0 B8R1.11 C1C=C(C(=N1)C=O)Br PB29916 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.11 C1C=C(C(=N1)C=O)Cl PB23804 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.11 CC1=C(N=CC1)C=O AB01496 [0,0,0,0,0,0|2,0,1]=3 3 B8R1.11 CC1=NN=CC1C=O PB32235 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.11 Cc1c(ccs1)C#N AB71665 [0,0,0,0,0,0|3,0,1]=4 5 B8R1.11 Cc1c(ccs1)C=O AB53893 [0,0,0,0,0,0|2,0,0]=2 6 B8R1.11 Cc1c(ccs1)CCl AB76281 [0,0,0,0,0,0|3,0,1]=4 7 B8R1.11 Cc1c(nco1)C=O AB62633 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.11 Cc1c(ncs1)C=O AB62627 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.11 Cc1c(scn1)C=O CB10986 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.11 Cn1c(ccn1)C#N PB25151 [0,0,0,0,0,0|2,0,1]=3 11 B8R1.11 Cn1c(ccn1)C=O PB21218 [0,0,0,0,0,0|1,0,0]=1 12 B8R1.11 Cn1c(ccn1)CN PB24806 [0,0,0,0,0,0|2,0,1]=3 13 B8R1.11 Cn1c(ccn1)CO PB14601 [0,0,0,0,0,0|1,0,2]=3 14 B8R1.11 Cn1c(cnn1)C=O AB57107 [0,0,0,0,0,0|2,0,0]=2 15 B8R1.11 Cn1c(cnn1)CCl AB69595 [0,0,0,0,0,0|3,0,1]=4 16 B8R1.11 Cn1c(cnn1)CN AB57111 [0,0,0,0,0,0|3,0,1]=4 17 B8R1.11 Cn1c(ncn1)CCl MB07932 [0,0,0,0,0,0|3,0,1]=4 18 B8R1.11 Cn1c(ncn1)CN AB25054 [0,0,0,0,0,0|3,0,1]=4 19 B8R1.11 Cn1c(ncn1)CO AB27921 [0,0,0,0,0,0|2,0,2]=4 20 B8R1.11 Cn1cccc1C#N AB12660 [0,0,0,0,0,0|1,0,1]=2 21 B8R1.11 Cn1ccnc1C#N PB34281 [0,0,0,0,0,0|2,0,1]=3 22 B8R1.11 Cn1ccnc1C=O PB12922 [0,0,0,0,0,0|1,0,0]=1 23 B8R1.11 Cn1ccnc1CN MB07317 [0,0,0,0,0,0|2,0,1]=3 24 B8R1.11 Cn1ccnc1CN PB30844 [0,0,0,0,0,0|2,0,1]=3 25 B8R1.11 Cn1cncc1C#N PB24888 [0,0,0,0,0,0|2,0,1]=3 26 B8R1.11 Cn1cncc1C=O PB21631 [0,0,0,0,0,0|1,0,0]=1 27 B8R1.11 Cn1cncc1CCl AB49658 [0,0,0,0,0,0|2,0,1]=3 28 B8R1.11 Cn1cncc1CN PB24886 [0,0,0,0,0,0|2,0,1]=3 29 B8R1.11 Cn1cncc1CO PB17276 [0,0,0,0,0,0|1,0,2]=3 30 B8R1.11 Cn1cnnc1C=O AB57353 [0,0,0,0,0,0|2,0,0]=2 31 B8R1.11 Cn1cnnc1CCl AB69765 [0,0,0,0,0,0|3,0,1]=4 32 B8R1.11 Cn1cnnc1CN AB53790 [0,0,0,0,0,0|3,0,1]=4 33 B8R1.11 Cn1cnnc1CO AB69764 [0,0,0,0,0,0|2,0,2]=4 34 B8R1.11 Cn1cnnc1SC AB20821 [0,0,0,0,0,0|4,0,0]=4 35 B8R1.11 c1c(c(cs1)Br)C=O AB08778 [0,0,0,0,0,0|3,0,0]=3 36 B8R1.11 c1cc(n(c1)N)C#N PB33171 [0,0,0,0,0,0|2,0,1]=3 37 B8R1.11 c1coc(c1Br)C=O AB31934 [0,0,0,0,0,0|3,0,0]=3 38 B8R1.11 c1csc(c1Br)C=O PB25976 [0,0,0,0,0,0|3,0,0]=3 39 B8R1.11 c1csc(c1Cl)C=O PB32269 [0,0,0,0,0,0|3,0,0]=3 40 B7R1.1 C1=NC=NC1C=O PB14141 [1,0,0,0,0,0|1,0,2]=4 41 B7R1.1 C1C=C(C=N1)C=O AB15013 [1,0,0,0,0,0|2,0,1]=4 42 B7R1.1 C1C=C(N=N1)C=O AB25611 [1,0,0,0,0,0|1,0,2]=4 43 B7R1.1 C1C=CCC1C=O AB76805 [1,0,0,0,0,0|1,0,2]=4 44 B7R1.1 C1C=CN=C1C=O AB00388 [1,0,0,0,0,0|0,0,2]=3 45 B7R1.1 c1[nH]c(nn1)C=O AB48516 [1,0,0,0,0,0|2,0,0]=3 46 B7R1.1 c1[nH]nc(n1)C=O AB63486 [1,0,0,0,0,0|2,0,1]=4 47 B7R1.1 c1c(con1)C=O AB11289 [1,0,0,0,0,0|3,0,0]=4 48 B7R1.1 c1c(csn1)C=O AB62620 [1,0,0,0,0,0|3,0,0]=4 49 B7R1.1 c1c(nco1)C=O PB23292 [1,0,0,0,0,0|1,0,1]=3 50 B7R1.1 c1c(ncs1)C=O AB06592 [1,0,0,0,0,0|1,0,1]=3 51 B7R1.1 c1c(ocn1)C=O AB11283 [1,0,0,0,0,0|2,0,0]=3 52 B7R1.1 c1c(scn1)C=O AB11293 [1,0,0,0,0,0|2,0,0]=3 53 B7R1.1 c1cc(oc1)C#N AB00309 [1,0,0,0,0,0|2,0,1]=4 54 B7R1.1 c1cc(oc1)CCl MB06568 [1,0,0,0,0,0|2,0,1]=4 55 B7R1.1 c1cc(sc1)CN PB17027 [1,0,0,0,0,0|2,0,1]=4 56 B7R1.1 c1cc(sc1)CO PB10001 [1,0,0,0,0,0|1,0,2]=4 57 B7R1.1 c1cn(nn1)C=O MB06576 [1,0,0,0,0,0|2,0,1]=4 58 B7R1.1 c1cnsc1C=O AB32448 [1,0,0,0,0,0|2,0,0]=3 59 B7R1.1 c1coc(n1)C=O AB14413 [1,0,0,0,0,0|1,0,1]=3 60 B7R1.1 c1conc1C=O PB26237 [1,0,0,0,0,0|1,0,1]=3 61 B7R1.1 c1csc(n1)C=O PB12109 [1,0,0,0,0,0|1,0,1]=3 62 B7R1.1 c1cscc1C=O PB14065 [1,0,0,0,0,0|2,0,0]=3 63 B7R1.4 Cc1c(cco1)N AB71442 [1,0,0,0,0,0|3,0,0]=4 64 B7R1.4 Cc1ccsc1Br PB25943 [1,0,0,0,0,0|3,0,0]=4 65 B7R1.4 Cc1nccn1N AB44383 [1,0,0,0,0,0|2,0,1]=4 66 B7R1.4 Cn1c(ccn1)N PB33809 [1,0,0,0,0,0|2,0,0]=3 67 B7R1.4 Cn1c(cnn1)Br AB69597 [1,0,0,0,0,0|3,0,0]=4 68 B7R1.4 Cn1c(cnn1)I AB69606 [1,0,0,0,0,0|3,0,0]=4 69 B7R1.4 Cn1ccnc1Br AB11315 [1,0,0,0,0,0|2,0,0]=3 70 B7R1.4 Cn1ccnc1Cl AB11324 [1,0,0,0,0,0|2,0,0]=3 71 B7R1.4 Cn1ccnc1I PB32223 [1,0,0,0,0,0|2,0,0]=3 72 B7R1.4 Cn1ccnc1N AB59774 [1,0,0,0,0,0|2,0,0]=3 73 B7R1.4 Cn1cncc1Br AB09509 [1,0,0,0,0,0|2,0,0]=3 74 B7R1.4 Cn1cncc1I PB12244 [1,0,0,0,0,0|2,0,0]=3 75 B7R1.4 Cn1cnnc1Br AB57304 [1,0,0,0,0,0|3,0,0]=4 76 B9R1.14 CCn1c(ccn1)C=O AB13772 [0,1,0,0,0,0|1,0,0]=2 77 B9R1.14 CCn1c(cnn1)C=O AB84659 [0,1,0,0,0,0|2,0,0]=3 78 B9R1.14 CCn1cncc1C=O AB30574 [0,1,0,0,0,0|1,0,0]=2 79 B9R1.22 Cc1c(cn(n1)C)C=O AB04183 [0,1,0,0,0,0|3,0,0]=4 80 B9R1.22 Cc1c(oc(n1)C)C=O AB27656 [0,1,0,0,0,0|3,0,0]=4 81 B9R1.22 Cc1c(oc(n1)Cl)C=O AB71590 [0,1,0,0,0,0|3,0,0]=4 82 B9R1.22 Cc1cc(n(n1)C)C=O AB12155 [0,1,0,0,0,0|1,0,0]=2 83 B9R1.22 Cc1cc(n(n1)C)CCl PB10408 [0,1,0,0,0,0|2,0,1]=4 84 B9R1.22 Cc1cc(n(n1)C)CN PB17288 [0,1,0,0,0,0|2,0,1]=4 85 B9R1.22 Cc1cc(n(n1)C)CO PB29211 [0,1,0,0,0,0|1,0,2]=4 86 B9R1.22 Cc1cc(sc1C=O)Br AB55882 [0,1,0,0,0,0|2,0,0]=3 87 B9R1.22 Cc1cn(c(n1)CO)C AB63450 [0,1,0,0,0,0|1,0,2]=4 88 B9R1.22 Cn1cc(cc1C#N)N AB65669 [0,1,0,0,0,0|1,0,1]=3 89 B9R1.22 c1c(cn(c1C#N)N)Br PB35912 [0,1,0,0,0,0|2,0,1]=4 90 B9R1.27 Cc1c(c(on1)C)C=O AB12163 [0,1,0,0,0,0|3,0,0]=4 91 B9R1.27 Cc1c(n(cn1)C)C=O AB62625 [0,1,0,0,0,0|1,0,0]=2 92 B9R1.27 Cc1cnn(c1C=O)C AB64141 [0,1,0,0,0,0|1,0,0]=2 93 B9R1.27 Cn1cnc(c1C=O)Br PB33964 [0,1,0,0,0,0|1,0,0]=2 94 B9R1.27 Cn1cnc(c1C=O)I PB21761 [0,1,0,0,0,0|1,0,0]=2 95 B9R1.33 CNCc1cccn1C AB22465 [0,1,0,0,0,0|1,0,1]=3 96 B9R1.33 CNCc1cncn1C AB42250 [0,1,0,0,0,0|2,0,1]=4 97 B9R1.33 Cc1c(scn1)CC=O AB24882 [0,1,0,0,0,0|3,0,0]=4 98 B9R1.33 Cn1ccnc1CCN AB26757 [0,1,0,0,0,0|2,0,1]=4 99 B9R1.33 Cn1ccnc1N=C=O AB74261 [0,1,0,0,0,0|1,0,1]=3 100 B9R1.41 B(c1cccn1C)(O)O AB17290 [0,1,0,0,0,0|1,0,1]=3 101 B9R1.41 B(c1ccnn1C)(O)O PB17790 [0,1,0,0,0,0|2,0,1]=4 102 B9R1.41 B(c1cncn1C)(O)O AB57795 [0,1,0,0,0,0|2,0,1]=4 103 B9R1.41 CC(=O)C1=NC=CC1N AB66021 [0,1,0,0,0,0|3,0,0]=4 104 B9R1.41 CC(=O)c1c(ccs1)Br AB07140 [0,1,0,0,0,0|3,0,0]=4 105 B9R1.41 CC(=O)c1c(ccs1)N AB02201 [0,1,0,0,0,0|3,0,0]=4 106 B9R1.41 CC(=O)c1ccsc1Cl AB72529 [0,1,0,0,0,0|3,0,0]=4 107 B9R1.41 CC(=O)c1ccsc1N AB71423 [0,1,0,0,0,0|3,0,0]=4 108 B9R1.41 CC(=O)c1nccn1C PB12530 [0,1,0,0,0,0|1,0,0]=2 109 B9R1.41 CC1=C(C=NC1)C(=O)C AB03448 [0,1,0,0,0,0|2,0,1]=4 110 B9R1.41 Cc1c(ccs1)C(=O)O AB10003 [0,1,0,0,0,0|2,0,0]=3 111 B9R1.41 Cc1c(ncs1)C(=O)O AB27941 [0,1,0,0,0,0|3,0,0]=4 112 B9R1.41 Cc1c(ocn1)C(=O)O MB01897 [0,1,0,0,0,0|3,0,0]=4 113 B9R1.41 Cc1c(scn1)C(=O)Cl CB11506 [0,1,0,0,0,0|3,0,0]=4 114 B9R1.41 Cc1ccoc1C(=O)O AB01137 [0,1,0,0,0,0|2,0,0]=3 115 B9R1.41 Cc1ccsc1C(=O)O AB00421 [0,1,0,0,0,0|2,0,0]=3 116 B9R1.41 Cn1c(ccn1)C(=O)O PB26026 [0,1,0,0,0,0|1,0,0]=2 117 B9R1.41 Cn1c(cnn1)C(=O)O AB57108 [0,1,0,0,0,0|2,0,0]=3 118 B9R1.41 Cn1cccc1C(=O)O CB10008 [0,1,0,0,0,0|0,0,0]=1 119 B9R1.41 Cn1ccnc1C(=N)N PB34492 [0,1,0,0,0,0|2,0,0]=3 120 B9R1.41 Cn1ccnc1C(=O)O PB21787 [0,1,0,0,0,0|1,0,0]=2 121 B9R1.41 Cn1ccnc1C(=S)N AB21755 [0,1,0,0,0,0|1,1,0]=3 122 B9R1.41 Cn1cncc1C(=O)O PB24704 [0,1,0,0,0,0|1,0,0]=2 123 B9R1.41 Cn1cnnc1C(=O)O AB57420 [0,1,0,0,0,0|2,0,0]=3 124 B9R1.41 c1c(c(cs1)Br)C(=O)O PB14213 [0,1,0,0,0,0|3,0,0]=4 125 B9R1.41 c1cc(n(c1)N)C(=O)N PB26616 [0,1,0,0,0,0|1,0,0]=2 126 B9R1.41 c1coc(c1Br)C(=O)O AB03324 [0,1,0,0,0,0|3,0,0]=4 127 B9R1.41 c1coc(c1I)C(=O)O AB85068 [0,1,0,0,0,0|3,0,0]=4 128 B9R1.41 c1csc(c1Br)C(=O)O PB25929 [0,1,0,0,0,0|3,0,0]=4 129 B9R1.41 c1csc(c1Cl)C(=O)O PB10064 [0,1,0,0,0,0|3,0,0]=4 130 B9R1.41 c1csc(c1N)C(=O)N AB02202 [0,1,0,0,0,0|3,0,0]=4 131 B9R1.41 c1csc(c1N)C(=O)O AB14784 [0,1,0,0,0,0|3,0,0]=4 132 B9R1.132 CC1=C(C(=NC1)C=O)C PB21628 [0,1,0,0,0,0|2,0,1]=4 133 B9R1.132 Cc1cnc(n1C)C=O AB62623 [0,1,0,0,0,0|1,0,0]=2 134 B9R1.132 Cc1cnc(n1C)CCl AB70176 [0,1,0,0,0,0|2,0,1]=4 135 B9R1.132 Cc1cnc(n1C)CN AB70180 [0,1,0,0,0,0|2,0,1]=4 136 B9R1.132 Cc1nnc(n1C)C=O AB45819 [0,1,0,0,0,0|2,0,0]=3 137 B9R1.132 Cn1c(cnc1Br)C=O AB56934 [0,1,0,0,0,0|1,0,0]=2 138 B9R1.132 Cn1c(cnc1Br)CN AB56941 [0,1,0,0,0,0|2,0,1]=4 139 B9R1.132 Cn1c(cnc1Br)CO AB39257 [0,1,0,0,0,0|1,0,2]=4 140 B9R1.132 Cn1c(cnc1Cl)C=O AB56928 [0,1,0,0,0,0|1,0,0]=2 141 B9R1.132 Cn1c(cnc1Cl)CN AB56939 [0,1,0,0,0,0|2,0,1]=4 142 B9R1.132 Cn1c(cnc1N)CO AB27795 [0,1,0,0,0,0|1,0,2]=4 143 B9R1.132 Cn1c(cnc1S)CO AB04871 [0,1,0,0,0,0|1,0,2]=4 144 B9R1.2 C=Cc1cccc(n1)Br AB74634 [0,0,0,0,0,1|3,0,0]=4 145 B9R1.2 Cc1cc(ccn1)C=O AB24827 [0,0,0,0,0,1|2,0,0]=3 146 B9R1.2 Cc1cc(cnc1)C=O PB18860 [0,0,0,0,0,1|2,0,0]=3 147 B9R1.2 Cc1cccc(n1)C#N AB04512 [0,0,0,0,0,1|2,0,1]=4 148 B9R1.2 Cc1cccc(n1)C=O AB00683 [0,0,0,0,0,1|1,0,0]=2 149 B9R1.2 Cc1cccc(n1)CCl AB49651 [0,0,0,0,0,1|2,0,1]=4 150 B9R1.2 Cc1cccc(n1)CN AB22796 [0,0,0,0,0,1|2,0,1]=4 151 B9R1.2 Cc1cccc(n1)NC AB60602 [0,0,0,0,0,1|3,0,0]=4 152 B9R1.2 Cc1ccnc(n1)C=O PB28177 [0,0,0,0,0,1|2,0,0]=3 153 B9R1.2 Cc1cncc(n1)C=O AB62637 [0,0,0,0,0,1|2,0,0]=3 154 B9R1.2 Cc1nccc(n1)C=O AB52721 [0,0,0,0,0,1|2,0,0]=3 155 B9R1.2 c1c(cncc1Br)C=O PB10234 [0,0,0,0,0,1|3,0,0]=4 156 B9R1.2 c1c(cncc1Cl)C=O PB29540 [0,0,0,0,0,1|3,0,0]=4 157 B9R1.2 c1c(cncc1F)C=O PB12469 [0,0,0,0,0,1|3,0,0]=4 158 B9R1.2 c1c(cncc1I)C=O AB45533 [0,0,0,0,0,1|3,0,0]=4 159 B9R1.2 c1c(cncc1N)C=O AB67741 [0,0,0,0,0,1|3,0,0]=4 160 B9R1.2 c1c(cncc1O)C=O AB67779 [0,0,0,0,0,1|3,0,0]=4 161 B9R1.2 c1c(nc(cn1)Cl)C=O PB16295 [0,0,0,0,0,1|3,0,0]=4 162 B9R1.2 c1cc(nc(c1)Br)C=O PB27582 [0,0,0,0,0,1|2,0,0]=3 163 B9R1.2 c1cc(nc(c1)Cl)C=O AB52723 [0,0,0,0,0,1|2,0,0]=3 164 B9R1.2 c1cc(nc(c1)F)C=O AB13533 [0,0,0,0,0,1|2,0,0]=3 165 B9R1.2 c1cnc(cc1Br)C=O PB10584 [0,0,0,0,0,1|3,0,0]=4 166 B9R1.2 c1cnc(cc1C=O)Br AB17326 [0,0,0,0,0,1|3,0,0]=4 167 B9R1.2 c1cnc(cc1C=O)Cl PB21899 [0,0,0,0,0,1|3,0,0]=4 168 B9R1.2 c1cnc(cc1C=O)F AB24818 [0,0,0,0,0,1|3,0,0]=4 169 B9R1.2 c1cnc(cc1Cl)C=O PB32513 [0,0,0,0,0,1|3,0,0]=4 170 B9R1.2 c1cnc(cc1F)C=O AB68024 [0,0,0,0,0,1|3,0,0]=4 171 B9R1.2 c1cnc(cc1N)C=O AB68102 [0,0,0,0,0,1|3,0,0]=4 172 B9R1.2 c1cnc(cc1O)C=O AB68125 [0,0,0,0,0,1|3,0,0]=4 173 B9R1.2 c1cnc(nc1C=O)Cl PB16282 [0,0,0,0,0,1|3,0,0]=4 174 B9R1.2 c1cnc(nc1Cl)C=O AB52774 [0,0,0,0,0,1|3,0,0]=4 175 B9R1.15 Cc1c(cccn1)C#C AB66573 [0,0,0,0,0,1|2,0,1]=4 176 B9R1.15 Cc1c(cccn1)C#N PB23449 [0,0,0,0,0,1|2,0,1]=4 177 B9R1.15 Cc1c(cccn1)C=O PB27878 [0,0,0,0,0,1|1,0,0]=2 178 B9R1.15 Cc1c(cccn1)CBr PB19196 [0,0,0,0,0,1|2,0,1]=4 179 B9R1.15 Cc1c(cccn1)CCl AB51469 [0,0,0,0,0,1|2,0,1]=4 180 B9R1.15 Cc1c(cccn1)CCl PB28159 [0,0,0,0,0,1|2,0,1]=4 181 B9R1.15 Cc1c(cccn1)CN AB14093 [0,0,0,0,0,1|2,0,1]=4 182 B9R1.15 Cc1c(cccn1)CO AB01512 [0,0,0,0,0,1|1,0,2]=4 183 B9R1.15 Cc1c(cccn1)OC AB03569 [0,0,0,0,0,1|3,0,0]=4 184 B9R1.15 Cc1c(nccn1)C=O PB13166 [0,0,0,0,0,1|2,0,0]=3 185 B9R1.15 Cc1cccnc1C=O PB14292 [0,0,0,0,0,1|1,0,0]=2 186 B9R1.15 Cc1cccnc1CCl PB32645 [0,0,0,0,0,1|2,0,1]=4 187 B9R1.15 Cc1cccnc1CN AB20671 [0,0,0,0,0,1|2,0,1]=4 188 B9R1.15 Cc1cccnc1CO AB12590 [0,0,0,0,0,1|1,0,2]=4 189 B9R1.15 Cc1cccnc1OC AB31414 [0,0,0,0,0,1|3,0,0]=4 190 B9R1.15 Cc1ccncc1C#C AB66569 [0,0,0,0,0,1|2,0,1]=4 191 B9R1.15 Cc1ccncc1C#N PB24636 [0,0,0,0,0,1|2,0,1]=4 192 B9R1.15 Cc1ccncc1C=O PB23498 [0,0,0,0,0,1|1,0,0]=2 193 B9R1.15 Cc1ccncc1CCl PB22427 [0,0,0,0,0,1|2,0,1]=4 194 B9R1.15 Cc1ccncc1CN PB14440 [0,0,0,0,0,1|2,0,1]=4 195 B9R1.15 Cc1ccncc1CO PB21746 [0,0,0,0,0,1|1,0,2]=4 196 B9R1.15 Cc1cnccc1C#C AB66570 [0,0,0,0,0,1|2,0,1]=4 197 B9R1.15 Cc1cnccc1C#N PB23623 [0,0,0,0,0,1|2,0,1]=4 198 B9R1.15 Cc1cnccc1C=O AB11481 [0,0,0,0,0,1|1,0,0]=2 199 B9R1.15 Cc1cnccc1CCl PB24122 [0,0,0,0,0,1|2,0,1]=4 200 B9R1.15 Cc1cnccc1CN AB17090 [0,0,0,0,0,1|2,0,1]=4 201 B9R1.15 Cc1cnccc1CO PB32359 [0,0,0,0,0,1|1,0,2]=4 202 B9R1.15 c1c(c(ncn1)Cl)C=O AB65173 [0,0,0,0,0,1|3,0,0]=4 203 B9R1.15 c1c(c(ncn1)N)C=O AB55705 [0,0,0,0,0,1|3,0,0]=4 204 B9R1.15 c1cc(c(nc1)Br)C=O AB20862 [0,0,0,0,0,1|2,0,0]=3 205 B9R1.15 c1cc(c(nc1)C=O)Br AB42598 [0,0,0,0,0,1|2,0,0]=3 206 B9R1.15 c1cc(c(nc1)C=O)F PB22063 [0,0,0,0,0,1|2,0,0]=3 207 B9R1.15 c1cc(c(nc1)C=O)N AB42378 [0,0,0,0,0,1|2,0,0]=3 208 B9R1.15 c1cc(c(nc1)C=O)O PB12355 [0,0,0,0,0,1|2,0,0]=3 209 B9R1.15 c1cc(c(nc1)Cl)C=O PB27532 [0,0,0,0,0,1|2,0,0]=3 210 B9R1.15 c1cc(c(nc1)F)C=O AB13640 [0,0,0,0,0,1|2,0,0]=3 211 B9R1.15 c1cc(c(nc1)N)C=O AB09963 [0,0,0,0,0,1|2,0,0]=3 212 B9R1.15 c1cc(c(nc1)O)C=O AB55041 [0,0,0,0,0,1|2,0,0]=3 213 B9R1.15 c1ccc(c(c1)C=O)I PB15618 [0,0,0,0,0,1|2,0,0]=3 214 B9R1.15 c1cnc(c(n1)C=O)Cl AB32644 [0,0,0,0,0,1|3,0,0]=4 215 B9R1.15 c1cnc(c(n1)C=O)N PB10822 [0,0,0,0,0,1|3,0,0]=4 216 B9R1.15 c1cncc(c1Br)C=O AB25683 [0,0,0,0,0,1|2,0,0]=3 217 B9R1.15 c1cncc(c1Br)C=O AB53933 [0,0,0,0,0,1|2,0,0]=3 218 B9R1.15 c1cncc(c1C=O)Br PB17335 [0,0,0,0,0,1|2,0,0]=3 219 B9R1.15 c1cncc(c1C=O)Cl AB23043 [0,0,0,0,0,1|2,0,0]=3 220 B9R1.15 c1cncc(c1C=O)F PB32422 [0,0,0,0,0,1|2,0,0]=3 221 B9R1.15 c1cncc(c1C=O)N PB20170 [0,0,0,0,0,1|2,0,0]=3 222 B9R1.15 c1cncc(c1C=O)O AB08714 [0,0,0,0,0,1|2,0,0]=3 223 B9R1.15 c1cncc(c1Cl)C=O AB17590 [0,0,0,0,0,1|2,0,0]=3 224 B9R1.15 c1cncc(c1F)C=O AB32109 [0,0,0,0,0,1|2,0,0]=3 225 B9R1.15 c1cncc(c1N)C=O AB12471 [0,0,0,0,0,1|2,0,0]=3 226 B9R1.15 c1cncc(c1N)C=O PB27639 [0,0,0,0,0,1|2,0,0]=3 227 B9R1.15 c1cncc(c1O)C=O AB59870 [0,0,0,0,0,1|2,0,0]=3 228 B6R0.1 COC(=O)\C=C\N AB31601 [1,0,1,0,0,0|2,0,0]=4 229 B6R1.2 C1=NC(=O)N=C1 AB01798 [2,0,0,0,0,0|1,0,1]=4 230 B6R1.2 Cn1cccn1 PB33818 [2,0,0,0,0,0|1,0,0]=3 231 B6R1.2 Cn1ccnn1 AB51214 [2,0,0,0,0,0|2,0,0]=4 232 B6R1.2 Cn1cnnc1 AB06345 [2,0,0,0,0,0|2,0,0]=4 233 B6R1.2 c1cc(oc1)Br AB04890 [2,0,0,0,0,0|2,0,0]=4 234 B6R1.2 c1cc(sc1)N AB08372 [2,0,0,0,0,0|2,0,0]=4 235 B6R1.2 c1ccn(c1)N PB33802 [2,0,0,0,0,0|1,0,0]=3 236 B6R1.2 c1cn(cn1)N AB53511 [2,0,0,0,0,0|2,0,0]=4 237 B8R1.1 C1=C(N=CC1Cl)C=O PB27576 [1,1,0,0,0,0|0,0,2]=4 238 B8R1.1 CC1=CN=C(C1)C=O AB43814 [1,1,0,0,0,0|0,0,2]=4 239 B8R1.1 CC1=NC(=CC1)C=O AB43978 [1,1,0,0,0,0|0,0,2]=4 240 B8R1.1 Cc1[nH]c(cn1)C=O AB05024 [1,1,0,0,0,0|1,0,0]=3 241 B8R1.1 Cc1[nH]c(nn1)C=O AB57354 [1,1,0,0,0,0|2,0,0]=4 242 B8R1.1 Cc1cc(on1)C=O CB11269 [1,1,0,0,0,0|2,0,0]=4 243 B8R1.1 Cc1ccc(s1)C=O AB00417 [1,1,0,0,0,0|1,0,0]=3 244 B8R1.1 Cc1cnc(s1)C=O AB43202 [1,1,0,0,0,0|1,0,1]=4 245 B8R1.1 Cc1coc(n1)C=O PB28183 [1,1,0,0,0,0|1,0,1]=4 246 B8R1.1 Cc1csc(n1)C=O PB14084 [1,1,0,0,0,0|1,0,1]=4 247 B8R1.1 Cc1nc(co1)C=O AB13940 [1,1,0,0,0,0|1,0,1]=4 248 B8R1.1 Cc1nc(cs1)C=O AB25415 [1,1,0,0,0,0|1,0,1]=4 249 B8R1.1 Cc1ncc(o1)C=O AB27658 [1,1,0,0,0,0|2,0,0]=4 250 B8R1.1 Cc1ncc(s1)C=O CB11336 [1,1,0,0,0,0|2,0,0]=4 251 B8R1.1 Cn1cc(nc1)C=O PB24797 [1,1,0,0,0,0|1,0,1]=4 252 B8R1.1 Cn1ccc(n1)C=O AB14508 [1,1,0,0,0,0|1,0,1]=4 253 B8R1.1 c1c(csc1Br)C=O PB31345 [1,1,0,0,0,0|2,0,0]=4 254 B8R1.1 c1c(csc1C=O)Br PB24526 [1,1,0,0,0,0|1,0,0]=3 255 B8R1.1 c1c(csc1C=O)Cl PB20572 [1,1,0,0,0,0|1,0,0]=3 256 B8R1.1 c1c(csc1Cl)C=O PB18241 [1,1,0,0,0,0|2,0,0]=4 257 B8R1.1 c1c(nc(o1)Cl)C=O AB68328 [1,1,0,0,0,0|1,0,1]=4 258 B8R1.1 c1c(onc1Br)C=O AB52798 [1,1,0,0,0,0|2,0,0]=4 259 B8R1.1 c1c(sc(n1)Br)C=O AB16053 [1,1,0,0,0,0|2,0,0]=4 260 B8R1.1 c1c(sc(n1)C=O)Br PB22294 [1,1,0,0,0,0|1,0,1]=4 261 B8R1.1 c1c(sc(n1)C=O)Cl PB22169 [1,1,0,0,0,0|1,0,1]=4 262 B8R1.1 c1c(sc(n1)Cl)C=O PB14244 [1,1,0,0,0,0|2,0,0]=4 263 B8R1.1 c1c(sc(n1)N)C=O AB11362 [1,1,0,0,0,0|2,0,0]=4 264 B8R1.1 c1cc(sc1C=O)Br PB32069 [1,1,0,0,0,0|1,0,0]=3 265 B8R1.1 c1cc(sc1C=O)Cl PB17085 [1,1,0,0,0,0|1,0,0]=3 266 B8R1.7 CC(=O)C1=CN=CC1 AB02749 [1,1,0,0,0,0|2,0,0]=4 267 B8R1.7 CC(=O)c1ccsc1 PB17033 [1,1,0,0,0,0|2,0,0]=4 268 B8R1.7 CC(=O)c1cocn1 AB73503 [1,1,0,0,0,0|1,0,1]=4 269 B8R1.7 CC(=O)c1ncco1 AB42105 [1,1,0,0,0,0|1,0,1]=4 270 B8R1.7 c1[nH]c(nn1)C(=O)O AB04453 [1,1,0,0,0,0|2,0,0]=4 271 B8R1.7 c1c(nco1)C(=O)O PB14470 [1,1,0,0,0,0|1,0,1]=4 272 B8R1.7 c1c(nco1)C(=O)[O-] AB28203 [1,1,0,0,0,0|1,0,1]=4 273 B8R1.7 c1c(ncs1)C(=O)N AB06564 [1,1,0,0,0,0|1,0,1]=4 274 B8R1.7 c1c(ncs1)C(=O)O AB06561 [1,1,0,0,0,0|1,0,1]=4 275 B8R1.7 c1c(ocn1)C(=O)N AB19298 [1,1,0,0,0,0|2,0,0]=4 276 B8R1.7 c1c(ocn1)C(=O)O AB19293 [1,1,0,0,0,0|2,0,0]=4 277 B8R1.7 c1c(scn1)C(=O)O AB15430 [1,1,0,0,0,0|2,0,0]=4 278 B8R1.7 c1cc(oc1)C(=N)N AB07706 [1,1,0,0,0,0|2,0,0]=4 279 B8R1.7 c1cnsc1C(=O)O AB32452 [1,1,0,0,0,0|2,0,0]=4 280 B8R1.7 c1coc(n1)C(=O)N AB19289 [1,1,0,0,0,0|1,0,1]=4 281 B8R1.7 c1coc(n1)C(=O)O AB19305 [1,1,0,0,0,0|1,0,1]=4 282 B8R1.7 c1cocc1C(=O)O PB30525 [1,1,0,0,0,0|2,0,0]=4 283 B8R1.7 c1conc1C(=O)O PB26232 [1,1,0,0,0,0|1,0,1]=4 284 B8R1.7 c1csc(n1)C(=O)O AB10888 [1,1,0,0,0,0|1,0,1]=4 285 B8R1.7 c1cscc1C(=O)O PB18386 [1,1,0,0,0,0|2,0,0]=4 286 B8R1.7 c1csnc1C(=O)O PB34433 [1,1,0,0,0,0|1,0,1]=4 287 B8R1.8 c1cc(oc1)N=C=O AB53758 [1,1,0,0,0,0|1,0,1]=4 288 B8R1.8 c1coc(n1)CC=O AB57661 [1,1,0,0,0,0|1,0,1]=4 289 B8R1.8 c1csc(n1)CC=O AB57662 [1,1,0,0,0,0|1,0,1]=4 290 B8R1.18 Cc1cc(n(n1)C)Br PB11837 [1,1,0,0,0,0|2,0,0]=4 291 B8R1.18 Cc1cc(n(n1)C)N AB02131 [1,1,0,0,0,0|2,0,0]=4 292 B8R1.18 Cc1cn(c(n1)Br)C AB26588 [1,1,0,0,0,0|2,0,0]=4 293 B8R1.18 Cc1nc(cn1C)Br AB26584 [1,1,0,0,0,0|1,0,1]=4 294 B8R1.18 Cn1c(cc(n1)Cl)N PB30426 [1,1,0,0,0,0|2,0,0]=4 295 B8R1.18 Cn1cc(nc1Br)Br AB26596 [1,1,0,0,0,0|2,0,0]=4 296 B8R1.50 CN1C(=O)CNC1=O AB65979 [1,1,0,0,0,0|1,0,1]=4 297 B8R1.50 CN1C(=O)N=NC1=O MB00223 [1,1,0,0,0,0|2,0,0]=4 298 B8R1.50 Cc1c(cnn1C)Br AB51571 [1,1,0,0,0,0|1,0,1]=4 299 B8R1.50 Cc1cnc(n1C)Br AB26586 [1,1,0,0,0,0|1,0,1]=4 300 B8R1.50 Cc1cnn(c1Br)C AB84867 [1,1,0,0,0,0|2,0,0]=4 301 B8R1.50 Cc1ncc(n1C)Br AB26592 [1,1,0,0,0,0|1,0,1]=4 302 B8R1.50 Cn1c(cnc1Br)Br AB09505 [1,1,0,0,0,0|2,0,0]=4 303 B8R1.50 Cn1c(cnc1I)I PB10221 [1,1,0,0,0,0|2,0,0]=4 304 B8R1.50 Cn1cnc(c1Br)Br AB07724 [1,1,0,0,0,0|2,0,0]=4 305 B8R1.50 Cn1cnc(c1I)I AB12801 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.2 Cc1c(c(ccn1)C=O)Cl AB71247 [0,1,0,0,0,1|2,0,0]=4 307 B10R1.2 Cc1c(c(ccn1)C=O)N AB70908 [0,1,0,0,0,1|2,0,0]=4 308 B10R1.2 Cc1c(c(ccn1)C=O)O AB24800 [0,1,0,0,0,1|2,0,0]=4 309 B10R1.2 Cc1c(cccc1O)C=O MB08410 [0,1,0,0,0,1|2,0,0]=4 310 B10R1.2 Cc1c(nccc1C=O)C AB62887 [0,1,0,0,0,1|2,0,0]=4 311 B10R1.2 Cc1ccnc(c1C)C=O AB66597 [0,1,0,0,0,1|2,0,0]=4 312 B10R1.2 Cc1ccnc(c1Cl)C=O AB44896 [0,1,0,0,0,1|2,0,0]=4 313 B10R1.2 Cc1ccnc(c1N)C=O AB83759 [0,1,0,0,0,1|2,0,0]=4 314 B10R1.2 Cc1ccnc(c1O)C=O AB75246 [0,1,0,0,0,1|2,0,0]=4 315 B10R1.2 Cc1cncc(c1C)C=O AB76785 [0,1,0,0,0,1|2,0,0]=4 316 B10R1.2 Cc1cncc(c1Cl)C=O AB67499 [0,1,0,0,0,1|2,0,0]=4 317 B10R1.2 Cc1cncc(c1F)C=O AB75176 [0,1,0,0,0,1|2,0,0]=4 318 B10R1.2 Cc1cncc(c1N)C=O AB83665 [0,1,0,0,0,1|2,0,0]=4 319 B10R1.2 Cc1cncc(c1O)C=O AB75247 [0,1,0,0,0,1|2,0,0]=4 320 B10R1.2 Cn1cccc(c1=O)CN PB24240 [0,1,0,0,0,1|1,0,1]=4 321 B10R1.2 Cn1cccc(c1=O)CO PB13713 [0,1,0,0,0,1|0,0,2]=4 322 B10R1.2 c1cc(c(c(c1)Br)O)C=O AB01203 [0,1,0,0,0,1|2,0,0]=4 323 B10R1.2 c1cc(c(c(c1)Cl)Br)C=O MB08895 [0,1,0,0,0,1|2,0,0]=4 324 B10R1.2 c1cc(c(c(c1)Cl)F)C=O AB09379 [0,1,0,0,0,1|2,0,0]=4 325 B10R1.2 c1cc(c(c(c1)Cl)O)C=O AB21383 [0,1,0,0,0,1|2,0,0]=4 326 B10R1.2 c1cc(c(c(c1)F)O)C=O AB00313 [0,1,0,0,0,1|2,0,0]=4 327 B10R1.2 c1cc(c(c(c1)I)O)C=O MB12368 [0,1,0,0,0,1|2,0,0]=4 328 B10R1.2 c1cc(c(c(c1)O)Br)C=O AB03304 [0,1,0,0,0,1|2,0,0]=4 329 B10R1.2 c1cc(c(c(c1)O)F)C=O AB63446 [0,1,0,0,0,1|2,0,0]=4 330 B10R1.2 c1cc(c(c(c1)O)I)C=O MB07518 [0,1,0,0,0,1|2,0,0]=4 331 B10R1.2 c1cc(c(c(c1)O)N)C=O MB38000 [0,1,0,0,0,1|2,0,0]=4 332 B10R1.8 Cc1cc(cc(c1)Br)C=O AB53369 [0,1,0,0,0,1|1,0,0]=3 333 B10R1.8 Cc1cc(cc(c1)C=O)C AB03134 [0,1,0,0,0,1|1,0,0]=3 334 B10R1.8 Cc1cc(cc(c1)Cl)C=O AB64288 [0,1,0,0,0,1|1,0,0]=3 335 B10R1.8 Cc1cc(cc(c1)F)C=O AB13319 [0,1,0,0,0,1|1,0,0]=3 336 B10R1.8 Cc1cc(cc(c1)I)C=O AB75646 [0,1,0,0,0,1|1,0,0]=3 337 B10R1.8 Cc1cc(cc(c1)O)C=O AB71633 [0,1,0,0,0,1|1,0,0]=3 338 B10R1.8 Cc1cc(cc(n1)Br)C=O AB66852 [0,1,0,0,0,1|2,0,0]=4 339 B10R1.8 Cc1cc(cc(n1)C)C=O AB24839 [0,1,0,0,0,1|2,0,0]=4 340 B10R1.8 Cc1cc(cc(n1)C=O)Br AB40795 [0,1,0,0,0,1|1,0,0]=3 341 B10R1.8 Cc1cc(cc(n1)C=O)Cl AB40806 [0,1,0,0,0,1|1,0,0]=3 342 B10R1.8 Cc1cc(cc(n1)C=O)F AB75160 [0,1,0,0,0,1|1,0,0]=3 343 B10R1.8 Cc1cc(cc(n1)C=O)I AB79033 [0,1,0,0,0,1|1,0,0]=3 344 B10R1.8 Cc1cc(cc(n1)C=O)O AB78936 [0,1,0,0,0,1|1,0,0]=3 345 B10R1.8 Cc1cc(cc(n1)Cl)C=O AB24805 [0,1,0,0,0,1|2,0,0]=4 346 B10R1.8 Cc1cc(cc(n1)F)C=O AB70701 [0,1,0,0,0,1|2,0,0]=4 347 B10R1.8 Cc1cc(cc(n1)I)C=O AB79154 [0,1,0,0,0,1|2,0,0]=4 348 B10R1.8 Cc1cc(cc(n1)O)C=O AB71363 [0,1,0,0,0,1|2,0,0]=4 349 B10R1.8 Cc1cc(nc(c1)Br)C=O AB67811 [0,1,0,0,0,1|2,0,0]=4 350 B10R1.8 Cc1cc(nc(c1)C=O)C AB04218 [0,1,0,0,0,1|1,0,0]=3 351 B10R1.8 Cc1cc(nc(c1)Cl)C=O AB67809 [0,1,0,0,0,1|2,0,0]=4 352 B10R1.8 Cc1cc(nc(c1)F)C=O AB75168 [0,1,0,0,0,1|2,0,0]=4 353 B10R1.8 Cc1cc(nc(c1)I)C=O AB78891 [0,1,0,0,0,1|2,0,0]=4 354 B10R1.8 Cc1cc(nc(c1)O)C=O AB79065 [0,1,0,0,0,1|2,0,0]=4 355 B10R1.8 Cc1cc(nc(n1)C)C=O AB58698 [0,1,0,0,0,1|2,0,0]=4 356 B10R1.8 Cc1nc(cc(n1)Cl)C=O AB58880 [0,1,0,0,0,1|2,0,0]=4 357 B10R1.8 Cc1nc(cc(n1)O)C=O AB58876 [0,1,0,0,0,1|2,0,0]=4 358 B10R1.8 c1c(cc(cc1Br)Br)C=O AB04160 [0,1,0,0,0,1|2,0,0]=4 359 B10R1.8 c1c(cc(cc1Br)I)C=O AB42478 [0,1,0,0,0,1|2,0,0]=4 360 B10R1.8 c1c(cc(cc1Cl)Br)C=O AB29574 [0,1,0,0,0,1|2,0,0]=4 361 B10R1.8 c1c(cc(cc1Cl)Cl)C=O AB00316 [0,1,0,0,0,1|2,0,0]=4 362 B10R1.8 c1c(cc(cc1Cl)I)C=O AB65246 [0,1,0,0,0,1|2,0,0]=4 363 B10R1.8 c1c(cc(cc1F)Br)C=O AB20677 [0,1,0,0,0,1|2,0,0]=4 364 B10R1.8 c1c(cc(cc1F)Cl)C=O AB11796 [0,1,0,0,0,1|2,0,0]=4 365 B10R1.8 c1c(cc(cc1F)F)C=O AB01034 [0,1,0,0,0,1|2,0,0]=4 366 B10R1.8 c1c(cc(cc1F)I)C=O AB42482 [0,1,0,0,0,1|2,0,0]=4 367 B10R1.8 c1c(cc(cc1I)I)C=O AB42481 [0,1,0,0,0,1|2,0,0]=4 368 B10R1.8 c1c(cc(cc1N)O)C=O MB35596 [0,1,0,0,0,1|2,0,0]=4 369 B10R1.8 c1c(cc(cc1O)Br)C=O AB29745 [0,1,0,0,0,1|2,0,0]=4 370 B10R1.8 c1c(cc(cc1O)Cl)C=O AB43616 [0,1,0,0,0,1|2,0,0]=4 371 B10R1.8 c1c(cc(cc1O)F)C=O AB66765 [0,1,0,0,0,1|2,0,0]=4 372 B10R1.8 c1c(cc(cc1O)I)C=O AB71641 [0,1,0,0,0,1|2,0,0]=4 373 B10R1.8 c1c(cc(cc1O)O)C=O AB01206 [0,1,0,0,0,1|2,0,0]=4 374 B10R1.8 c1c(cc(nc1C=O)Br)Br AB68241 [0,1,0,0,0,1|2,0,0]=4 375 B10R1.8 c1c(cc(nc1C=O)Br)Cl AB67258 [0,1,0,0,0,1|2,0,0]=4 376 B10R1.8 c1c(cc(nc1C=O)Br)F AB68031 [0,1,0,0,0,1|2,0,0]=4 377 B10R1.8 c1c(cc(nc1C=O)Br)I AB78872 [0,1,0,0,0,1|2,0,0]=4 378 B10R1.8 c1c(cc(nc1C=O)Br)N AB68107 [0,1,0,0,0,1|2,0,0]=4 379 B10R1.8 c1c(cc(nc1C=O)Br)O AB78887 [0,1,0,0,0,1|2,0,0]=4 380 B10R1.8 c1c(cc(nc1C=O)Cl)Br AB67308 [0,1,0,0,0,1|2,0,0]=4 381 B10R1.8 c1c(cc(nc1C=O)Cl)Cl AB62517 [0,1,0,0,0,1|2,0,0]=4 382 B10R1.8 c1c(cc(nc1C=O)Cl)F AB68025 [0,1,0,0,0,1|2,0,0]=4 383 B10R1.8 c1c(cc(nc1C=O)Cl)I AB78865 [0,1,0,0,0,1|2,0,0]=4 384 B10R1.8 c1c(cc(nc1C=O)Cl)N AB68105 [0,1,0,0,0,1|2,0,0]=4 385 B10R1.8 c1c(cc(nc1C=O)Cl)O AB74846 [0,1,0,0,0,1|2,0,0]=4 386 B10R1.8 c1c(cc(nc1C=O)F)Br AB72838 [0,1,0,0,0,1|2,0,0]=4 387 B10R1.8 c1c(cc(nc1C=O)F)Cl AB78846 [0,1,0,0,0,1|2,0,0]=4 388 B10R1.8 c1c(cc(nc1C=O)F)F AB78843 [0,1,0,0,0,1|2,0,0]=4 389 B10R1.8 c1c(cc(nc1C=O)F)I AB78848 [0,1,0,0,0,1|2,0,0]=4 390 B10R1.8 c1c(cc(nc1C=O)F)O AB78862 [0,1,0,0,0,1|2,0,0]=4 391 B10R1.8 c1c(cc(nc1C=O)I)Br AB79019 [0,1,0,0,0,1|2,0,0]=4 392 B10R1.8 c1c(cc(nc1C=O)I)Cl AB79008 [0,1,0,0,0,1|2,0,0]=4 393 B10R1.8 c1c(cc(nc1C=O)I)F AB78986 [0,1,0,0,0,1|2,0,0]=4 394 B10R1.8 c1c(cc(nc1C=O)I)O AB78911 [0,1,0,0,0,1|2,0,0]=4 395 B10R1.8 c1c(cc(nc1C=O)O)Br AB79027 [0,1,0,0,0,1|2,0,0]=4 396 B10R1.8 c1c(cc(nc1C=O)O)Cl AB79017 [0,1,0,0,0,1|2,0,0]=4 397 B10R1.8 c1c(cc(nc1C=O)O)F AB79005 [0,1,0,0,0,1|2,0,0]=4 398 B10R1.8 c1c(cc(nc1C=O)O)I AB79041 [0,1,0,0,0,1|2,0,0]=4 399 B10R1.8 c1c(cc(nc1C=O)O)O AB78985 [0,1,0,0,0,1|2,0,0]=4 400 B10R1.10 Cc1cccc(c1)CC=O AB11815 [0,1,0,0,0,1|1,0,0]=3 401 B10R1.10 c1cc(cc(c1)Br)CC=O AB11787 [0,1,0,0,0,1|2,0,0]=4 402 B10R1.10 c1cc(cc(c1)Cl)CC=O AB11792 [0,1,0,0,0,1|2,0,0]=4 403 B10R1.10 c1cc(cc(c1)F)CC=O AB11802 [0,1,0,0,0,1|2,0,0]=4 404 B10R1.30 Cc1cc(c(cn1)Br)C=O AB68164 [0,1,0,0,0,1|2,0,0]=4 405 B10R1.30 Cc1cc(c(cn1)C)C=O AB74126 [0,1,0,0,0,1|2,0,0]=4 406 B10R1.30 Cc1cc(c(cn1)Cl)C=O AB68146 [0,1,0,0,0,1|2,0,0]=4 407 B10R1.30 Cc1cc(c(cn1)N)C=O AB83642 [0,1,0,0,0,1|2,0,0]=4 408 B10R1.30 Cc1cc(c(cn1)O)C=O AB76792 [0,1,0,0,0,1|2,0,0]=4 409 B10R1.30 Cc1cc(c(nc1)Br)C=O AB71097 [0,1,0,0,0,1|2,0,0]=4 410 B10R1.30 Cc1cc(c(nc1)C)C=O AB71657 [0,1,0,0,0,1|2,0,0]=4 411 B10R1.30 Cc1cc(c(nc1)Cl)C=O AB41813 [0,1,0,0,0,1|2,0,0]=4 412 B10R1.30 Cc1cc(c(nc1)F)C=O AB65261 [0,1,0,0,0,1|2,0,0]=4 413 B10R1.30 Cc1cc(c(nc1)N)C=O AB51533 [0,1,0,0,0,1|2,0,0]=4 414 B10R1.30 Cc1cc(c(nc1)O)C=O AB71365 [0,1,0,0,0,1|2,0,0]=4 415 B10R1.30 Cc1ccc(c(c1)C=O)N AB58438 [0,1,0,0,0,1|1,0,0]=3 416 B10R1.30 Cc1ccc(c(n1)C=O)Br AB68163 [0,1,0,0,0,1|1,0,0]=3 417 B10R1.30 Cc1ccc(c(n1)C=O)Cl AB68143 [0,1,0,0,0,1|1,0,0]=3 418 B10R1.30 Cc1ccc(c(n1)C=O)N AB76244 [0,1,0,0,0,1|1,0,0]=3 419 B10R1.30 Cc1ccc(c(n1)C=O)O AB62933 [0,1,0,0,0,1|1,0,0]=3 420 B10R1.30 Cc1ccc(cc1C=O)Cl AB63586 [0,1,0,0,0,1|2,0,0]=4 421 B10R1.30 Cc1ccc(cc1C=O)O MB23457 [0,1,0,0,0,1|2,0,0]=4 422 B10R1.30 Cc1ccc(nc1C=O)C AB75403 [0,1,0,0,0,1|1,0,0]=3 423 B10R1.30 Cc1ccc(nc1C=O)Cl AB75110 [0,1,0,0,0,1|2,0,0]=4 424 B10R1.30 Cc1ccc(nc1C=O)F AB75170 [0,1,0,0,0,1|2,0,0]=4 425 B10R1.30 Cc1cnc(c(n1)C=O)C AB77040 [0,1,0,0,0,1|2,0,0]=4 426 B10R1.30 c1cc(c(cc1Br)C=O)Br MB01225 [0,1,0,0,0,1|2,0,0]=4 427 B10R1.30 c1cc(c(cc1Br)C=O)N AB58429 [0,1,0,0,0,1|2,0,0]=4 428 B10R1.30 c1cc(c(cc1Cl)C=O)O AB00314 [0,1,0,0,0,1|2,0,0]=4 429 B10R1.30 c1cc(c(cc1F)C=O)Br AB03821 [0,1,0,0,0,1|2,0,0]=4 430 B10R1.30 c1cc(c(cc1F)C=O)N AB58443 [0,1,0,0,0,1|2,0,0]=4 431 B10R1.30 c1cc(c(cc1N)C=O)O MB01352 [0,1,0,0,0,1|2,0,0]=4 432 B10R1.30 c1cc(c(cc1O)C=O)Br AB13035 [0,1,0,0,0,1|2,0,0]=4 433 B10R1.30 c1cc(c(cc1O)C=O)Cl MB05036 [0,1,0,0,0,1|2,0,0]=4 434 B10R1.30 c1cc(c(cc1O)C=O)F MB06891 [0,1,0,0,0,1|2,0,0]=4 435 B10R1.30 c1cc(c(cc1O)C=O)N MB29975 [0,1,0,0,0,1|2,0,0]=4 436 B10R1.30 c1cc(nc(c1Br)C=O)Cl AB68225 [0,1,0,0,0,1|2,0,0]=4 437 B10R1.30 c1cc(nc(c1Cl)C=O)Br AB68236 [0,1,0,0,0,1|2,0,0]=4 438 B10R1.30 c1cc(nc(c1Cl)C=O)Cl AB66502 [0,1,0,0,0,1|2,0,0]=4 439 B10R1.30 c1cc(nc(c1F)C=O)Br PB23527 [0,1,0,0,0,1|2,0,0]=4 440 B10R1.30 c1cc(nc(c1F)C=O)Cl AB20968 [0,1,0,0,0,1|2,0,0]=4 441 B10R1.30 c1cc(nc(c1N)C=O)Br AB83719 [0,1,0,0,0,1|2,0,0]=4 442 B10R1.30 c1cc(nc(c1N)C=O)Cl AB76329 [0,1,0,0,0,1|2,0,0]=4 443 B10R1.30 c1cc(nc(c1N)C=O)N AB83733 [0,1,0,0,0,1|2,0,0]=4 444 B10R1.30 c1cc(nc(c1O)C=O)Br AB84561 [0,1,0,0,0,1|2,0,0]=4 445 B10R1.30 c1cc(nc(c1O)C=O)Cl AB74851 [0,1,0,0,0,1|2,0,0]=4 446 B10R1.30 c1cc(nc(c1O)C=O)N AB84562 [0,1,0,0,0,1|2,0,0]=4 447 B10R1.113 CC(=O)c1cccc(n1)Br AB05570 [0,1,0,0,0,1|2,0,0]=4 448 B10R1.113 CC(=O)c1cccc(n1)Cl AB41100 [0,1,0,0,0,1|2,0,0]=4 449 B10R1.113 CC(=O)c1cccc(n1)F AB50226 [0,1,0,0,0,1|2,0,0]=4 450 B10R1.113 CC(=O)c1cccc(n1)N AB67452 [0,1,0,0,0,1|2,0,0]=4 451 B10R1.113 Cc1cc(ccn1)C(=O)C AB41122 [0,1,0,0,0,1|2,0,0]=4 452 B10R1.113 Cc1cc(ccn1)C(=O)Cl AB60195 [0,1,0,0,0,1|2,0,0]=4 453 B10R1.113 Cc1cc(ccn1)C(=O)O AB06393 [0,1,0,0,0,1|2,0,0]=4 454 B10R1.113 Cc1cc(cnc1)C(=O)O PB12710 [0,1,0,0,0,1|2,0,0]=4 455 B10R1.113 Cc1cccc(c1)C(=N)N AB11452 [0,1,0,0,0,1|2,0,0]=4 456 B10R1.113 Cc1cccc(c1)C(=S)N AB08506 [0,1,0,0,0,1|1,1,0]=4 457 B10R1.113 Cc1cccc(n1)C(=O)C AB25782 [0,1,0,0,0,1|1,0,0]=3 458 B10R1.113 Cc1cccc(n1)C(=O)O AB01368 [0,1,0,0,0,1|1,0,0]=3 459 B10R1.113 Cc1ccnc(c1)C(=O)C AB10395 [0,1,0,0,0,1|2,0,0]=4 460 B10R1.113 Cc1ccnc(c1)C(=O)O AB15851 [0,1,0,0,0,1|2,0,0]=4 461 B10R1.113 Cc1ccnc(n1)C(=O)O PB31505 [0,1,0,0,0,1|2,0,0]=4 462 B10R1.113 Cc1cncc(n1)C(=O)O AB48615 [0,1,0,0,0,1|2,0,0]=4 463 B10R1.113 Cc1nccc(n1)C(=O)C AB04788 [0,1,0,0,0,1|2,0,0]=4 464 B10R1.113 c1cc(cc(c1)Br)C(=O)N MB00265 [0,1,0,0,0,1|2,0,0]=4 465 B10R1.113 c1cc(cc(c1)O)C(=O)N MB00281 [0,1,0,0,0,1|2,0,0]=4 466 B10R1.113 c1cc(nc(c1)Br)C(=O)N MB00999 [0,1,0,0,0,1|2,0,0]=4 467 B10R1.113 c1cc(nc(c1)Br)C(=O)O AB03328 [0,1,0,0,0,1|2,0,0]=4 468 B10R1.113 c1cc(nc(c1)Cl)C(=O)O AB04138 [0,1,0,0,0,1|2,0,0]=4 469 B10R1.113 c1cc(nc(c1)F)C(=O)O AB11487 [0,1,0,0,0,1|2,0,0]=4 470 B10R1.113 c1cc(nc(c1)I)C(=O)N AB42518 [0,1,0,0,0,1|2,0,0]=4 471 B10R1.113 c1cc(nc(c1)I)C(=O)O AB42497 [0,1,0,0,0,1|2,0,0]=4 472 B10R1.113 c1cc(nc(c1)N)C(=O)O PB23179 [0,1,0,0,0,1|2,0,0]=4 473 B10R1.172 C#Cc1cccc(c1)C=O AB23573 [0,1,0,0,0,1|1,0,1]=4 474 B10R1.172 COc1cc(ccn1)C=O PB32415 [0,1,0,0,0,1|2,0,0]=4 475 B10R1.172 COc1cc(cnc1)C=O PB23495 [0,1,0,0,0,1|2,0,0]=4 476 B10R1.172 COc1cccc(c1)C=O AB00318 [0,1,0,0,0,1|1,0,0]=3 477 B10R1.172 COc1cccc(n1)C=O AB22243 [0,1,0,0,0,1|1,0,0]=3 478 B10R1.172 COc1ccnc(c1)C=O AB43663 [0,1,0,0,0,1|2,0,0]=4 479 B10R1.172 COc1cncc(n1)C=O AB73162 [0,1,0,0,0,1|2,0,0]=4 480 B10R1.172 COc1nccc(n1)C=O AB44816 [0,1,0,0,0,1|2,0,0]=4 481 B10R1.172 CSc1nccc(n1)C=O PB17294 [0,1,0,0,0,1|2,0,0]=4 482 B10R1.172 c1c(cncc1C=O)CCl AB69676 [0,1,0,0,0,1|2,0,0]=4 483 B10R1.172 c1c(cncc1C=O)CN AB31382 [0,1,0,0,0,1|2,0,0]=4 484 B10R1.172 c1cc(nc(c1)C#N)C=O AB08283 [0,1,0,0,0,1|1,0,1]=4 485 B10R1.172 c1cc(nc(c1)C=O)CCl AB54693 [0,1,0,0,0,1|1,0,0]=3 486 B10R1.172 c1cnc(cc1C=O)CN AB31349 [0,1,0,0,0,1|2,0,0]=4 487 B10R1.172 c1cnc(nc1C=O)CBr MB10437 [0,1,0,0,0,1|2,0,0]=4 488 B10R1.172 c1cnc(nc1C=O)CCl AB58728 [0,1,0,0,0,1|2,0,0]=4 489 B10R1.172 c1cnc(nc1C=O)CO AB58724 [0,1,0,0,0,1|2,0,0]=4 490 B10R1.176 Cc1c(ccc(n1)C=O)Br MB09863 [0,1,0,0,0,1|1,0,0]=3 491 B10R1.176 Cc1c(ccc(n1)C=O)Cl AB70731 [0,1,0,0,0,1|1,0,0]=3 492 B10R1.176 Cc1c(ccc(n1)C=O)F AB44884 [0,1,0,0,0,1|1,0,0]=3 493 B10R1.176 Cc1c(nc(cn1)C=O)C AB77048 [0,1,0,0,0,1|2,0,0]=4 494 B10R1.176 Cc1cc(ccc1Br)C=O AB42951 [0,1,0,0,0,1|1,0,0]=3 495 B10R1.176 Cc1cc(ccc1Cl)C=O AB11800 [0,1,0,0,0,1|1,0,0]=3 496 B10R1.176 Cc1cc(cnc1Br)C=O AB44906 [0,1,0,0,0,1|2,0,0]=4 497 B10R1.176 Cc1cc(cnc1C)C=O AB75407 [0,1,0,0,0,1|2,0,0]=4 498 B10R1.176 Cc1cc(cnc1Cl)C=O AB64236 [0,1,0,0,0,1|2,0,0]=4 499 B10R1.176 Cc1cc(cnc1F)C=O AB25943 [0,1,0,0,0,1|2,0,0]=4 500 B10R1.176 Cc1cc(ncc1Br)C=O AB41159 [0,1,0,0,0,1|2,0,0]=4 501 B10R1.176 Cc1cc(ncc1C)C=O AB74125 [0,1,0,0,0,1|2,0,0]=4 502 B10R1.176 Cc1cc(ncc1Cl)C=O AB41161 [0,1,0,0,0,1|2,0,0]=4 503 B10R1.176 Cc1cc(ncc1F)C=O AB75169 [0,1,0,0,0,1|2,0,0]=4 504 B10R1.176 Cc1ccc(cc1O)C=O MB01933 [0,1,0,0,0,1|2,0,0]=4 505 B10R1.176 Cc1ccc(nc1C)C=O AB74104 [0,1,0,0,0,1|1,0,0]=3 506 B10R1.176 Cc1ccc(nc1Cl)C=O AB75097 [0,1,0,0,0,1|2,0,0]=4 507 B10R1.176 Cc1ccc(nc1F)C=O AB72847 [0,1,0,0,0,1|2,0,0]=4 508 B10R1.176 Cn1cc(ccc1=O)CN PB15234 [0,1,0,0,0,1|1,0,1]=4 509 B10R1.176 Cn1cc(ccc1=O)CO PB22835 [0,1,0,0,0,1|0,0,2]=4 510 B10R1.176 c1cc(c(cc1C=O)Cl)Br AB43050 [0,1,0,0,0,1|2,0,0]=4 511 B10R1.176 c1cc(c(cc1C=O)I)F AB44172 [0,1,0,0,0,1|2,0,0]=4 512 B10R1.176 c1cc(c(cc1C=O)I)O MB00259 [0,1,0,0,0,1|2,0,0]=4 513 B10R1.176 c1cc(c(cc1C=O)N)O MB13575 [0,1,0,0,0,1|2,0,0]=4 514 B10R1.176 c1cc(c(cc1C=O)O)Br MB09255 [0,1,0,0,0,1|2,0,0]=4 515 B10R1.176 c1cc(c(cc1C=O)O)Cl MB25536 [0,1,0,0,0,1|2,0,0]=4 516 B10R1.176 c1cc(c(cc1C=O)O)F MB09319 [0,1,0,0,0,1|2,0,0]=4 517 B10R1.176 c1cc(c(cc1C=O)O)N MB34962 [0,1,0,0,0,1|2,0,0]=4 518 B10R1.176 c1cc(c(nc1C=O)Cl)F AB70948 [0,1,0,0,0,1|2,0,0]=4 519 B10R1.176 c1cc(c(nc1C=O)Cl)N AB75366 [0,1,0,0,0,1|2,0,0]=4 520 B10R1.176 c1cc(c(nc1C=O)Cl)O AB74848 [0,1,0,0,0,1|2,0,0]=4 521 B10R1.176 c1cc(c(nc1C=O)F)Cl AB70952 [0,1,0,0,0,1|2,0,0]=4 522 B10R1.176 c1cc(c(nc1C=O)F)F AB70940 [0,1,0,0,0,1|2,0,0]=4 523 B10R1.176 c1cc(c(nc1C=O)N)Cl AB83955 [0,1,0,0,0,1|2,0,0]=4 524 B10R1.176 c1cc(c(nc1C=O)O)Cl AB70962 [0,1,0,0,0,1|2,0,0]=4 525 B10R1.4 Cc1ccccc1CC=O AB11813 [0,1,0,0,0,1|1,0,0]=3 526 B10R1.20 C#Cc1ccccc1C=O AB17472 [0,1,0,0,0,1|1,0,1]=4 527 B10R1.20 C#Cc1ccncc1C=O AB69095 [0,1,0,0,0,1|1,0,1]=4 528 B10R1.20 C#Cc1cnccc1C=O AB69064 [0,1,0,0,0,1|1,0,1]=4 529 B10R1.20 COc1c(cccn1)C=O PB26137 [0,1,0,0,0,1|1,0,0]=3 530 B10R1.20 COc1c(nccn1)C=O AB55611 [0,1,0,0,0,1|2,0,0]=4 531 B10R1.20 COc1ccccc1C=O AB00311 [0,1,0,0,0,1|1,0,0]=3 532 B10R1.20 COc1cccnc1C=O AB22246 [0,1,0,0,0,1|1,0,0]=3 533 B10R1.20 COc1ccncc1C=O AB17569 [0,1,0,0,0,1|1,0,0]=3 534 B10R1.20 COc1cnccc1C=O AB17541 [0,1,0,0,0,1|1,0,0]=3 535 B10R1.20 CSc1c(cccn1)C=O MB07044 [0,1,0,0,0,1|1,0,0]=3 536 B10R1.20 c1cc(c(nc1)C#N)C=O AB31409 [0,1,0,0,0,1|1,0,1]=4 537 B10R1.20 c1cc(c(nc1)C=O)C#N AB54498 [0,1,0,0,0,1|1,0,1]=4 538 B10R1.20 c1cc(c(nc1)CCl)C=O AB69680 [0,1,0,0,0,1|1,0,0]=3 539 B10R1.20 c1cc(c(nc1)CN)C=O AB31410 [0,1,0,0,0,1|1,0,0]=3 540 B10R1.20 c1cncc(c1C#N)C=O AB74128 [0,1,0,0,0,1|1,0,1]=4 541 B10R1.20 c1cncc(c1C=O)C#N AB67707 [0,1,0,0,0,1|1,0,1]=4 542 B10R1.20 c1cncc(c1CCl)C=O AB69679 [0,1,0,0,0,1|1,0,0]=3 543 B10R1.25 Cc1c(ccc(n1)Br)C=O AB66856 [0,1,0,0,0,1|1,0,0]=3 544 B10R1.25 Cc1c(ccc(n1)Cl)C=O AB32133 [0,1,0,0,0,1|1,0,0]=3 545 B10R1.25 Cc1c(ncc(n1)Br)C=O AB85714 [0,1,0,0,0,1|2,0,0]=4 546 B10R1.25 Cc1c(ncc(n1)Cl)C=O AB85687 [0,1,0,0,0,1|2,0,0]=4 547 B10R1.25 Cc1cc(c(cn1)C=O)Br AB66855 [0,1,0,0,0,1|2,0,0]=4 548 B10R1.25 Cc1cc(c(cn1)C=O)Cl AB66849 [0,1,0,0,0,1|2,0,0]=4 549 B10R1.25 Cc1cc(c(cn1)C=O)F AB75172 [0,1,0,0,0,1|2,0,0]=4 550 B10R1.25 Cc1cc(c(cn1)C=O)N AB83689 [0,1,0,0,0,1|2,0,0]=4 551 B10R1.25 Cc1cc(c(cn1)C=O)O AB75249 [0,1,0,0,0,1|2,0,0]=4 552 B10R1.25 Cc1cc(c(nc1)C=O)C AB53525 [0,1,0,0,0,1|1,0,0]=3 553 B10R1.25 Cc1cc(c(nc1)C=O)Cl AB75087 [0,1,0,0,0,1|2,0,0]=4 554 B10R1.25 Cc1cc(c(nc1)C=O)F AB75163 [0,1,0,0,0,1|2,0,0]=4 555 B10R1.25 Cc1cc(c(nc1)C=O)N AB83746 [0,1,0,0,0,1|2,0,0]=4 556 B10R1.25 Cc1cc(c(nc1)C=O)O AB75242 [0,1,0,0,0,1|2,0,0]=4 557 B10R1.25 Cc1cc(cnc1C=O)Br AB42359 [0,1,0,0,0,1|1,0,0]=3 558 B10R1.25 Cc1cc(cnc1C=O)Cl AB75118 [0,1,0,0,0,1|1,0,0]=3 559 B10R1.25 Cc1cc(cnc1C=O)F AB74798 [0,1,0,0,0,1|1,0,0]=3 560 B10R1.25 Cc1cc(ncc1C=O)Br AB67814 [0,1,0,0,0,1|1,0,0]=3 561 B10R1.25 Cc1cc(ncc1C=O)C AB74124 [0,1,0,0,0,1|1,0,0]=3 562 B10R1.25 Cc1cc(ncc1C=O)Cl AB32140 [0,1,0,0,0,1|1,0,0]=3 563 B10R1.25 Cc1cc(ncc1C=O)F AB75824 [0,1,0,0,0,1|1,0,0]=3 564 B10R1.25 Cc1ccc(c(c1)N)C=O AB58436 [0,1,0,0,0,1|2,0,0]=4 565 B10R1.25 Cc1ccc(c(n1)Br)C=O AB55809 [0,1,0,0,0,1|2,0,0]=4 566 B10R1.25 Cc1ccc(c(n1)C)C=O AB13970 [0,1,0,0,0,1|1,0,0]=3 567 B10R1.25 Cc1ccc(c(n1)Cl)C=O AB32135 [0,1,0,0,0,1|2,0,0]=4 568 B10R1.25 Cc1ccc(c(n1)N)C=O AB27631 [0,1,0,0,0,1|2,0,0]=4 569 B10R1.25 Cc1ccc(c(n1)O)C=O AB42321 [0,1,0,0,0,1|2,0,0]=4 570 B10R1.25 Cc1cnc(c(n1)C)C=O AB73104 [0,1,0,0,0,1|2,0,0]=4 571 B10R1.25 c1c(c(cnc1Br)C=O)Cl AB67260 [0,1,0,0,0,1|2,0,0]=4 572 B10R1.25 c1c(c(cnc1Br)C=O)F AB68032 [0,1,0,0,0,1|2,0,0]=4 573 B10R1.25 c1c(c(cnc1Br)C=O)N AB68108 [0,1,0,0,0,1|2,0,0]=4 574 B10R1.25 c1c(c(cnc1Br)C=O)O AB72645 [0,1,0,0,0,1|2,0,0]=4 575 B10R1.25 c1c(c(cnc1Cl)C=O)Br AB67955 [0,1,0,0,0,1|2,0,0]=4 576 B10R1.25 c1c(c(cnc1Cl)C=O)Cl PB13495 [0,1,0,0,0,1|2,0,0]=4 577 B10R1.25 c1c(c(cnc1Cl)C=O)F AB68027 [0,1,0,0,0,1|2,0,0]=4 578 B10R1.25 c1c(c(cnc1Cl)C=O)N AB52769 [0,1,0,0,0,1|2,0,0]=4 579 B10R1.25 c1c(c(cnc1Cl)C=O)O AB69327 [0,1,0,0,0,1|2,0,0]=4 580 B10R1.25 c1c(c(cnc1F)C=O)Cl AB75063 [0,1,0,0,0,1|2,0,0]=4 581 B10R1.25 c1c(c(cnc1N)C=O)Cl AB71947 [0,1,0,0,0,1|2,0,0]=4 582 B10R1.25 c1c(c(cnc1N)C=O)N AB43397 [0,1,0,0,0,1|2,0,0]=4 583 B10R1.25 c1c(c(cnc1N)C=O)O AB84438 [0,1,0,0,0,1|2,0,0]=4 584 B10R1.25 c1c(c(cnc1O)C=O)O AB69704 [0,1,0,0,0,1|2,0,0]=4 585 B10R1.25 c1c(cnc(c1Br)C=O)Br AB48580 [0,1,0,0,0,1|2,0,0]=4 586 B10R1.25 c1c(cnc(c1Cl)C=O)F AB70954 [0,1,0,0,0,1|2,0,0]=4 587 B10R1.25 c1c(cnc(c1F)C=O)Br PB11091 [0,1,0,0,0,1|2,0,0]=4 588 B10R1.25 c1c(cnc(c1F)C=O)Cl AB70957 [0,1,0,0,0,1|2,0,0]=4 589 B10R1.25 c1c(cnc(c1N)C=O)Br AB83734 [0,1,0,0,0,1|2,0,0]=4 590 B10R1.25 c1c(cnc(c1N)C=O)Cl AB83735 [0,1,0,0,0,1|2,0,0]=4 591 B10R1.25 c1c(cnc(c1N)C=O)N AB83749 [0,1,0,0,0,1|2,0,0]=4 592 B10R1.25 c1c(cnc(c1O)C=O)Br AB70969 [0,1,0,0,0,1|2,0,0]=4 593 B10R1.25 c1c(cnc(c1O)C=O)Cl AB75009 [0,1,0,0,0,1|2,0,0]=4 594 B10R1.25 c1c(cnc(c1O)C=O)N AB84581 [0,1,0,0,0,1|2,0,0]=4 595 B10R1.25 c1cc(c(cc1Br)Br)C=O AB66752 [0,1,0,0,0,1|2,0,0]=4 596 B10R1.25 c1cc(c(cc1Br)N)C=O AB45657 [0,1,0,0,0,1|2,0,0]=4 597 B10R1.25 c1cc(c(cc1Br)O)C=O AB23661 [0,1,0,0,0,1|2,0,0]=4 598 B10R1.25 c1cc(c(cc1Cl)Br)C=O MB06997 [0,1,0,0,0,1|2,0,0]=4 599 B10R1.25 c1cc(c(cc1Cl)N)C=O AB58432 [0,1,0,0,0,1|2,0,0]=4 600 B10R1.25 c1cc(c(cc1Cl)O)C=O AB23660 [0,1,0,0,0,1|2,0,0]=4 601 B10R1.25 c1cc(c(cc1F)Br)C=O AB06851 [0,1,0,0,0,1|2,0,0]=4 602 B10R1.25 c1cc(c(cc1F)N)C=O AB55874 [0,1,0,0,0,1|2,0,0]=4 603 B10R1.25 c1cc(c(cc1I)O)C=O MB06220 [0,1,0,0,0,1|2,0,0]=4 604 B10R1.25 c1cc(c(cc1N)O)C=O MB09039 [0,1,0,0,0,1|2,0,0]=4 605 B10R1.25 c1cc(c(cc1O)Br)C=O MB25584 [0,1,0,0,0,1|2,0,0]=4 606 B10R1.25 c1cc(c(cc1O)I)C=O MB25658 [0,1,0,0,0,1|2,0,0]=4 607 B10R1.25 c1cc(c(cc1O)N)C=O MB38477 [0,1,0,0,0,1|2,0,0]=4 608 B10R1.25 c1cc(nc(c1C=O)Br)Br PB20462 [0,1,0,0,0,1|2,0,0]=4 609 B10R1.25 c1cc(nc(c1C=O)Br)Cl AB64562 [0,1,0,0,0,1|2,0,0]=4 610 B10R1.25 c1cc(nc(c1C=O)Cl)Cl PB17413 [0,1,0,0,0,1|2,0,0]=4 611 B10R1.25 c1cc(nc(c1C=O)F)Br AB70853 [0,1,0,0,0,1|2,0,0]=4 612 B10R1.25 c1cc(nc(c1C=O)N)Br AB69709 [0,1,0,0,0,1|2,0,0]=4 613 B10R1.25 c1cc(nc(c1C=O)N)Cl AB69707 [0,1,0,0,0,1|2,0,0]=4 614 B10R1.25 c1cc(nc(c1C=O)N)N AB76145 [0,1,0,0,0,1|2,0,0]=4 615 B10R1.25 c1cc(nc(c1C=O)O)Br AB84532 [0,1,0,0,0,1|2,0,0]=4 616 B10R1.25 c1cc(nc(c1C=O)O)Cl AB84535 [0,1,0,0,0,1|2,0,0]=4 617 B10R1.25 c1cc(nc(c1C=O)O)N AB84539 [0,1,0,0,0,1|2,0,0]=4 618 B10R1.61 CC(=O)c1c(cccn1)Cl PB28312 [0,1,0,0,0,1|2,0,0]=4 619 B10R1.61 CC(=O)c1c(cccn1)F PB26212 [0,1,0,0,0,1|2,0,0]=4 620 B10R1.61 CC(=O)c1c(cccn1)N AB08681 [0,1,0,0,0,1|2,0,0]=4 621 B10R1.61 CC(=O)c1cccnc1Br AB18171 [0,1,0,0,0,1|2,0,0]=4 622 B10R1.61 CC(=O)c1cccnc1Cl PB32351 [0,1,0,0,0,1|2,0,0]=4 623 B10R1.61 CC(=O)c1cccnc1F AB41104 [0,1,0,0,0,1|2,0,0]=4 624 B10R1.61 CC(=O)c1cccnc1N AB11689 [0,1,0,0,0,1|2,0,0]=4 625 B10R1.61 CC(=O)c1ccncc1Br PB12099 [0,1,0,0,0,1|2,0,0]=4 626 B10R1.61 CC(=O)c1ccncc1F PB22036 [0,1,0,0,0,1|2,0,0]=4 627 B10R1.61 CC(=O)c1ccncc1N AB41121 [0,1,0,0,0,1|2,0,0]=4 628 B10R1.61 CC(=O)c1cnccc1Br AB64732 [0,1,0,0,0,1|2,0,0]=4 629 B10R1.61 CC(=O)c1cnccc1Cl AB64447 [0,1,0,0,0,1|2,0,0]=4 630 B10R1.61 CC(=O)c1cnccc1F AB41107 [0,1,0,0,0,1|2,0,0]=4 631 B10R1.61 Cc1c(cccn1)C(=O)C AB03570 [0,1,0,0,0,1|1,0,0]=3 632 B10R1.61 Cc1c(cccn1)C(=O)O PB27380 [0,1,0,0,0,1|1,0,0]=3 633 B10R1.61 Cc1c(cccn1)[N+](=O)[O-] PB15768 [0,1,0,0,0,1|2,0,0]=4 634 B10R1.61 Cc1c(ccnn1)C(=O)O PB22593 [0,1,0,0,0,1|2,0,0]=4 635 B10R1.61 Cc1c(nccn1)C(=O)O PB12562 [0,1,0,0,0,1|2,0,0]=4 636 B10R1.61 Cc1ccccc1C(=N)N AB18273 [0,1,0,0,0,1|2,0,0]=4 637 B10R1.61 Cc1ccccc1C(=S)N AB16881 [0,1,0,0,0,1|1,1,0]=4 638 B10R1.61 Cc1cccnc1C(=O)O PB10121 [0,1,0,0,0,1|1,0,0]=3 639 B10R1.61 Cc1ccncc1C(=O)C AB45306 [0,1,0,0,0,1|1,0,0]=3 640 B10R1.61 Cc1ccncc1C(=O)O PB17119 [0,1,0,0,0,1|1,0,0]=3 641 B10R1.61 Cc1ccncc1[N+](=O)[O-] PB27407 [0,1,0,0,0,1|2,0,0]=4 642 B10R1.61 Cc1ccnnc1C(=O)O PB17664 [0,1,0,0,0,1|2,0,0]=4 643 B10R1.61 Cc1cnccc1C(=O)O PB12103 [0,1,0,0,0,1|1,0,0]=3 644 B10R1.61 Cc1cnccc1[N+](=O)[O-] PB15731 [0,1,0,0,0,1|2,0,0]=4 645 B10R1.61 Cc1cnncc1C(=O)O PB17923 [0,1,0,0,0,1|2,0,0]=4 646 B10R1.61 c1cc(c(nc1)Br)C(=O)O AB09561 [0,1,0,0,0,1|2,0,0]=4 647 B10R1.61 c1cc(c(nc1)C(=O)N)N PB24920 [0,1,0,0,0,1|2,0,0]=4 648 B10R1.61 c1cc(c(nc1)C(=O)O)Cl PB30690 [0,1,0,0,0,1|2,0,0]=4 649 B10R1.61 c1cc(c(nc1)C(=O)O)F PB12310 [0,1,0,0,0,1|2,0,0]=4 650 B10R1.61 c1cc(c(nc1)C(=O)O)I AB10544 [0,1,0,0,0,1|2,0,0]=4 651 B10R1.61 c1cc(c(nc1)C(=O)O)N PB32134 [0,1,0,0,0,1|2,0,0]=4 652 B10R1.61 c1cc(c(nc1)Cl)C(=O)O AB00651 [0,1,0,0,0,1|2,0,0]=4 653 B10R1.61 c1cc(c(nc1)F)C(=O)O AB01814 [0,1,0,0,0,1|2,0,0]=4 654 B10R1.61 c1cc(c(nc1)N)C(=O)O PB30535 [0,1,0,0,0,1|2,0,0]=4 655 B10R1.61 c1cc(c(nc1)O)C(=O)O AB01020 [0,1,0,0,0,1|2,0,0]=4 656 B10R1.61 c1ccc(c(c1)C(=O)O)Br AB00223 [0,1,0,0,0,1|2,0,0]=4 657 B10R1.61 c1cncc(c1Br)C(=O)O AB18009 [0,1,0,0,0,1|2,0,0]=4 658 B10R1.61 c1cncc(c1C(=O)N)O MB13532 [0,1,0,0,0,1|2,0,0]=4 659 B10R1.61 c1cncc(c1C(=O)O)Br PB10062 [0,1,0,0,0,1|2,0,0]=4 660 B10R1.61 c1cncc(c1C(=O)O)Cl AB13346 [0,1,0,0,0,1|2,0,0]=4 661 B10R1.61 c1cncc(c1C(=O)O)I AB09565 [0,1,0,0,0,1|2,0,0]=4 662 B10R1.61 c1cncc(c1C(=O)O)N PB17122 [0,1,0,0,0,1|2,0,0]=4 663 B10R1.61 c1cncc(c1C(=O)O)O PB29057 [0,1,0,0,0,1|2,0,0]=4 664 B10R1.61 c1cncc(c1Cl)C(=O)O AB03598 [0,1,0,0,0,1|2,0,0]=4 665 B10R1.61 c1cncc(c1F)C(=O)O AB18036 [0,1,0,0,0,1|2,0,0]=4 666 B10R1.61 c1cncc(c1I)C(=O)O AB15003 [0,1,0,0,0,1|2,0,0]=4 667 B10R1.61 c1cncc(c1N)C(=O)N PB21456 [0,1,0,0,0,1|2,0,0]=4 668 B10R1.61 c1cncc(c1N)C(=O)O PB26016 [0,1,0,0,0,1|2,0,0]=4 669 B10R1.61 c1cncc(c1O)C(=O)N MB06099 [0,1,0,0,0,1|2,0,0]=4 670 B10R1.61 c1cncc(c1O)C(=O)O AB01802 [0,1,0,0,0,1|2,0,0]=4 671 B10R1.245 Cc1c(c(ccn1)Br)C=O AB66858 [0,1,0,0,0,1|1,0,0]=3 672 B10R1.245 Cc1c(c(ccn1)Cl)C=O AB66851 [0,1,0,0,0,1|1,0,0]=3 673 B10R1.245 Cc1c(c(ccn1)F)C=O AB68033 [0,1,0,0,0,1|1,0,0]=3 674 B10R1.245 Cc1c(c(ccn1)N)C=O AB68110 [0,1,0,0,0,1|1,0,0]=3 675 B10R1.245 Cc1c(c(ccn1)O)C=O AB84477 [0,1,0,0,0,1|1,0,0]=3 676 B10R1.245 Cc1cccc(c1C=O)O MB14829 [0,1,0,0,0,1|1,0,0]=3 677 B10R1.245 Cc1ccnc(c1C=O)C AB63129 [0,1,0,0,0,1|1,0,0]=3 678 B10R1.245 Cc1ccnc(c1C=O)Cl AB44897 [0,1,0,0,0,1|1,0,0]=3 679 B10R1.245 Cc1ccnc(c1C=O)F AB44902 [0,1,0,0,0,1|1,0,0]=3 680 B10R1.245 Cc1ccnc(c1C=O)N AB70910 [0,1,0,0,0,1|1,0,0]=3 681 B10R1.245 Cc1ccnc(c1C=O)O AB71364 [0,1,0,0,0,1|1,0,0]=3 682 B10R1.245 Cc1cncc(c1C=O)C AB24811 [0,1,0,0,0,1|1,0,0]=3 683 B10R1.245 Cc1cncc(c1C=O)Cl AB75138 [0,1,0,0,0,1|1,0,0]=3 684 B10R1.245 Cc1cncc(c1C=O)F AB75180 [0,1,0,0,0,1|1,0,0]=3 685 B10R1.245 Cc1cncc(c1C=O)N AB83619 [0,1,0,0,0,1|1,0,0]=3 686 B10R1.245 Cc1cncc(c1C=O)O AB75255 [0,1,0,0,0,1|1,0,0]=3 687 B10R1.245 c1c(c(c(cn1)Br)C=O)N AB83602 [0,1,0,0,0,1|2,0,0]=4 688 B10R1.245 c1c(c(c(cn1)Br)C=O)O AB84381 [0,1,0,0,0,1|2,0,0]=4 689 B10R1.245 c1c(c(c(cn1)Cl)C=O)Cl AB17460 [0,1,0,0,0,1|2,0,0]=4 690 B10R1.245 c1c(c(c(cn1)Cl)C=O)F AB70955 [0,1,0,0,0,1|2,0,0]=4 691 B10R1.245 c1c(c(c(cn1)Cl)C=O)N AB83603 [0,1,0,0,0,1|2,0,0]=4 692 B10R1.245 c1c(c(c(cn1)Cl)C=O)O AB75024 [0,1,0,0,0,1|2,0,0]=4 693 B10R1.245 c1c(c(c(cn1)F)C=O)F AB31964 [0,1,0,0,0,1|2,0,0]=4 694 B10R1.245 c1c(c(c(cn1)N)C=O)N AB83622 [0,1,0,0,0,1|2,0,0]=4 695 B10R1.245 c1c(c(c(cn1)O)C=O)N AB84386 [0,1,0,0,0,1|2,0,0]=4 696 B10R1.245 c1cc(c(c(c1)Br)C=O)Br CB11474 [0,1,0,0,0,1|2,0,0]=4 697 B10R1.245 c1cc(c(c(c1)Br)C=O)Cl MB01095 [0,1,0,0,0,1|2,0,0]=4 698 B10R1.245 c1cc(c(c(c1)Br)C=O)F AB14028 [0,1,0,0,0,1|2,0,0]=4 699 B10R1.245 c1cc(c(c(c1)Br)C=O)N PB34549 [0,1,0,0,0,1|2,0,0]=4 700 B10R1.245 c1cc(c(c(c1)Br)C=O)O AB43626 [0,1,0,0,0,1|2,0,0]=4 701 B10R1.245 c1cc(c(c(c1)Cl)C=O)N AB58431 [0,1,0,0,0,1|2,0,0]=4 702 B10R1.245 c1cc(c(c(c1)Cl)C=O)O MB01945 [0,1,0,0,0,1|2,0,0]=4 703 B10R1.245 c1cc(c(c(c1)F)C=O)O MB01694 [0,1,0,0,0,1|2,0,0]=4 704 B10R1.245 c1cc(c(c(c1)I)C=O)O MB14699 [0,1,0,0,0,1|2,0,0]=4 705 B10R1.245 c1cc(c(c(c1)O)C=O)N MB27161 [0,1,0,0,0,1|2,0,0]=4 706 B10R1.245 c1cnc(c(c1Br)C=O)Cl AB62918 [0,1,0,0,0,1|2,0,0]=4 707 B10R1.245 c1cnc(c(c1Br)C=O)N AB83695 [0,1,0,0,0,1|2,0,0]=4 708 B10R1.245 c1cnc(c(c1Br)C=O)O AB84479 [0,1,0,0,0,1|2,0,0]=4 709 B10R1.245 c1cnc(c(c1Cl)C=O)Cl AB41952 [0,1,0,0,0,1|2,0,0]=4 710 B10R1.245 c1cnc(c(c1Cl)C=O)F AB70637 [0,1,0,0,0,1|2,0,0]=4 711 B10R1.245 c1cnc(c(c1Cl)C=O)N PB22850 [0,1,0,0,0,1|2,0,0]=4 712 B10R1.245 c1cnc(c(c1Cl)C=O)O AB84482 [0,1,0,0,0,1|2,0,0]=4 713 B10R1.245 c1cnc(c(c1F)C=O)Cl AB68028 [0,1,0,0,0,1|2,0,0]=4 714 B10R1.245 c1cnc(c(c1I)C=O)Cl MB02652 [0,1,0,0,0,1|2,0,0]=4 715 B10R1.245 c1cnc(c(c1N)C=O)Br AB83694 [0,1,0,0,0,1|2,0,0]=4 716 B10R1.245 c1cnc(c(c1N)C=O)Cl AB52768 [0,1,0,0,0,1|2,0,0]=4 717 B10R1.245 c1cnc(c(c1N)C=O)O AB84486 [0,1,0,0,0,1|2,0,0]=4 718 B10R1.245 c1cnc(c(c1O)C=O)Br AB84458 [0,1,0,0,0,1|2,0,0]=4 719 B10R1.245 c1cnc(c(c1O)C=O)Cl AB66422 [0,1,0,0,0,1|2,0,0]=4 720 B10R1.245 c1cnc(c(c1O)C=O)N AB84460 [0,1,0,0,0,1|2,0,0]=4 721 B10R1.5 COCn1c(cnn1)C=O AB69669 [0,2,0,0,0,0|2,0,0]=4 722 B10R1.39 CC(C)n1c(ccn1)C=O AB13775 [0,2,0,0,0,0|1,0,0]=3 723 B10R1.39 CCn1c(cnn1)C(=O)C AB84662 [0,2,0,0,0,0|2,0,0]=4 724 B10R1.39 CCn1c(cnn1)C(=O)O AB76279 [0,2,0,0,0,0|2,0,0]=4 725 B10R1.34 Cc1c(sc(c1Br)Br)C=O AB10018 [0,2,0,0,0,0|2,0,0]=4 726 B10R1.59 B(c1cc(cn1C)Cl)(O)O AB73976 [0,2,0,0,0,0|1,0,1]=4 727 B10R1.59 B(c1cc(cn1C)F)(O)O AB73975 [0,2,0,0,0,0|1,0,1]=4 728 B10R1.59 Cc1c(cc(s1)Cl)C(=O)N AB65699 [0,2,0,0,0,0|2,0,0]=4 729 B10R1.59 Cc1cc(c(o1)C)C(=O)O AB03078 [0,2,0,0,0,0|2,0,0]=4 730 B10R1.59 Cc1cc(n(n1)C)C(=O)C AB20875 [0,2,0,0,0,0|1,0,0]=3 731 B10R1.59 Cc1cc(n(n1)C)C(=O)O PB14132 [0,2,0,0,0,0|1,0,0]=3 732 B10R1.59 Cc1cc(sc1C(=O)O)Br CB11471 [0,2,0,0,0,0|2,0,0]=4 733 B10R1.59 Cn1c(cc(n1)Cl)C(=O)O PB35003 [0,2,0,0,0,0|1,0,0]=3 734 B10R1.59 Cn1cc(cc1C(=O)O)N AB42940 [0,2,0,0,0,0|0,0,0]=2 735 B10R1.59 c1c(cn(c1C(=O)O)N)Br MB14547 [0,2,0,0,0,0|1,0,0]=3 736 B10R1.192 B(c1c(ccn1C)F)(O)O AB73978 [0,2,0,0,0,0|1,0,1]=4 737 B10R1.64 Cn1cccc1CC(=O)O AB31637 [0,2,0,0,0,0|0,0,0]=2 738 B10R1.149 Cn1cccc1C(=O)OC CB10178 [0,2,0,0,0,0|0,0,0]=2 739 B10R1.149 Cn1ccnc1C(=O)OC PB27571 [0,2,0,0,0,0|1,0,0]=3 740 B10R1.149 Cn1cncc1C(=O)OC PB26064 [0,2,0,0,0,0|1,0,0]=3 741 B10R1.65 Cn1ccnc1S(=O)(=O)Cl AB71408 [0,2,0,0,0,0|2,0,0]=4 742 B10R1.194 Cc1c(csc1C(=O)Cl)Br AB13922 [0,2,0,0,0,0|2,0,0]=4 743 B10R1.194 Cc1c(csc1C(=O)N)Br AB65689 [0,2,0,0,0,0|2,0,0]=4 744 B10R1.194 Cc1cnc(n1C)C(=O)O AB70178 [0,2,0,0,0,0|1,0,0]=3 745 B10R1.194 Cc1ncc(n1C)C(=O)C AB45828 [0,2,0,0,0,0|1,0,0]=3 746 B10R1.194 Cc1nnc(n1C)C(=O)O AB84875 [0,2,0,0,0,0|2,0,0]=4 747 B10R1.194 Cn1c(cnc1Br)C(=O)O AB56938 [0,2,0,0,0,0|1,0,0]=3 748 B10R1.194 Cn1c(cnc1Cl)C(=O)O AB56929 [0,2,0,0,0,0|1,0,0]=3 749 B10R1.258 Cn1c(cnc1C#N)C=O AB56944 [0,2,0,0,0,0|1,0,0]=3 750 B8R1.2 CNc1cccnc1 AB09114 [0,0,1,1,0,0|2,0,0]=4 751 B8R1.2 CNc1ccncn1 AB60623 [0,0,1,1,0,0|2,0,0]=4 752 B8R1.2 CNc1ncccn1 AB05135 [0,0,1,1,0,0|2,0,0]=4 753 B8R1.2 c1cc(cnc1)C=O AB00744 [0,0,1,1,0,0|0,0,2]=4 754 B8R1.2 c1cc(nnc1)C=O PB20119 [0,0,1,1,0,0|1,0,1]=4 755 B8R1.2 c1ccnc(c1)C=O AB00680 [0,0,1,1,0,0|2,0,0]=4 756 B10R2.7 c1cc2cnccn2c1 CB10529 [0,0,0,1,0,1|1,0,1]=4 757 B10R2.7 c1ccn2c(c1)ccn2 AB48944 [0,0,0,1,0,1|2,0,0]=4 758 B10R2.7 c1ccn2c(c1)cnn2 MB00828 [0,0,0,1,0,1|2,0,0]=4 759 B10R2.7 c1ccn2cccc2c1 AB01491 [0,0,0,1,0,1|1,0,1]=4 760 B10R2.7 c1ccn2cncc2c1 AB14043 [0,0,0,1,0,1|1,0,1]=4 761 B10R2.7 c1cnc2ccnn2c1 PB20510 [0,0,0,1,0,1|2,0,0]=4 762 B10R2.32 C1CC(=O)C2=CN=CC21 AB22250 [0,1,0,1,0,0|2,0,0]=4