CO)N AB31896 [0,1,0,0,0,0|2,0,0]=3 470 B9R1.15 c1cc(c(nc1)CO)O MB00702 [0,1,0,0,0,0|1,0,0]=2 471 B9R1.15 c1cc(c(nc1)Cl)C#N AB01170 [0,1,0,0,0,0|2,0,1]=4 472 B9R1.15 c1cc(c(nc1)Cl)C=O PB27532 [0,1,0,0,0,0|2,0,1]=4 473 B9R1.15 c1cc(c(nc1)Cl)CCl PB14751 [0,1,0,0,0,0|2,0,0]=3 474 B9R1.15 c1cc(c(nc1)Cl)CO PB27555 [0,1,0,0,0,0|2,0,0]=3 475 B9R1.15 c1cc(c(nc1)F)C=O AB13640 [0,1,0,0,0,0|2,0,1]=4 476 B9R1.15 c1cc(c(nc1)F)CCl AB60073 [0,1,0,0,0,0|2,0,0]=3 477 B9R1.15 c1cc(c(nc1)F)CN AB23466 [0,1,0,0,0,0|2,0,0]=3 478 B9R1.15 c1cc(c(nc1)N)C#N AB03606 [0,1,0,0,0,0|2,0,1]=4 479 B9R1.15 c1cc(c(nc1)N)C=O AB09963 [0,1,0,0,0,0|2,0,1]=4 480 B9R1.15 c1cc(c(nc1)N)CCl AB21190 [0,1,0,0,0,0|2,0,0]=3 481 B9R1.15 c1cc(c(nc1)N)CO PB32383 [0,1,0,0,0,0|2,0,0]=3 482 B9R1.15 c1cc(c(nc1)NN)Br MB01287 [0,1,0,0,0,0|3,0,0]=4 483 B9R1.15 c1cc(c(nc1)O)C#N PB21004 [0,1,0,0,0,0|1,0,1]=3 484 B9R1.15 c1cc(c(nc1)O)C=O AB55041 [0,1,0,0,0,0|1,0,1]=3 485 B9R1.15 c1cc(c(nc1)O)CO AB52938 [0,1,0,0,0,0|1,0,0]=2 486 B9R1.15 c1cc[n+](c(c1)CCl)[O-] AB59958 [0,1,0,0,0,0|1,0,1]=3 487 B9R1.15 c1ccc(c(c1)C=O)I PB15618 [0,1,0,0,0,0|1,0,1]=3 488 B9R1.15 c1ccc(c(c1)CI)O MB07048 [0,1,0,0,0,0|0,0,0]=1 489 B9R1.15 c1ccc(c(c1)CN)O MB01565 [0,1,0,0,0,0|0,0,0]=1 490 B9R1.15 c1cn[nH]c(=O)c1CN PB11396 [0,1,0,0,0,0|2,0,1]=4 491 B9R1.15 c1cnc(c(n1)CCl)Cl PB22753 [0,1,0,0,0,0|3,0,0]=4 492 B9R1.15 c1cnc(c(n1)CN)Cl PB12787 [0,1,0,0,0,0|3,0,0]=4 493 B9R1.15 c1cnc(c(n1)CN)N AB53146 [0,1,0,0,0,0|3,0,0]=4 494 B9R1.15 c1cnc(c(n1)CO)Cl PB33021 [0,1,0,0,0,0|3,0,0]=4 495 B9R1.15 c1cncc(c1Br)C#N AB48189 [0,1,0,0,0,0|2,0,1]=4 496 B9R1.15 c1cncc(c1Br)C=O AB25683 [0,1,0,0,0,0|2,0,1]=4 497 B9R1.15 c1cncc(c1Br)C=O AB53933 [0,1,0,0,0,0|2,0,1]=4 498 B9R1.15 c1cncc(c1Br)CCl AB67965 [0,1,0,0,0,0|2,0,0]=3 499 B9R1.15 c1cncc(c1Br)CN AB67954 [0,1,0,0,0,0|2,0,0]=3 500 B9R1.15 c1cncc(c1C#N)Br AB05148 [0,1,0,0,0,0|2,0,1]=4 501 B9R1.15 c1cncc(c1C#N)Cl AB21895 [0,1,0,0,0,0|2,0,1]=4 502 B9R1.15 c1cncc(c1C#N)N AB16955 [0,1,0,0,0,0|2,0,1]=4 503 B9R1.15 c1cncc(c1C#N)O MB12322 [0,1,0,0,0,0|1,0,1]=3 504 B9R1.15 c1cncc(c1C=O)Br PB17335 [0,1,0,0,0,0|2,0,1]=4 505 B9R1.15 c1cncc(c1C=O)Cl AB23043 [0,1,0,0,0,0|2,0,1]=4 506 B9R1.15 c1cncc(c1C=O)F PB32422 [0,1,0,0,0,0|2,0,1]=4 507 B9R1.15 c1cncc(c1C=O)N PB20170 [0,1,0,0,0,0|2,0,1]=4 508 B9R1.15 c1cncc(c1C=O)O AB08714 [0,1,0,0,0,0|1,0,1]=3 509 B9R1.15 c1cncc(c1CCl)Br AB67648 [0,1,0,0,0,0|2,0,0]=3 510 B9R1.15 c1cncc(c1CCl)Cl AB67608 [0,1,0,0,0,0|2,0,0]=3 511 B9R1.15 c1cncc(c1CCl)F AB67665 [0,1,0,0,0,0|2,0,0]=3 512 B9R1.15 c1cncc(c1CN)Br AB63141 [0,1,0,0,0,0|2,0,0]=3 513 B9R1.15 c1cncc(c1CN)Cl AB63139 [0,1,0,0,0,0|2,0,0]=3 514 B9R1.15 c1cncc(c1CN)F AB63136 [0,1,0,0,0,0|2,0,0]=3 515 B9R1.15 c1cncc(c1CN)N AB49287 [0,1,0,0,0,0|2,0,0]=3 516 B9R1.15 c1cncc(c1CN)O MB09249 [0,1,0,0,0,0|1,0,0]=2 517 B9R1.15 c1cncc(c1CO)Br PB19192 [0,1,0,0,0,0|2,0,0]=3 518 B9R1.15 c1cncc(c1CO)F PB29849 [0,1,0,0,0,0|2,0,0]=3 519 B9R1.15 c1cncc(c1CO)N AB25787 [0,1,0,0,0,0|2,0,0]=3 520 B9R1.15 c1cncc(c1Cl)C#N AB43637 [0,1,0,0,0,0|2,0,1]=4 521 B9R1.15 c1cncc(c1Cl)C=O AB17590 [0,1,0,0,0,0|2,0,1]=4 522 B9R1.15 c1cncc(c1Cl)CCl AB60091 [0,1,0,0,0,0|2,0,0]=3 523 B9R1.15 c1cncc(c1Cl)CN AB49675 [0,1,0,0,0,0|2,0,0]=3 524 B9R1.15 c1cncc(c1F)C#N AB17580 [0,1,0,0,0,0|2,0,1]=4 525 B9R1.15 c1cncc(c1F)C=O AB32109 [0,1,0,0,0,0|2,0,1]=4 526 B9R1.15 c1cncc(c1F)CCl AB68054 [0,1,0,0,0,0|2,0,0]=3 527 B9R1.15 c1cncc(c1F)CN AB68023 [0,1,0,0,0,0|2,0,0]=3 528 B9R1.15 c1cncc(c1N)C#N AB16952 [0,1,0,0,0,0|2,0,1]=4 529 B9R1.15 c1cncc(c1N)C=O AB12471 [0,1,0,0,0,0|2,0,1]=4 530 B9R1.15 c1cncc(c1N)C=O PB27639 [0,1,0,0,0,0|2,0,1]=4 531 B9R1.15 c1cncc(c1N)CCl AB31893 [0,1,0,0,0,0|2,0,0]=3 532 B9R1.15 c1cncc(c1N)CO PB14435 [0,1,0,0,0,0|2,0,0]=3 533 B9R1.15 c1cncc(c1O)C#N MB01597 [0,1,0,0,0,0|1,0,1]=3 534 B9R1.15 c1cncc(c1O)C=O AB59870 [0,1,0,0,0,0|1,0,1]=3 535 B9R1.15 c1cncc(c1O)CN MB35531 [0,1,0,0,0,0|1,0,0]=2 536 B9R1.69 C1C(=C(C=NC1=O)Cl)O AB45636 [0,1,0,0,0,0|2,0,1]=4 537 B9R1.69 Cc1c(cc(cn1)Br)Br PB30636 [0,1,0,0,0,0|2,0,0]=3 538 B9R1.69 Cc1c(cc(cn1)Br)Cl PB25103 [0,1,0,0,0,0|2,0,0]=3 539 B9R1.69 Cc1c(cc(cn1)Br)F AB65410 [0,1,0,0,0,0|2,0,0]=3 540 B9R1.69 Cc1c(cc(cn1)Br)N PB18946 [0,1,0,0,0,0|2,0,0]=3 541 B9R1.69 Cc1c(cc(cn1)Cl)N PB22604 [0,1,0,0,0,0|2,0,0]=3 542 B9R1.69 Cc1c(cc(cn1)F)N AB73550 [0,1,0,0,0,0|2,0,0]=3 543 B9R1.69 Cc1c(cc(cn1)N)Br PB15954 [0,1,0,0,0,0|2,0,0]=3 544 B9R1.69 Cc1c(cc(cn1)N)Cl AB62794 [0,1,0,0,0,0|2,0,0]=3 545 B9R1.69 Cc1c(cc(cn1)N)F AB73533 [0,1,0,0,0,0|2,0,0]=3 546 B9R1.69 Cc1c(cc(cn1)O)Cl AB71195 [0,1,0,0,0,0|2,0,0]=3 547 B9R1.69 Cc1c(cc(cn1)O)F AB71314 [0,1,0,0,0,0|2,0,0]=3 548 B9R1.69 Cc1c(ccc(n1)Br)Cl AB63580 [0,1,0,0,0,0|2,0,0]=3 549 B9R1.69 Cc1c(ccc(n1)Br)F AB13446 [0,1,0,0,0,0|2,0,0]=3 550 B9R1.69 Cc1c(ccc(n1)Br)N PB20014 [0,1,0,0,0,0|2,0,0]=3 551 B9R1.69 Cc1c(ccc(n1)Cl)Br AB41208 [0,1,0,0,0,0|2,0,0]=3 552 B9R1.69 Cc1c(ccc(n1)Cl)N PB20018 [0,1,0,0,0,0|2,0,0]=3 553 B9R1.69 Cc1c(ccc(n1)F)Br AB13479 [0,1,0,0,0,0|2,0,0]=3 554 B9R1.69 Cc1c(ccc(n1)I)Br MB09866 [0,1,0,0,0,0|2,0,0]=3 555 B9R1.69 Cc1c(ccc(n1)N)Br AB02783 [0,1,0,0,0,0|2,0,0]=3 556 B9R1.69 Cc1c(ccc(n1)N)Cl AB50593 [0,1,0,0,0,0|2,0,0]=3 557 B9R1.69 Cc1c(ccc(n1)N)F AB53307 [0,1,0,0,0,0|2,0,0]=3 558 B9R1.69 Cc1c(ccc(n1)N)I AB20800 [0,1,0,0,0,0|2,0,0]=3 559 B9R1.69 Cc1c(ccc(n1)O)Br AB15079 [0,1,0,0,0,0|2,0,0]=3 560 B9R1.69 Cc1c(ccc(n1)O)Cl AB71196 [0,1,0,0,0,0|2,0,0]=3 561 B9R1.69 Cc1c(ccc(n1)O)F AB71316 [0,1,0,0,0,0|2,0,0]=3 562 B9R1.69 Cc1c(ccc(n1)O)N AB41212 [0,1,0,0,0,0|2,0,0]=3 563 B9R1.69 Cc1c(cnc(n1)C)Br AB70482 [0,1,0,0,0,0|3,0,0]=4 564 B9R1.69 Cc1c(cnc(n1)Cl)Br AB70433 [0,1,0,0,0,0|3,0,0]=4 565 B9R1.69 Cc1c(cnc(n1)Cl)N AB66433 [0,1,0,0,0,0|3,0,0]=4 566 B9R1.69 Cc1c(nc(cn1)Br)N AB85726 [0,1,0,0,0,0|3,0,0]=4 567 B9R1.69 Cc1c(nc(cn1)Cl)C AB68573 [0,1,0,0,0,0|3,0,0]=4 568 B9R1.69 Cc1c(nc(cn1)N)Br CB11882 [0,1,0,0,0,0|3,0,0]=4 569 B9R1.69 Cc1c(nc(cn1)N)C AB53106 [0,1,0,0,0,0|3,0,0]=4 570 B9R1.69 Cc1c(ncc(n1)Br)Br AB72476 [0,1,0,0,0,0|3,0,0]=4 571 B9R1.69 Cc1c(ncc(n1)Br)Cl AB72492 [0,1,0,0,0,0|3,0,0]=4 572 B9R1.69 Cc1c(ncc(n1)Br)I AB72495 [0,1,0,0,0,0|3,0,0]=4 573 B9R1.69 Cc1c(ncc(n1)Br)N AB48639 [0,1,0,0,0,0|3,0,0]=4 574 B9R1.69 Cc1c(ncc(n1)Br)O AB85718 [0,1,0,0,0,0|2,0,0]=3 575 B9R1.69 Cc1c(ncc(n1)Cl)Br AB72477 [0,1,0,0,0,0|3,0,0]=4 576 B9R1.69 Cc1c(ncc(n1)Cl)Cl AB70649 [0,1,0,0,0,0|3,0,0]=4 577 B9R1.69 Cc1c(ncc(n1)Cl)F AB85699 [0,1,0,0,0,0|3,0,0]=4 578 B9R1.69 Cc1c(ncc(n1)Cl)I AB72504 [0,1,0,0,0,0|3,0,0]=4 579 B9R1.69 Cc1c(ncc(n1)Cl)N AB54525 [0,1,0,0,0,0|3,0,0]=4 580 B9R1.69 Cc1c(ncc(n1)F)Br AB85703 [0,1,0,0,0,0|3,0,0]=4 581 B9R1.69 Cc1c(ncc(n1)F)Cl AB85700 [0,1,0,0,0,0|3,0,0]=4 582 B9R1.69 Cc1c(ncc(n1)I)Br AB72480 [0,1,0,0,0,0|3,0,0]=4 583 B9R1.69 Cc1c(ncc(n1)N)Br AB48621 [0,1,0,0,0,0|3,0,0]=4 584 B9R1.69 Cc1cc(c(cn1)Br)Cl PB25215 [0,1,0,0,0,0|3,0,0]=4 585 B9R1.69 Cc1cc(c(cn1)Br)F AB74992 [0,1,0,0,0,0|3,0,0]=4 586 B9R1.69 Cc1cc(c(cn1)Br)N PB10415 [0,1,0,0,0,0|3,0,0]=4 587 B9R1.69 Cc1cc(c(cn1)C)Br AB05202 [0,1,0,0,0,0|2,0,0]=3 588 B9R1.69 Cc1cc(c(cn1)C)N AB05308 [0,1,0,0,0,0|2,0,0]=3 589 B9R1.69 Cc1cc(c(cn1)C)O AB66580 [0,1,0,0,0,0|1,0,0]=2 590 B9R1.69 Cc1cc(c(cn1)Cl)Br AB71664 [0,1,0,0,0,0|3,0,0]=4 591 B9R1.69 Cc1cc(c(cn1)Cl)I AB71748 [0,1,0,0,0,0|3,0,0]=4 592 B9R1.69 Cc1cc(c(cn1)Cl)N AB40682 [0,1,0,0,0,0|3,0,0]=4 593 B9R1.69 Cc1cc(c(cn1)Cl)O AB69303 [0,1,0,0,0,0|2,0,0]=3 594 B9R1.69 Cc1cc(c(cn1)F)Br AB74121 [0,1,0,0,0,0|3,0,0]=4 595 B9R1.69 Cc1cc(c(cn1)F)N AB70850 [0,1,0,0,0,0|3,0,0]=4 596 B9R1.69 Cc1cc(c(cn1)N)Br AB68541 [0,1,0,0,0,0|3,0,0]=4 597 B9R1.69 Cc1cc(c(cn1)N)Cl AB64291 [0,1,0,0,0,0|3,0,0]=4 598 B9R1.69 Cc1cc(c(cn1)N)F AB73537 [0,1,0,0,0,0|3,0,0]=4 599 B9R1.69 Cc1cc(c(cn1)N)N AB51224 [0,1,0,0,0,0|3,0,0]=4 600 B9R1.69 Cc1cc(c(cn1)O)Cl AB75747 [0,1,0,0,0,0|2,0,0]=3 601 B9R1.69 Cc1cc(c(cn1)O)F AB74750 [0,1,0,0,0,0|2,0,0]=3 602 B9R1.69 Cc1cc(c(nc1)Br)C AB05204 [0,1,0,0,0,0|2,0,0]=3 603 B9R1.69 Cc1cc(c(nc1)Br)Cl AB53543 [0,1,0,0,0,0|3,0,0]=4 604 B9R1.69 Cc1cc(c(nc1)Br)F AB55034 [0,1,0,0,0,0|3,0,0]=4 605 B9R1.69 Cc1cc(c(nc1)C)Br AB05199 [0,1,0,0,0,0|2,0,0]=3 606 B9R1.69 Cc1cc(c(nc1)C)N AB66586 [0,1,0,0,0,0|2,0,0]=3 607 B9R1.69 Cc1cc(c(nc1)C)O AB65617 [0,1,0,0,0,0|1,0,0]=2 608 B9R1.69 Cc1cc(c(nc1)Cl)Br AB09970 [0,1,0,0,0,0|3,0,0]=4 609 B9R1.69 Cc1cc(c(nc1)Cl)N AB15085 [0,1,0,0,0,0|3,0,0]=4 610 B9R1.69 Cc1cc(c(nc1)Cl)O AB53552 [0,1,0,0,0,0|2,0,0]=3 611 B9R1.69 Cc1cc(c(nc1)F)Br AB13665 [0,1,0,0,0,0|3,0,0]=4 612 B9R1.69 Cc1cc(c(nc1)F)N AB66726 [0,1,0,0,0,0|3,0,0]=4 613 B9R1.69 Cc1cc(c(nc1)F)O AB71300 [0,1,0,0,0,0|2,0,0]=3 614 B9R1.69 Cc1cc(c(nc1)N)Br AB02784 [0,1,0,0,0,0|3,0,0]=4 615 B9R1.69 Cc1cc(c(nc1)N)C AB62796 [0,1,0,0,0,0|2,0,0]=3 616 B9R1.69 Cc1cc(c(nc1)N)Cl AB32106 [0,1,0,0,0,0|3,0,0]=4 617 B9R1.69 Cc1cc(c(nc1)N)F AB66724 [0,1,0,0,0,0|3,0,0]=4 618 B9R1.69 Cc1cc(c(nc1)N)N AB16874 [0,1,0,0,0,0|3,0,0]=4 619 B9R1.69 Cc1cc(c(nc1)O)Br AB16221 [0,1,0,0,0,0|2,0,0]=3 620 B9R1.69 Cc1cc(c(nc1)O)C AB71284 [0,1,0,0,0,0|1,0,0]=2 621 B9R1.69 Cc1cc(c(nc1)O)Cl AB70490 [0,1,0,0,0,0|2,0,0]=3 622 B9R1.69 Cc1cc(c(nc1)O)F AB71311 [0,1,0,0,0,0|2,0,0]=3 623 B9R1.69 Cc1cc(c(nc1)O)N AB53563 [0,1,0,0,0,0|2,0,0]=3 624 B9R1.69 Cc1cc(cc[n+]1[O-])Br AB70404 [0,1,0,0,0,0|1,0,1]=3 625 B9R1.69 Cc1cc(ccc1I)O MB06793 [0,1,0,0,0,0|1,0,0]=2 626 B9R1.69 Cc1cc(cnc1Br)Br AB10779 [0,1,0,0,0,0|2,0,0]=3 627 B9R1.69 Cc1cc(cnc1Br)Cl AB13444 [0,1,0,0,0,0|2,0,0]=3 628 B9R1.69 Cc1cc(cnc1Br)F AB53312 [0,1,0,0,0,0|2,0,0]=3 629 B9R1.69 Cc1cc(cnc1Br)N AB13464 [0,1,0,0,0,0|2,0,0]=3 630 B9R1.69 Cc1cc(cnc1Br)O AB53545 [0,1,0,0,0,0|2,0,0]=3 631 B9R1.69 Cc1cc(cnc1C)Br AB64498 [0,1,0,0,0,0|2,0,0]=3 632 B9R1.69 Cc1cc(cnc1C)Cl AB75734 [0,1,0,0,0,0|2,0,0]=3 633 B9R1.69 Cc1cc(cnc1C)N AB42833 [0,1,0,0,0,0|2,0,0]=3 634 B9R1.69 Cc1cc(cnc1C)O AB65534 [0,1,0,0,0,0|2,0,0]=3 635 B9R1.69 Cc1cc(cnc1Cl)Cl AB16614 [0,1,0,0,0,0|2,0,0]=3 636 B9R1.69 Cc1cc(cnc1Cl)F AB21234 [0,1,0,0,0,0|2,0,0]=3 637 B9R1.69 Cc1cc(cnc1Cl)I CB11216 [0,1,0,0,0,0|2,0,0]=3 638 B9R1.69 Cc1cc(cnc1Cl)N AB13470 [0,1,0,0,0,0|2,0,0]=3 639 B9R1.69 Cc1cc(cnc1Cl)O PB31577 [0,1,0,0,0,0|2,0,0]=3 640 B9R1.69 Cc1cc(cnc1F)Br AB13475 [0,1,0,0,0,0|2,0,0]=3 641 B9R1.69 Cc1cc(cnc1F)Cl AB13483 [0,1,0,0,0,0|2,0,0]=3 642 B9R1.69 Cc1cc(cnc1F)N AB13474 [0,1,0,0,0,0|2,0,0]=3 643 B9R1.69 Cc1cc(cnc1F)O AB53562 [0,1,0,0,0,0|2,0,0]=3 644 B9R1.69 Cc1cc(cnc1I)Br AB42361 [0,1,0,0,0,0|2,0,0]=3 645 B9R1.69 Cc1cc(cnc1I)Cl AB75751 [0,1,0,0,0,0|2,0,0]=3 646 B9R1.69 Cc1cc(cnc1N)Br AB02787 [0,1,0,0,0,0|2,0,0]=3 647 B9R1.69 Cc1cc(cnc1N)Cl AB03635 [0,1,0,0,0,0|2,0,0]=3 648 B9R1.69 Cc1cc(cnc1N)F AB41238 [0,1,0,0,0,0|2,0,0]=3 649 B9R1.69 Cc1cc(cnc1N)I AB10923 [0,1,0,0,0,0|2,0,0]=3 650 B9R1.69 Cc1cc(cnc1O)Br AB15087 [0,1,0,0,0,0|1,0,0]=2 651 B9R1.69 Cc1cc(cnc1O)Cl AB03537 [0,1,0,0,0,0|1,0,0]=2 652 B9R1.69 Cc1cc(cnc1O)F AB82901 [0,1,0,0,0,0|1,0,0]=2 653 B9R1.69 Cc1cc(cnc1O)I CB10781 [0,1,0,0,0,0|1,0,0]=2 654 B9R1.69 Cc1cc(cnc1O)N AB41215 [0,1,0,0,0,0|1,0,0]=2 655 B9R1.69 Cc1cc(ncc1Br)Br AB05276 [0,1,0,0,0,0|2,0,0]=3 656 B9R1.69 Cc1cc(ncc1Br)C AB53714 [0,1,0,0,0,0|2,0,0]=3 657 B9R1.69 Cc1cc(ncc1Br)Cl AB15095 [0,1,0,0,0,0|2,0,0]=3 658 B9R1.69 Cc1cc(ncc1Br)F AB53532 [0,1,0,0,0,0|2,0,0]=3 659 B9R1.69 Cc1cc(ncc1Br)I AB52611 [0,1,0,0,0,0|2,0,0]=3 660 B9R1.69 Cc1cc(ncc1Br)N AB15088 [0,1,0,0,0,0|2,0,0]=3 661 B9R1.69 Cc1cc(ncc1Br)O AB15096 [0,1,0,0,0,0|2,0,0]=3 662 B9R1.69 Cc1cc(ncc1C)Br AB64948 [0,1,0,0,0,0|2,0,0]=3 663 B9R1.69 Cc1cc(ncc1C)N AB49139 [0,1,0,0,0,0|2,0,0]=3 664 B9R1.69 Cc1cc(ncc1C)O AB71287 [0,1,0,0,0,0|2,0,0]=3 665 B9R1.69 Cc1cc(ncc1Cl)Br AB64601 [0,1,0,0,0,0|2,0,0]=3 666 B9R1.69 Cc1cc(ncc1Cl)Cl AB41172 [0,1,0,0,0,0|2,0,0]=3 667 B9R1.69 Cc1cc(ncc1Cl)N AB24850 [0,1,0,0,0,0|2,0,0]=3 668 B9R1.69 Cc1cc(ncc1Cl)O AB41155 [0,1,0,0,0,0|2,0,0]=3 669 B9R1.69 Cc1cc(ncc1F)Br AB44912 [0,1,0,0,0,0|2,0,0]=3 670 B9R1.69 Cc1cc(ncc1I)N AB25384 [0,1,0,0,0,0|2,0,0]=3 671 B9R1.69 Cc1cc(ncc1N)Br PB25040 [0,1,0,0,0,0|2,0,0]=3 672 B9R1.69 Cc1cc(ncc1N)C AB41994 [0,1,0,0,0,0|2,0,0]=3 673 B9R1.69 Cc1cc(ncc1N)F AB53863 [0,1,0,0,0,0|2,0,0]=3 674 B9R1.69 Cc1cc(ncc1O)C AB44457 [0,1,0,0,0,0|1,0,0]=2 675 B9R1.69 Cc1cc(ncc1O)Cl AB71184 [0,1,0,0,0,0|1,0,0]=2 676 B9R1.69 Cc1cc(ncc1O)F AB71303 [0,1,0,0,0,0|1,0,0]=2 677 B9R1.69 Cc1cc(nnc1Cl)C PB31877 [0,1,0,0,0,0|3,0,0]=4 678 B9R1.69 Cc1cc(nnc1Cl)Cl PB23168 [0,1,0,0,0,0|3,0,0]=4 679 B9R1.69 Cc1cc(nnc1O)O PB15638 [0,1,0,0,0,0|2,0,0]=3 680 B9R1.69 Cc1ccc(c(c1)Br)S AB16734 [0,1,0,0,0,0|1,1,0]=3 681 B9R1.69 Cc1ccc(c(c1)F)Br AB01835 [0,1,0,0,0,0|2,0,0]=3 682 B9R1.69 Cc1ccc(c(c1)I)O MB00839 [0,1,0,0,0,0|1,0,0]=2 683 B9R1.69 Cc1ccc(c(c1)N)Br AB09930 [0,1,0,0,0,0|2,0,0]=3 684 B9R1.69 Cc1ccc(c(c1)O)Br MB09252 [0,1,0,0,0,0|1,0,0]=2 685 B9R1.69 Cc1ccc(c(c1)O)I MB23426 [0,1,0,0,0,0|1,0,0]=2 686 B9R1.69 Cc1ccc(c(c1)O)N AB00890 [0,1,0,0,0,0|1,0,0]=2 687 B9R1.69 Cc1ccc(c(n1)Br)N AB13459 [0,1,0,0,0,0|3,0,0]=4 688 B9R1.69 Cc1ccc(c(n1)Br)O PB10360 [0,1,0,0,0,0|2,0,0]=3 689 B9R1.69 Cc1ccc(c(n1)C)Br AB05311 [0,1,0,0,0,0|2,0,0]=3 690 B9R1.69 Cc1ccc(c(n1)Cl)Br AB13590 [0,1,0,0,0,0|3,0,0]=4 691 B9R1.69 Cc1ccc(c(n1)Cl)N AB13580 [0,1,0,0,0,0|3,0,0]=4 692 B9R1.69 Cc1ccc(c(n1)Cl)O AB42392 [0,1,0,0,0,0|2,0,0]=3 693 B9R1.69 Cc1ccc(c(n1)F)N AB13597 [0,1,0,0,0,0|3,0,0]=4 694 B9R1.69 Cc1ccc(c(n1)N)Br AB13584 [0,1,0,0,0,0|3,0,0]=4 695 B9R1.69 Cc1ccc(c(n1)N)Cl AB41203 [0,1,0,0,0,0|3,0,0]=4 696 B9R1.69 Cc1ccc(c(n1)N)N AB15083 [0,1,0,0,0,0|3,0,0]=4 697 B9R1.69 Cc1ccc(c(n1)N)O AB53537 [0,1,0,0,0,0|2,0,0]=3 698 B9R1.69 Cc1ccc(c(n1)O)Br AB13586 [0,1,0,0,0,0|2,0,0]=3 699 B9R1.69 Cc1ccc(c(n1)O)Cl AB41205 [0,1,0,0,0,0|2,0,0]=3 700 B9R1.69 Cc1ccc(cc1I)O MB07177 [0,1,0,0,0,0|1,0,0]=2 701 B9R1.69 Cc1ccc(cc1O)Br MB05210 [0,1,0,0,0,0|0,0,0]=1 702 B9R1.69 Cc1ccc(cc1O)I MB12091 [0,1,0,0,0,0|0,0,0]=1 703 B9R1.69 Cc1ccc(nc1Br)Br AB16615 [0,1,0,0,0,0|2,0,0]=3 704 B9R1.69 Cc1ccc(nc1Br)C AB65454 [0,1,0,0,0,0|2,0,0]=3 705 B9R1.69 Cc1ccc(nc1Br)Cl AB62917 [0,1,0,0,0,0|2,0,0]=3 706 B9R1.69 Cc1ccc(nc1Br)F AB71569 [0,1,0,0,0,0|2,0,0]=3 707 B9R1.69 Cc1ccc(nc1C)Br AB64947 [0,1,0,0,0,0|2,0,0]=3 708 B9R1.69 Cc1ccc(nc1C)N AB23050 [0,1,0,0,0,0|2,0,0]=3 709 B9R1.69 Cc1ccc(nc1C)O AB54521 [0,1,0,0,0,0|2,0,0]=3 710 B9R1.69 Cc1ccc(nc1Cl)Br AB74690 [0,1,0,0,0,0|2,0,0]=3 711 B9R1.69 Cc1ccc(nc1Cl)N AB70428 [0,1,0,0,0,0|2,0,0]=3 712 B9R1.69 Cc1ccc(nc1Cl)O AB71186 [0,1,0,0,0,0|2,0,0]=3 713 B9R1.69 Cc1ccc(nc1F)Br AB74556 [0,1,0,0,0,0|2,0,0]=3 714 B9R1.69 Cc1ccc(nc1F)N AB83080 [0,1,0,0,0,0|2,0,0]=3 715 B9R1.69 Cc1ccc(nc1F)O AB71306 [0,1,0,0,0,0|2,0,0]=3 716 B9R1.69 Cc1ccc(nc1N)Br AB71668 [0,1,0,0,0,0|2,0,0]=3 717 B9R1.69 Cc1ccc(nc1N)C AB25382 [0,1,0,0,0,0|2,0,0]=3 718 B9R1.69 Cc1ccc(nc1N)Cl AB73562 [0,1,0,0,0,0|2,0,0]=3 719 B9R1.69 Cc1ccc(nc1N)F AB82883 [0,1,0,0,0,0|2,0,0]=3 720 B9R1.69 Cc1ccc(nc1N)N AB43423 [0,1,0,0,0,0|2,0,0]=3 721 B9R1.69 Cc1ccc(nc1O)C AB71286 [0,1,0,0,0,0|1,0,0]=2 722 B9R1.69 Cc1ccc(nc1O)Cl AB75750 [0,1,0,0,0,0|1,0,0]=2 723 B9R1.69 Cc1ccc(nc1O)F AB82880 [0,1,0,0,0,0|1,0,0]=2 724 B9R1.69 Cc1cnc(c(n1)Br)C AB65522 [0,1,0,0,0,0|3,0,0]=4 725 B9R1.69 Cc1cnc(c(n1)C)Br AB73101 [0,1,0,0,0,0|3,0,0]=4 726 B9R1.69 Cc1cnc(c(n1)C)Cl AB03542 [0,1,0,0,0,0|3,0,0]=4 727 B9R1.69 Cc1cnc(c(n1)C)N AB03436 [0,1,0,0,0,0|3,0,0]=4 728 B9R1.69 Cc1cnc(c(n1)Cl)C AB00609 [0,1,0,0,0,0|3,0,0]=4 729 B9R1.69 Cc1cnc(cc1Br)Cl AB63102 [0,1,0,0,0,0|2,0,0]=3 730 B9R1.69 Cc1cnc(cc1Br)F AB71091 [0,1,0,0,0,0|2,0,0]=3 731 B9R1.69 Cc1cnc(cc1Cl)Br AB63106 [0,1,0,0,0,0|2,0,0]=3 732 B9R1.69 Cc1cnc(cc1Cl)N AB63097 [0,1,0,0,0,0|2,0,0]=3 733 B9R1.69 Cc1cnc(cc1Cl)O AB71200 [0,1,0,0,0,0|2,0,0]=3 734 B9R1.69 Cc1cnc(cc1F)Br AB71082 [0,1,0,0,0,0|2,0,0]=3 735 B9R1.69 Cc1cnc(cc1F)N AB70899 [0,1,0,0,0,0|2,0,0]=3 736 B9R1.69 Cc1cnc(cc1F)O AB71320 [0,1,0,0,0,0|2,0,0]=3 737 B9R1.69 Cc1cnc(cc1N)Br AB63107 [0,1,0,0,0,0|2,0,0]=3 738 B9R1.69 Cc1cnc(cc1N)Cl AB65156 [0,1,0,0,0,0|2,0,0]=3 739 B9R1.69 Cc1cnc(cc1N)F AB82864 [0,1,0,0,0,0|2,0,0]=3 740 B9R1.69 Cc1cnc(cc1O)Cl AB71181 [0,1,0,0,0,0|1,0,0]=2 741 B9R1.69 Cc1cnc(cc1O)F AB71302 [0,1,0,0,0,0|1,0,0]=2 742 B9R1.69 Cc1cnc(nc1Cl)C AB51539 [0,1,0,0,0,0|3,0,0]=4 743 B9R1.69 Cc1cnc(nc1Cl)Cl PB17064 [0,1,0,0,0,0|3,0,0]=4 744 B9R1.69 Cc1cnc(nc1Cl)N PB24678 [0,1,0,0,0,0|3,0,0]=4 745 B9R1.69 Cc1cnc(nc1N)C AB54986 [0,1,0,0,0,0|3,0,0]=4 746 B9R1.69 Cc1cnc(nc1N)Cl PB10226 [0,1,0,0,0,0|3,0,0]=4 747 B9R1.69 Cc1cnc(nc1O)C AB21544 [0,1,0,0,0,0|2,0,0]=3 748 B9R1.69 Cc1ncc(c(n1)O)F AB04979 [0,1,0,0,0,0|3,0,0]=4 749 B9R1.69 Cn1c(=O)cc(cn1)I PB36201 [0,1,0,0,0,0|2,0,1]=4 750 B9R1.69 Cn1c(=O)cc(cn1)N PB19682 [0,1,0,0,0,0|2,0,1]=4 751 B9R1.69 Cn1c(=O)ccc(n1)Cl MB02254 [0,1,0,0,0,0|2,0,1]=4 752 B9R1.69 Cn1cc(ccc1=O)Br PB32830 [0,1,0,0,0,0|1,0,1]=3 753 B9R1.69 Cn1cc(ccc1=O)N PB19693 [0,1,0,0,0,0|1,0,1]=3 754 B9R1.69 Cn1cc(ncc1=O)Br MB15013 [0,1,0,0,0,0|2,0,1]=4 755 B9R1.69 Cn1ccc(=O)c(c1)I MB19762 [0,1,0,0,0,0|2,0,1]=4 756 B9R1.69 Cn1ccc(cc1=O)Br PB26645 [0,1,0,0,0,0|1,0,1]=3 757 B9R1.69 Cn1ccc(cc1=O)Cl MB19760 [0,1,0,0,0,0|1,0,1]=3 758 B9R1.69 Cn1ccc(cc1=O)I MB14735 [0,1,0,0,0,0|1,0,1]=3 759 B9R1.69 Cn1ccc(cc1=O)N PB11442 [0,1,0,0,0,0|1,0,1]=3 760 B9R1.69 Cn1cnc(cc1=O)Cl MB01596 [0,1,0,0,0,0|2,0,1]=4 761 B9R1.69 c1c(c(cnc1Br)Br)O AB63125 [0,1,0,0,0,0|2,0,0]=3 762 B9R1.69 c1c(c(cnc1Br)Cl)Cl AB63111 [0,1,0,0,0,0|3,0,0]=4 763 B9R1.69 c1c(c(cnc1Br)Cl)F AB63114 [0,1,0,0,0,0|3,0,0]=4 764 B9R1.69 c1c(c(cnc1Br)Cl)I AB70807 [0,1,0,0,0,0|3,0,0]=4 765 B9R1.69 c1c(c(cnc1Br)Cl)N AB65425 [0,1,0,0,0,0|3,0,0]=4 766 B9R1.69 c1c(c(cnc1Br)Cl)O AB69302 [0,1,0,0,0,0|2,0,0]=3 767 B9R1.69 c1c(c(cnc1Br)F)Cl AB63112 [0,1,0,0,0,0|3,0,0]=4 768 B9R1.69 c1c(c(cnc1Br)F)N AB05092 [0,1,0,0,0,0|3,0,0]=4 769 B9R1.69 c1c(c(cnc1Br)F)O AB69315 [0,1,0,0,0,0|2,0,0]=3 770 B9R1.69 c1c(c(cnc1Br)N)Cl AB75030 [0,1,0,0,0,0|3,0,0]=4 771 B9R1.69 c1c(c(cnc1Br)N)N AB63109 [0,1,0,0,0,0|3,0,0]=4 772 B9R1.69 c1c(c(cnc1Br)O)Cl AB74967 [0,1,0,0,0,0|2,0,0]=3 773 B9R1.69 c1c(c(cnc1Cl)Br)Cl AB49334 [0,1,0,0,0,0|3,0,0]=4 774 B9R1.69 c1c(c(cnc1Cl)Br)I AB55676 [0,1,0,0,0,0|3,0,0]=4 775 B9R1.69 c1c(c(cnc1Cl)Br)N PB26428 [0,1,0,0,0,0|3,0,0]=4 776 B9R1.69 c1c(c(cnc1Cl)Br)O AB69298 [0,1,0,0,0,0|2,0,0]=3 777 B9R1.69 c1c(c(cnc1Cl)Cl)I AB66762 [0,1,0,0,0,0|3,0,0]=4 778 B9R1.69 c1c(c(cnc1Cl)Cl)N AB62909 [0,1,0,0,0,0|3,0,0]=4 779 B9R1.69 c1c(c(cnc1Cl)Cl)O AB10186 [0,1,0,0,0,0|2,0,0]=3 780 B9R1.69 c1c(c(cnc1Cl)F)Br AB25947 [0,1,0,0,0,0|3,0,0]=4 781 B9R1.69 c1c(c(cnc1Cl)F)I AB13669 [0,1,0,0,0,0|3,0,0]=4 782 B9R1.69 c1c(c(cnc1Cl)F)N AB71414 [0,1,0,0,0,0|3,0,0]=4 783 B9R1.69 c1c(c(cnc1Cl)F)O AB69309 [0,1,0,0,0,0|2,0,0]=3 784 B9R1.69 c1c(c(cnc1Cl)I)N PB25202 [0,1,0,0,0,0|3,0,0]=4 785 B9R1.69 c1c(c(cnc1Cl)N)Cl AB05110 [0,1,0,0,0,0|3,0,0]=4 786 B9R1.69 c1c(c(cnc1Cl)N)N PB14373 [0,1,0,0,0,0|3,0,0]=4 787 B9R1.69 c1c(c(cnc1Cl)N)O AB69320 [0,1,0,0,0,0|2,0,0]=3 788 B9R1.69 c1c(c(cnc1Cl)O)Cl AB69698 [0,1,0,0,0,0|2,0,0]=3 789 B9R1.69 c1c(c(cnc1Cl)O)N AB69322 [0,1,0,0,0,0|2,0,0]=3 790 B9R1.69 c1c(c(cnc1Cl)O)O AB69329 [0,1,0,0,0,0|2,0,0]=3 791 B9R1.69 c1c(c(cnc1F)Br)Cl AB66391 [0,1,0,0,0,0|3,0,0]=4 792 B9R1.69 c1c(c(cnc1F)Br)N PB22736 [0,1,0,0,0,0|3,0,0]=4 793 B9R1.69 c1c(c(cnc1F)Cl)I AB17633 [0,1,0,0,0,0|3,0,0]=4 794 B9R1.69 c1c(c(cnc1F)N)Cl AB75066 [0,1,0,0,0,0|3,0,0]=4 795 B9R1.69 c1c(c(cnc1F)N)N AB51225 [0,1,0,0,0,0|3,0,0]=4 796 B9R1.69 c1c(c(cnc1F)O)Cl AB71151 [0,1,0,0,0,0|2,0,0]=3 797 B9R1.69 c1c(c(cnc1I)Br)Cl AB73519 [0,1,0,0,0,0|3,0,0]=4 798 B9R1.69 c1c(c(cnc1I)Br)F AB73522 [0,1,0,0,0,0|3,0,0]=4 799 B9R1.69 c1c(c(cnc1I)Cl)Cl AB70215 [0,1,0,0,0,0|3,0,0]=4 800 B9R1.69 c1c(c(cnc1N)Br)Cl PB17989 [0,1,0,0,0,0|3,0,0]=4 801 B9R1.69 c1c(c(cnc1N)Cl)Br AB70622 [0,1,0,0,0,0|3,0,0]=4 802 B9R1.69 c1c(c(cnc1N)Cl)Cl AB41930 [0,1,0,0,0,0|3,0,0]=4 803 B9R1.69 c1c(c(cnc1N)Cl)F AB82981 [0,1,0,0,0,0|3,0,0]=4 804 B9R1.69 c1c(c(cnc1N)Cl)I AB72299 [0,1,0,0,0,0|3,0,0]=4 805 B9R1.69 c1c(c(cnc1N)Cl)N AB70629 [0,1,0,0,0,0|3,0,0]=4 806 B9R1.69 c1c(c(cnc1N)Cl)O AB42978 [0,1,0,0,0,0|2,0,0]=3 807 B9R1.69 c1c(c(cnc1N)F)Cl AB83155 [0,1,0,0,0,0|3,0,0]=4 808 B9R1.69 c1c(c(cnc1N)N)Cl AB64825 [0,1,0,0,0,0|3,0,0]=4 809 B9R1.69 c1c(c(cnc1N)N)N AB60253 [0,1,0,0,0,0|3,0,0]=4 810 B9R1.69 c1c(c(cnc1N)O)Cl AB84009 [0,1,0,0,0,0|2,0,0]=3 811 B9R1.69 c1c(c(cnc1O)Cl)F AB71160 [0,1,0,0,0,0|3,0,0]=4 812 B9R1.69 c1c(c(cnc1O)Cl)N AB70866 [0,1,0,0,0,0|3,0,0]=4 813 B9R1.69 c1c(c(cnc1O)F)Cl AB71159 [0,1,0,0,0,0|3,0,0]=4 814 B9R1.69 c1c(c(cnc1O)N)Cl AB83889 [0,1,0,0,0,0|3,0,0]=4 815 B9R1.69 c1c(c(cnc1O)O)Cl AB84006 [0,1,0,0,0,0|2,0,0]=3 816 B9R1.69 c1c(cnc(c1Br)Cl)Cl AB25941 [0,1,0,0,0,0|3,0,0]=4 817 B9R1.69 c1c(cnc(c1Br)Cl)F AB13638 [0,1,0,0,0,0|3,0,0]=4 818 B9R1.69 c1c(cnc(c1Br)Cl)N CB10761 [0,1,0,0,0,0|3,0,0]=4 819 B9R1.69 c1c(cnc(c1Br)Cl)O CB11311 [0,1,0,0,0,0|3,0,0]=4 820 B9R1.69 c1c(cnc(c1Br)F)Cl AB20989 [0,1,0,0,0,0|3,0,0]=4 821 B9R1.69 c1c(cnc(c1Br)I)Cl AB64692 [0,1,0,0,0,0|3,0,0]=4 822 B9R1.69 c1c(cnc(c1Br)N)Br AB01699 [0,1,0,0,0,0|3,0,0]=4 823 B9R1.69 c1c(cnc(c1Br)N)Cl AB07737 [0,1,0,0,0,0|3,0,0]=4 824 B9R1.69 c1c(cnc(c1Br)N)I AB44276 [0,1,0,0,0,0|3,0,0]=4 825 B9R1.69 c1c(cnc(c1Br)O)Br AB01360 [0,1,0,0,0,0|2,0,0]=3 826 B9R1.69 c1c(cnc(c1Br)O)Cl AB09921 [0,1,0,0,0,0|2,0,0]=3 827 B9R1.69 c1c(cnc(c1Cl)Br)Br PB18868 [0,1,0,0,0,0|3,0,0]=4 828 B9R1.69 c1c(cnc(c1Cl)Br)Cl AB05062 [0,1,0,0,0,0|3,0,0]=4 829 B9R1.69 c1c(cnc(c1Cl)Br)F AB66730 [0,1,0,0,0,0|3,0,0]=4 830 B9R1.69 c1c(cnc(c1Cl)Cl)I PB23692 [0,1,0,0,0,0|3,0,0]=4 831 B9R1.69 c1c(cnc(c1Cl)F)Br AB52757 [0,1,0,0,0,0|3,0,0]=4 832 B9R1.69 c1c(cnc(c1Cl)F)N AB75047 [0,1,0,0,0,0|3,0,0]=4 833 B9R1.69 c1c(cnc(c1Cl)F)O AB43291 [0,1,0,0,0,0|3,0,0]=4 834 B9R1.69 c1c(cnc(c1Cl)N)Br AB63574 [0,1,0,0,0,0|3,0,0]=4 835 B9R1.69 c1c(cnc(c1Cl)N)Cl AB00689 [0,1,0,0,0,0|3,0,0]=4 836 B9R1.69 c1c(cnc(c1Cl)N)F AB50026 [0,1,0,0,0,0|3,0,0]=4 837 B9R1.69 c1c(cnc(c1Cl)N)N AB70626 [0,1,0,0,0,0|3,0,0]=4 838 B9R1.69 c1c(cnc(c1Cl)O)Br AB05076 [0,1,0,0,0,0|2,0,0]=3 839 B9R1.69 c1c(cnc(c1Cl)O)Cl AB03534 [0,1,0,0,0,0|2,0,0]=3 840 B9R1.69 c1c(cnc(c1Cl)O)F AB66743 [0,1,0,0,0,0|2,0,0]=3 841 B9R1.69 c1c(cnc(c1Cl)O)N AB76242 [0,1,0,0,0,0|2,0,0]=3 842 B9R1.69 c1c(cnc(c1Cl)O)O AB71133 [0,1,0,0,0,0|2,0,0]=3 843 B9R1.69 c1c(cnc(c1F)Br)Cl AB62913 [0,1,0,0,0,0|3,0,0]=4 844 B9R1.69 c1c(cnc(c1F)Cl)Br AB14161 [0,1,0,0,0,0|3,0,0]=4 845 B9R1.69 c1c(cnc(c1F)Cl)N AB75042 [0,1,0,0,0,0|3,0,0]=4 846 B9R1.69 c1c(cnc(c1F)Cl)O AB14157 [0,1,0,0,0,0|3,0,0]=4 847 B9R1.69 c1c(cnc(c1F)I)Br AB73520 [0,1,0,0,0,0|3,0,0]=4 848 B9R1.69 c1c(cnc(c1F)N)Cl AB53928 [0,1,0,0,0,0|3,0,0]=4 849 B9R1.69 c1c(cnc(c1F)O)Br AB40961 [0,1,0,0,0,0|2,0,0]=3 850 B9R1.69 c1c(cnc(c1F)O)Cl AB41032 [0,1,0,0,0,0|2,0,0]=3 851 B9R1.69 c1c(cnc(c1I)Cl)Br AB48194 [0,1,0,0,0,0|3,0,0]=4 852 B9R1.69 c1c(cnc(c1I)Cl)F AB13622 [0,1,0,0,0,0|3,0,0]=4 853 B9R1.69 c1c(cnc(c1I)N)Br AB25852 [0,1,0,0,0,0|3,0,0]=4 854 B9R1.69 c1c(cnc(c1I)N)Cl AB42079 [0,1,0,0,0,0|3,0,0]=4 855 B9R1.69 c1c(cnc(c1I)N)F AB48199 [0,1,0,0,0,0|3,0,0]=4 856 B9R1.69 c1c(cnc(c1I)O)Br AB48195 [0,1,0,0,0,0|2,0,0]=3 857 B9R1.69 c1c(cnc(c1N)Br)Br PB32717 [0,1,0,0,0,0|3,0,0]=4 858 B9R1.69 c1c(cnc(c1N)Br)F AB21745 [0,1,0,0,0,0|3,0,0]=4 859 B9R1.69 c1c(cnc(c1N)Cl)Br PB21183 [0,1,0,0,0,0|3,0,0]=4 860 B9R1.69 c1c(cnc(c1N)Cl)Cl AB04748 [0,1,0,0,0,0|3,0,0]=4 861 B9R1.69 c1c(cnc(c1N)Cl)F AB44890 [0,1,0,0,0,0|3,0,0]=4 862 B9R1.69 c1c(cnc(c1N)Cl)I AB17086 [0,1,0,0,0,0|3,0,0]=4 863 B9R1.69 c1c(cnc(c1N)Cl)N AB51565 [0,1,0,0,0,0|3,0,0]=4 864 B9R1.69 c1c(cnc(c1N)Cl)O AB70860 [0,1,0,0,0,0|3,0,0]=4 865 B9R1.69 c1c(cnc(c1N)F)Cl AB25964 [0,1,0,0,0,0|3,0,0]=4 866 B9R1.69 c1c(cnc(c1N)N)Br PB10156 [0,1,0,0,0,0|3,0,0]=4 867 B9R1.69 c1c(cnc(c1N)N)Cl AB08400 [0,1,0,0,0,0|3,0,0]=4 868 B9R1.69 c1c(cnc(c1N)N)I AB60257 [0,1,0,0,0,0|3,0,0]=4 869 B9R1.69 c1c(cnc(c1N)O)Br AB16428 [0,1,0,0,0,0|2,0,0]=3 870 B9R1.69 c1c(cnc(c1N)O)Cl AB40990 [0,1,0,0,0,0|2,0,0]=3 871 B9R1.69 c1c(cnc(c1N)O)N AB64414 [0,1,0,0,0,0|2,0,0]=3 872 B9R1.69 c1c(cnc(c1N)S)Br AB40982 [0,1,0,0,0,0|2,1,0]=4 873 B9R1.69 c1c(cnc(c1N)S)Cl AB41057 [0,1,0,0,0,0|2,1,0]=4 874 B9R1.69 c1c(cnc(c1O)Br)F MB09912 [0,1,0,0,0,0|2,0,0]=3 875 B9R1.69 c1c(cnc(c1O)Cl)Br PB17565 [0,1,0,0,0,0|2,0,0]=3 876 B9R1.69 c1c(cnc(c1O)Cl)Cl AB66760 [0,1,0,0,0,0|2,0,0]=3 877 B9R1.69 c1c(cnc(c1O)Cl)F AB13634 [0,1,0,0,0,0|2,0,0]=3 878 B9R1.69 c1c(cnc(c1O)Cl)N AB76704 [0,1,0,0,0,0|2,0,0]=3 879 B9R1.69 c1c(cnc(c1O)Cl)O AB71129 [0,1,0,0,0,0|2,0,0]=3 880 B9R1.69 c1cc([n+](cc1Br)[O-])Br AB23015 [0,1,0,0,0,0|2,0,1]=4 881 B9R1.69 c1cc(c(cc1Br)Br)I AB51495 [0,1,0,0,0,0|2,0,0]=3 882 B9R1.69 c1cc(c(cc1Br)Cl)O AB00210 [0,1,0,0,0,0|1,0,0]=2 883 B9R1.69 c1cc(c(cc1Br)I)N AB10839 [0,1,0,0,0,0|2,0,0]=3 884 B9R1.69 c1cc(c(cc1Br)I)O MB06781 [0,1,0,0,0,0|1,0,0]=2 885 B9R1.69 c1cc(c(cc1Br)N)I AB51497 [0,1,0,0,0,0|2,0,0]=3 886 B9R1.69 c1cc(c(cc1Br)N)N AB11949 [0,1,0,0,0,0|2,0,0]=3 887 B9R1.69 c1cc(c(cc1Br)N)O MB01067 [0,1,0,0,0,0|1,0,0]=2 888 B9R1.69 c1cc(c(cc1Br)N)S AB54823 [0,1,0,0,0,0|1,1,0]=3 889 B9R1.69 c1cc(c(cc1Br)O)I MB25447 [0,1,0,0,0,0|1,0,0]=2 890 B9R1.69 c1cc(c(cc1Br)O)N AB13424 [0,1,0,0,0,0|1,0,0]=2 891 B9R1.69 c1cc(c(cc1Br)S)N AB07437 [0,1,0,0,0,0|1,1,0]=3 892 B9R1.69 c1cc(c(cc1Cl)I)N PB21792 [0,1,0,0,0,0|2,0,0]=3 893 B9R1.69 c1cc(c(cc1Cl)I)O MB05977 [0,1,0,0,0,0|1,0,0]=2 894 B9R1.69 c1cc(c(cc1Cl)N)I AB28269 [0,1,0,0,0,0|2,0,0]=3 895 B9R1.69 c1cc(c(cc1Cl)O)F MB03336 [0,1,0,0,0,0|1,0,0]=2 896 B9R1.69 c1cc(c(cc1Cl)O)I MB07629 [0,1,0,0,0,0|1,0,0]=2 897 B9R1.69 c1cc(c(cc1Cl)S)N AB13353 [0,1,0,0,0,0|1,1,0]=3 898 B9R1.69 c1cc(c(cc1F)F)I MB00398 [0,1,0,0,0,0|2,0,0]=3 899 B9R1.69 c1cc(c(cc1F)I)N AB01932 [0,1,0,0,0,0|2,0,0]=3 900 B9R1.69 c1cc(c(cc1F)I)O MB14767 [0,1,0,0,0,0|1,0,0]=2 901 B9R1.69 c1cc(c(cc1F)N)N AB01910 [0,1,0,0,0,0|2,0,0]=3 902 B9R1.69 c1cc(c(cc1F)N)S AB54821 [0,1,0,0,0,0|1,1,0]=3 903 B9R1.69 c1cc(c(cc1F)O)I MB25431 [0,1,0,0,0,0|1,0,0]=2 904 B9R1.69 c1cc(c(cc1F)S)N AB54817 [0,1,0,0,0,0|1,1,0]=3 905 B9R1.69 c1cc(c(cc1I)Br)O MB10373 [0,1,0,0,0,0|1,0,0]=2 906 B9R1.69 c1cc(c(cc1I)Cl)O MB09341 [0,1,0,0,0,0|1,0,0]=2 907 B9R1.69 c1cc(c(cc1I)F)O MB09308 [0,1,0,0,0,0|1,0,0]=2 908 B9R1.69 c1cc(c(cc1I)I)O MB01999 [0,1,0,0,0,0|1,0,0]=2 909 B9R1.69 c1cc(c(cc1I)N)Cl AB64100 [0,1,0,0,0,0|2,0,0]=3 910 B9R1.69 c1cc(c(cc1I)N)O MB14432 [0,1,0,0,0,0|1,0,0]=2 911 B9R1.69 c1cc(c(cc1I)O)Br MB08154 [0,1,0,0,0,0|1,0,0]=2 912 B9R1.69 c1cc(c(cc1I)O)F MB14983 [0,1,0,0,0,0|1,0,0]=2 913 B9R1.69 c1cc(c(cc1I)O)I MB07529 [0,1,0,0,0,0|1,0,0]=2 914 B9R1.69 c1cc(c(cc1I)O)N MB14436 [0,1,0,0,0,0|1,0,0]=2 915 B9R1.69 c1cc(c(cc1N)Cl)I AB02146 [0,1,0,0,0,0|2,0,0]=3 916 B9R1.69 c1cc(c(cc1N)F)Cl AB08243 [0,1,0,0,0,0|2,0,0]=3 917 B9R1.69 c1cc(c(cc1N)F)I AB42340 [0,1,0,0,0,0|2,0,0]=3 918 B9R1.69 c1cc(c(cc1N)F)N MB08293 [0,1,0,0,0,0|2,0,0]=3 919 B9R1.69 c1cc(c(cc1N)I)Cl MB09944 [0,1,0,0,0,0|2,0,0]=3 920 B9R1.69 c1cc(c(cc1N)O)Br MB08323 [0,1,0,0,0,0|1,0,0]=2 921 B9R1.69 c1cc(c(cc1N)O)F MB13362 [0,1,0,0,0,0|1,0,0]=2 922 B9R1.69 c1cc(c(cc1N)O)I MB37209 [0,1,0,0,0,0|1,0,0]=2 923 B9R1.69 c1cc(c(cc1O)Br)Br MB00539 [0,1,0,0,0,0|2,0,0]=3 924 B9R1.69 c1cc(c(cc1O)Br)Cl MB00535 [0,1,0,0,0,0|2,0,0]=3 925 B9R1.69 c1cc(c(cc1O)Br)I MB26105 [0,1,0,0,0,0|2,0,0]=3 926 B9R1.69 c1cc(c(cc1O)Br)N MB08329 [0,1,0,0,0,0|2,0,0]=3 927 B9R1.69 c1cc(c(cc1O)Cl)I MB25466 [0,1,0,0,0,0|2,0,0]=3 928 B9R1.69 c1cc(c(cc1O)Cl)N MB01478 [0,1,0,0,0,0|2,0,0]=3 929 B9R1.69 c1cc(c(cc1O)F)I MB11930 [0,1,0,0,0,0|2,0,0]=3 930 B9R1.69 c1cc(c(cc1O)F)N AB09438 [0,1,0,0,0,0|2,0,0]=3 931 B9R1.69 c1cc(c(cc1O)I)Br MB00538 [0,1,0,0,0,0|2,0,0]=3 932 B9R1.69 c1cc(c(cc1O)I)F MB25606 [0,1,0,0,0,0|2,0,0]=3 933 B9R1.69 c1cc(c(cc1O)I)I MB25449 [0,1,0,0,0,0|2,0,0]=3 934 B9R1.69 c1cc(c(cc1O)I)N MB25412 [0,1,0,0,0,0|2,0,0]=3 935 B9R1.69 c1cc(c(cc1O)N)Br MB07114 [0,1,0,0,0,0|2,0,0]=3 936 B9R1.69 c1cc(c(cc1O)N)I MB13452 [0,1,0,0,0,0|2,0,0]=3 937 B9R1.69 c1cc(c(cc1O)N)N MB04238 [0,1,0,0,0,0|2,0,0]=3 938 B9R1.69 c1cc(nc(c1Br)Cl)I AB73525 [0,1,0,0,0,0|3,0,0]=4 939 B9R1.69 c1cc(nc(c1Br)F)I AB73526 [0,1,0,0,0,0|3,0,0]=4 940 B9R1.69 c1cc(nc(c1Br)I)N CB11794 [0,1,0,0,0,0|3,0,0]=4 941 B9R1.69 c1cc(nc(c1Br)N)Br AB13816 [0,1,0,0,0,0|3,0,0]=4 942 B9R1.69 c1cc(nc(c1Br)N)Cl AB68223 [0,1,0,0,0,0|3,0,0]=4 943 B9R1.69 c1cc(nc(c1Br)N)N PB14375 [0,1,0,0,0,0|3,0,0]=4 944 B9R1.69 c1cc(nc(c1Cl)F)Br AB74962 [0,1,0,0,0,0|3,0,0]=4 945 B9R1.69 c1cc(nc(c1Cl)F)N AB74549 [0,1,0,0,0,0|3,0,0]=4 946 B9R1.69 c1cc(nc(c1Cl)F)O AB71143 [0,1,0,0,0,0|3,0,0]=4 947 B9R1.69 c1cc(nc(c1Cl)N)Br AB68234 [0,1,0,0,0,0|3,0,0]=4 948 B9R1.69 c1cc(nc(c1Cl)N)Cl AB06148 [0,1,0,0,0,0|3,0,0]=4 949 B9R1.69 c1cc(nc(c1Cl)N)N AB03196 [0,1,0,0,0,0|3,0,0]=4 950 B9R1.69 c1cc(nc(c1Cl)N)O AB83953 [0,1,0,0,0,0|3,0,0]=4 951 B9R1.69 c1cc(nc(c1Cl)O)Br AB84077 [0,1,0,0,0,0|2,0,0]=3 952 B9R1.69 c1cc(nc(c1Cl)O)Cl AB10185 [0,1,0,0,0,0|2,0,0]=3 953 B9R1.69 c1cc(nc(c1Cl)O)N AB84080 [0,1,0,0,0,0|2,0,0]=3 954 B9R1.69 c1cc(nc(c1Cl)O)O AB84078 [0,1,0,0,0,0|2,0,0]=3 955 B9R1.69 c1cc(nc(c1F)Br)Cl AB74954 [0,1,0,0,0,0|3,0,0]=4 956 B9R1.69 c1cc(nc(c1F)Cl)Br AB74951 [0,1,0,0,0,0|3,0,0]=4 957 B9R1.69 c1cc(nc(c1F)Cl)N AB75035 [0,1,0,0,0,0|3,0,0]=4 958 B9R1.69 c1cc(nc(c1F)Cl)O AB71136 [0,1,0,0,0,0|3,0,0]=4 959 B9R1.69 c1cc(nc(c1F)N)Cl AB73059 [0,1,0,0,0,0|3,0,0]=4 960 B9R1.69 c1cc(nc(c1F)O)Cl AB83102 [0,1,0,0,0,0|2,0,0]=3 961 B9R1.69 c1cc(nc(c1N)Br)Br PB17118 [0,1,0,0,0,0|3,0,0]=4 962 B9R1.69 c1cc(nc(c1N)Br)Cl PB34600 [0,1,0,0,0,0|3,0,0]=4 963 B9R1.69 c1cc(nc(c1N)Cl)Br AB20901 [0,1,0,0,0,0|3,0,0]=4 964 B9R1.69 c1cc(nc(c1N)Cl)Cl AB01354 [0,1,0,0,0,0|3,0,0]=4 965 B9R1.69 c1cc(nc(c1N)Cl)N AB83963 [0,1,0,0,0,0|3,0,0]=4 966 B9R1.69 c1cc(nc(c1N)Cl)O AB70861 [0,1,0,0,0,0|3,0,0]=4 967 B9R1.69 c1cc(nc(c1N)N)Br AB60264 [0,1,0,0,0,0|3,0,0]=4 968 B9R1.69 c1cc(nc(c1N)N)Cl PB14154 [0,1,0,0,0,0|3,0,0]=4 969 B9R1.69 c1cc(nc(c1N)N)F AB66676 [0,1,0,0,0,0|3,0,0]=4 970 B9R1.69 c1cc(nc(c1N)N)N AB03630 [0,1,0,0,0,0|3,0,0]=4 971 B9R1.69 c1cc(nc(c1N)O)Br AB26870 [0,1,0,0,0,0|2,0,0]=3 972 B9R1.69 c1cc(nc(c1O)Cl)Br AB64867 [0,1,0,0,0,0|2,0,0]=3 973 B9R1.69 c1cc(nc(c1O)Cl)Cl AB62926 [0,1,0,0,0,0|2,0,0]=3 974 B9R1.69 c1cc(nc(c1O)Cl)N AB84093 [0,1,0,0,0,0|2,0,0]=3 975 B9R1.69 c1cc(nc(c1O)Cl)O AB71131 [0,1,0,0,0,0|2,0,0]=3 976 B9R1.69 c1cc(nc(c1O)N)Br AB63559 [0,1,0,0,0,0|2,0,0]=3 977 B9R1.69 c1cc(nc(c1O)N)Cl AB69334 [0,1,0,0,0,0|2,0,0]=3 978 B7R1.4 CC1=C(C=NC1)C PB27606 [0,0,0,0,1,0|2,0,1]=4 979 B7R1.4 Cc1c(cco1)N AB71442 [0,0,0,0,1,0|2,0,0]=3 980 B7R1.4 Cc1c(cno1)N MB10128 [0,0,0,0,1,0|3,0,0]=4 981 B7R1.4 Cc1c(con1)N MB11367 [0,0,0,0,1,0|3,0,0]=4 982 B7R1.4 Cc1c(nco1)N MB11380 [0,0,0,0,1,0|3,0,0]=4 983 B7R1.4 Cc1c(ocn1)C AB63543 [0,0,0,0,1,0|3,0,0]=4 984 B7R1.4 Cc1c(ocn1)N MB11381 [0,0,0,0,1,0|3,0,0]=4 985 B7R1.4 Cc1ccsc1Br PB25943 [0,0,0,0,1,0|2,0,0]=3 986 B7R1.4 Cc1cnoc1N MB11360 [0,0,0,0,1,0|3,0,0]=4 987 B7R1.4 Cc1conc1N MB11363 [0,0,0,0,1,0|3,0,0]=4 988 B7R1.4 Cc1nccn1N AB44383 [0,0,0,0,1,0|3,0,0]=4 989 B7R1.4 Cn1c(ccn1)N PB33809 [0,0,0,0,1,0|3,0,0]=4 990 B7R1.4 Cn1ccnc1Br AB11315 [0,0,0,0,1,0|3,0,0]=4 991 B7R1.4 Cn1ccnc1Cl AB11324 [0,0,0,0,1,0|3,0,0]=4 992 B7R1.4 Cn1ccnc1I PB32223 [0,0,0,0,1,0|3,0,0]=4 993 B7R1.4 Cn1ccnc1N AB59774 [0,0,0,0,1,0|3,0,0]=4 994 B7R1.4 Cn1cncc1Br AB09509 [0,0,0,0,1,0|3,0,0]=4 995 B7R1.4 Cn1cncc1I PB12244 [0,0,0,0,1,0|3,0,0]=4 996 B7R1.4 c1c(c(cs1)Br)Br AB00432 [0,0,0,0,1,0|3,0,0]=4 997 B7R1.4 c1coc(c1N)Br AB71394 [0,0,0,0,1,0|3,0,0]=4 998 B8R1.2 C#Cc1ccccn1 PB17077 [1,1,0,0,0,0|1,0,1]=4 999 B8R1.2 C#Cc1cccnc1 PB29186 [1,1,0,0,0,0|1,0,1]=4 1000 B8R1.2 C#Cc1ccncc1 PB29291 [1,1,0,0,0,0|1,0,1]=4 1001 B8R1.2 CNc1cccnc1 AB09114 [1,1,0,0,0,0|1,0,0]=3 1002 B8R1.2 CNc1ccncn1 AB60623 [1,1,0,0,0,0|2,0,0]=4 1003 B8R1.2 CNc1cncnc1 AB60774 [1,1,0,0,0,0|2,0,0]=4 1004 B8R1.2 CNc1ncccn1 AB05135 [1,1,0,0,0,0|2,0,0]=4 1005 B8R1.2 COc1cccnc1 AB06864 [1,1,0,0,0,0|1,0,0]=3 1006 B8R1.2 COc1cccnn1 AB05130 [1,1,0,0,0,0|2,0,0]=4 1007 B8R1.2 COc1ccnnc1 AB44150 [1,1,0,0,0,0|2,0,0]=4 1008 B8R1.2 c1c(cncn1)CCl PB31962 [1,1,0,0,0,0|2,0,0]=4 1009 B8R1.2 c1c(cncn1)CCl PB34530 [1,1,0,0,0,0|2,0,0]=4 1010 B8R1.2 c1c(cncn1)CN PB26277 [1,1,0,0,0,0|2,0,0]=4 1011 B8R1.2 c1c(cncn1)CO PB18631 [1,1,0,0,0,0|2,0,0]=4 1012 B8R1.2 c1cc(cnc1)C=O AB00744 [1,1,0,0,0,0|1,0,1]=4 1013 B8R1.2 c1cc(cnc1)CCl AB01984 [1,1,0,0,0,0|1,0,0]=3 1014 B8R1.2 c1cc(cnc1)CN AB00752 [1,1,0,0,0,0|1,0,0]=3 1015 B8R1.2 c1cc(cnc1)NN AB42924 [1,1,0,0,0,0|2,0,0]=4 1016 B8R1.2 c1cc(cnc1)NN PB18886 [1,1,0,0,0,0|2,0,0]=4 1017 B8R1.2 c1cc(nnc1)CCl PB28814 [1,1,0,0,0,0|2,0,0]=4 1018 B8R1.2 c1cc(nnc1)CN PB29341 [1,1,0,0,0,0|2,0,0]=4 1019 B8R1.2 c1cc(nnc1)CO PB30818 [1,1,0,0,0,0|2,0,0]=4 1020 B8R1.2 c1ccnc(c1)C=O AB00680 [1,1,0,0,0,0|1,0,1]=4 1021 B8R1.2 c1ccnc(c1)CBr MB02148 [1,1,0,0,0,0|1,0,0]=3 1022 B8R1.2 c1ccnc(c1)CCl AB22495 [1,1,0,0,0,0|1,0,0]=3 1023 B8R1.2 c1ccnc(c1)CN AB00731 [1,1,0,0,0,0|1,0,0]=3 1024 B8R1.2 c1cnc(cn1)CCl PB20483 [1,1,0,0,0,0|2,0,0]=4 1025 B8R1.2 c1cnc(cn1)CN PB14180 [1,1,0,0,0,0|2,0,0]=4 1026 B8R1.2 c1cnc(cn1)CO PB21779 [1,1,0,0,0,0|2,0,0]=4 1027 B8R1.2 c1cnc(nc1)CCl PB20403 [1,1,0,0,0,0|2,0,0]=4 1028 B8R1.2 c1cnc(nc1)CN CB11589 [1,1,0,0,0,0|2,0,0]=4 1029 B8R1.2 c1cnc(nc1)CN PB23443 [1,1,0,0,0,0|2,0,0]=4 1030 B8R1.2 c1cnc(nc1)CO PB12410 [1,1,0,0,0,0|2,0,0]=4 1031 B8R1.2 c1cnccc1C=O AB00754 [1,1,0,0,0,0|1,0,1]=4 1032 B8R1.2 c1cnccc1CCl AB15539 [1,1,0,0,0,0|1,0,0]=3 1033 B8R1.2 c1cnccc1CN AB00767 [1,1,0,0,0,0|1,0,0]=3 1034 B8R1.2 c1cnccc1NN PB27392 [1,1,0,0,0,0|2,0,0]=4 1035 B8R1.2 c1cnccc1ON AB31585 [1,1,0,0,0,0|1,0,0]=3 1036 B8R1.2 c1cncnc1CCl AB58895 [1,1,0,0,0,0|2,0,0]=4 1037 B8R1.2 c1cncnc1CN PB10439 [1,1,0,0,0,0|2,0,0]=4 1038 B8R1.2 c1cncnc1CO PB12296 [1,1,0,0,0,0|2,0,0]=4 1039 B8R1.2 c1cnncc1CN PB31361 [1,1,0,0,0,0|2,0,0]=4 1040 B8R1.2 c1cnncc1CO PB26178 [1,1,0,0,0,0|2,0,0]=4 1041 B8R1.3 Cc1ccc(=O)[nH]n1 PB21643 [1,1,0,0,0,0|2,0,0]=4 1042 B8R1.3 Cc1ccc(cn1)Br AB06624 [1,1,0,0,0,0|1,0,0]=3 1043 B8R1.3 Cc1ccc(cn1)Cl AB17956 [1,1,0,0,0,0|1,0,0]=3 1044 B8R1.3 Cc1ccc(cn1)F PB18589 [1,1,0,0,0,0|1,0,0]=3 1045 B8R1.3 Cc1ccc(cn1)N PB32227 [1,1,0,0,0,0|1,0,0]=3 1046 B8R1.3 Cc1ccc(cn1)O PB30543 [1,1,0,0,0,0|1,0,0]=3 1047 B8R1.3 Cc1ccc(nc1)Br PB17145 [1,1,0,0,0,0|1,0,0]=3 1048 B8R1.3 Cc1ccc(nc1)Cl AB07104 [1,1,0,0,0,0|1,0,0]=3 1049 B8R1.3 Cc1ccc(nc1)F AB01857 [1,1,0,0,0,0|1,0,0]=3 1050 B8R1.3 Cc1ccc(nc1)N AB17938 [1,1,0,0,0,0|1,0,0]=3 1051 B8R1.3 Cc1ccc(nc1)O AB13138 [1,1,0,0,0,0|1,0,0]=3 1052 B8R1.3 Cc1ccc(nn1)Br PB26503 [1,1,0,0,0,0|2,0,0]=4 1053 B8R1.3 Cc1ccc(nn1)Cl PB20885 [1,1,0,0,0,0|2,0,0]=4 1054 B8R1.3 Cc1ccc(nn1)I PB11607 [1,1,0,0,0,0|2,0,0]=4 1055 B8R1.3 Cc1ccc(nn1)N PB33947 [1,1,0,0,0,0|2,0,0]=4 1056 B8R1.3 Cc1cnc(cn1)Br PB27954 [1,1,0,0,0,0|2,0,0]=4 1057 B8R1.3 Cc1cnc(cn1)Cl AB02272 [1,1,0,0,0,0|2,0,0]=4 1058 B8R1.3 Cc1cnc(cn1)N PB32613 [1,1,0,0,0,0|2,0,0]=4 1059 B8R1.3 Cc1cnc(nc1)Cl PB25116 [1,1,0,0,0,0|2,0,0]=4 1060 B8R1.3 Cc1cnc(nc1)N AB06143 [1,1,0,0,0,0|2,0,0]=4 1061 B8R1.3 Cc1ncc(cn1)Br PB18804 [1,1,0,0,0,0|2,0,0]=4 1062 B8R1.3 Cc1ncc(cn1)Cl AB56396 [1,1,0,0,0,0|2,0,0]=4 1063 B8R1.3 Cc1ncc(cn1)N PB10666 [1,1,0,0,0,0|2,0,0]=4 1064 B8R1.3 Cc1ncc(cn1)O AB54467 [1,1,0,0,0,0|2,0,0]=4 1065 B8R1.3 c1c(cnc(n1)Br)O PB31459 [1,1,0,0,0,0|2,0,0]=4 1066 B8R1.3 c1c(cnc(n1)Cl)O PB12674 [1,1,0,0,0,0|2,0,0]=4 1067 B8R1.3 c1c(cnc(n1)N)O PB32565 [1,1,0,0,0,0|2,0,0]=4 1068 B8R1.3 c1c(cnc(n1)O)Br AB05049 [1,1,0,0,0,0|2,0,0]=4 1069 B8R1.3 c1c(cnc(n1)O)Cl AB03656 [1,1,0,0,0,0|2,0,0]=4 1070 B8R1.3 c1c(ncc(n1)Br)O PB26179 [1,1,0,0,0,0|2,0,0]=4 1071 B8R1.3 c1c(ncc(n1)Cl)O MB09316 [1,1,0,0,0,0|2,0,0]=4 1072 B8R1.3 c1c(ncc(n1)O)O AB44015 [1,1,0,0,0,0|2,0,0]=4 1073 B8R1.3 c1c[n+](ccc1F)[O-] PB19565 [1,1,0,0,0,0|1,0,1]=4 1074 B8R1.3 c1cc(ncc1Br)Br AB00634 [1,1,0,0,0,0|2,0,0]=4 1075 B8R1.3 c1cc(ncc1Br)Cl AB08767 [1,1,0,0,0,0|2,0,0]=4 1076 B8R1.3 c1cc(ncc1Br)F PB30707 [1,1,0,0,0,0|2,0,0]=4 1077 B8R1.3 c1cc(ncc1Br)N PB30536 [1,1,0,0,0,0|2,0,0]=4 1078 B8R1.3 c1cc(ncc1Br)O AB05097 [1,1,0,0,0,0|1,0,0]=3 1079 B8R1.3 c1cc(ncc1Br)S AB51097 [1,1,0,0,0,0|1,1,0]=4 1080 B8R1.3 c1cc(ncc1Cl)Br AB05069 [1,1,0,0,0,0|2,0,0]=4 1081 B8R1.3 c1cc(ncc1Cl)Cl AB00654 [1,1,0,0,0,0|2,0,0]=4 1082 B8R1.3 c1cc(ncc1Cl)F AB17577 [1,1,0,0,0,0|2,0,0]=4 1083 B8R1.3 c1cc(ncc1Cl)I AB32114 [1,1,0,0,0,0|2,0,0]=4 1084 B8R1.3 c1cc(ncc1Cl)N AB00712 [1,1,0,0,0,0|2,0,0]=4 1085 B8R1.3 c1cc(ncc1F)Br PB17160 [1,1,0,0,0,0|2,0,0]=4 1086 B8R1.3 c1cc(ncc1F)I AB42989 [1,1,0,0,0,0|2,0,0]=4 1087 B8R1.3 c1cc(ncc1F)N AB10107 [1,1,0,0,0,0|2,0,0]=4 1088 B8R1.3 c1cc(ncc1I)Br PB14333 [1,1,0,0,0,0|2,0,0]=4 1089 B8R1.3 c1cc(ncc1I)Cl AB10394 [1,1,0,0,0,0|2,0,0]=4 1090 B8R1.3 c1cc(ncc1I)N PB25985 [1,1,0,0,0,0|2,0,0]=4 1091 B8R1.3 c1cc(ncc1I)O AB05112 [1,1,0,0,0,0|1,0,0]=3 1092 B8R1.3 c1cc(ncc1N)Br PB17224 [1,1,0,0,0,0|2,0,0]=4 1093 B8R1.3 c1cc(ncc1N)Cl AB00661 [1,1,0,0,0,0|2,0,0]=4 1094 B8R1.3 c1cc(ncc1N)F PB33962 [1,1,0,0,0,0|2,0,0]=4 1095 B8R1.3 c1cc(ncc1N)O AB15078 [1,1,0,0,0,0|1,0,0]=3 1096 B8R1.3 c1cc(ncc1O)Br PB15771 [1,1,0,0,0,0|1,0,0]=3 1097 B8R1.3 c1cc(ncc1O)Cl PB32188 [1,1,0,0,0,0|1,0,0]=3 1098 B8R1.3 c1cc(ncc1O)F AB08123 [1,1,0,0,0,0|1,0,0]=3 1099 B8R1.3 c1cc(ncc1O)I AB50021 [1,1,0,0,0,0|1,0,0]=3 1100 B8R1.3 c1cc(ncc1O)N AB15563 [1,1,0,0,0,0|1,0,0]=3 1101 B8R1.3 c1cc(nnc1O)Cl PB29050 [1,1,0,0,0,0|2,0,0]=4 1102 B8R1.4 Cc1cc(ccn1)Br AB17599 [1,1,0,0,0,0|1,0,0]=3 1103 B8R1.4 Cc1cc(ccn1)Br PB26077 [1,1,0,0,0,0|1,0,0]=3 1104 B8R1.4 Cc1cc(ccn1)Cl AB01756 [1,1,0,0,0,0|1,0,0]=3 1105 B8R1.4 Cc1cc(ccn1)F AB17919 [1,1,0,0,0,0|1,0,0]=3 1106 B8R1.4 Cc1cc(ccn1)O PB24839 [1,1,0,0,0,0|1,0,0]=3 1107 B8R1.4 Cc1cc(cnc1)Br AB09597 [1,1,0,0,0,0|1,0,0]=3 1108 B8R1.4 Cc1cc(cnc1)Cl AB17994 [1,1,0,0,0,0|1,0,0]=3 1109 B8R1.4 Cc1cc(cnc1)F AB13643 [1,1,0,0,0,0|1,0,0]=3 1110 B8R1.4 Cc1cc(cnc1)N AB17573 [1,1,0,0,0,0|1,0,0]=3 1111 B8R1.4 Cc1cc(cnc1)O MB01362 [1,1,0,0,0,0|1,0,0]=3 1112 B8R1.4 Cc1cc(cnn1)N MB11385 [1,1,0,0,0,0|2,0,0]=4 1113 B8R1.4 Cc1cc(ncn1)C PB24534 [1,1,0,0,0,0|2,0,0]=4 1114 B8R1.4 Cc1cc(ncn1)Cl PB29204 [1,1,0,0,0,0|2,0,0]=4 1115 B8R1.4 Cc1cc(ncn1)N PB12118 [1,1,0,0,0,0|2,0,0]=4 1116 B8R1.4 Cc1cc(nnc1)Cl PB14716 [1,1,0,0,0,0|2,0,0]=4 1117 B8R1.4 Cc1cc(nnc1)N AB61142 [1,1,0,0,0,0|2,0,0]=4 1118 B8R1.4 Cc1cc[nH]c(=O)n1 PB19074 [1,1,0,0,0,0|2,0,0]=4 1119 B8R1.4 Cc1cccc(n1)Br AB01812 [1,1,0,0,0,0|1,0,0]=3 1120 B8R1.4 Cc1cccc(n1)Cl AB00666 [1,1,0,0,0,0|1,0,0]=3 1121 B8R1.4 Cc1cccc(n1)F AB01860 [1,1,0,0,0,0|1,0,0]=3 1122 B8R1.4 Cc1cccc(n1)N AB00717 [1,1,0,0,0,0|1,0,0]=3 1123 B8R1.4 Cc1cccc(n1)O AB00679 [1,1,0,0,0,0|1,0,0]=3 1124 B8R1.4 Cc1cccc(n1)S AB25230 [1,1,0,0,0,0|1,0,0]=3 1125 B8R1.4 Cc1ccnc(c1)Br AB03099 [1,1,0,0,0,0|1,0,0]=3 1126 B8R1.4 Cc1ccnc(c1)Cl PB10051 [1,1,0,0,0,0|1,0,0]=3 1127 B8R1.4 Cc1ccnc(c1)F AB01854 [1,1,0,0,0,0|1,0,0]=3 1128 B8R1.4 Cc1ccnc(c1)N AB00703 [1,1,0,0,0,0|1,0,0]=3 1129 B8R1.4 Cc1ccnc(c1)O AB03735 [1,1,0,0,0,0|1,0,0]=3 1130 B8R1.4 Cc1ccnc(n1)Cl PB14106 [1,1,0,0,0,0|2,0,0]=4 1131 B8R1.4 Cc1ccnc(n1)N MB00179 [1,1,0,0,0,0|2,0,0]=4 1132 B8R1.4 Cc1cncc(n1)Br AB48617 [1,1,0,0,0,0|2,0,0]=4 1133 B8R1.4 Cc1cncc(n1)Cl AB02267 [1,1,0,0,0,0|2,0,0]=4 1134 B8R1.4 Cc1cncc(n1)N AB43812 [1,1,0,0,0,0|2,0,0]=4 1135 B8R1.4 Cc1nccc(n1)Cl PB30633 [1,1,0,0,0,0|2,0,0]=4 1136 B8R1.4 Cc1nccc(n1)N AB06587 [1,1,0,0,0,0|2,0,0]=4 1137 B8R1.4 c1c(cncc1Br)Br AB01172 [1,1,0,0,0,0|2,0,0]=4 1138 B8R1.4 c1c(cncc1Br)Cl AB18001 [1,1,0,0,0,0|2,0,0]=4 1139 B8R1.4 c1c(cncc1Br)N PB12251 [1,1,0,0,0,0|2,0,0]=4 1140 B8R1.4 c1c(cncc1Br)O PB30658 [1,1,0,0,0,0|1,0,0]=3 1141 B8R1.4 c1c(cncc1Cl)Cl AB00743 [1,1,0,0,0,0|2,0,0]=4 1142 B8R1.4 c1c(cncc1Cl)F AB21896 [1,1,0,0,0,0|2,0,0]=4 1143 B8R1.4 c1c(cncc1Cl)N AB15758 [1,1,0,0,0,0|2,0,0]=4 1144 B8R1.4 c1c(cncc1F)F AB14383 [1,1,0,0,0,0|2,0,0]=4 1145 B8R1.4 c1c(cncc1F)N AB05123 [1,1,0,0,0,0|2,0,0]=4 1146 B8R1.4 c1c(cncc1F)O AB13569 [1,1,0,0,0,0|1,0,0]=3 1147 B8R1.4 c1c(cncc1I)Br AB13102 [1,1,0,0,0,0|2,0,0]=4 1148 B8R1.4 c1c(cncc1I)Cl AB43784 [1,1,0,0,0,0|2,0,0]=4 1149 B8R1.4 c1c(cncc1I)F AB45557 [1,1,0,0,0,0|2,0,0]=4 1150 B8R1.4 c1c(cncc1I)I PB19957 [1,1,0,0,0,0|2,0,0]=4 1151 B8R1.4 c1c(cncc1I)N AB43802 [1,1,0,0,0,0|2,0,0]=4 1152 B8R1.4 c1c(cncc1N)N AB07746 [1,1,0,0,0,0|2,0,0]=4 1153 B8R1.4 c1c(cncc1O)N AB17983 [1,1,0,0,0,0|1,0,0]=3 1154 B8R1.4 c1c(cncc1O)O MB02073 [1,1,0,0,0,0|1,0,0]=3 1155 B8R1.4 c1c(cnnc1O)Cl AB61137 [1,1,0,0,0,0|2,0,0]=4 1156 B8R1.4 c1c(nc(cn1)Cl)O MB00903 [1,1,0,0,0,0|2,0,0]=4 1157 B8R1.4 c1c(ncnc1Cl)O AB05055 [1,1,0,0,0,0|2,0,0]=4 1158 B8R1.4 c1c(ncnc1O)N AB02119 [1,1,0,0,0,0|2,0,0]=4 1159 B8R1.4 c1cc(c[n+](c1)[O-])Br AB09548 [1,1,0,0,0,0|1,0,1]=4 1160 B8R1.4 c1cc(nc(c1)Br)Br AB00637 [1,1,0,0,0,0|2,0,0]=4 1161 B8R1.4 c1cc(nc(c1)Br)Cl PB33830 [1,1,0,0,0,0|2,0,0]=4 1162 B8R1.4 c1cc(nc(c1)Br)F AB13626 [1,1,0,0,0,0|2,0,0]=4 1163 B8R1.4 c1cc(nc(c1)Br)N PB32140 [1,1,0,0,0,0|2,0,0]=4 1164 B8R1.4 c1cc(nc(c1)Br)O AB05100 [1,1,0,0,0,0|1,0,0]=3 1165 B8R1.4 c1cc(nc(c1)Cl)Cl AB00664 [1,1,0,0,0,0|2,0,0]=4 1166 B8R1.4 c1cc(nc(c1)Cl)F AB02970 [1,1,0,0,0,0|2,0,0]=4 1167 B8R1.4 c1cc(nc(c1)Cl)N PB26011 [1,1,0,0,0,0|2,0,0]=4 1168 B8R1.4 c1cc(nc(c1)F)N AB17974 [1,1,0,0,0,0|2,0,0]=4 1169 B8R1.4 c1cc(nc(c1)I)Cl AB42915 [1,1,0,0,0,0|2,0,0]=4 1170 B8R1.4 c1cc(nc(c1)I)I AB31088 [1,1,0,0,0,0|2,0,0]=4 1171 B8R1.4 c1cc(nc(c1)I)N AB42508 [1,1,0,0,0,0|2,0,0]=4 1172 B8R1.4 c1cnc(cc1Br)Br PB10210 [1,1,0,0,0,0|2,0,0]=4 1173 B8R1.4 c1cnc(cc1Br)Cl AB16617 [1,1,0,0,0,0|2,0,0]=4 1174 B8R1.4 c1cnc(cc1Br)F AB17567 [1,1,0,0,0,0|2,0,0]=4 1175 B8R1.4 c1cnc(cc1Br)I AB31627 [1,1,0,0,0,0|2,0,0]=4 1176 B8R1.4 c1cnc(cc1Br)N PB12936 [1,1,0,0,0,0|2,0,0]=4 1177 B8R1.4 c1cnc(cc1Cl)Br PB23373 [1,1,0,0,0,0|2,0,0]=4 1178 B8R1.4 c1cnc(cc1Cl)Cl AB07735 [1,1,0,0,0,0|2,0,0]=4 1179 B8R1.4 c1cnc(cc1Cl)F AB17564 [1,1,0,0,0,0|2,0,0]=4 1180 B8R1.4 c1cnc(cc1Cl)N PB32361 [1,1,0,0,0,0|2,0,0]=4 1181 B8R1.4 c1cnc(cc1Cl)O AB13188 [1,1,0,0,0,0|1,0,0]=3 1182 B8R1.4 c1cnc(cc1F)Br AB50032 [1,1,0,0,0,0|2,0,0]=4 1183 B8R1.4 c1cnc(cc1F)Cl AB17349 [1,1,0,0,0,0|2,0,0]=4 1184 B8R1.4 c1cnc(cc1F)F PB26122 [1,1,0,0,0,0|2,0,0]=4 1185 B8R1.4 c1cnc(cc1F)N AB50025 [1,1,0,0,0,0|2,0,0]=4 1186 B8R1.4 c1cnc(cc1I)Br PB29229 [1,1,0,0,0,0|2,0,0]=4 1187 B8R1.4 c1cnc(cc1I)Cl PB17253 [1,1,0,0,0,0|2,0,0]=4 1188 B8R1.4 c1cnc(cc1I)F PB12274 [1,1,0,0,0,0|2,0,0]=4 1189 B8R1.4 c1cnc(cc1I)N PB10642 [1,1,0,0,0,0|2,0,0]=4 1190 B8R1.4 c1cnc(cc1N)Br PB30686 [1,1,0,0,0,0|2,0,0]=4 1191 B8R1.4 c1cnc(cc1N)Cl PB24583 [1,1,0,0,0,0|2,0,0]=4 1192 B8R1.4 c1cnc(cc1N)F PB21208 [1,1,0,0,0,0|2,0,0]=4 1193 B8R1.4 c1cnc(cc1N)O PB15716 [1,1,0,0,0,0|1,0,0]=3 1194 B8R1.4 c1cnc(cc1O)Br AB05095 [1,1,0,0,0,0|1,0,0]=3 1195 B8R1.4 c1cnc(cc1O)Cl AB09576 [1,1,0,0,0,0|1,0,0]=3 1196 B8R1.4 c1cnc(cc1O)F AB17930 [1,1,0,0,0,0|1,0,0]=3 1197 B8R1.4 c1cnc(cc1O)I MB26582 [1,1,0,0,0,0|1,0,0]=3 1198 B8R1.4 c1cnc(cc1O)N AB17934 [1,1,0,0,0,0|1,0,0]=3 1199 B8R1.4 c1cnc(nc1Cl)O AB68453 [1,1,0,0,0,0|2,0,0]=4 1200 B8R1.11 Cc1c(ccs1)C#N AB71665 [0,1,0,0,1,0|2,0,0]=4 1201 B8R1.11 Cc1c(ccs1)C=O AB53893 [0,1,0,0,1,0|1,0,1]=4 1202 B8R1.11 Cc1c(ccs1)CCl AB76281 [0,1,0,0,1,0|2,0,0]=4 1203 B8R1.11 Cc1c(ncs1)CO AB44114 [0,1,0,0,1,0|2,0,0]=4 1204 B8R1.11 Cc1c(ocn1)CO MB03682 [0,1,0,0,1,0|2,0,0]=4 1205 B8R1.11 Cn1c(ccn1)CO PB14601 [0,1,0,0,1,0|2,0,0]=4 1206 B8R1.11 Cn1cccc1C#N AB12660 [0,1,0,0,1,0|2,0,0]=4 1207 B8R1.11 Cn1cncc1CO PB17276 [0,1,0,0,1,0|2,0,0]=4 1208 B8R1.11 c1csc(c1Br)CN PB34113 [0,1,0,0,1,0|2,0,0]=4 1209 B8R1.11 c1csc(c1Br)CO PB27714 [0,1,0,0,1,0|2,0,0]=4 1210 B8R1.11 c1csc(c1CBr)Br PB14291 [0,1,0,0,1,0|2,0,0]=4 1211 B8R1.11 c1csc(c1Cl)CN PB11803 [0,1,0,0,1,0|2,0,0]=4 1212 B8R1.11 c1csc(c1Cl)CO PB23440 [0,1,0,0,1,0|2,0,0]=4 1213 B8R1.18 Cc1c(cc(s1)Br)Br MB04800 [0,1,0,0,1,0|2,0,0]=4 1214 B10R1.2 CCc1cccc(c1Br)O MB24080 [0,2,0,0,0,0|1,0,0]=3 1215 B10R1.2 CCc1cccc(c1C)O MB24030 [0,2,0,0,0,0|0,0,0]=2 1216 B10R1.2 CCc1cccc(c1Cl)O MB24081 [0,2,0,0,0,0|1,0,0]=3 1217 B10R1.2 CCc1cccc(c1F)O MB24054 [0,2,0,0,0,0|1,0,0]=3 1218 B10R1.2 CCc1cccc(c1I)O MB24055 [0,2,0,0,0,0|1,0,0]=3 1219 B10R1.2 CCc1cccc(c1N)O MB24059 [0,2,0,0,0,0|1,0,0]=3 1220 B10R1.2 CCc1cccc(c1O)Br MB02008 [0,2,0,0,0,0|0,0,0]=2 1221 B10R1.2 CCc1cccc(c1O)Cl MB02005 [0,2,0,0,0,0|0,0,0]=2 1222 B10R1.2 CCc1cccc(c1O)F MB24014 [0,2,0,0,0,0|0,0,0]=2 1223 B10R1.2 CCc1cccc(c1O)I MB24016 [0,2,0,0,0,0|0,0,0]=2 1224 B10R1.2 CCc1cccc(c1O)N MB24022 [0,2,0,0,0,0|0,0,0]=2 1225 B10R1.2 CNc1cccc(c1Br)O MB28270 [0,2,0,0,0,0|1,0,0]=3 1226 B10R1.2 CNc1cccc(c1Cl)O MB26964 [0,2,0,0,0,0|1,0,0]=3 1227 B10R1.2 CNc1cccc(c1F)O MB34647 [0,2,0,0,0,0|1,0,0]=3 1228 B10R1.2 CNc1cccc(c1I)O MB29498 [0,2,0,0,0,0|1,0,0]=3 1229 B10R1.2 CNc1cccc(c1N)O MB33054 [0,2,0,0,0,0|1,0,0]=3 1230 B10R1.2 CNc1cccc(c1O)Br MB26263 [0,2,0,0,0,0|0,0,0]=2 1231 B10R1.2 CNc1cccc(c1O)Cl MB33654 [0,2,0,0,0,0|0,0,0]=2 1232 B10R1.2 CNc1cccc(c1O)F MB28274 [0,2,0,0,0,0|0,0,0]=2 1233 B10R1.2 CNc1cccc(c1O)I MB32214 [0,2,0,0,0,0|0,0,0]=2 1234 B10R1.2 CNc1cccc(c1O)N MB33525 [0,2,0,0,0,0|0,0,0]=2 1235 B10R1.2 COc1c(c(ccn1)Br)F AB71080 [0,2,0,0,0,0|2,0,0]=4 1236 B10R1.2 COc1c(c(ccn1)Cl)N AB71673 [0,2,0,0,0,0|2,0,0]=4 1237 B10R1.2 COc1c(c(ccn1)Cl)O AB75738 [0,2,0,0,0,0|1,0,0]=3 1238 B10R1.2 COc1c(c(ccn1)I)F AB71332 [0,2,0,0,0,0|2,0,0]=4 1239 B10R1.2 COc1c(c(ccn1)N)Br PB32978 [0,2,0,0,0,0|2,0,0]=4 1240 B10R1.2 COc1c(c(ccn1)N)Cl AB65262 [0,2,0,0,0,0|2,0,0]=4 1241 B10R1.2 COc1c(c(ccn1)N)F AB70892 [0,2,0,0,0,0|2,0,0]=4 1242 B10R1.2 COc1c(c(ccn1)N)N AB56399 [0,2,0,0,0,0|2,0,0]=4 1243 B10R1.2 COc1c(c(ccn1)O)Cl AB71177 [0,2,0,0,0,0|2,0,0]=4 1244 B10R1.2 COc1cccc(c1Br)O MB06929 [0,2,0,0,0,0|1,0,0]=3 1245 B10R1.2 COc1cccc(c1Cl)N PB11874 [0,2,0,0,0,0|1,0,0]=3 1246 B10R1.2 COc1cccc(c1Cl)O MB06074 [0,2,0,0,0,0|1,0,0]=3 1247 B10R1.2 COc1cccc(c1F)O MB09318 [0,2,0,0,0,0|1,0,0]=3 1248 B10R1.2 COc1cccc(c1I)O MB14766 [0,2,0,0,0,0|1,0,0]=3 1249 B10R1.2 COc1cccc(c1N)O MB12204 [0,2,0,0,0,0|1,0,0]=3 1250 B10R1.2 COc1cccc(c1O)Br PB18847 [0,2,0,0,0,0|0,0,0]=2 1251 B10R1.2 COc1cccc(c1O)Cl MB25402 [0,2,0,0,0,0|0,0,0]=2 1252 B10R1.2 COc1cccc(c1O)I MB09225 [0,2,0,0,0,0|0,0,0]=2 1253 B10R1.2 COc1cccc(c1O)N MB25613 [0,2,0,0,0,0|0,0,0]=2 1254 B10R1.2 COc1ccnc(c1Cl)N AB70635 [0,2,0,0,0,0|2,0,0]=4 1255 B10R1.2 COc1ccnc(c1Cl)O AB71172 [0,2,0,0,0,0|2,0,0]=4 1256 B10R1.2 COc1ccnc(c1I)N AB48785 [0,2,0,0,0,0|2,0,0]=4 1257 B10R1.2 COc1ccnc(c1N)Cl AB62572 [0,2,0,0,0,0|2,0,0]=4 1258 B10R1.2 COc1ccnc(c1O)Cl AB71167 [0,2,0,0,0,0|1,0,0]=3 1259 B10R1.2 COc1cncc(c1Cl)N AB64859 [0,2,0,0,0,0|2,0,0]=4 1260 B10R1.2 COc1cncc(c1Cl)O AB75741 [0,2,0,0,0,0|2,0,0]=4 1261 B10R1.2 COc1cncc(c1N)Cl AB75723 [0,2,0,0,0,0|2,0,0]=4 1262 B10R1.2 COc1cncc(c1O)Cl AB75737 [0,2,0,0,0,0|1,0,0]=3 1263 B10R1.2 CSc1cccc(c1Br)O MB26789 [0,2,0,0,0,0|1,0,0]=3 1264 B10R1.2 CSc1cccc(c1Cl)O MB33312 [0,2,0,0,0,0|1,0,0]=3 1265 B10R1.2 CSc1cccc(c1F)O MB25404 [0,2,0,0,0,0|1,0,0]=3 1266 B10R1.2 CSc1cccc(c1I)O MB31760 [0,2,0,0,0,0|1,0,0]=3 1267 B10R1.2 CSc1cccc(c1N)O MB32351 [0,2,0,0,0,0|1,0,0]=3 1268 B10R1.2 CSc1cccc(c1O)Cl MB27718 [0,2,0,0,0,0|0,0,0]=2 1269 B10R1.2 CSc1cccc(c1O)F MB25614 [0,2,0,0,0,0|0,0,0]=2 1270 B10R1.2 CSc1cccc(c1O)I MB28360 [0,2,0,0,0,0|0,0,0]=2 1271 B10R1.2 CSc1cccc(c1O)N MB28757 [0,2,0,0,0,0|0,0,0]=2 1272 B10R1.2 Cc1c(c(ccn1)C=O)Cl AB71247 [0,2,0,0,0,0|2,0,0]=4 1273 B10R1.2 Cc1c(c(ccn1)C=O)N AB70908 [0,2,0,0,0,0|2,0,0]=4 1274 B10R1.2 Cc1c(c(ccn1)C=O)O AB24800 [0,2,0,0,0,0|1,0,0]=3 1275 B10R1.2 Cc1c(c(ccn1)CCl)Cl AB71122 [0,2,0,0,0,0|2,0,0]=4 1276 B10R1.2 Cc1c(c(ccn1)CN)Cl AB75137 [0,2,0,0,0,0|2,0,0]=4 1277 B10R1.2 Cc1c(cccc1Br)C#N CB11199 [0,2,0,0,0,0|1,0,0]=3 1278 B10R1.2 Cc1c(cccc1O)C#N MB02463 [0,2,0,0,0,0|0,0,0]=2 1279 B10R1.2 Cc1c(cccc1O)C=O MB08410 [0,2,0,0,0,0|0,0,0]=2 1280 B10R1.2 Cc1c(cccc1O)NC MB37053 [0,2,0,0,0,0|0,0,0]=2 1281 B10R1.2 Cc1c(cccc1OC)O MB09432 [0,2,0,0,0,0|0,0,0]=2 1282 B10R1.2 Cc1c(cccc1SC)O MB35924 [0,2,0,0,0,0|0,0,0]=2 1283 B10R1.2 Cc1c(ccnc1C#N)Br AB40724 [0,2,0,0,0,0|2,0,0]=4 1284 B10R1.2 Cc1c(ccnc1C#N)Cl AB40716 [0,2,0,0,0,0|2,0,0]=4 1285 B10R1.2 Cc1c(ccnc1C=O)Br AB40731 [0,2,0,0,0,0|1,0,1]=4 1286 B10R1.2 Cc1c(ccnc1C=O)Cl AB40720 [0,2,0,0,0,0|1,0,1]=4 1287 B10R1.2 Cc1c(ccnc1C=O)F AB82923 [0,2,0,0,0,0|1,0,1]=4 1288 B10R1.2 Cc1c(ccnc1CCl)Cl AB75387 [0,2,0,0,0,0|2,0,0]=4 1289 B10R1.2 Cc1c(ccnc1CCl)F AB82925 [0,2,0,0,0,0|2,0,0]=4 1290 B10R1.2 Cc1c(ccnc1CN)Br AB40727 [0,2,0,0,0,0|2,0,0]=4 1291 B10R1.2 Cc1c(ccnc1CN)Cl AB40719 [0,2,0,0,0,0|2,0,0]=4 1292 B10R1.2 Cc1c(ccnc1CN)F AB82928 [0,2,0,0,0,0|2,0,0]=4 1293 B10R1.2 Cc1c(ccnc1CO)Br AB53756 [0,2,0,0,0,0|1,0,0]=3 1294 B10R1.2 Cc1c(ccnc1Cl)C=O AB55074 [0,2,0,0,0,0|1,0,1]=4 1295 B10R1.2 Cc1c(ccnc1Cl)CCl AB71116 [0,2,0,0,0,0|2,0,0]=4 1296 B10R1.2 Cc1c(ccnc1Cl)CN AB72647 [0,2,0,0,0,0|2,0,0]=4 1297 B10R1.2 Cc1c(ccnc1F)C=O AB71343 [0,2,0,0,0,0|1,0,1]=4 1298 B10R1.2 Cc1c(ccnc1F)CCl AB71238 [0,2,0,0,0,0|2,0,0]=4 1299 B10R1.2 Cc1c(ccnc1F)CN AB82854 [0,2,0,0,0,0|2,0,0]=4 1300 B10R1.2 Cc1c(cncc1Cl)C=O AB75131 [0,2,0,0,0,0|1,0,1]=4 1301 B10R1.2 Cc1c(cncc1Cl)CCl AB83287 [0,2,0,0,0,0|2,0,0]=4 1302 B10R1.2 Cc1c(cncc1Cl)CN AB83289 [0,2,0,0,0,0|2,0,0]=4 1303 B10R1.2 Cc1c(cncc1OC)N CB11797 [0,2,0,0,0,0|1,0,0]=3 1304 B10R1.2 Cc1c(nccc1C=O)C AB62887 [0,2,0,0,0,0|1,0,1]=4 1305 B10R1.2 Cc1c(nccc1CCl)C AB75402 [0,2,0,0,0,0|2,0,0]=4 1306 B10R1.2 Cc1c(nccc1CN)C AB75354 [0,2,0,0,0,0|2,0,0]=4 1307 B10R1.2 Cc1c(nccc1CO)C AB62891 [0,2,0,0,0,0|1,0,0]=3 1308 B10R1.2 Cc1cccc(c1N)C#N MB08131 [0,2,0,0,0,0|1,0,0]=3 1309 B10R1.2 Cc1cccc(c1N)CN MB08906 [0,2,0,0,0,0|1,0,0]=3 1310 B10R1.2 Cc1cccc(c1N)OC AB02877 [0,2,0,0,0,0|1,0,0]=3 1311 B10R1.2 Cc1cccc(c1O)C#N MB07838 [0,2,0,0,0,0|0,0,0]=2 1312 B10R1.2 Cc1cccc(c1O)CN MB05058 [0,2,0,0,0,0|0,0,0]=2 1313 B10R1.2 Cc1cccc(c1O)NC MB31993 [0,2,0,0,0,0|0,0,0]=2 1314 B10R1.2 Cc1cccc(c1O)SC MB31066 [0,2,0,0,0,0|0,0,0]=2 1315 B10R1.2 Cc1ccnc(c1Br)OC PB25008 [0,2,0,0,0,0|2,0,0]=4 1316 B10R1.2 Cc1ccnc(c1C)C=O AB66597 [0,2,0,0,0,0|1,0,1]=4 1317 B10R1.2 Cc1ccnc(c1C)CCl AB49318 [0,2,0,0,0,0|2,0,0]=4 1318 B10R1.2 Cc1ccnc(c1C)CN AB76790 [0,2,0,0,0,0|2,0,0]=4 1319 B10R1.2 Cc1ccnc(c1Cl)C=O AB44896 [0,2,0,0,0,0|2,0,0]=4 1320 B10R1.2 Cc1ccnc(c1Cl)CCl AB83300 [0,2,0,0,0,0|2,0,0]=4 1321 B10R1.2 Cc1ccnc(c1Cl)CN AB83302 [0,2,0,0,0,0|2,0,0]=4 1322 B10R1.2 Cc1ccnc(c1F)C#N AB63156 [0,2,0,0,0,0|2,0,0]=4 1323 B10R1.2 Cc1ccnc(c1N)C=O AB83759 [0,2,0,0,0,0|2,0,0]=4 1324 B10R1.2 Cc1ccnc(c1O)C=O AB75246 [0,2,0,0,0,0|1,0,0]=3 1325 B10R1.2 Cc1cncc(c1C)C=O AB76785 [0,2,0,0,0,0|1,0,1]=4 1326 B10R1.2 Cc1cncc(c1C)CCl AB75396 [0,2,0,0,0,0|2,0,0]=4 1327 B10R1.2 Cc1cncc(c1C)CN AB76787 [0,2,0,0,0,0|2,0,0]=4 1328 B10R1.2 Cc1cncc(c1Cl)C=O AB67499 [0,2,0,0,0,0|2,0,0]=4 1329 B10R1.2 Cc1cncc(c1Cl)CCl AB83266 [0,2,0,0,0,0|2,0,0]=4 1330 B10R1.2 Cc1cncc(c1Cl)CN AB83269 [0,2,0,0,0,0|2,0,0]=4 1331 B10R1.2 Cc1cncc(c1F)C=O AB75176 [0,2,0,0,0,0|2,0,0]=4 1332 B10R1.2 Cc1cncc(c1F)CCl AB82938 [0,2,0,0,0,0|2,0,0]=4 1333 B10R1.2 Cc1cncc(c1F)CN AB82941 [0,2,0,0,0,0|2,0,0]=4 1334 B10R1.2 Cc1cncc(c1N)C=O AB83665 [0,2,0,0,0,0|2,0,0]=4 1335 B10R1.2 Cc1cncc(c1O)C=O AB75247 [0,2,0,0,0,0|1,0,0]=3 1336 B10R1.2 Cn1cccc(c1=O)CN PB24240 [0,2,0,0,0,0|1,0,1]=4 1337 B10R1.2 Cn1cccc(c1=O)CO PB13713 [0,2,0,0,0,0|1,0,1]=4 1338 B10R1.2 c1c(c(c(cn1)Br)O)C=O AB84418 [0,2,0,0,0,0|1,0,1]=4 1339 B10R1.2 c1c(c(c(cn1)Cl)F)CCl AB82974 [0,2,0,0,0,0|2,0,0]=4 1340 B10R1.2 c1c(c(c(cn1)Cl)F)CN AB75056 [0,2,0,0,0,0|2,0,0]=4 1341 B10R1.2 c1c(c(c(cn1)Cl)N)CN AB83904 [0,2,0,0,0,0|2,0,0]=4 1342 B10R1.2 c1c(c(c(cn1)Cl)O)C=O AB84026 [0,2,0,0,0,0|1,0,1]=4 1343 B10R1.2 c1c(c(c(cn1)Cl)O)CCl AB84031 [0,2,0,0,0,0|1,0,0]=3 1344 B10R1.2 c1c(c(c(cn1)Cl)O)CN AB84033 [0,2,0,0,0,0|1,0,0]=3 1345 B10R1.2 c1c(c(c(cn1)F)Cl)CCl AB83148 [0,2,0,0,0,0|2,0,0]=4 1346 B10R1.2 c1c(c(c(cn1)F)Cl)CN AB83149 [0,2,0,0,0,0|2,0,0]=4 1347 B10R1.2 c1c(c(c(cn1)N)Cl)CN AB83884 [0,2,0,0,0,0|2,0,0]=4 1348 B10R1.2 c1c(c(c(cn1)N)O)C=O AB84419 [0,2,0,0,0,0|1,0,1]=4 1349 B10R1.2 c1c(c(c(cn1)O)Cl)C=O AB67784 [0,2,0,0,0,0|2,0,0]=4 1350 B10R1.2 c1c(c(c(cn1)O)Cl)CCl AB83999 [0,2,0,0,0,0|2,0,0]=4 1351 B10R1.2 c1c(c(c(cn1)O)Cl)CN AB84000 [0,2,0,0,0,0|2,0,0]=4 1352 B10R1.2 c1cc(c(c(c1)Br)Cl)C#N CB11304 [0,2,0,0,0,0|1,0,1]=4 1353 B10R1.2 c1cc(c(c(c1)Br)O)C#N PB14860 [0,2,0,0,0,0|0,0,1]=3 1354 B10R1.2 c1cc(c(c(c1)Br)O)C=O AB01203 [0,2,0,0,0,0|0,0,1]=3 1355 B10R1.2 c1cc(c(c(c1)Br)O)CN MB05060 [0,2,0,0,0,0|0,0,0]=2 1356 B10R1.2 c1cc(c(c(c1)Cl)Br)C#N MB08912 [0,2,0,0,0,0|1,0,1]=4 1357 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O MB08895 [0,2,0,0,0,0|1,0,1]=4 1358 B10R1.2 c1cc(c(c(c1)Cl)F)C=O AB09379 [0,2,0,0,0,0|1,0,1]=4 1359 B10R1.2 c1cc(c(c(c1)Cl)I)C#N AB72108 [0,2,0,0,0,0|1,0,1]=4 1360 B10R1.2 c1cc(c(c(c1)Cl)O)C#N MB08412 [0,2,0,0,0,0|0,0,1]=3 1361 B10R1.2 c1cc(c(c(c1)Cl)O)C=O AB21383 [0,2,0,0,0,0|0,0,1]=3 1362 B10R1.2 c1cc(c(c(c1)Cl)O)CN MB34616 [0,2,0,0,0,0|0,0,0]=2 1363 B10R1.2 c1cc(c(c(c1)F)Br)C#N AB32074 [0,2,0,0,0,0|1,0,1]=4 1364 B10R1.2 c1cc(c(c(c1)F)F)CCl AB13673 [0,2,0,0,0,0|1,0,0]=3 1365 B10R1.2 c1cc(c(c(c1)F)O)C#N MB11932 [0,2,0,0,0,0|0,0,1]=3 1366 B10R1.2 c1cc(c(c(c1)F)O)C=O AB00313 [0,2,0,0,0,0|0,0,1]=3 1367 B10R1.2 c1cc(c(c(c1)F)O)CN MB05070 [0,2,0,0,0,0|0,0,0]=2 1368 B10R1.2 c1cc(c(c(c1)I)O)C#N MB14863 [0,2,0,0,0,0|0,0,1]=3 1369 B10R1.2 c1cc(c(c(c1)I)O)C=O MB12368 [0,2,0,0,0,0|0,0,1]=3 1370 B10R1.2 c1cc(c(c(c1)I)O)CN MB29107 [0,2,0,0,0,0|0,0,0]=2 1371 B10R1.2 c1cc(c(c(c1)N)F)C#N AB43380 [0,2,0,0,0,0|1,0,1]=4 1372 B10R1.2 c1cc(c(c(c1)N)F)CN AB65760 [0,2,0,0,0,0|1,0,0]=3 1373 B10R1.2 c1cc(c(c(c1)N)O)C#N MB02411 [0,2,0,0,0,0|0,0,1]=3 1374 B10R1.2 c1cc(c(c(c1)N)O)CN MB34782 [0,2,0,0,0,0|0,0,0]=2 1375 B10R1.2 c1cc(c(c(c1)O)Br)C#N MB07308 [0,2,0,0,0,0|1,0,0]=3 1376 B10R1.2 c1cc(c(c(c1)O)Br)C=O AB03304 [0,2,0,0,0,0|1,0,0]=3 1377 B10R1.2 c1cc(c(c(c1)O)Br)CN MB08516 [0,2,0,0,0,0|1,0,0]=3 1378 B10R1.2 c1cc(c(c(c1)O)Cl)C#N MB10145 [0,2,0,0,0,0|1,0,0]=3 1379 B10R1.2 c1cc(c(c(c1)O)F)C=O AB63446 [0,2,0,0,0,0|1,0,0]=3 1380 B10R1.2 c1cc(c(c(c1)O)F)CN MB25461 [0,2,0,0,0,0|1,0,0]=3 1381 B10R1.2 c1cc(c(c(c1)O)I)C#N MB28827 [0,2,0,0,0,0|1,0,0]=3 1382 B10R1.2 c1cc(c(c(c1)O)I)C=O MB07518 [0,2,0,0,0,0|1,0,0]=3 1383 B10R1.2 c1cc(c(c(c1)O)I)CN MB34403 [0,2,0,0,0,0|1,0,0]=3 1384 B10R1.2 c1cc(c(c(c1)O)N)C#N MB09969 [0,2,0,0,0,0|1,0,0]=3 1385 B10R1.2 c1cc(c(c(c1)O)N)C=O MB38000 [0,2,0,0,0,0|1,0,0]=3 1386 B10R1.2 c1cc(c(c(c1)O)N)CN MB35261 [0,2,0,0,0,0|1,0,0]=3 1387 B10R1.2 c1cnc(c(c1Br)O)C=O AB84603 [0,2,0,0,0,0|1,0,1]=4 1388 B10R1.2 c1cnc(c(c1C=O)Cl)O AB70959 [0,2,0,0,0,0|2,0,0]=4 1389 B10R1.2 c1cnc(c(c1C=O)O)Br AB69695 [0,2,0,0,0,0|1,0,1]=4 1390 B10R1.2 c1cnc(c(c1C=O)O)Cl AB69323 [0,2,0,0,0,0|1,0,1]=4 1391 B10R1.2 c1cnc(c(c1C=O)O)N AB84363 [0,2,0,0,0,0|1,0,1]=4 1392 B10R1.2 c1cnc(c(c1CCl)Cl)F AB66313 [0,2,0,0,0,0|2,0,0]=4 1393 B10R1.2 c1cnc(c(c1CCl)Cl)O AB71003 [0,2,0,0,0,0|2,0,0]=4 1394 B10R1.2 c1cnc(c(c1CCl)F)Cl AB70985 [0,2,0,0,0,0|2,0,0]=4 1395 B10R1.2 c1cnc(c(c1CCl)O)Cl AB71002 [0,2,0,0,0,0|1,0,0]=3 1396 B10R1.2 c1cnc(c(c1CN)Cl)F AB66314 [0,2,0,0,0,0|2,0,0]=4 1397 B10R1.2 c1cnc(c(c1CN)Cl)N AB83937 [0,2,0,0,0,0|2,0,0]=4 1398 B10R1.2 c1cnc(c(c1CN)F)Cl AB76202 [0,2,0,0,0,0|2,0,0]=4 1399 B10R1.2 c1cnc(c(c1CN)O)Cl AB76795 [0,2,0,0,0,0|1,0,0]=3 1400 B10R1.2 c1cnc(c(c1Cl)F)CCl AB70769 [0,2,0,0,0,0|2,0,0]=4 1401 B10R1.2 c1cnc(c(c1Cl)F)CN AB70770 [0,2,0,0,0,0|2,0,0]=4 1402 B10R1.2 c1cnc(c(c1Cl)O)C=O AB75013 [0,2,0,0,0,0|1,0,1]=4 1403 B10R1.2 c1cnc(c(c1Cl)O)CCl AB83984 [0,2,0,0,0,0|1,0,0]=3 1404 B10R1.2 c1cnc(c(c1Cl)O)CN AB76801 [0,2,0,0,0,0|1,0,0]=3 1405 B10R1.2 c1cnc(c(c1F)Cl)CCl AB83006 [0,2,0,0,0,0|2,0,0]=4 1406 B10R1.2 c1cnc(c(c1F)Cl)CN AB83007 [0,2,0,0,0,0|2,0,0]=4 1407 B10R1.2 c1cnc(c(c1N)Cl)CN AB83927 [0,2,0,0,0,0|2,0,0]=4 1408 B10R1.2 c1cnc(c(c1N)O)C=O AB84604 [0,2,0,0,0,0|1,0,1]=4 1409 B10R1.2 c1cnc(c(c1O)Cl)C=O AB75006 [0,2,0,0,0,0|2,0,0]=4 1410 B10R1.2 c1cnc(c(c1O)Cl)CCl AB84054 [0,2,0,0,0,0|2,0,0]=4 1411 B10R1.2 c1cnc(c(c1O)Cl)CN AB84056 [0,2,0,0,0,0|2,0,0]=4 1412 B10R1.22 Cc1cc(nc(c1C)C)Br AB82584 [0,2,0,0,0,0|2,0,0]=4 1413 B10R1.22 Cc1cc(nc(c1C)C)N AB76138 [0,2,0,0,0,0|2,0,0]=4 1414 B10R1.22 Cc1cc(nc(c1C)C)O AB82587 [0,2,0,0,0,0|2,0,0]=4 1415 B10R1.22 Cc1cc(nc(c1C)O)O AB21779 [0,2,0,0,0,0|1,0,0]=3 1416 B10R1.22 Cc1cc(nc(c1N)N)C AB44982 [0,2,0,0,0,0|2,0,0]=4 1417 B10R1.22 Cc1cc(nc(c1N)N)Cl PB31872 [0,2,0,0,0,0|2,0,0]=4 1418 B10R1.22 Cn1cc(cc(c1=O)N)Br PB10719 [0,2,0,0,0,0|1,0,1]=4 1419 B10R1.22 c1c(cc(c(c1Br)Br)Br)N AB11948 [0,2,0,0,0,0|2,0,0]=4 1420 B10R1.22 c1c(cc(c(c1Br)Br)Br)S AB65762 [0,2,0,0,0,0|2,0,0]=4 1421 B10R1.22 c1c(cc(c(c1Cl)Br)Cl)F CB11555 [0,2,0,0,0,0|2,0,0]=4 1422 B10R1.22 c1c(cc(c(c1F)F)Cl)Br AB64596 [0,2,0,0,0,0|2,0,0]=4 1423 B10R1.22 c1c(cc(c(c1F)N)F)Br MB00220 [0,2,0,0,0,0|2,0,0]=4 1424 B10R1.119 Cc1c(ccc(c1Cl)Br)N CB10999 [0,2,0,0,0,0|1,0,0]=3 1425 B10R1.119 Cc1c(ccc(c1F)F)Br AB42398 [0,2,0,0,0,0|1,0,0]=3 1426 B10R1.119 Cc1c(cnc(c1Br)N)Br AB09556 [0,2,0,0,0,0|2,0,0]=4 1427 B10R1.119 Cc1c(cnc(c1Br)O)Br AB23695 [0,2,0,0,0,0|2,0,0]=4 1428 B10R1.119 Cc1c(cnc(c1Cl)N)Cl AB03636 [0,2,0,0,0,0|2,0,0]=4 1429 B10R1.119 Cc1c(cnc(c1N)N)Br PB25025 [0,2,0,0,0,0|2,0,0]=4 1430 B10R1.119 Cc1ccc(c(c1O)C)O AB24905 [0,2,0,0,0,0|0,0,0]=2 1431 B10R1.119 Cc1ccc(c(c1O)Cl)N AB13339 [0,2,0,0,0,0|0,0,0]=2 1432 B10R1.119 c1cc(c(c(c1Cl)N)Cl)Br PB16810 [0,2,0,0,0,0|2,0,0]=4 1433 B10R1.119 c1cc(c(c(c1N)F)F)Br CB11209 [0,2,0,0,0,0|2,0,0]=4 1434 B10R1.119 c1cc(c(c(c1N)I)F)Cl AB73418 [0,2,0,0,0,0|2,0,0]=4 1435 B10R1.245 CCc1c(cccc1Br)O MB23614 [0,2,0,0,0,0|0,0,0]=2 1436 B10R1.245 CCc1c(cccc1Cl)O MB23615 [0,2,0,0,0,0|0,0,0]=2 1437 B10R1.245 CCc1c(cccc1F)O MB23585 [0,2,0,0,0,0|0,0,0]=2 1438 B10R1.245 CCc1c(cccc1I)O MB23587 [0,2,0,0,0,0|0,0,0]=2 1439 B10R1.245 CCc1c(cccc1O)C MB23554 [0,2,0,0,0,0|0,0,0]=2 1440 B10R1.245 CCc1c(cccc1O)N MB23558 [0,2,0,0,0,0|0,0,0]=2 1441 B10R1.245 CNc1c(cccc1Br)O MB31500 [0,2,0,0,0,0|0,0,0]=2 1442 B10R1.245 CNc1c(cccc1Cl)O MB33359 [0,2,0,0,0,0|0,0,0]=2 1443 B10R1.245 CNc1c(cccc1F)O MB29137 [0,2,0,0,0,0|0,0,0]=2 1444 B10R1.245 CNc1c(cccc1I)O MB30346 [0,2,0,0,0,0|0,0,0]=2 1445 B10R1.245 CNc1c(cccc1O)N MB01610 [0,2,0,0,0,0|0,0,0]=2 1446 B10R1.245 COc1c(cccc1Br)F AB21504 [0,2,0,0,0,0|1,0,0]=3 1447 B10R1.245 COc1c(cccc1Br)O MB09199 [0,2,0,0,0,0|0,0,0]=2 1448 B10R1.245 COc1c(cccc1Cl)O MB34190 [0,2,0,0,0,0|0,0,0]=2 1449 B10R1.245 COc1c(cccc1F)N MB00204 [0,2,0,0,0,0|1,0,0]=3 1450 B10R1.245 COc1c(cccc1I)O MB33689 [0,2,0,0,0,0|0,0,0]=2 1451 B10R1.245 COc1c(cccc1O)N MB14425 [0,2,0,0,0,0|0,0,0]=2 1452 B10R1.245 CSc1c(cccc1Br)O MB32344 [0,2,0,0,0,0|0,0,0]=2 1453 B10R1.245 CSc1c(cccc1Cl)O MB25403 [0,2,0,0,0,0|0,0,0]=2 1454 B10R1.245 CSc1c(cccc1I)O MB36697 [0,2,0,0,0,0|0,0,0]=2 1455 B10R1.245 CSc1c(cccc1O)N MB26572 [0,2,0,0,0,0|0,0,0]=2 1456 B10R1.245 Cc1c(c(ccn1)Br)C=O AB66858 [0,2,0,0,0,0|1,0,1]=4 1457 B10R1.245 Cc1c(c(ccn1)Cl)C=O AB66851 [0,2,0,0,0,0|1,0,1]=4 1458 B10R1.245 Cc1c(c(ccn1)Cl)CCl AB83333 [0,2,0,0,0,0|2,0,0]=4 1459 B10R1.245 Cc1c(c(ccn1)Cl)CN AB83336 [0,2,0,0,0,0|2,0,0]=4 1460 B10R1.245 Cc1c(c(ccn1)Cl)OC PB19448 [0,2,0,0,0,0|1,0,0]=3 1461 B10R1.245 Cc1c(c(ccn1)F)C=O AB68033 [0,2,0,0,0,0|1,0,1]=4 1462 B10R1.245 Cc1c(c(ccn1)F)CCl AB83019 [0,2,0,0,0,0|2,0,0]=4 1463 B10R1.245 Cc1c(c(ccn1)F)CN AB83020 [0,2,0,0,0,0|2,0,0]=4 1464 B10R1.245 Cc1c(c(ccn1)N)C=O AB68110 [0,2,0,0,0,0|1,0,1]=4 1465 B10R1.245 Cc1c(c(ccn1)O)C=O AB84477 [0,2,0,0,0,0|1,0,1]=4 1466 B10R1.245 Cc1cccc(c1C#N)O MB02406 [0,2,0,0,0,0|0,0,1]=3 1467 B10R1.245 Cc1cccc(c1C=O)O MB14829 [0,2,0,0,0,0|0,0,1]=3 1468 B10R1.245 Cc1cccc(c1CCl)C AB08451 [0,2,0,0,0,0|1,0,0]=3 1469 B10R1.245 Cc1cccc(c1CN)O MB25667 [0,2,0,0,0,0|0,0,0]=2 1470 B10R1.245 Cc1cccc(c1CO)C AB03562 [0,2,0,0,0,0|0,0,0]=2 1471 B10R1.245 Cc1cccc(c1OC)O MB33579 [0,2,0,0,0,0|0,0,0]=2 1472 B10R1.245 Cc1cccc(c1SC)O MB08534 [0,2,0,0,0,0|0,0,0]=2 1473 B10R1.245 Cc1ccnc(c1C#N)Cl AB30548 [0,2,0,0,0,0|2,0,0]=4 1474 B10R1.245 Cc1ccnc(c1C#N)N PB26426 [0,2,0,0,0,0|2,0,0]=4 1475 B10R1.245 Cc1ccnc(c1C=O)C AB63129 [0,2,0,0,0,0|1,0,1]=4 1476 B10R1.245 Cc1ccnc(c1C=O)Cl AB44897 [0,2,0,0,0,0|1,0,1]=4 1477 B10R1.245 Cc1ccnc(c1C=O)F AB44902 [0,2,0,0,0,0|1,0,1]=4 1478 B10R1.245 Cc1ccnc(c1C=O)N AB70910 [0,2,0,0,0,0|1,0,1]=4 1479 B10R1.245 Cc1ccnc(c1C=O)O AB71364 [0,2,0,0,0,0|1,0,1]=4 1480 B10R1.245 Cc1ccnc(c1CCl)C AB75399 [0,2,0,0,0,0|2,0,0]=4 1481 B10R1.245 Cc1ccnc(c1CCl)Cl AB71112 [0,2,0,0,0,0|2,0,0]=4 1482 B10R1.245 Cc1ccnc(c1CCl)F AB71236 [0,2,0,0,0,0|2,0,0]=4 1483 B10R1.245 Cc1ccnc(c1CN)C AB75357 [0,2,0,0,0,0|2,0,0]=4 1484 B10R1.245 Cc1ccnc(c1CN)Cl AB74563 [0,2,0,0,0,0|2,0,0]=4 1485 B10R1.245 Cc1ccnc(c1CN)F AB83056 [0,2,0,0,0,0|2,0,0]=4 1486 B10R1.245 Cc1cncc(c1C#N)C AB63049 [0,2,0,0,0,0|2,0,0]=4 1487 B10R1.245 Cc1cncc(c1C=O)C AB24811 [0,2,0,0,0,0|1,0,1]=4 1488 B10R1.245 Cc1cncc(c1C=O)Cl AB75138 [0,2,0,0,0,0|1,0,1]=4 1489 B10R1.245 Cc1cncc(c1C=O)F AB75180 [0,2,0,0,0,0|1,0,1]=4 1490 B10R1.245 Cc1cncc(c1C=O)N AB83619 [0,2,0,0,0,0|1,0,1]=4 1491 B10R1.245 Cc1cncc(c1C=O)O AB75255 [0,2,0,0,0,0|1,0,1]=4 1492 B10R1.245 Cc1cncc(c1CCl)C AB75400 [0,2,0,0,0,0|2,0,0]=4 1493 B10R1.245 Cc1cncc(c1CCl)Cl AB83249 [0,2,0,0,0,0|2,0,0]=4 1494 B10R1.245 Cc1cncc(c1CCl)F AB82911 [0,2,0,0,0,0|2,0,0]=4 1495 B10R1.245 Cc1cncc(c1CN)C AB65429 [0,2,0,0,0,0|2,0,0]=4 1496 B10R1.245 Cc1cncc(c1CN)Cl AB83251 [0,2,0,0,0,0|2,0,0]=4 1497 B10R1.245 Cc1cncc(c1CN)F AB82914 [0,2,0,0,0,0|2,0,0]=4 1498 B10R1.245 c1c(c(c(cn1)Br)C=O)O AB84381 [0,2,0,0,0,0|1,0,1]=4 1499 B10R1.245 c1c(c(c(cn1)Cl)C=O)O AB75024 [0,2,0,0,0,0|1,0,1]=4 1500 B10R1.245 c1c(c(c(cn1)Cl)CCl)F AB70995 [0,2,0,0,0,0|2,0,0]=4 1501 B10R1.245 c1c(c(c(cn1)Cl)CN)F AB75075 [0,2,0,0,0,0|2,0,0]=4 1502 B10R1.245 c1c(c(c(cn1)O)C=O)N AB84386 [0,2,0,0,0,0|1,0,1]=4 1503 B10R1.245 c1cc(c(c(c1)Br)C#N)Cl MB03774 [0,2,0,0,0,0|1,0,1]=4 1504 B10R1.245 c1cc(c(c(c1)Br)C#N)O MB12048 [0,2,0,0,0,0|0,0,1]=3 1505 B10R1.245 c1cc(c(c(c1)Br)C=O)Br CB11474 [0,2,0,0,0,0|1,0,1]=4 1506 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl MB01095 [0,2,0,0,0,0|1,0,1]=4 1507 B10R1.245 c1cc(c(c(c1)Br)C=O)F AB14028 [0,2,0,0,0,0|1,0,1]=4 1508 B10R1.245 c1cc(c(c(c1)Br)C=O)N PB34549 [0,2,0,0,0,0|1,0,1]=4 1509 B10R1.245 c1cc(c(c(c1)Br)C=O)O AB43626 [0,2,0,0,0,0|0,0,1]=3 1510 B10R1.245 c1cc(c(c(c1)Br)CN)O MB12052 [0,2,0,0,0,0|0,0,0]=2 1511 B10R1.245 c1cc(c(c(c1)Br)CO)F AB50340 [0,2,0,0,0,0|1,0,0]=3 1512 B10R1.245 c1cc(c(c(c1)Cl)C#N)O PB19932 [0,2,0,0,0,0|0,0,1]=3 1513 B10R1.245 c1cc(c(c(c1)Cl)C=O)N AB58431 [0,2,0,0,0,0|1,0,1]=4 1514 B10R1.245 c1cc(c(c(c1)Cl)C=O)O MB01945 [0,2,0,0,0,0|0,0,1]=3 1515 B10R1.245 c1cc(c(c(c1)Cl)CN)O MB15041 [0,2,0,0,0,0|0,0,0]=2 1516 B10R1.245 c1cc(c(c(c1)F)C=O)O MB01694 [0,2,0,0,0,0|0,0,1]=3 1517 B10R1.245 c1cc(c(c(c1)F)CN)O MB03739 [0,2,0,0,0,0|0,0,0]=2 1518 B10R1.245 c1cc(c(c(c1)I)C#N)F AB01183 [0,2,0,0,0,0|1,0,1]=4 1519 B10R1.245 c1cc(c(c(c1)I)C#N)O MB37282 [0,2,0,0,0,0|0,0,1]=3 1520 B10R1.245 c1cc(c(c(c1)I)C=O)O MB14699 [0,2,0,0,0,0|0,0,1]=3 1521 B10R1.245 c1cc(c(c(c1)I)CN)O MB31821 [0,2,0,0,0,0|0,0,0]=2 1522 B10R1.245 c1cc(c(c(c1)O)C#N)N MB34868 [0,2,0,0,0,0|0,0,1]=3 1523 B10R1.245 c1cc(c(c(c1)O)C=O)N MB27161 [0,2,0,0,0,0|0,0,1]=3 1524 B10R1.245 c1cc(c(c(c1)O)CN)N MB31845 [0,2,0,0,0,0|0,0,0]=2 1525 B10R1.245 c1cnc(c(c1Br)C=O)O AB84479 [0,2,0,0,0,0|1,0,1]=4 1526 B10R1.245 c1cnc(c(c1Cl)C=O)O AB84482 [0,2,0,0,0,0|1,0,1]=4 1527 B10R1.245 c1cnc(c(c1Cl)CCl)F AB83202 [0,2,0,0,0,0|2,0,0]=4 1528 B10R1.245 c1cnc(c(c1Cl)CN)F AB83203 [0,2,0,0,0,0|2,0,0]=4 1529 B10R1.245 c1cnc(c(c1N)C=O)O AB84486 [0,2,0,0,0,0|1,0,1]=4 1530 B10R1.245 c1cnc(c(c1O)C=O)Br AB84458 [0,2,0,0,0,0|1,0,1]=4 1531 B10R1.245 c1cnc(c(c1O)C=O)Cl AB66422 [0,2,0,0,0,0|1,0,1]=4 1532 B10R1.245 c1cnc(c(c1O)C=O)N AB84460 [0,2,0,0,0,0|1,0,1]=4 1533 B10R1.4 CCOc1c(cccn1)Br AB05207 [0,2,0,0,0,0|2,0,0]=4 1534 B10R1.4 CCOc1c(cccn1)I AB05213 [0,2,0,0,0,0|2,0,0]=4 1535 B10R1.4 CCOc1ccncc1Br MB01009 [0,2,0,0,0,0|2,0,0]=4 1536 B10R1.4 CNCc1c(cccn1)F PB12566 [0,2,0,0,0,0|2,0,0]=4 1537 B10R1.4 CNCc1cccnc1Cl AB53845 [0,2,0,0,0,0|2,0,0]=4 1538 B10R1.4 CNCc1cnccc1Br AB67968 [0,2,0,0,0,0|2,0,0]=4 1539 B10R1.4 CNCc1cnccc1Cl AB67984 [0,2,0,0,0,0|2,0,0]=4 1540 B10R1.4 CNCc1cnccc1F AB68060 [0,2,0,0,0,0|2,0,0]=4 1541 B10R1.4 Cc1c(cccn1)CCN AB66943 [0,2,0,0,0,0|2,0,0]=4 1542 B10R1.4 Cc1c(cccn1)CNC AB66889 [0,2,0,0,0,0|2,0,0]=4 1543 B10R1.4 Cc1ccccc1CC=O AB11813 [0,2,0,0,0,0|0,0,1]=3 1544 B10R1.4 Cc1cccnc1CCN AB31462 [0,2,0,0,0,0|2,0,0]=4 1545 B10R1.4 Cc1ccncc1CCN AB55157 [0,2,0,0,0,0|2,0,0]=4 1546 B10R1.4 Cc1ccncc1CNC AB67828 [0,2,0,0,0,0|2,0,0]=4 1547 B10R1.4 c1cc(c(nc1)Br)CCN AB45464 [0,2,0,0,0,0|2,0,0]=4 1548 B10R1.4 c1cc(c(nc1)Br)\C=N\O AB70377 [0,2,0,0,0,0|2,0,0]=4 1549 B10R1.4 c1cc(c(nc1)CC#N)Br PB13243 [0,2,0,0,0,0|2,0,0]=4 1550 B10R1.4 c1cc(c(nc1)CCN)Br PB14588 [0,2,0,0,0,0|2,0,0]=4 1551 B10R1.4 c1cc(c(nc1)CCN)F AB45483 [0,2,0,0,0,0|2,0,0]=4 1552 B10R1.4 c1cc(c(nc1)CCO)F AB55231 [0,2,0,0,0,0|2,0,0]=4 1553 B10R1.4 c1cc(c(nc1)Cl)CC#N PB13101 [0,2,0,0,0,0|2,0,0]=4 1554 B10R1.4 c1cc(c(nc1)Cl)CCN AB45428 [0,2,0,0,0,0|2,0,0]=4 1555 B10R1.4 c1cc(c(nc1)N)\C=N\O AB25853 [0,2,0,0,0,0|2,0,0]=4 1556 B10R1.4 c1ccc(c(c1)CC#N)Br AB00169 [0,2,0,0,0,0|1,0,0]=3 1557 B10R1.4 c1ccc(c(c1)CC#N)F AB00172 [0,2,0,0,0,0|1,0,0]=3 1558 B10R1.4 c1ccc(c(c1)CCN)N AB22073 [0,2,0,0,0,0|1,0,0]=3 1559 B10R1.4 c1ccc(c(c1)CCN)O MB00877 [0,2,0,0,0,0|0,0,0]=2 1560 B10R1.4 c1ccc(c(c1)CNN)Br PB27972 [0,2,0,0,0,0|1,0,0]=3 1561 B10R1.4 c1ccc(c(c1)CNN)Cl PB29439 [0,2,0,0,0,0|1,0,0]=3 1562 B10R1.4 c1ccc(c(c1)CNN)F PB23531 [0,2,0,0,0,0|1,0,0]=3 1563 B10R1.4 c1ccc(c(c1)\C=N\O)Cl AB01188 [0,2,0,0,0,0|1,0,0]=3 1564 B10R1.4 c1cncc(c1Br)CC#N AB74620 [0,2,0,0,0,0|2,0,0]=4 1565 B10R1.4 c1cncc(c1Br)CCN AB45481 [0,2,0,0,0,0|2,0,0]=4 1566 B10R1.4 c1cncc(c1Cl)CCN AB68002 [0,2,0,0,0,0|2,0,0]=4 1567 B10R1.4 c1cncc(c1F)CCN AB55177 [0,2,0,0,0,0|2,0,0]=4 1568 B10R1.20 C#Cc1ccccc1C=O AB17472 [0,2,0,0,0,0|0,0,2]=4 1569 B10R1.20 COc1c(cccn1)C#C AB69070 [0,2,0,0,0,0|1,0,1]=4 1570 B10R1.20 COc1c(cccn1)C#N PB30871 [0,2,0,0,0,0|1,0,1]=4 1571 B10R1.20 COc1c(cccn1)C=O PB26137 [0,2,0,0,0,0|1,0,1]=4 1572 B10R1.20 COc1c(cccn1)CCl AB54482 [0,2,0,0,0,0|1,0,0]=3 1573 B10R1.20 COc1c(cccn1)CN PB10680 [0,2,0,0,0,0|1,0,0]=3 1574 B10R1.20 COc1c(cccn1)CN PB15194 [0,2,0,0,0,0|1,0,0]=3 1575 B10R1.20 COc1c(cccn1)CO PB20446 [0,2,0,0,0,0|1,0,0]=3 1576 B10R1.20 COc1ccccc1C#N AB00156 [0,2,0,0,0,0|0,0,1]=3 1577 B10R1.20 COc1ccccc1C=O AB00311 [0,2,0,0,0,0|0,0,1]=3 1578 B10R1.20 COc1cccnc1C#N AB40617 [0,2,0,0,0,0|1,0,1]=4 1579 B10R1.20 COc1cccnc1C=O AB22246 [0,2,0,0,0,0|1,0,1]=4 1580 B10R1.20 COc1cccnc1CCl AB60052 [0,2,0,0,0,0|1,0,0]=3 1581 B10R1.20 COc1cccnc1CN AB40619 [0,2,0,0,0,0|1,0,0]=3 1582 B10R1.20 COc1cccnc1CO MB05449 [0,2,0,0,0,0|1,0,0]=3 1583 B10R1.20 COc1cccnc1OC AB13430 [0,2,0,0,0,0|1,0,0]=3 1584 B10R1.20 COc1ccncc1C#C AB69060 [0,2,0,0,0,0|1,0,1]=4 1585 B10R1.20 COc1ccncc1C=O AB17569 [0,2,0,0,0,0|1,0,1]=4 1586 B10R1.20 COc1ccncc1CCl AB68800 [0,2,0,0,0,0|1,0,0]=3 1587 B10R1.20 COc1ccncc1CN AB67859 [0,2,0,0,0,0|1,0,0]=3 1588 B10R1.20 COc1cnccc1C#C AB69090 [0,2,0,0,0,0|1,0,1]=4 1589 B10R1.20 COc1cnccc1C=O AB17541 [0,2,0,0,0,0|1,0,1]=4 1590 B10R1.20 COc1cnccc1CCl AB67554 [0,2,0,0,0,0|1,0,0]=3 1591 B10R1.20 COc1cnccc1CN AB63142 [0,2,0,0,0,0|1,0,0]=3 1592 B10R1.20 CSc1c(cccn1)C=O MB07044 [0,2,0,0,0,0|1,0,1]=4 1593 B10R1.20 CSc1c(cccn1)CO MB07043 [0,2,0,0,0,0|1,0,0]=3 1594 B10R1.20 c1cc(c(nc1)C#N)CBr MB06806 [0,2,0,0,0,0|2,0,0]=4 1595 B10R1.20 c1cc(c(nc1)C#N)CCl AB60071 [0,2,0,0,0,0|2,0,0]=4 1596 B10R1.20 c1cc(c(nc1)C#N)CN AB67388 [0,2,0,0,0,0|2,0,0]=4 1597 B10R1.20 c1cc(c(nc1)C#N)CO AB31401 [0,2,0,0,0,0|1,0,1]=4 1598 B10R1.20 c1cc(c(nc1)CCl)C#N AB60058 [0,2,0,0,0,0|2,0,0]=4 1599 B10R1.20 c1cc(c(nc1)CCl)C=O AB69680 [0,2,0,0,0,0|1,0,1]=4 1600 B10R1.20 c1cc(c(nc1)CCl)CCl AB60050 [0,2,0,0,0,0|2,0,0]=4 1601 B10R1.20 c1cc(c(nc1)CN)C#N AB67702 [0,2,0,0,0,0|2,0,0]=4 1602 B10R1.20 c1cc(c(nc1)CN)C=O AB31410 [0,2,0,0,0,0|1,0,1]=4 1603 B10R1.20 c1cc(c(nc1)CN)CO AB31405 [0,2,0,0,0,0|1,0,0]=3 1604 B10R1.20 c1cc(c(nc1)CO)CO AB10176 [0,2,0,0,0,0|1,0,0]=3 1605 B10R1.20 c1cncc(c1C#N)CCl AB60090 [0,2,0,0,0,0|2,0,0]=4 1606 B10R1.20 c1cncc(c1C#N)CN AB68131 [0,2,0,0,0,0|2,0,0]=4 1607 B10R1.20 c1cncc(c1CCl)C#N AB67717 [0,2,0,0,0,0|2,0,0]=4 1608 B10R1.20 c1cncc(c1CCl)C=O AB69679 [0,2,0,0,0,0|1,0,1]=4 1609 B10R1.20 c1cncc(c1CCl)CCl AB60081 [0,2,0,0,0,0|2,0,0]=4 1610 B10R1.20 c1cncc(c1CN)C#N AB67699 [0,2,0,0,0,0|2,0,0]=4 1611 B10R1.25 CCc1c(cc(cn1)Br)N PB11662 [0,2,0,0,0,0|2,0,0]=4 1612 B10R1.25 CCc1ccc(cc1Br)O MB23966 [0,2,0,0,0,0|1,0,0]=3 1613 B10R1.25 CCc1ccc(cc1C)O MB23913 [0,2,0,0,0,0|1,0,0]=3 1614 B10R1.25 CCc1ccc(cc1Cl)O MB23969 [0,2,0,0,0,0|1,0,0]=3 1615 B10R1.25 CCc1ccc(cc1F)O MB14963 [0,2,0,0,0,0|1,0,0]=3 1616 B10R1.25 CCc1ccc(cc1I)O MB23946 [0,2,0,0,0,0|1,0,0]=3 1617 B10R1.25 CCc1ccc(cc1N)O MB23949 [0,2,0,0,0,0|1,0,0]=3 1618 B10R1.25 CCc1ccc(cc1O)Br MB23992 [0,2,0,0,0,0|0,0,0]=2 1619 B10R1.25 CCc1ccc(cc1O)Cl MB23993 [0,2,0,0,0,0|0,0,0]=2 1620 B10R1.25 CCc1ccc(cc1O)F MB23841 [0,2,0,0,0,0|0,0,0]=2 1621 B10R1.25 CCc1ccc(cc1O)I MB23846 [0,2,0,0,0,0|0,0,0]=2 1622 B10R1.25 CCc1ccc(cc1O)N MB23852 [0,2,0,0,0,0|0,0,0]=2 1623 B10R1.25 CCc1ccc(nc1N)C AB03677 [0,2,0,0,0,0|2,0,0]=4 1624 B10R1.25 CCn1ccc(cc1=O)Br PB38061 [0,2,0,0,0,0|1,0,1]=4 1625 B10R1.25 CCn1ccc(cc1=O)N PB23013 [0,2,0,0,0,0|1,0,1]=4 1626 B10R1.25 CNc1c(cc(cn1)Br)N AB40964 [0,2,0,0,0,0|2,0,0]=4 1627 B10R1.25 CNc1c(cc(cn1)Cl)N AB41038 [0,2,0,0,0,0|2,0,0]=4 1628 B10R1.25 CNc1ccc(cc1F)O MB31256 [0,2,0,0,0,0|1,0,0]=3 1629 B10R1.25 CNc1ccc(cc1I)O MB37121 [0,2,0,0,0,0|1,0,0]=3 1630 B10R1.25 CNc1ccc(cc1N)O MB30558 [0,2,0,0,0,0|1,0,0]=3 1631 B10R1.25 CNc1ccc(cc1O)Cl MB25839 [0,2,0,0,0,0|0,0,0]=2 1632 B10R1.25 CNc1ccc(cc1O)N MB33015 [0,2,0,0,0,0|0,0,0]=2 1633 B10R1.25 COc1c(cc(cn1)Br)Cl AB20950 [0,2,0,0,0,0|2,0,0]=4 1634 B10R1.25 COc1c(cc(cn1)Br)F AB17621 [0,2,0,0,0,0|2,0,0]=4 1635 B10R1.25 COc1c(cc(cn1)Br)I AB21850 [0,2,0,0,0,0|2,0,0]=4 1636 B10R1.25 COc1c(cc(cn1)Br)N PB15873 [0,2,0,0,0,0|2,0,0]=4 1637 B10R1.25 COc1c(cc(cn1)Br)O PB15354 [0,2,0,0,0,0|1,0,0]=3 1638 B10R1.25 COc1c(cc(cn1)Cl)Br AB43095 [0,2,0,0,0,0|2,0,0]=4 1639 B10R1.25 COc1c(cc(cn1)Cl)F AB41066 [0,2,0,0,0,0|2,0,0]=4 1640 B10R1.25 COc1c(cc(cn1)Cl)N AB41036 [0,2,0,0,0,0|2,0,0]=4 1641 B10R1.25 COc1c(cc(cn1)F)N AB75363 [0,2,0,0,0,0|2,0,0]=4 1642 B10R1.25 COc1c(cc(cn1)N)Cl AB70284 [0,2,0,0,0,0|2,0,0]=4 1643 B10R1.25 COc1c(cc(cn1)N)F AB40818 [0,2,0,0,0,0|2,0,0]=4 1644 B10R1.25 COc1c(cc(cn1)O)Cl AB70289 [0,2,0,0,0,0|2,0,0]=4 1645 B10R1.25 COc1c(cc(cn1)O)F AB70291 [0,2,0,0,0,0|2,0,0]=4 1646 B10R1.25 COc1ccc(cc1Cl)Br AB03565 [0,2,0,0,0,0|1,0,0]=3 1647 B10R1.25 COc1ccc(cc1Cl)O MB13556 [0,2,0,0,0,0|1,0,0]=3 1648 B10R1.25 COc1ccc(cc1F)Br AB01075 [0,2,0,0,0,0|1,0,0]=3 1649 B10R1.25 COc1ccc(cc1I)O MB26647 [0,2,0,0,0,0|1,0,0]=3 1650 B10R1.25 COc1ccc(cc1N)O MB34521 [0,2,0,0,0,0|1,0,0]=3 1651 B10R1.25 COc1ccc(cc1O)Cl MB09234 [0,2,0,0,0,0|0,0,0]=2 1652 B10R1.25 COc1ccc(cc1O)I MB38179 [0,2,0,0,0,0|0,0,0]=2 1653 B10R1.25 COc1ccc(nc1Br)N AB26774 [0,2,0,0,0,0|2,0,0]=4 1654 B10R1.25 COc1ccc(nc1Cl)N AB40624 [0,2,0,0,0,0|2,0,0]=4 1655 B10R1.25 COc1cnc(cc1Cl)N PB15356 [0,2,0,0,0,0|2,0,0]=4 1656 B10R1.25 COc1cnc(cc1O)Cl AB69306 [0,2,0,0,0,0|1,0,0]=3 1657 B10R1.25 CSc1c(cc(cn1)Br)N AB40978 [0,2,0,0,0,0|2,0,0]=4 1658 B10R1.25 CSc1c(cc(cn1)Cl)N AB41053 [0,2,0,0,0,0|2,0,0]=4 1659 B10R1.25 CSc1ccc(cc1Br)O MB25524 [0,2,0,0,0,0|1,0,0]=3 1660 B10R1.25 CSc1ccc(cc1Cl)O MB38487 [0,2,0,0,0,0|1,0,0]=3 1661 B10R1.25 CSc1ccc(cc1F)O MB25544 [0,2,0,0,0,0|1,0,0]=3 1662 B10R1.25 CSc1ccc(cc1N)O MB34593 [0,2,0,0,0,0|1,0,0]=3 1663 B10R1.25 CSc1ccc(cc1O)Br MB35434 [0,2,0,0,0,0|0,0,0]=2 1664 B10R1.25 CSc1ccc(cc1O)F MB25440 [0,2,0,0,0,0|0,0,0]=2 1665 B10R1.25 CSc1ccc(cc1O)I MB29501 [0,2,0,0,0,0|0,0,0]=2 1666 B10R1.25 CSc1ccc(cc1O)N MB36502 [0,2,0,0,0,0|0,0,0]=2 1667 B10R1.25 Cc1c(ccc(n1)Br)C=O AB66856 [0,2,0,0,0,0|1,0,1]=4 1668 B10R1.25 Cc1c(ccc(n1)Br)CCl AB69339 [0,2,0,0,0,0|2,0,0]=4 1669 B10R1.25 Cc1c(ccc(n1)Br)CN AB69340 [0,2,0,0,0,0|2,0,0]=4 1670 B10R1.25 Cc1c(ccc(n1)Cl)C#N AB30550 [0,2,0,0,0,0|2,0,0]=4 1671 B10R1.25 Cc1c(ccc(n1)Cl)C=O AB32133 [0,2,0,0,0,0|1,0,1]=4 1672 B10R1.25 Cc1c(ccc(n1)Cl)CN AB74568 [0,2,0,0,0,0|2,0,0]=4 1673 B10R1.25 Cc1c(ccc(n1)Cl)OC AB63867 [0,2,0,0,0,0|1,0,0]=3 1674 B10R1.25 Cc1c(ccc(n1)N)OC AB53570 [0,2,0,0,0,0|1,0,0]=3 1675 B10R1.25 Cc1c(ccc(n1)O)C#N AB55004 [0,2,0,0,0,0|2,0,0]=4 1676 B10R1.25 Cc1c(ccc(n1)O)OC AB63862 [0,2,0,0,0,0|1,0,0]=3 1677 B10R1.25 Cc1c(ncc(n1)Br)OC AB85717 [0,2,0,0,0,0|2,0,0]=4 1678 B10R1.25 Cc1cc(c(cn1)C=O)O AB75249 [0,2,0,0,0,0|1,0,1]=4 1679 B10R1.25 Cc1cc(c(cn1)CCl)Cl AB83327 [0,2,0,0,0,0|2,0,0]=4 1680 B10R1.25 Cc1cc(c(cn1)CCl)F AB83045 [0,2,0,0,0,0|2,0,0]=4 1681 B10R1.25 Cc1cc(c(cn1)CN)Br AB68171 [0,2,0,0,0,0|2,0,0]=4 1682 B10R1.25 Cc1cc(c(cn1)CN)Cl AB68154 [0,2,0,0,0,0|2,0,0]=4 1683 B10R1.25 Cc1cc(c(cn1)CN)F AB83048 [0,2,0,0,0,0|2,0,0]=4 1684 B10R1.25 Cc1cc(c(nc1)C#N)C AB22974 [0,2,0,0,0,0|2,0,0]=4 1685 B10R1.25 Cc1cc(c(nc1)C=O)C AB53525 [0,2,0,0,0,0|1,0,1]=4 1686 B10R1.25 Cc1cc(c(nc1)C=O)O AB75242 [0,2,0,0,0,0|1,0,1]=4 1687 B10R1.25 Cc1cc(c(nc1)CCl)C AB44395 [0,2,0,0,0,0|2,0,0]=4 1688 B10R1.25 Cc1cc(c(nc1)CCl)Cl AB75094 [0,2,0,0,0,0|2,0,0]=4 1689 B10R1.25 Cc1cc(c(nc1)CCl)F AB76356 [0,2,0,0,0,0|2,0,0]=4 1690 B10R1.25 Cc1cc(c(nc1)CN)C AB53521 [0,2,0,0,0,0|2,0,0]=4 1691 B10R1.25 Cc1cc(c(nc1)CN)Cl AB75093 [0,2,0,0,0,0|2,0,0]=4 1692 B10R1.25 Cc1cc(c(nc1)CN)F AB75165 [0,2,0,0,0,0|2,0,0]=4 1693 B10R1.25 Cc1cc(c(nc1)CO)C AB53524 [0,2,0,0,0,0|1,0,0]=3 1694 B10R1.25 Cc1cc(c(nc1)OC)N AB66728 [0,2,0,0,0,0|2,0,0]=4 1695 B10R1.25 Cc1cc(ccc1C#N)Cl MB00421 [0,2,0,0,0,0|1,0,0]=3 1696 B10R1.25 Cc1cc(ccc1C#N)O MB23389 [0,2,0,0,0,0|1,0,0]=3 1697 B10R1.25 Cc1cc(ccc1NC)O MB05083 [0,2,0,0,0,0|1,0,0]=3 1698 B10R1.25 Cc1cc(ccc1OC)O MB07842 [0,2,0,0,0,0|0,0,0]=2 1699 B10R1.25 Cc1cc(cnc1C#N)Br AB65088 [0,2,0,0,0,0|2,0,0]=4 1700 B10R1.25 Cc1cc(cnc1C#N)Cl AB71756 [0,2,0,0,0,0|2,0,0]=4 1701 B10R1.25 Cc1cc(cnc1C#N)N AB41218 [0,2,0,0,0,0|2,0,0]=4 1702 B10R1.25 Cc1cc(cnc1C=O)Br AB42359 [0,2,0,0,0,0|1,0,1]=4 1703 B10R1.25 Cc1cc(cnc1C=O)Cl AB75118 [0,2,0,0,0,0|1,0,1]=4 1704 B10R1.25 Cc1cc(cnc1C=O)F AB74798 [0,2,0,0,0,0|1,0,1]=4 1705 B10R1.25 Cc1cc(cnc1CCl)Cl AB75121 [0,2,0,0,0,0|2,0,0]=4 1706 B10R1.25 Cc1cc(cnc1CCl)F AB74796 [0,2,0,0,0,0|2,0,0]=4 1707 B10R1.25 Cc1cc(cnc1CN)Br AB41237 [0,2,0,0,0,0|2,0,0]=4 1708 B10R1.25 Cc1cc(cnc1CN)Cl AB75120 [0,2,0,0,0,0|2,0,0]=4 1709 B10R1.25 Cc1cc(cnc1CN)F AB41242 [0,2,0,0,0,0|2,0,0]=4 1710 B10R1.25 Cc1cc(cnc1OC)Br AB41223 [0,2,0,0,0,0|1,0,0]=3 1711 B10R1.25 Cc1cc(cnc1OC)Cl AB75754 [0,2,0,0,0,0|1,0,0]=3 1712 B10R1.25 Cc1cc(cnc1OC)N AB20996 [0,2,0,0,0,0|1,0,0]=3 1713 B10R1.25 Cc1cc(ncc1C=O)Br AB67814 [0,2,0,0,0,0|1,0,1]=4 1714 B10R1.25 Cc1cc(ncc1C=O)C AB74124 [0,2,0,0,0,0|1,0,1]=4 1715 B10R1.25 Cc1cc(ncc1C=O)Cl AB32140 [0,2,0,0,0,0|1,0,1]=4 1716 B10R1.25 Cc1cc(ncc1C=O)F AB75824 [0,2,0,0,0,0|1,0,1]=4 1717 B10R1.25 Cc1cc(ncc1CCl)C AB75393 [0,2,0,0,0,0|2,0,0]=4 1718 B10R1.25 Cc1cc(ncc1CCl)Cl AB74566 [0,2,0,0,0,0|2,0,0]=4 1719 B10R1.25 Cc1cc(ncc1CCl)F AB76758 [0,2,0,0,0,0|2,0,0]=4 1720 B10R1.25 Cc1cc(ncc1CCl)N AB76224 [0,2,0,0,0,0|2,0,0]=4 1721 B10R1.25 Cc1cc(ncc1CN)C AB62611 [0,2,0,0,0,0|2,0,0]=4 1722 B10R1.25 Cc1cc(ncc1CN)Cl AB74564 [0,2,0,0,0,0|2,0,0]=4 1723 B10R1.25 Cc1cc(ncc1CN)F AB83068 [0,2,0,0,0,0|2,0,0]=4 1724 B10R1.25 Cc1ccc(c(c1)F)NN AB27888 [0,2,0,0,0,0|2,0,0]=4 1725 B10R1.25 Cc1ccc(c(c1)N)C#N AB04357 [0,2,0,0,0,0|1,0,1]=4 1726 B10R1.25 Cc1ccc(c(c1)N)C=O AB58436 [0,2,0,0,0,0|1,0,1]=4 1727 B10R1.25 Cc1ccc(c(c1)O)C#N AB11820 [0,2,0,0,0,0|0,0,1]=3 1728 B10R1.25 Cc1ccc(c(c1)O)CN MB15038 [0,2,0,0,0,0|0,0,0]=2 1729 B10R1.25 Cc1ccc(c(c1)O)NC MB33283 [0,2,0,0,0,0|0,0,0]=2 1730 B10R1.25 Cc1ccc(c(c1)O)SC MB02032 [0,2,0,0,0,0|0,0,0]=2 1731 B10R1.25 Cc1ccc(c(n1)Br)CN AB68158 [0,2,0,0,0,0|2,0,0]=4 1732 B10R1.25 Cc1ccc(c(n1)Br)OC AB25427 [0,2,0,0,0,0|2,0,0]=4 1733 B10R1.25 Cc1ccc(c(n1)C)C=O AB13970 [0,2,0,0,0,0|1,0,1]=4 1734 B10R1.25 Cc1ccc(c(n1)Cl)CN AB23323 [0,2,0,0,0,0|2,0,0]=4 1735 B10R1.25 Cc1ccc(c(n1)N)CCl AB76121 [0,2,0,0,0,0|2,0,0]=4 1736 B10R1.25 Cc1ccc(c(n1)O)C=O AB42321 [0,2,0,0,0,0|1,0,1]=4 1737 B10R1.25 Cc1ncc(c(n1)O)CO AB48547 [0,2,0,0,0,0|2,0,0]=4 1738 B10R1.25 c1c(c(cnc1Br)C=O)O AB72645 [0,2,0,0,0,0|1,0,1]=4 1739 B10R1.25 c1c(c(cnc1Cl)C=O)O AB69327 [0,2,0,0,0,0|1,0,1]=4 1740 B10R1.25 c1c(c(cnc1Cl)CN)Cl AB68217 [0,2,0,0,0,0|2,0,0]=4 1741 B10R1.25 c1c(c(cnc1F)CCl)Cl AB83187 [0,2,0,0,0,0|2,0,0]=4 1742 B10R1.25 c1c(c(cnc1F)CN)Cl AB83188 [0,2,0,0,0,0|2,0,0]=4 1743 B10R1.25 c1c(c(cnc1N)C=O)O AB84438 [0,2,0,0,0,0|1,0,1]=4 1744 B10R1.25 c1c(c(cnc1O)C=O)O AB69704 [0,2,0,0,0,0|1,0,1]=4 1745 B10R1.25 c1c(cnc(c1Cl)CCl)F AB70994 [0,2,0,0,0,0|2,0,0]=4 1746 B10R1.25 c1c(cnc(c1Cl)CN)F AB71565 [0,2,0,0,0,0|2,0,0]=4 1747 B10R1.25 c1c(cnc(c1F)CCl)Cl AB70997 [0,2,0,0,0,0|2,0,0]=4 1748 B10R1.25 c1c(cnc(c1F)CN)Br PB24277 [0,2,0,0,0,0|2,0,0]=4 1749 B10R1.25 c1c(cnc(c1F)CN)Cl AB75040 [0,2,0,0,0,0|2,0,0]=4 1750 B10R1.25 c1c(cnc(c1F)CO)Br PB34795 [0,2,0,0,0,0|2,0,0]=4 1751 B10R1.25 c1c(cnc(c1N)CO)Br PB37232 [0,2,0,0,0,0|2,0,0]=4 1752 B10R1.25 c1c(cnc(c1O)C=O)Br AB70969 [0,2,0,0,0,0|1,0,1]=4 1753 B10R1.25 c1c(cnc(c1O)C=O)Cl AB75009 [0,2,0,0,0,0|1,0,1]=4 1754 B10R1.25 c1c(cnc(c1O)C=O)N AB84581 [0,2,0,0,0,0|1,0,1]=4 1755 B10R1.25 c1cc(c(cc1Br)Br)C#N AB66754 [0,2,0,0,0,0|1,0,1]=4 1756 B10R1.25 c1cc(c(cc1Br)Br)C=O AB66752 [0,2,0,0,0,0|1,0,1]=4 1757 B10R1.25 c1cc(c(cc1Br)F)C#N AB03862 [0,2,0,0,0,0|1,0,1]=4 1758 B10R1.25 c1cc(c(cc1Br)N)C=O AB45657 [0,2,0,0,0,0|1,0,1]=4 1759 B10R1.25 c1cc(c(cc1Br)N)CO AB42495 [0,2,0,0,0,0|1,0,0]=3 1760 B10R1.25 c1cc(c(cc1Br)O)C=O AB23661 [0,2,0,0,0,0|0,0,1]=3 1761 B10R1.25 c1cc(c(cc1Br)O)CN MB08429 [0,2,0,0,0,0|0,0,0]=2 1762 B10R1.25 c1cc(c(cc1Cl)Br)C=O MB06997 [0,2,0,0,0,0|1,0,1]=4 1763 B10R1.25 c1cc(c(cc1Cl)Br)CO MB06939 [0,2,0,0,0,0|1,0,0]=3 1764 B10R1.25 c1cc(c(cc1Cl)N)C=O AB58432 [0,2,0,0,0,0|1,0,1]=4 1765 B10R1.25 c1cc(c(cc1Cl)O)C#N MB01011 [0,2,0,0,0,0|0,0,1]=3 1766 B10R1.25 c1cc(c(cc1Cl)O)C=O AB23660 [0,2,0,0,0,0|0,0,1]=3 1767 B10R1.25 c1cc(c(cc1Cl)O)CN MB26819 [0,2,0,0,0,0|0,0,0]=2 1768 B10R1.25 c1cc(c(cc1F)Br)C#N AB06855 [0,2,0,0,0,0|1,0,1]=4 1769 B10R1.25 c1cc(c(cc1F)Br)C=O AB06851 [0,2,0,0,0,0|1,0,1]=4 1770 B10R1.25 c1cc(c(cc1F)Br)CO AB06857 [0,2,0,0,0,0|1,0,0]=3 1771 B10R1.25 c1cc(c(cc1F)N)C=O AB55874 [0,2,0,0,0,0|1,0,1]=4 1772 B10R1.25 c1cc(c(cc1F)N)CN AB50268 [0,2,0,0,0,0|1,0,0]=3 1773 B10R1.25 c1cc(c(cc1F)O)C#N MB13366 [0,2,0,0,0,0|0,0,1]=3 1774 B10R1.25 c1cc(c(cc1F)O)CN MB14866 [0,2,0,0,0,0|0,0,0]=2 1775 B10R1.25 c1cc(c(cc1I)O)C#N MB11881 [0,2,0,0,0,0|0,0,1]=3 1776 B10R1.25 c1cc(c(cc1I)O)C=O MB06220 [0,2,0,0,0,0|0,0,1]=3 1777 B10R1.25 c1cc(c(cc1I)O)CN MB10252 [0,2,0,0,0,0|0,0,0]=2 1778 B10R1.25 c1cc(c(cc1N)F)C#N AB32067 [0,2,0,0,0,0|1,0,1]=4 1779 B10R1.25 c1cc(c(cc1N)F)CBr AB56061 [0,2,0,0,0,0|1,0,0]=3 1780 B10R1.25 c1cc(c(cc1N)F)CN AB50282 [0,2,0,0,0,0|1,0,0]=3 1781 B10R1.25 c1cc(c(cc1N)O)C#N AB53481 [0,2,0,0,0,0|0,0,1]=3 1782 B10R1.25 c1cc(c(cc1N)O)C=O MB09039 [0,2,0,0,0,0|0,0,1]=3 1783 B10R1.25 c1cc(c(cc1N)O)CN MB10253 [0,2,0,0,0,0|0,0,0]=2 1784 B10R1.25 c1cc(c(cc1O)Br)C#N MB14756 [0,2,0,0,0,0|1,0,1]=4 1785 B10R1.25 c1cc(c(cc1O)Br)C=O MB25584 [0,2,0,0,0,0|1,0,1]=4 1786 B10R1.25 c1cc(c(cc1O)Cl)CN MB02722 [0,2,0,0,0,0|1,0,0]=3 1787 B10R1.25 c1cc(c(cc1O)F)C#N AB04647 [0,2,0,0,0,0|1,0,1]=4 1788 B10R1.25 c1cc(c(cc1O)F)CN MB02723 [0,2,0,0,0,0|1,0,0]=3 1789 B10R1.25 c1cc(c(cc1O)I)C#N MB14759 [0,2,0,0,0,0|1,0,1]=4 1790 B10R1.25 c1cc(c(cc1O)I)C=O MB25658 [0,2,0,0,0,0|1,0,1]=4 1791 B10R1.25 c1cc(c(cc1O)N)C#N MB14762 [0,2,0,0,0,0|1,0,1]=4 1792 B10R1.25 c1cc(c(cc1O)N)C=O MB38477 [0,2,0,0,0,0|1,0,1]=4 1793 B10R1.25 c1cc(c(cc1O)N)CN MB29325 [0,2,0,0,0,0|1,0,0]=3 1794 B10R1.25 c1cc(nc(c1C=O)O)Br AB84532 [0,2,0,0,0,0|1,0,1]=4 1795 B10R1.25 c1cc(nc(c1C=O)O)Cl AB84535 [0,2,0,0,0,0|1,0,1]=4 1796 B10R1.25 c1cc(nc(c1C=O)O)N AB84539 [0,2,0,0,0,0|1,0,1]=4 1797 B10R1.25 c1cc(nc(c1CCl)Cl)Cl AB31596 [0,2,0,0,0,0|2,0,0]=4 1798 B10R1.25 c1cc(nc(c1CCl)N)Br AB85294 [0,2,0,0,0,0|2,0,0]=4 1799 B10R1.25 c1cc(nc(c1CCl)N)Cl AB71432 [0,2,0,0,0,0|2,0,0]=4 1800 B10R1.25 c1cc(nc(c1CN)Br)Cl AB68220 [0,2,0,0,0,0|2,0,0]=4 1801 B10R1.25 c1cc(nc(c1CN)Cl)Br AB68231 [0,2,0,0,0,0|2,0,0]=4 1802 B10R1.25 c1cc(nc(c1CN)Cl)Cl AB68210 [0,2,0,0,0,0|2,0,0]=4 1803 B10R1.25 c1cc(nc(c1CO)Cl)Cl PB32897 [0,2,0,0,0,0|2,0,0]=4 1804 B10R1.30 CCc1cc(ccc1Br)O MB23770 [0,2,0,0,0,0|1,0,0]=3 1805 B10R1.30 CCc1cc(ccc1C)O MB23722 [0,2,0,0,0,0|1,0,0]=3 1806 B10R1.30 CCc1cc(ccc1F)O MB23754 [0,2,0,0,0,0|1,0,0]=3 1807 B10R1.30 CCc1cc(ccc1I)O MB09270 [0,2,0,0,0,0|1,0,0]=3 1808 B10R1.30 CCc1cc(ccc1N)O MB23757 [0,2,0,0,0,0|1,0,0]=3 1809 B10R1.30 CCc1cc(ccc1O)Br MB00480 [0,2,0,0,0,0|0,0,0]=2 1810 B10R1.30 CCc1cc(ccc1O)C MB23622 [0,2,0,0,0,0|0,0,0]=2 1811 B10R1.30 CCc1cc(ccc1O)Cl MB00701 [0,2,0,0,0,0|0,0,0]=2 1812 B10R1.30 CCc1cc(ccc1O)I MB23657 [0,2,0,0,0,0|0,0,0]=2 1813 B10R1.30 CCc1cc(ccc1O)N MB23663 [0,2,0,0,0,0|0,0,0]=2 1814 B10R1.30 CNc1cc(ccc1Cl)O MB30361 [0,2,0,0,0,0|1,0,0]=3 1815 B10R1.30 CNc1cc(ccc1F)O MB28645 [0,2,0,0,0,0|1,0,0]=3 1816 B10R1.30 CNc1cc(ccc1I)O MB33108 [0,2,0,0,0,0|1,0,0]=3 1817 B10R1.30 CNc1cc(ccc1N)O MB33092 [0,2,0,0,0,0|1,0,0]=3 1818 B10R1.30 CNc1cc(ccc1O)Br MB32072 [0,2,0,0,0,0|0,0,0]=2 1819 B10R1.30 CNc1cc(ccc1O)F MB26737 [0,2,0,0,0,0|0,0,0]=2 1820 B10R1.30 CNc1cc(ccc1O)I MB35760 [0,2,0,0,0,0|0,0,0]=2 1821 B10R1.30 CNc1cc(ccc1O)N MB28647 [0,2,0,0,0,0|0,0,0]=2 1822 B10R1.30 CNc1cc(cnc1Cl)Br AB40833 [0,2,0,0,0,0|2,0,0]=4 1823 B10R1.30 CNc1cc(cnc1Cl)Cl AB41028 [0,2,0,0,0,0|2,0,0]=4 1824 B10R1.30 COc1c(ccc(n1)Br)F AB74998 [0,2,0,0,0,0|2,0,0]=4 1825 B10R1.30 COc1c(ccc(n1)Cl)O AB69331 [0,2,0,0,0,0|1,0,0]=3 1826 B10R1.30 COc1c(ccc(n1)I)Br AB73529 [0,2,0,0,0,0|2,0,0]=4 1827 B10R1.30 COc1c(ccc(n1)N)F AB76983 [0,2,0,0,0,0|2,0,0]=4 1828 B10R1.30 COc1cc(ccc1Br)O MB00359 [0,2,0,0,0,0|1,0,0]=3 1829 B10R1.30 COc1cc(ccc1Cl)O MB25434 [0,2,0,0,0,0|1,0,0]=3 1830 B10R1.30 COc1cc(ccc1F)O MB08744 [0,2,0,0,0,0|1,0,0]=3 1831 B10R1.30 COc1cc(ccc1I)Br CB11560 [0,2,0,0,0,0|1,0,0]=3 1832 B10R1.30 COc1cc(ccc1I)O MB29625 [0,2,0,0,0,0|1,0,0]=3 1833 B10R1.30 COc1cc(ccc1N)F MB00562 [0,2,0,0,0,0|1,0,0]=3 1834 B10R1.30 COc1cc(ccc1N)O MB01122 [0,2,0,0,0,0|1,0,0]=3 1835 B10R1.30 COc1cc(ccc1O)Br PB30583 [0,2,0,0,0,0|0,0,0]=2 1836 B10R1.30 COc1cc(ccc1O)I MB05217 [0,2,0,0,0,0|0,0,0]=2 1837 B10R1.30 COc1cc(cnc1Cl)Br AB43719 [0,2,0,0,0,0|2,0,0]=4 1838 B10R1.30 COc1cc(cnc1Cl)F AB74801 [0,2,0,0,0,0|2,0,0]=4 1839 B10R1.30 COc1cc(ncc1Cl)N AB70478 [0,2,0,0,0,0|2,0,0]=4 1840 B10R1.30 CSc1cc(ccc1Br)O MB38334 [0,2,0,0,0,0|1,0,0]=3 1841 B10R1.30 CSc1cc(ccc1Cl)O MB38239 [0,2,0,0,0,0|1,0,0]=3 1842 B10R1.30 CSc1cc(ccc1F)O MB25679 [0,2,0,0,0,0|1,0,0]=3 1843 B10R1.30 CSc1cc(ccc1I)O MB30001 [0,2,0,0,0,0|1,0,0]=3 1844 B10R1.30 CSc1cc(ccc1N)O MB25516 [0,2,0,0,0,0|1,0,0]=3 1845 B10R1.30 CSc1cc(ccc1O)Br MB28713 [0,2,0,0,0,0|0,0,0]=2 1846 B10R1.30 CSc1cc(ccc1O)Cl MB35043 [0,2,0,0,0,0|0,0,0]=2 1847 B10R1.30 CSc1cc(ccc1O)F MB35476 [0,2,0,0,0,0|0,0,0]=2 1848 B10R1.30 CSc1cc(ccc1O)N MB29519 [0,2,0,0,0,0|0,0,0]=2 1849 B10R1.30 Cc1c(cc(cn1)Cl)C=O AB62434 [0,2,0,0,0,0|1,0,1]=4 1850 B10R1.30 Cc1c(cc(cn1)Cl)CN AB62431 [0,2,0,0,0,0|2,0,0]=4 1851 B10R1.30 Cc1cc(c(cn1)Br)CN AB68167 [0,2,0,0,0,0|2,0,0]=4 1852 B10R1.30 Cc1cc(c(cn1)Br)OC AB40816 [0,2,0,0,0,0|2,0,0]=4 1853 B10R1.30 Cc1cc(c(cn1)C)C=O AB74126 [0,2,0,0,0,0|1,0,1]=4 1854 B10R1.30 Cc1cc(c(cn1)C)CCl AB75401 [0,2,0,0,0,0|2,0,0]=4 1855 B10R1.30 Cc1cc(c(cn1)C)CN AB76782 [0,2,0,0,0,0|2,0,0]=4 1856 B10R1.30 Cc1cc(c(cn1)Cl)CN AB68151 [0,2,0,0,0,0|2,0,0]=4 1857 B10R1.30 Cc1cc(c(cn1)O)C=O AB76792 [0,2,0,0,0,0|1,0,1]=4 1858 B10R1.30 Cc1cc(c(nc1)Br)CCl AB71047 [0,2,0,0,0,0|2,0,0]=4 1859 B10R1.30 Cc1cc(c(nc1)C)C=O AB71657 [0,2,0,0,0,0|1,0,1]=4 1860 B10R1.30 Cc1cc(c(nc1)C)CCl AB75394 [0,2,0,0,0,0|2,0,0]=4 1861 B10R1.30 Cc1cc(c(nc1)C)CN AB76781 [0,2,0,0,0,0|2,0,0]=4 1862 B10R1.30 Cc1cc(c(nc1)Cl)CCl AB71113 [0,2,0,0,0,0|2,0,0]=4 1863 B10R1.30 Cc1cc(c(nc1)Cl)CN AB41819 [0,2,0,0,0,0|2,0,0]=4 1864 B10R1.30 Cc1cc(c(nc1)F)CCl AB71237 [0,2,0,0,0,0|2,0,0]=4 1865 B10R1.30 Cc1cc(c(nc1)F)CN AB65158 [0,2,0,0,0,0|2,0,0]=4 1866 B10R1.30 Cc1cc(c(nc1)N)CCl AB70870 [0,2,0,0,0,0|2,0,0]=4 1867 B10R1.30 Cc1cc(c(nc1)O)C#N AB64064 [0,2,0,0,0,0|1,0,1]=4 1868 B10R1.30 Cc1cc(c(nc1)O)C=O AB71365 [0,2,0,0,0,0|1,0,1]=4 1869 B10R1.30 Cc1cc(c(nn1)O)CN PB23030 [0,2,0,0,0,0|2,0,0]=4 1870 B10R1.30 Cc1ccc(c(c1)C#N)O MB36141 [0,2,0,0,0,0|0,0,1]=3 1871 B10R1.30 Cc1ccc(c(c1)C=O)N AB58438 [0,2,0,0,0,0|1,0,1]=4 1872 B10R1.30 Cc1ccc(c(c1)SC)O MB34646 [0,2,0,0,0,0|0,0,0]=2 1873 B10R1.30 Cc1ccc(c(n1)C=O)O AB62933 [0,2,0,0,0,0|1,0,1]=4 1874 B10R1.30 Cc1ccc(c(n1)CN)Br AB68170 [0,2,0,0,0,0|2,0,0]=4 1875 B10R1.30 Cc1ccc(c(n1)CN)Cl AB68153 [0,2,0,0,0,0|2,0,0]=4 1876 B10R1.30 Cc1ccc(cc1C#N)O MB23451 [0,2,0,0,0,0|1,0,0]=3 1877 B10R1.30 Cc1ccc(cc1C=O)Cl AB63586 [0,2,0,0,0,0|0,0,1]=3 1878 B10R1.30 Cc1ccc(cc1C=O)O MB23457 [0,2,0,0,0,0|0,0,1]=3 1879 B10R1.30 Cc1ccc(cc1CBr)Cl CB11653 [0,2,0,0,0,0|1,0,0]=3 1880 B10R1.30 Cc1ccc(cc1CN)O MB26411 [0,2,0,0,0,0|1,0,0]=3 1881 B10R1.30 Cc1ccc(cc1NC)O MB36159 [0,2,0,0,0,0|1,0,0]=3 1882 B10R1.30 Cc1ccc(cc1OC)Br MB04159 [0,2,0,0,0,0|0,0,0]=2 1883 B10R1.30 Cc1ccc(cc1OC)O MB25418 [0,2,0,0,0,0|0,0,0]=2 1884 B10R1.30 Cc1ccc(nc1C#N)C AB25377 [0,2,0,0,0,0|2,0,0]=4 1885 B10R1.30 Cc1ccc(nc1C#N)Cl AB71445 [0,2,0,0,0,0|2,0,0]=4 1886 B10R1.30 Cc1ccc(nc1C=O)C AB75403 [0,2,0,0,0,0|1,0,1]=4 1887 B10R1.30 Cc1ccc(nc1C=O)Cl AB75110 [0,2,0,0,0,0|1,0,1]=4 1888 B10R1.30 Cc1ccc(nc1C=O)F AB75170 [0,2,0,0,0,0|1,0,1]=4 1889 B10R1.30 Cc1ccc(nc1CCl)C AB75390 [0,2,0,0,0,0|2,0,0]=4 1890 B10R1.30 Cc1ccc(nc1CCl)Cl AB75115 [0,2,0,0,0,0|2,0,0]=4 1891 B10R1.30 Cc1ccc(nc1CCl)F AB82887 [0,2,0,0,0,0|2,0,0]=4 1892 B10R1.30 Cc1ccc(nc1CN)C AB65466 [0,2,0,0,0,0|2,0,0]=4 1893 B10R1.30 Cc1ccc(nc1CN)Cl AB75112 [0,2,0,0,0,0|2,0,0]=4 1894 B10R1.30 Cc1ccc(nc1CN)F AB82890 [0,2,0,0,0,0|2,0,0]=4 1895 B10R1.30 Cc1cnc(cc1C=O)Cl AB67498 [0,2,0,0,0,0|1,0,1]=4 1896 B10R1.30 Cc1cnc(cc1C=O)F AB71344 [0,2,0,0,0,0|1,0,1]=4 1897 B10R1.30 Cc1cnc(cc1CCl)Cl AB71119 [0,2,0,0,0,0|2,0,0]=4 1898 B10R1.30 Cc1cnc(cc1CCl)F AB71241 [0,2,0,0,0,0|2,0,0]=4 1899 B10R1.30 Cc1cnc(cc1CN)Cl AB75278 [0,2,0,0,0,0|2,0,0]=4 1900 B10R1.30 Cc1cnc(cc1CN)F AB82870 [0,2,0,0,0,0|2,0,0]=4 1901 B10R1.30 c1c(c(cnc1Br)O)C=O AB69284 [0,2,0,0,0,0|1,0,1]=4 1902 B10R1.30 c1c(c(cnc1Cl)Cl)CCl AB69878 [0,2,0,0,0,0|2,0,0]=4 1903 B10R1.30 c1c(c(cnc1Cl)Cl)CN AB68213 [0,2,0,0,0,0|2,0,0]=4 1904 B10R1.30 c1c(c(cnc1Cl)F)CCl AB70990 [0,2,0,0,0,0|2,0,0]=4 1905 B10R1.30 c1c(c(cnc1Cl)F)CN AB72294 [0,2,0,0,0,0|2,0,0]=4 1906 B10R1.30 c1c(c(cnc1Cl)O)C=O AB67782 [0,2,0,0,0,0|1,0,1]=4 1907 B10R1.30 c1c(c(cnc1N)O)C=O AB84402 [0,2,0,0,0,0|1,0,1]=4 1908 B10R1.30 c1c(cnc(c1C#N)O)Br PB30875 [0,2,0,0,0,0|1,0,1]=4 1909 B10R1.30 c1c(cnc(c1C#N)O)Cl AB63087 [0,2,0,0,0,0|1,0,1]=4 1910 B10R1.30 c1c(cnc(c1C=O)O)Br AB70946 [0,2,0,0,0,0|1,0,1]=4 1911 B10R1.30 c1c(cnc(c1C=O)O)Cl AB70935 [0,2,0,0,0,0|1,0,1]=4 1912 B10R1.30 c1c(cnc(c1C=O)O)N AB84511 [0,2,0,0,0,0|1,0,1]=4 1913 B10R1.30 c1c(cnc(c1CBr)N)Br AB44379 [0,2,0,0,0,0|2,0,0]=4 1914 B10R1.30 c1c(cnc(c1CCl)Cl)F AB70662 [0,2,0,0,0,0|2,0,0]=4 1915 B10R1.30 c1c(cnc(c1CCl)N)Br AB71006 [0,2,0,0,0,0|2,0,0]=4 1916 B10R1.30 c1c(cnc(c1CCl)N)Cl AB75385 [0,2,0,0,0,0|2,0,0]=4 1917 B10R1.30 c1c(cnc(c1CN)Cl)F AB65094 [0,2,0,0,0,0|2,0,0]=4 1918 B10R1.30 c1c(cnc(c1CN)F)Br PB16767 [0,2,0,0,0,0|2,0,0]=4 1919 B10R1.30 c1c(cnc(c1CO)Cl)Br PB17569 [0,2,0,0,0,0|2,0,0]=4 1920 B10R1.30 c1c(cnc(c1CO)Cl)F AB13672 [0,2,0,0,0,0|2,0,0]=4 1921 B10R1.30 c1c(cnc(c1CO)F)Br PB34780 [0,2,0,0,0,0|2,0,0]=4 1922 B10R1.30 c1c(cnc(c1CO)N)Br AB22233 [0,2,0,0,0,0|2,0,0]=4 1923 B10R1.30 c1c(cnc(c1CO)N)Br AB44376 [0,2,0,0,0,0|2,0,0]=4 1924 B10R1.30 c1c(cnc(c1CO)N)I AB21855 [0,2,0,0,0,0|2,0,0]=4 1925 B10R1.30 c1cc(c(cc1Br)C#N)N MB00791 [0,2,0,0,0,0|1,0,1]=4 1926 B10R1.30 c1cc(c(cc1Br)C=O)Br MB01225 [0,2,0,0,0,0|1,0,1]=4 1927 B10R1.30 c1cc(c(cc1Br)C=O)N AB58429 [0,2,0,0,0,0|1,0,1]=4 1928 B10R1.30 c1cc(c(cc1Br)CN)N AB23393 [0,2,0,0,0,0|1,0,0]=3 1929 B10R1.30 c1cc(c(cc1Br)CN)O AB10938 [0,2,0,0,0,0|0,0,0]=2 1930 B10R1.30 c1cc(c(cc1Br)CO)Cl MB02484 [0,2,0,0,0,0|1,0,0]=3 1931 B10R1.30 c1cc(c(cc1Br)CO)N MB05459 [0,2,0,0,0,0|1,0,0]=3 1932 B10R1.30 c1cc(c(cc1Br)NN)F AB13329 [0,2,0,0,0,0|2,0,0]=4 1933 B10R1.30 c1cc(c(cc1Cl)C#N)Br AB45293 [0,2,0,0,0,0|1,0,1]=4 1934 B10R1.30 c1cc(c(cc1Cl)C=O)O AB00314 [0,2,0,0,0,0|0,0,1]=3 1935 B10R1.30 c1cc(c(cc1Cl)CN)N AB23303 [0,2,0,0,0,0|1,0,0]=3 1936 B10R1.30 c1cc(c(cc1Cl)CN)O AB23336 [0,2,0,0,0,0|0,0,0]=2 1937 B10R1.30 c1cc(c(cc1Cl)CO)N MB00550 [0,2,0,0,0,0|1,0,0]=3 1938 B10R1.30 c1cc(c(cc1F)C#N)O MB10100 [0,2,0,0,0,0|0,0,1]=3 1939 B10R1.30 c1cc(c(cc1F)C=O)Br AB03821 [0,2,0,0,0,0|1,0,1]=4 1940 B10R1.30 c1cc(c(cc1F)C=O)N AB58443 [0,2,0,0,0,0|1,0,1]=4 1941 B10R1.30 c1cc(c(cc1F)CN)N AB23426 [0,2,0,0,0,0|1,0,0]=3 1942 B10R1.30 c1cc(c(cc1F)CN)O MB12059 [0,2,0,0,0,0|0,0,0]=2 1943 B10R1.30 c1cc(c(cc1F)CO)N MB05463 [0,2,0,0,0,0|1,0,0]=3 1944 B10R1.30 c1cc(c(cc1I)C#N)O MB02487 [0,2,0,0,0,0|0,0,1]=3 1945 B10R1.30 c1cc(c(cc1I)CBr)Cl AB43862 [0,2,0,0,0,0|1,0,0]=3 1946 B10R1.30 c1cc(c(cc1I)CN)Cl AB44524 [0,2,0,0,0,0|1,0,0]=3 1947 B10R1.30 c1cc(c(cc1I)CN)O MB08421 [0,2,0,0,0,0|0,0,0]=2 1948 B10R1.30 c1cc(c(cc1N)C#N)Cl AB07265 [0,2,0,0,0,0|1,0,1]=4 1949 B10R1.30 c1cc(c(cc1N)C#N)O MB01949 [0,2,0,0,0,0|0,0,1]=3 1950 B10R1.30 c1cc(c(cc1N)C=O)O MB01352 [0,2,0,0,0,0|0,0,1]=3 1951 B10R1.30 c1cc(c(cc1N)CN)F AB23413 [0,2,0,0,0,0|1,0,0]=3 1952 B10R1.30 c1cc(c(cc1N)CN)O MB10073 [0,2,0,0,0,0|0,0,0]=2 1953 B10R1.30 c1cc(c(cc1O)C#N)Br MB05213 [0,2,0,0,0,0|1,0,1]=4 1954 B10R1.30 c1cc(c(cc1O)C#N)Cl MB07522 [0,2,0,0,0,0|1,0,1]=4 1955 B10R1.30 c1cc(c(cc1O)C#N)I MB27967 [0,2,0,0,0,0|1,0,1]=4 1956 B10R1.30 c1cc(c(cc1O)C#N)N MB03902 [0,2,0,0,0,0|1,0,1]=4 1957 B10R1.30 c1cc(c(cc1O)C=O)Br AB13035 [0,2,0,0,0,0|1,0,1]=4 1958 B10R1.30 c1cc(c(cc1O)C=O)Cl MB05036 [0,2,0,0,0,0|1,0,1]=4 1959 B10R1.30 c1cc(c(cc1O)C=O)F MB06891 [0,2,0,0,0,0|1,0,1]=4 1960 B10R1.30 c1cc(c(cc1O)C=O)N MB29975 [0,2,0,0,0,0|1,0,1]=4 1961 B10R1.30 c1cc(c(cc1O)CN)Br MB08427 [0,2,0,0,0,0|1,0,0]=3 1962 B10R1.30 c1cc(c(cc1O)CN)Cl MB37155 [0,2,0,0,0,0|1,0,0]=3 1963 B10R1.30 c1cc(c(cc1O)CN)F MB12208 [0,2,0,0,0,0|1,0,0]=3 1964 B10R1.30 c1cc(c(cc1O)CN)I MB36844 [0,2,0,0,0,0|1,0,0]=3 1965 B10R1.30 c1cc(nc(c1Br)CN)Cl AB73060 [0,2,0,0,0,0|2,0,0]=4 1966 B10R1.30 c1cc(nc(c1Cl)CN)Cl AB68215 [0,2,0,0,0,0|2,0,0]=4 1967 B10R1.30 c1cc(nc(c1F)CCl)Cl AB71000 [0,2,0,0,0,0|2,0,0]=4 1968 B10R1.30 c1cc(nc(c1F)CN)Cl AB74839 [0,2,0,0,0,0|2,0,0]=4 1969 B10R1.30 c1cc(nc(c1O)C=O)Br AB84561 [0,2,0,0,0,0|1,0,1]=4 1970 B10R1.30 c1cc(nc(c1O)C=O)Cl AB74851 [0,2,0,0,0,0|1,0,1]=4 1971 B10R1.30 c1cc(nc(c1O)C=O)N AB84562 [0,2,0,0,0,0|1,0,1]=4 1972 B10R1.61 B(c1c(cccn1)C)(O)O AB06942 [0,2,0,0,0,0|1,0,0]=3 1973 B10R1.61 B(c1c(cccn1)O)(O)O AB48454 [0,2,0,0,0,0|2,0,0]=4 1974 B10R1.61 B(c1ccccc1Br)(O)O AB08325 [0,2,0,0,0,0|1,0,0]=3 1975 B10R1.61 B(c1ccccc1C)(O)O AB03348 [0,2,0,0,0,0|0,0,0]=2 1976 B10R1.61 B(c1ccccc1Cl)(O)O AB06914 [0,2,0,0,0,0|1,0,0]=3 1977 B10R1.61 B(c1ccccc1F)(O)O AB06918 [0,2,0,0,0,0|1,0,0]=3 1978 B10R1.61 B(c1ccccc1N)(O)O AB08088 [0,2,0,0,0,0|1,0,0]=3 1979 B10R1.61 B(c1ccccc1O)(O)O AB08053 [0,2,0,0,0,0|1,0,0]=3 1980 B10R1.61 B(c1cccnc1Br)(O)O AB17846 [0,2,0,0,0,0|2,0,0]=4 1981 B10R1.61 B(c1cccnc1C)(O)O AB25945 [0,2,0,0,0,0|1,0,0]=3 1982 B10R1.61 B(c1cccnc1Cl)(O)O PB10233 [0,2,0,0,0,0|2,0,0]=4 1983 B10R1.61 B(c1cccnc1F)(O)O AB14130 [0,2,0,0,0,0|2,0,0]=4 1984 B10R1.61 B(c1cccnc1F)(O)O AB17194 [0,2,0,0,0,0|2,0,0]=4 1985 B10R1.61 B(c1cccnc1O)(O)O AB59785 [0,2,0,0,0,0|2,0,0]=4 1986 B10R1.61 B(c1ccncc1Br)(O)O AB30060 [0,2,0,0,0,0|2,0,0]=4 1987 B10R1.61 B(c1ccncc1C)(O)O PB33663 [0,2,0,0,0,0|1,0,0]=3 1988 B10R1.61 B(c1ccncc1Cl)(O)O AB14722 [0,2,0,0,0,0|2,0,0]=4 1989 B10R1.61 B(c1ccncc1F)(O)O AB15803 [0,2,0,0,0,0|2,0,0]=4 1990 B10R1.61 B(c1ccncc1F)(O)O AB16034 [0,2,0,0,0,0|2,0,0]=4 1991 B10R1.61 B(c1ccncc1N)(O)O AB67765 [0,2,0,0,0,0|2,0,0]=4 1992 B10R1.61 B(c1ccncc1O)(O)O AB67807 [0,2,0,0,0,0|2,0,0]=4 1993 B10R1.61 B(c1cnccc1C)(O)O AB15952 [0,2,0,0,0,0|1,0,0]=3 1994 B10R1.61 B(c1cnccc1Cl)(O)O AB30062 [0,2,0,0,0,0|2,0,0]=4 1995 B10R1.61 B(c1cnccc1F)(O)O AB32070 [0,2,0,0,0,0|2,0,0]=4 1996 B10R1.61 B(c1cnccc1O)(O)O AB59789 [0,2,0,0,0,0|2,0,0]=4 1997 B10R1.61 B(c1cncnc1C)(O)O AB72382 [0,2,0,0,0,0|2,0,0]=4 1998 B10R1.61 CC(=O)c1c(cccn1)Cl PB28312 [0,2,0,0,0,0|2,0,0]=4 1999 B10R1.61 CC(=O)c1c(cccn1)F PB26212 [0,2,0,0,0,0|2,0,0]=4 2000 B10R1.61 CC(=O)c1c(cccn1)N AB08681 [0,2,0,0,0,0|2,0,0]=4 2001 B10R1.61 CC(=O)c1cccnc1Br AB18171 [0,2,0,0,0,0|2,0,0]=4 2002 B10R1.61 CC(=O)c1cccnc1Cl PB32351 [0,2,0,0,0,0|2,0,0]=4 2003 B10R1.61 CC(=O)c1cccnc1F AB41104 [0,2,0,0,0,0|2,0,0]=4 2004 B10R1.61 CC(=O)c1cccnc1N AB11689 [0,2,0,0,0,0|2,0,0]=4 2005 B10R1.61 CC(=O)c1ccncc1Br PB12099 [0,2,0,0,0,0|2,0,0]=4 2006 B10R1.61 CC(=O)c1ccncc1F PB22036 [0,2,0,0,0,0|2,0,0]=4 2007 B10R1.61 CC(=O)c1ccncc1N AB41121 [0,2,0,0,0,0|2,0,0]=4 2008 B10R1.61 CC(=O)c1cnccc1Br AB64732 [0,2,0,0,0,0|2,0,0]=4 2009 B10R1.61 CC(=O)c1cnccc1Cl AB64447 [0,2,0,0,0,0|2,0,0]=4 2010 B10R1.61 CC(=O)c1cnccc1F AB41107 [0,2,0,0,0,0|2,0,0]=4 2011 B10R1.61 CC(C)c1c(cccn1)O MB22687 [0,2,0,0,0,0|1,0,0]=3 2012 B10R1.61 CC(C)c1ccncc1O MB22678 [0,2,0,0,0,0|1,0,0]=3 2013 B10R1.61 CC(C)c1cnccc1O MB22684 [0,2,0,0,0,0|1,0,0]=3 2014 B10R1.61 CC(c1cccnc1Br)N AB41828 [0,2,0,0,0,0|2,0,0]=4 2015 B10R1.61 CC(c1cccnc1Cl)N AB67346 [0,2,0,0,0,0|2,0,0]=4 2016 B10R1.61 CC(c1cnccc1Cl)N AB68000 [0,2,0,0,0,0|2,0,0]=4 2017 B10R1.61 CN(C)c1c(cccn1)Br AB67478 [0,2,0,0,0,0|2,0,0]=4 2018 B10R1.61 CN(C)c1c(cccn1)Cl AB67480 [0,2,0,0,0,0|2,0,0]=4 2019 B10R1.61 CN(C)c1c(cccn1)O MB24991 [0,2,0,0,0,0|1,0,0]=3 2020 B10R1.61 CN(C)c1ccccc1O MB08302 [0,2,0,0,0,0|0,0,0]=2 2021 B10R1.61 CN(C)c1ccncc1O MB24982 [0,2,0,0,0,0|1,0,0]=3 2022 B10R1.61 CN(C)c1cnccc1O MB24989 [0,2,0,0,0,0|1,0,0]=3 2023 B10R1.61 Cc1c(cccn1)C(=O)C AB03570 [0,2,0,0,0,0|1,0,1]=4 2024 B10R1.61 Cc1c(cccn1)C(=O)O PB27380 [0,2,0,0,0,0|1,0,0]=3 2025 B10R1.61 Cc1c(cccn1)C(C)C AB65910 [0,2,0,0,0,0|2,0,0]=4 2026 B10R1.61 Cc1c(cccn1)C(C)N AB66938 [0,2,0,0,0,0|2,0,0]=4 2027 B10R1.61 Cc1c(cccn1)[N+](=O)[O-] PB15768 [0,2,0,0,0,0|1,0,1]=4 2028 B10R1.61 Cc1c(ccnn1)C(=O)O PB22593 [0,2,0,0,0,0|2,0,0]=4 2029 B10R1.61 Cc1c(nccn1)C(=O)O PB12562 [0,2,0,0,0,0|2,0,0]=4 2030 B10R1.61 Cc1ccccc1C(=N)N AB18273 [0,2,0,0,0,0|1,0,0]=3 2031 B10R1.61 Cc1ccccc1C(=S)N AB16881 [0,2,0,0,0,0|0,1,0]=3 2032 B10R1.61 Cc1cccnc1C(=O)O PB10121 [0,2,0,0,0,0|1,0,0]=3 2033 B10R1.61 Cc1ccncc1C(=O)C AB45306 [0,2,0,0,0,0|1,0,1]=4 2034 B10R1.61 Cc1ccncc1C(=O)O PB17119 [0,2,0,0,0,0|1,0,0]=3 2035 B10R1.61 Cc1ccncc1C(C)N AB67850 [0,2,0,0,0,0|2,0,0]=4 2036 B10R1.61 Cc1ccncc1[N+](=O)[O-] PB27407 [0,2,0,0,0,0|1,0,1]=4 2037 B10R1.61 Cc1ccnnc1C(=O)O PB17664 [0,2,0,0,0,0|2,0,0]=4 2038 B10R1.61 Cc1cnccc1C(=O)O PB12103 [0,2,0,0,0,0|1,0,0]=3 2039 B10R1.61 Cc1cnccc1[N+](=O)[O-] PB15731 [0,2,0,0,0,0|1,0,1]=4 2040 B10R1.61 Cc1cnncc1C(=O)O PB17923 [0,2,0,0,0,0|2,0,0]=4 2041 B10R1.61 c1cc(c(nc1)Br)C(=O)O AB09561 [0,2,0,0,0,0|2,0,0]=4 2042 B10R1.61 c1cc(c(nc1)C(=O)O)Cl PB30690 [0,2,0,0,0,0|2,0,0]=4 2043 B10R1.61 c1cc(c(nc1)C(=O)O)F PB12310 [0,2,0,0,0,0|2,0,0]=4 2044 B10R1.61 c1cc(c(nc1)C(=O)O)I AB10544 [0,2,0,0,0,0|2,0,0]=4 2045 B10R1.61 c1cc(c(nc1)C(=O)O)N PB32134 [0,2,0,0,0,0|2,0,0]=4 2046 B10R1.61 c1cc(c(nc1)Cl)C(=O)O AB00651 [0,2,0,0,0,0|2,0,0]=4 2047 B10R1.61 c1cc(c(nc1)F)C(=O)O AB01814 [0,2,0,0,0,0|2,0,0]=4 2048 B10R1.61 c1cc(c(nc1)N)C(=O)O PB30535 [0,2,0,0,0,0|2,0,0]=4 2049 B10R1.61 c1cc(c(nc1)O)C(=O)O AB01020 [0,2,0,0,0,0|1,0,1]=4 2050 B10R1.61 c1cc(c(nc1)O)[N+](=O)[O-] PB30530 [0,2,0,0,0,0|2,0,0]=4 2051 B10R1.61 c1cc(c(nc1)[N+](=O)[O-])O AB00667 [0,2,0,0,0,0|2,0,0]=4 2052 B10R1.61 c1ccc(c(c1)C(=N)N)Br AB18326 [0,2,0,0,0,0|1,0,1]=4 2053 B10R1.61 c1ccc(c(c1)C(=N)N)Cl AB05888 [0,2,0,0,0,0|1,0,1]=4 2054 B10R1.61 c1ccc(c(c1)C(=N)N)F AB18318 [0,2,0,0,0,0|1,0,1]=4 2055 B10R1.61 c1ccc(c(c1)C(=N)N)O AB55085 [0,2,0,0,0,0|0,0,1]=3 2056 B10R1.61 c1ccc(c(c1)C(=O)O)Br AB00223 [0,2,0,0,0,0|1,0,0]=3 2057 B10R1.61 c1ccc(c(c1)C(=S)N)Br AB21272 [0,2,0,0,0,0|1,0,1]=4 2058 B10R1.61 c1ccc(c(c1)C(=S)N)Cl AB01839 [0,2,0,0,0,0|1,0,1]=4 2059 B10R1.61 c1ccc(c(c1)C(=S)N)N AB07816 [0,2,0,0,0,0|1,0,1]=4 2060 B10R1.61 c1cncc(c1Br)C(=O)O AB18009 [0,2,0,0,0,0|2,0,0]=4 2061 B10R1.61 c1cncc(c1C(=O)N)O MB13532 [0,2,0,0,0,0|1,0,1]=4 2062 B10R1.61 c1cncc(c1C(=O)O)Br PB10062 [0,2,0,0,0,0|2,0,0]=4 2063 B10R1.61 c1cncc(c1C(=O)O)Cl AB13346 [0,2,0,0,0,0|2,0,0]=4 2064 B10R1.61 c1cncc(c1C(=O)O)I AB09565 [0,2,0,0,0,0|2,0,0]=4 2065 B10R1.61 c1cncc(c1C(=O)O)N PB17122 [0,2,0,0,0,0|2,0,0]=4 2066 B10R1.61 c1cncc(c1C(=O)O)O PB29057 [0,2,0,0,0,0|1,0,1]=4 2067 B10R1.61 c1cncc(c1Cl)C(=O)O AB03598 [0,2,0,0,0,0|2,0,0]=4 2068 B10R1.61 c1cncc(c1F)C(=O)O AB18036 [0,2,0,0,0,0|2,0,0]=4 2069 B10R1.61 c1cncc(c1I)C(=O)O AB15003 [0,2,0,0,0,0|2,0,0]=4 2070 B10R1.61 c1cncc(c1N)C(=O)O PB26016 [0,2,0,0,0,0|2,0,0]=4 2071 B10R1.61 c1cncc(c1O)C(=O)N MB06099 [0,2,0,0,0,0|1,0,1]=4 2072 B10R1.61 c1cncc(c1O)C(=O)O AB01802 [0,2,0,0,0,0|1,0,1]=4 2073 B10R1.61 c1cncc(c1O)[N+](=O)[O-] PB12105 [0,2,0,0,0,0|2,0,0]=4 2074 B10R1.118 Cc1c(cc(c(n1)N)Br)Br AB02781 [0,2,0,0,0,0|2,0,0]=4 2075 B10R1.118 Cc1c(nc(c(n1)O)C)O AB44017 [0,2,0,0,0,0|2,0,0]=4 2076 B10R1.118 Cc1cc(c(cc1Cl)Cl)N CB11300 [0,2,0,0,0,0|1,0,0]=3 2077 B10R1.118 Cc1cc(c(cc1N)Cl)Br CB11038 [0,2,0,0,0,0|1,0,0]=3 2078 B10R1.118 Cc1cc(c(nc1Br)Br)Br AB13867 [0,2,0,0,0,0|2,0,0]=4 2079 B10R1.118 Cc1cc(c(nc1C)N)N AB66679 [0,2,0,0,0,0|2,0,0]=4 2080 B10R1.118 c1c(c(cc(c1F)Cl)Cl)N AB16109 [0,2,0,0,0,0|2,0,0]=4 2081 B10R1.118 c1c(c(cc(c1I)Br)I)Br AB03145 [0,2,0,0,0,0|2,0,0]=4 2082 B10R1.176 CCc1ccc(c(c1)C)O MB23862 [0,2,0,0,0,0|0,0,0]=2 2083 B10R1.176 CCc1ccc(c(c1)Cl)O MB23911 [0,2,0,0,0,0|1,0,0]=3 2084 B10R1.176 CCc1ccc(c(c1)F)O MB23895 [0,2,0,0,0,0|1,0,0]=3 2085 B10R1.176 CCc1ccc(c(c1)I)O MB23898 [0,2,0,0,0,0|1,0,0]=3 2086 B10R1.176 CCc1ccc(c(c1)N)O MB00456 [0,2,0,0,0,0|1,0,0]=3 2087 B10R1.176 CCc1ccc(c(c1)O)Br MB09100 [0,2,0,0,0,0|1,0,0]=3 2088 B10R1.176 CCc1ccc(c(c1)O)Cl MB01396 [0,2,0,0,0,0|1,0,0]=3 2089 B10R1.176 CCc1ccc(c(c1)O)F MB23840 [0,2,0,0,0,0|1,0,0]=3 2090 B10R1.176 CCc1ccc(c(c1)O)I MB23844 [0,2,0,0,0,0|1,0,0]=3 2091 B10R1.176 CCc1ccc(c(c1)O)N MB03784 [0,2,0,0,0,0|1,0,0]=3 2092 B10R1.176 CNc1ccc(c(c1)Br)O MB30977 [0,2,0,0,0,0|1,0,0]=3 2093 B10R1.176 CNc1ccc(c(c1)Cl)O MB15061 [0,2,0,0,0,0|1,0,0]=3 2094 B10R1.176 CNc1ccc(c(c1)F)O MB33460 [0,2,0,0,0,0|1,0,0]=3 2095 B10R1.176 CNc1ccc(c(c1)I)O MB28237 [0,2,0,0,0,0|1,0,0]=3 2096 B10R1.176 CNc1ccc(c(c1)N)O MB27818 [0,2,0,0,0,0|1,0,0]=3 2097 B10R1.176 CNc1ccc(c(c1)O)Br MB32226 [0,2,0,0,0,0|1,0,0]=3 2098 B10R1.176 CNc1ccc(c(c1)O)Cl MB28131 [0,2,0,0,0,0|1,0,0]=3 2099 B10R1.176 CNc1ccc(c(c1)O)F MB37912 [0,2,0,0,0,0|1,0,0]=3 2100 B10R1.176 CNc1ccc(c(c1)O)I MB26459 [0,2,0,0,0,0|1,0,0]=3 2101 B10R1.176 CNc1ccc(c(c1)O)N MB25952 [0,2,0,0,0,0|1,0,0]=3 2102 B10R1.176 COc1cc(c(cn1)Cl)O AB69300 [0,2,0,0,0,0|2,0,0]=4 2103 B10R1.176 COc1cc(c(cn1)F)O AB69312 [0,2,0,0,0,0|2,0,0]=4 2104 B10R1.176 COc1cc(c(cn1)O)Cl AB70292 [0,2,0,0,0,0|2,0,0]=4 2105 B10R1.176 COc1cc(c(nc1)Cl)O AB71170 [0,2,0,0,0,0|2,0,0]=4 2106 B10R1.176 COc1cc(c(nc1)O)Cl AB71174 [0,2,0,0,0,0|2,0,0]=4 2107 B10R1.176 COc1ccc(c(c1)Br)I CB11658 [0,2,0,0,0,0|2,0,0]=4 2108 B10R1.176 COc1ccc(c(c1)Br)N AB49251 [0,2,0,0,0,0|2,0,0]=4 2109 B10R1.176 COc1ccc(c(c1)Br)O AB10935 [0,2,0,0,0,0|1,0,0]=3 2110 B10R1.176 COc1ccc(c(c1)F)N AB09440 [0,2,0,0,0,0|2,0,0]=4 2111 B10R1.176 COc1ccc(c(c1)I)N AB42374 [0,2,0,0,0,0|2,0,0]=4 2112 B10R1.176 COc1ccc(c(c1)I)O MB07821 [0,2,0,0,0,0|1,0,0]=3 2113 B10R1.176 COc1ccc(c(c1)N)I AB45640 [0,2,0,0,0,0|2,0,0]=4 2114 B10R1.176 COc1ccc(c(c1)N)N AB02069 [0,2,0,0,0,0|2,0,0]=4 2115 B10R1.176 COc1ccc(c(c1)N)O AB25358 [0,2,0,0,0,0|1,0,0]=3 2116 B10R1.176 COc1ccc(c(c1)O)Br MB02872 [0,2,0,0,0,0|1,0,0]=3 2117 B10R1.176 COc1ccc(c(c1)O)F MB25573 [0,2,0,0,0,0|1,0,0]=3 2118 B10R1.176 COc1ccc(c(c1)O)I MB12203 [0,2,0,0,0,0|1,0,0]=3 2119 B10R1.176 COc1ccc(c(n1)Cl)O AB69288 [0,2,0,0,0,0|2,0,0]=4 2120 B10R1.176 COc1ccc(c(n1)O)Cl AB75736 [0,2,0,0,0,0|2,0,0]=4 2121 B10R1.176 CSc1ccc(c(c1)Br)O MB09158 [0,2,0,0,0,0|1,0,0]=3 2122 B10R1.176 CSc1ccc(c(c1)Cl)O MB31036 [0,2,0,0,0,0|1,0,0]=3 2123 B10R1.176 CSc1ccc(c(c1)F)O MB25631 [0,2,0,0,0,0|1,0,0]=3 2124 B10R1.176 CSc1ccc(c(c1)I)O MB38361 [0,2,0,0,0,0|1,0,0]=3 2125 B10R1.176 CSc1ccc(c(c1)N)O MB34167 [0,2,0,0,0,0|1,0,0]=3 2126 B10R1.176 CSc1ccc(c(c1)O)Cl MB33637 [0,2,0,0,0,0|1,0,0]=3 2127 B10R1.176 CSc1ccc(c(c1)O)F MB25520 [0,2,0,0,0,0|1,0,0]=3 2128 B10R1.176 CSc1ccc(c(c1)O)I MB38424 [0,2,0,0,0,0|1,0,0]=3 2129 B10R1.176 Cc1c(cc(cn1)C=O)Cl AB74641 [0,2,0,0,0,0|2,0,0]=4 2130 B10R1.176 Cc1c(cc(cn1)C=O)F AB62781 [0,2,0,0,0,0|2,0,0]=4 2131 B10R1.176 Cc1c(cc(cn1)CCl)Cl AB74647 [0,2,0,0,0,0|2,0,0]=4 2132 B10R1.176 Cc1c(cc(cn1)CCl)F AB76305 [0,2,0,0,0,0|2,0,0]=4 2133 B10R1.176 Cc1c(cc(cn1)CN)Cl AB74649 [0,2,0,0,0,0|2,0,0]=4 2134 B10R1.176 Cc1c(cc(cn1)CN)F AB76308 [0,2,0,0,0,0|2,0,0]=4 2135 B10R1.176 Cc1c(cc(cn1)OC)N AB73554 [0,2,0,0,0,0|2,0,0]=4 2136 B10R1.176 Cc1c(ccc(n1)C#N)N AB43410 [0,2,0,0,0,0|2,0,0]=4 2137 B10R1.176 Cc1c(ccc(n1)C=O)Br MB09863 [0,2,0,0,0,0|2,0,0]=4 2138 B10R1.176 Cc1c(ccc(n1)C=O)Cl AB70731 [0,2,0,0,0,0|2,0,0]=4 2139 B10R1.176 Cc1c(ccc(n1)C=O)F AB44884 [0,2,0,0,0,0|2,0,0]=4 2140 B10R1.176 Cc1c(ccc(n1)CCl)Cl AB83321 [0,2,0,0,0,0|2,0,0]=4 2141 B10R1.176 Cc1c(ccc(n1)CCl)F AB83035 [0,2,0,0,0,0|2,0,0]=4 2142 B10R1.176 Cc1c(ccc(n1)CN)Cl AB75079 [0,2,0,0,0,0|2,0,0]=4 2143 B10R1.176 Cc1c(ccc(n1)CN)F AB75158 [0,2,0,0,0,0|2,0,0]=4 2144 B10R1.176 Cc1c(ccc(n1)OC)Br AB13393 [0,2,0,0,0,0|2,0,0]=4 2145 B10R1.176 Cc1cc(ccc1Br)C#N AB01529 [0,2,0,0,0,0|1,0,0]=3 2146 B10R1.176 Cc1cc(ccc1Br)C=O AB42951 [0,2,0,0,0,0|1,0,0]=3 2147 B10R1.176 Cc1cc(ccc1Br)CO AB50387 [0,2,0,0,0,0|1,0,0]=3 2148 B10R1.176 Cc1cc(ccc1Br)NN AB12016 [0,2,0,0,0,0|1,0,0]=3 2149 B10R1.176 Cc1cc(ccc1Cl)C=O AB11800 [0,2,0,0,0,0|1,0,0]=3 2150 B10R1.176 Cc1cc(ccc1Cl)NN AB13351 [0,2,0,0,0,0|1,0,0]=3 2151 B10R1.176 Cc1cc(ccc1O)C#N MB10144 [0,2,0,0,0,0|0,0,0]=2 2152 B10R1.176 Cc1cc(ccc1O)CN MB05062 [0,2,0,0,0,0|0,0,0]=2 2153 B10R1.176 Cc1cc(ccc1O)NC MB07546 [0,2,0,0,0,0|0,0,0]=2 2154 B10R1.176 Cc1cc(cnc1Br)C=O AB44906 [0,2,0,0,0,0|2,0,0]=4 2155 B10R1.176 Cc1cc(cnc1Br)OC AB74660 [0,2,0,0,0,0|2,0,0]=4 2156 B10R1.176 Cc1cc(cnc1C)C=O AB75407 [0,2,0,0,0,0|2,0,0]=4 2157 B10R1.176 Cc1cc(cnc1C)CCl AB75391 [0,2,0,0,0,0|2,0,0]=4 2158 B10R1.176 Cc1cc(cnc1C)CN AB70585 [0,2,0,0,0,0|2,0,0]=4 2159 B10R1.176 Cc1cc(cnc1C)OC AB85300 [0,2,0,0,0,0|2,0,0]=4 2160 B10R1.176 Cc1cc(cnc1Cl)C#N AB50049 [0,2,0,0,0,0|2,0,0]=4 2161 B10R1.176 Cc1cc(cnc1Cl)C=O AB64236 [0,2,0,0,0,0|2,0,0]=4 2162 B10R1.176 Cc1cc(cnc1Cl)CCl AB50053 [0,2,0,0,0,0|2,0,0]=4 2163 B10R1.176 Cc1cc(cnc1Cl)CN AB74569 [0,2,0,0,0,0|2,0,0]=4 2164 B10R1.176 Cc1cc(cnc1Cl)OC AB71233 [0,2,0,0,0,0|2,0,0]=4 2165 B10R1.176 Cc1cc(cnc1F)C=O AB25943 [0,2,0,0,0,0|2,0,0]=4 2166 B10R1.176 Cc1cc(cnc1F)CCl AB64242 [0,2,0,0,0,0|2,0,0]=4 2167 B10R1.176 Cc1cc(cnc1F)CN AB83087 [0,2,0,0,0,0|2,0,0]=4 2168 B10R1.176 Cc1cc(cnc1N)C#N AB25364 [0,2,0,0,0,0|2,0,0]=4 2169 B10R1.176 Cc1cc(cnc1N)OC AB73557 [0,2,0,0,0,0|2,0,0]=4 2170 B10R1.176 Cc1cc(ncc1Br)C#N AB41150 [0,2,0,0,0,0|2,0,0]=4 2171 B10R1.176 Cc1cc(ncc1Br)C=O AB41159 [0,2,0,0,0,0|2,0,0]=4 2172 B10R1.176 Cc1cc(ncc1Br)CN AB41153 [0,2,0,0,0,0|2,0,0]=4 2173 B10R1.176 Cc1cc(ncc1Br)NC AB41168 [0,2,0,0,0,0|2,0,0]=4 2174 B10R1.176 Cc1cc(ncc1Br)OC AB17469 [0,2,0,0,0,0|2,0,0]=4 2175 B10R1.176 Cc1cc(ncc1C)C=O AB74125 [0,2,0,0,0,0|2,0,0]=4 2176 B10R1.176 Cc1cc(ncc1C)CCl AB64952 [0,2,0,0,0,0|2,0,0]=4 2177 B10R1.176 Cc1cc(ncc1C)CN AB65468 [0,2,0,0,0,0|2,0,0]=4 2178 B10R1.176 Cc1cc(ncc1Cl)C#N AB41147 [0,2,0,0,0,0|2,0,0]=4 2179 B10R1.176 Cc1cc(ncc1Cl)C=O AB41161 [0,2,0,0,0,0|2,0,0]=4 2180 B10R1.176 Cc1cc(ncc1Cl)CCl AB75108 [0,2,0,0,0,0|2,0,0]=4 2181 B10R1.176 Cc1cc(ncc1Cl)CN AB41152 [0,2,0,0,0,0|2,0,0]=4 2182 B10R1.176 Cc1cc(ncc1Cl)NC AB41164 [0,2,0,0,0,0|2,0,0]=4 2183 B10R1.176 Cc1cc(ncc1F)C=O AB75169 [0,2,0,0,0,0|2,0,0]=4 2184 B10R1.176 Cc1cc(ncc1F)CCl AB84689 [0,2,0,0,0,0|2,0,0]=4 2185 B10R1.176 Cc1cc(ncc1F)CN AB74877 [0,2,0,0,0,0|2,0,0]=4 2186 B10R1.176 Cc1cc(ncc1N)OC AB44888 [0,2,0,0,0,0|2,0,0]=4 2187 B10R1.176 Cc1ccc(cc1Br)C#N AB29736 [0,2,0,0,0,0|1,0,0]=3 2188 B10R1.176 Cc1ccc(cc1O)C#N MB06106 [0,2,0,0,0,0|0,0,0]=2 2189 B10R1.176 Cc1ccc(cc1O)C=O MB01933 [0,2,0,0,0,0|0,0,0]=2 2190 B10R1.176 Cc1ccc(cc1O)NC MB25401 [0,2,0,0,0,0|0,0,0]=2 2191 B10R1.176 Cc1ccc(cc1O)OC MB11905 [0,2,0,0,0,0|0,0,0]=2 2192 B10R1.176 Cc1ccc(cc1O)SC MB25438 [0,2,0,0,0,0|0,0,0]=2 2193 B10R1.176 Cc1ccc(nc1C)C=O AB74104 [0,2,0,0,0,0|2,0,0]=4 2194 B10R1.176 Cc1ccc(nc1C)CCl AB64955 [0,2,0,0,0,0|2,0,0]=4 2195 B10R1.176 Cc1ccc(nc1C)CN AB65463 [0,2,0,0,0,0|2,0,0]=4 2196 B10R1.176 Cc1ccc(nc1Cl)C=O AB75097 [0,2,0,0,0,0|2,0,0]=4 2197 B10R1.176 Cc1ccc(nc1Cl)CCl AB75101 [0,2,0,0,0,0|2,0,0]=4 2198 B10R1.176 Cc1ccc(nc1Cl)CN AB75099 [0,2,0,0,0,0|2,0,0]=4 2199 B10R1.176 Cc1ccc(nc1F)C=O AB72847 [0,2,0,0,0,0|2,0,0]=4 2200 B10R1.176 Cc1ccc(nc1F)CCl AB72849 [0,2,0,0,0,0|2,0,0]=4 2201 B10R1.176 Cc1ccc(nc1F)CN AB72850 [0,2,0,0,0,0|2,0,0]=4 2202 B10R1.176 Cc1ccc(nc1N)OC AB73563 [0,2,0,0,0,0|2,0,0]=4 2203 B10R1.176 Cc1cnc(cc1Br)C=O AB70162 [0,2,0,0,0,0|2,0,0]=4 2204 B10R1.176 Cc1cnc(cc1Br)CCl AB70165 [0,2,0,0,0,0|2,0,0]=4 2205 B10R1.176 Cc1cnc(cc1Br)CN AB70168 [0,2,0,0,0,0|2,0,0]=4 2206 B10R1.176 Cc1cnc(cc1Cl)C=O AB67497 [0,2,0,0,0,0|2,0,0]=4 2207 B10R1.176 Cc1cnc(cc1Cl)CCl AB70036 [0,2,0,0,0,0|2,0,0]=4 2208 B10R1.176 Cc1cnc(cc1Cl)CN AB70034 [0,2,0,0,0,0|2,0,0]=4 2209 B10R1.176 Cc1cnc(cc1F)C=O AB82952 [0,2,0,0,0,0|2,0,0]=4 2210 B10R1.176 Cc1cnc(cc1F)CCl AB82954 [0,2,0,0,0,0|2,0,0]=4 2211 B10R1.176 Cc1cnc(cc1F)CN AB82957 [0,2,0,0,0,0|2,0,0]=4 2212 B10R1.176 Cc1cnc(cc1N)OC AB73589 [0,2,0,0,0,0|2,0,0]=4 2213 B10R1.176 Cn1cc(ccc1=O)CN PB15234 [0,2,0,0,0,0|1,0,1]=4 2214 B10R1.176 Cn1cc(ccc1=O)CO PB22835 [0,2,0,0,0,0|1,0,1]=4 2215 B10R1.176 Cn1ccc(cc1=O)C=O PB35148 [0,2,0,0,0,0|1,0,1]=4 2216 B10R1.176 Cn1ccc(cc1=O)CN PB15227 [0,2,0,0,0,0|1,0,1]=4 2217 B10R1.176 Cn1ccc(cc1=O)CO PB18199 [0,2,0,0,0,0|1,0,1]=4 2218 B10R1.176 c1c(cnc(c1Cl)O)C=O AB20957 [0,2,0,0,0,0|2,0,0]=4 2219 B10R1.176 c1c(cnc(c1Cl)O)CCl AB70975 [0,2,0,0,0,0|2,0,0]=4 2220 B10R1.176 c1c(cnc(c1Cl)O)CN AB84069 [0,2,0,0,0,0|2,0,0]=4 2221 B10R1.176 c1c(cnc(c1O)Cl)C=O AB62785 [0,2,0,0,0,0|2,0,0]=4 2222 B10R1.176 c1c(cnc(c1O)Cl)CCl AB84103 [0,2,0,0,0,0|2,0,0]=4 2223 B10R1.176 c1c(cnc(c1O)Cl)CN AB84104 [0,2,0,0,0,0|2,0,0]=4 2224 B10R1.176 c1c(ncc(c1Cl)O)C=O AB67780 [0,2,0,0,0,0|2,0,0]=4 2225 B10R1.176 c1c(ncc(c1Cl)O)CCl AB84011 [0,2,0,0,0,0|2,0,0]=4 2226 B10R1.176 c1c(ncc(c1Cl)O)CN AB84014 [0,2,0,0,0,0|2,0,0]=4 2227 B10R1.176 c1c(ncc(c1O)Cl)C=O AB75002 [0,2,0,0,0,0|2,0,0]=4 2228 B10R1.176 c1c(ncc(c1O)Cl)CCl AB84042 [0,2,0,0,0,0|2,0,0]=4 2229 B10R1.176 c1c(ncc(c1O)Cl)CN AB84044 [0,2,0,0,0,0|2,0,0]=4 2230 B10R1.176 c1cc(c(cc1C#N)F)N AB02282 [0,2,0,0,0,0|2,0,0]=4 2231 B10R1.176 c1cc(c(cc1C#N)I)N AB17464 [0,2,0,0,0,0|2,0,0]=4 2232 B10R1.176 c1cc(c(cc1C#N)I)O MB09222 [0,2,0,0,0,0|1,0,0]=3 2233 B10R1.176 c1cc(c(cc1C#N)O)Br MB25476 [0,2,0,0,0,0|1,0,0]=3 2234 B10R1.176 c1cc(c(cc1C#N)O)Cl MB25577 [0,2,0,0,0,0|1,0,0]=3 2235 B10R1.176 c1cc(c(cc1C#N)O)I MB12046 [0,2,0,0,0,0|1,0,0]=3 2236 B10R1.176 c1cc(c(cc1C#N)O)N MB03898 [0,2,0,0,0,0|1,0,0]=3 2237 B10R1.176 c1cc(c(cc1C=O)Cl)Br AB43050 [0,2,0,0,0,0|2,0,0]=4 2238 B10R1.176 c1cc(c(cc1C=O)I)F AB44172 [0,2,0,0,0,0|2,0,0]=4 2239 B10R1.176 c1cc(c(cc1C=O)I)O MB00259 [0,2,0,0,0,0|1,0,0]=3 2240 B10R1.176 c1cc(c(cc1C=O)N)O MB13575 [0,2,0,0,0,0|1,0,0]=3 2241 B10R1.176 c1cc(c(cc1C=O)O)Br MB09255 [0,2,0,0,0,0|1,0,0]=3 2242 B10R1.176 c1cc(c(cc1C=O)O)Cl MB25536 [0,2,0,0,0,0|1,0,0]=3 2243 B10R1.176 c1cc(c(cc1C=O)O)F MB09319 [0,2,0,0,0,0|1,0,0]=3 2244 B10R1.176 c1cc(c(cc1C=O)O)N MB34962 [0,2,0,0,0,0|1,0,0]=3 2245 B10R1.176 c1cc(c(cc1CBr)I)F AB44169 [0,2,0,0,0,0|2,0,0]=4 2246 B10R1.176 c1cc(c(cc1CN)Br)O MB02719 [0,2,0,0,0,0|1,0,0]=3 2247 B10R1.176 c1cc(c(cc1CN)Cl)O MB03734 [0,2,0,0,0,0|1,0,0]=3 2248 B10R1.176 c1cc(c(cc1CN)F)N AB50278 [0,2,0,0,0,0|2,0,0]=4 2249 B10R1.176 c1cc(c(cc1CN)F)O MB03723 [0,2,0,0,0,0|1,0,0]=3 2250 B10R1.176 c1cc(c(cc1CN)I)O MB27028 [0,2,0,0,0,0|1,0,0]=3 2251 B10R1.176 c1cc(c(cc1CN)N)O MB37291 [0,2,0,0,0,0|1,0,0]=3 2252 B10R1.176 c1cc(c(cc1CN)O)Br MB27292 [0,2,0,0,0,0|1,0,0]=3 2253 B10R1.176 c1cc(c(cc1CN)O)Cl MB25545 [0,2,0,0,0,0|1,0,0]=3 2254 B10R1.176 c1cc(c(cc1CN)O)F MB35973 [0,2,0,0,0,0|1,0,0]=3 2255 B10R1.176 c1cc(c(cc1CN)O)I MB25685 [0,2,0,0,0,0|1,0,0]=3 2256 B10R1.176 c1cc(c(cc1CN)O)N MB29053 [0,2,0,0,0,0|1,0,0]=3 2257 B10R1.176 c1cc(c(cc1CO)F)Br AB44195 [0,2,0,0,0,0|2,0,0]=4 2258 B10R1.176 c1cc(c(cc1NN)F)F AB13306 [0,2,0,0,0,0|2,0,0]=4 2259 B10R1.176 c1cc(c(nc1C=O)Cl)O AB74848 [0,2,0,0,0,0|2,0,0]=4 2260 B10R1.176 c1cc(c(nc1C=O)O)Cl AB70962 [0,2,0,0,0,0|2,0,0]=4 2261 B10R1.176 c1cc(c(nc1CCl)Cl)O AB76573 [0,2,0,0,0,0|2,0,0]=4 2262 B10R1.176 c1cc(c(nc1CCl)O)Cl AB71004 [0,2,0,0,0,0|2,0,0]=4 2263 B10R1.176 c1cc(c(nc1CN)Cl)O AB84096 [0,2,0,0,0,0|2,0,0]=4 2264 B10R1.176 c1cc(c(nc1CN)O)Cl AB84086 [0,2,0,0,0,0|2,0,0]=4 2265 B8R1.1 Cc1cc(oc1)CN PB24200 [0,0,1,1,0,0|1,0,1]=4 2266 B8R1.1 Cc1cc(on1)C=O CB11269 [0,0,1,1,0,0|2,0,0]=4 2267 B8R1.1 Cc1coc(n1)C=O PB28183 [0,0,1,1,0,0|2,0,0]=4 2268 B8R1.7 CC(=O)c1ncco1 AB42105 [0,0,1,1,0,0|2,0,0]=4 2269 B8R1.7 c1cc(oc1)C(=N)N AB07706 [0,0,1,1,0,0|2,0,0]=4 2270 B10R2.7 c1cc2c(cco2)nc1 PB26741 [0,1,0,1,0,0|1,0,1]=4 2271 B10R2.7 c1cc2c(nc1)CNC2 PB30869 [0,1,0,1,0,0|2,0,0]=4 2272 B10R2.7 c1cc2c(nc1)NCC2 PB34146 [0,1,0,1,0,0|2,0,0]=4 2273 B10R2.7 c1ccc2c(c1)CNC2 MB01342 [0,1,0,1,0,0|1,0,0]=3 2274 B10R2.7 c1ccc2c(c1)CNN2 AB31648 [0,1,0,1,0,0|1,0,0]=3 2275 B10R2.7 c1cncc2=CCN=c21 PB12213 [0,1,0,1,0,0|2,0,0]=4 2276 B10R2.7 c1cncc2=NCC=c21 PB21773 [0,1,0,1,0,0|2,0,0]=4 2277 B10R2.7 c1cncc2c1CNC2 AB30511 [0,1,0,1,0,0|2,0,0]=4 2278 B10R2.7 c1cncc2c1CNC2 PB24193 [0,1,0,1,0,0|2,0,0]=4 2279 B6R1.2 CC1=CN=CC1 PB12076 [1,0,0,0,1,0|1,0,1]=4 2280 B6R1.2 CC1=NC=CC1 AB12705 [1,0,0,0,1,0|1,0,1]=4 2281 B6R1.2 Cc1ccon1 AB01288 [1,0,0,0,1,0|2,0,0]=4 2282 B6R1.2 Cc1cocn1 AB63545 [1,0,0,0,1,0|2,0,0]=4 2283 B6R1.2 Cn1cccn1 PB33818 [1,0,0,0,1,0|2,0,0]=4 2284 B6R1.2 c1cc(oc1)Br AB04890 [1,0,0,0,1,0|2,0,0]=4 2285 B6R1.2 c1cc(sc1)N AB08372 [1,0,0,0,1,0|2,0,0]=4 2286 B6R1.2 c1ccn(c1)N PB33802 [1,0,0,0,1,0|2,0,0]=4 2287 B6R1.2 c1conc1O MB20248 [1,0,0,0,1,0|2,0,0]=4 2288 B6R1.2 c1csc(n1)O AB10887 [1,0,0,0,1,0|2,0,0]=4 2289 B6R1.2 c1cscc1N MB09694 [1,0,0,0,1,0|2,0,0]=4 2290 B6R1.2 c1cscc1N PB23357 [1,0,0,0,1,0|2,0,0]=4