0 B7R1.3 Br[13c]1[13cH][13cH][13cH][13cH][13cH]1 1P008T6V [0,0,0,0,0,0|2,0,0]=2 1 B7R1.3 Brc1cc[c]nc1 1P003MWR [0,0,0,0,0,0|3,0,0]=3 2 B7R1.3 Brc1ccccn1 1P0033NM [0,0,0,0,0,0|3,0,0]=3 3 B7R1.3 Brc1cccnc1 1P00343S [0,0,0,0,0,0|3,0,0]=3 4 B7R1.3 Brc1cccnn1 1P00343R [0,0,0,0,0,0|4,0,0]=4 5 B7R1.3 Brc1ccncc1 1P0034FC [0,0,0,0,0,0|1,0,0]=1 6 B7R1.3 Brc1ccncc1 1P0038SJ [0,0,0,0,0,0|1,0,0]=1 7 B7R1.3 Brc1ccncc1 1P00FDJY [0,0,0,0,0,0|1,0,0]=1 8 B7R1.3 Brc1ccncn1 1P0039MI [0,0,0,0,0,0|2,0,0]=2 9 B7R1.3 Brc1ccnnc1 1P000WQH [0,0,0,0,0,0|2,0,0]=2 10 B7R1.3 Brc1ccnnc1 1P00171L [0,0,0,0,0,0|2,0,0]=2 11 B7R1.3 Brc1cnccn1 1P0033NL [0,0,0,0,0,0|4,0,0]=4 12 B7R1.3 Brc1cnccn1 1P01ANMT [0,0,0,0,0,0|4,0,0]=4 13 B7R1.3 Brc1cncnc1 1P0034P7 [0,0,0,0,0,0|4,0,0]=4 14 B7R1.3 Brc1cnnnc1 1P000AZ3 [0,0,0,0,0,0|3,0,0]=3 15 B7R1.3 Brc1ncccn1 1P00I90J [0,0,0,0,0,0|4,0,0]=4 16 B7R1.3 CC1=C=C[N]C=C1 1P008USL [0,0,0,0,0,0|1,0,2]=3 17 B7R1.3 C[n+]1ccccc1 1P003EZK [0,0,0,0,0,0|3,0,0]=3 18 B7R1.3 C[n+]1ccccc1 1P00GUZE [0,0,0,0,0,0|3,0,0]=3 19 B7R1.3 Cc1ccccn1 1P0023GU [0,0,0,0,0,0|3,0,0]=3 20 B7R1.3 Cc1ccccn1 1P0037Z6 [0,0,0,0,0,0|3,0,0]=3 21 B7R1.3 Cc1cccnc1 1P003486 [0,0,0,0,0,0|3,0,0]=3 22 B7R1.3 Cc1cccnn1 1P001UBK [0,0,0,0,0,0|4,0,0]=4 23 B7R1.3 Cc1ccncn1 1P003M9B [0,0,0,0,0,0|2,0,0]=2 24 B7R1.3 Cc1ccnnc1 1P00HCT0 [0,0,0,0,0,0|2,0,0]=2 25 B7R1.3 Cc1cnccn1 1P003I6Y [0,0,0,0,0,0|4,0,0]=4 26 B7R1.3 Cc1cncnc1 1P0029HT [0,0,0,0,0,0|4,0,0]=4 27 B7R1.3 Cc1ncccn1 1P003I70 [0,0,0,0,0,0|4,0,0]=4 28 B7R1.3 ClC1=C[N]C=C=C1 1P00BI1M [0,0,0,0,0,0|3,0,1]=4 29 B7R1.3 Clc1c[c-]ccn1 1P008UMS [0,0,0,0,0,0|3,0,1]=4 30 B7R1.3 Clc1c[c-]ncc1 1P008S4G [0,0,0,0,0,0|1,0,1]=2 31 B7R1.3 Clc1ccccc1 1P003522 [0,0,0,0,0,0|2,0,0]=2 32 B7R1.3 Clc1cccnc1 1P003JSA [0,0,0,0,0,0|3,0,0]=3 33 B7R1.3 Clc1cccnn1 1P00345B [0,0,0,0,0,0|4,0,0]=4 34 B7R1.3 Clc1cccnn1 1P003ARR [0,0,0,0,0,0|4,0,0]=4 35 B7R1.3 Clc1ccncc1 1P0034H0 [0,0,0,0,0,0|1,0,0]=1 36 B7R1.3 Clc1ccncc1 1P003ACI [0,0,0,0,0,0|1,0,0]=1 37 B7R1.3 Clc1ccncn1 1P00276O [0,0,0,0,0,0|2,0,0]=2 38 B7R1.3 Clc1ccncn1 1P0029FC [0,0,0,0,0,0|2,0,0]=2 39 B7R1.3 Clc1ccncn1 1P0038PQ [0,0,0,0,0,0|2,0,0]=2 40 B7R1.3 Clc1ccnnc1 1P000J2M [0,0,0,0,0,0|2,0,0]=2 41 B7R1.3 Clc1ccnnc1 1P007DV7 [0,0,0,0,0,0|2,0,0]=2 42 B7R1.3 Clc1cnccn1 1P001L0E [0,0,0,0,0,0|4,0,0]=4 43 B7R1.3 Clc1cncnc1 1P007DV6 [0,0,0,0,0,0|4,0,0]=4 44 B7R1.3 Clc1ncccn1 1P0033QC [0,0,0,0,0,0|4,0,0]=4 45 B7R1.3 Fc1ccccc1 1P0035E9 [0,0,0,0,0,0|2,0,0]=2 46 B7R1.3 Fc1ccccn1 1P0033SI [0,0,0,0,0,0|3,0,0]=3 47 B7R1.3 Fc1cccnc1 1P003JYE [0,0,0,0,0,0|3,0,0]=3 48 B7R1.3 Fc1ccncc1 1P0034IB [0,0,0,0,0,0|1,0,0]=1 49 B7R1.3 Fc1cnccn1 1P00D9L3 [0,0,0,0,0,0|4,0,0]=4 50 B7R1.3 Fc1cncnc1 1P0060KF [0,0,0,0,0,0|4,0,0]=4 51 B7R1.3 Fc1ncccn1 1P00I6G6 [0,0,0,0,0,0|4,0,0]=4 52 B7R1.3 Ic1ccccc1 1P0035HS [0,0,0,0,0,0|2,0,0]=2 53 B7R1.3 Ic1ccccn1 1P0036MH [0,0,0,0,0,0|3,0,0]=3 54 B7R1.3 Ic1cccnc1 1P003476 [0,0,0,0,0,0|3,0,0]=3 55 B7R1.3 Ic1cccnn1 1P01BGGD [0,0,0,0,0,0|4,0,0]=4 56 B7R1.3 Ic1ccncc1 1P001QR9 [0,0,0,0,0,0|1,0,0]=1 57 B7R1.3 Ic1ccncn1 1P00CLGQ [0,0,0,0,0,0|2,0,0]=2 58 B7R1.3 Ic1ccnnc1 1P019GH6 [0,0,0,0,0,0|2,0,0]=2 59 B7R1.3 Ic1cnccn1 1P0035HV [0,0,0,0,0,0|4,0,0]=4 60 B7R1.3 Ic1cncnc1 1P0037VD [0,0,0,0,0,0|4,0,0]=4 61 B7R1.3 Ic1ncccn1 1P00C7DI [0,0,0,0,0,0|4,0,0]=4 62 B7R1.3 NC1CCCC=C1 1P018SO4 [0,0,0,0,0,0|1,0,3]=4 63 B7R1.3 N[13c]1[13cH][13cH][13cH][13cH][13cH]1 1P0003HD [0,0,0,0,0,0|1,0,0]=1 64 B7R1.3 N[C@@H]1CCCC=C1 1P028YJZ [0,0,0,0,0,0|1,0,3]=4 65 B7R1.3 N[C@H]1CCCC=C1 1P028TS8 [0,0,0,0,0,0|1,0,3]=4 66 B7R1.3 N[n+]1ccccc1 1P003EEU [0,0,0,0,0,0|2,0,0]=2 67 B7R1.3 Nc1ccccc1 1P003OD2 [0,0,0,0,0,0|1,0,0]=1 68 B7R1.3 Nc1ccccc1 1P003OD4 [0,0,0,0,0,0|1,0,0]=1 69 B7R1.3 Nc1ccccc1 1P003OD5 [0,0,0,0,0,0|1,0,0]=1 70 B7R1.3 Nc1ccccc1 1P00DANN [0,0,0,0,0,0|1,0,0]=1 71 B7R1.3 Nc1ccccn1 1P00CMJB [0,0,0,0,0,0|2,0,0]=2 72 B7R1.3 Nc1cccnc1 1P003JEQ [0,0,0,0,0,0|2,0,0]=2 73 B7R1.3 Nc1cccnn1 1P003426 [0,0,0,0,0,0|3,0,0]=3 74 B7R1.3 Nc1cccnn1 1P0089JT [0,0,0,0,0,0|3,0,0]=3 75 B7R1.3 Nc1ccncc1 1P0039PA [0,0,0,0,0,0|0,0,0]=0 76 B7R1.3 Nc1ccncn1 1P00IAZ2 [0,0,0,0,0,0|1,0,0]=1 77 B7R1.3 Nc1ccnnc1 1P001CGL [0,0,0,0,0,0|1,0,0]=1 78 B7R1.3 Nc1ccnnc1 1P002JIJ [0,0,0,0,0,0|1,0,0]=1 79 B7R1.3 Nc1cnccn1 1P003H0L [0,0,0,0,0,0|3,0,0]=3 80 B7R1.3 Nc1cncnc1 1P0034NO [0,0,0,0,0,0|3,0,0]=3 81 B7R1.3 Nc1cnncn1 1P0050GR [0,0,0,0,0,0|2,0,0]=2 82 B7R1.3 Nc1ncccn1 1P0033L4 [0,0,0,0,0,0|3,0,0]=3 83 B7R1.3 Nc1nccnn1 1P003JAB [0,0,0,0,0,0|4,0,0]=4 84 B7R1.3 Nc1ncncn1 1P00BYVN [0,0,0,0,0,0|2,0,0]=2 85 B7R1.3 O=C1CCCC=C1 1P0033QS [0,0,0,0,0,0|2,0,2]=4 86 B7R1.3 O=C1CCNC=C1 1P002PGW [0,0,0,0,0,0|1,0,3]=4 87 B7R1.3 O=C1CCOC=C1 1P004TYE [0,0,0,0,0,0|2,0,2]=4 88 B7R1.3 O=C1CNCC=C1 1P028FY8 [0,0,0,0,0,0|3,0,1]=4 89 B7R1.3 O=C1COCC=C1 1P00IKIB [0,0,0,0,0,0|3,0,1]=4 90 B7R1.3 O=C1NCCC=C1 1P00EDGZ [0,0,0,0,0,0|3,0,1]=4 91 B7R1.3 O=C1OCCC=C1 1P003MQL [0,0,0,0,0,0|3,0,1]=4 92 B7R1.3 O=c1cc[nH]cc1 1P007C4C [0,0,0,0,0,0|1,0,1]=2 93 B7R1.3 O=c1cc[nH]nc1 1P001ZYO [0,0,0,0,0,0|2,0,1]=3 94 B7R1.3 O=c1cccc[nH]1 1P00HWQR [0,0,0,0,0,0|3,0,0]=3 95 B7R1.3 O=c1cccco1 1P003O98 [0,0,0,0,0,0|3,0,0]=3 96 B7R1.3 O=c1ccnc[nH]1 1P003967 [0,0,0,0,0,0|2,0,0]=2 97 B7R1.3 O=c1ccocc1 1P003LXT [0,0,0,0,0,0|2,0,0]=2 98 B7R1.3 O=c1cncc[nH]1 1P003HWP [0,0,0,0,0,0|4,0,0]=4 99 B7R1.3 OC1=CN=NCC1 1P001UCT [0,0,0,0,0,0|2,0,2]=4 100 B7R1.3 O[13c]1[13cH][13cH][13cH][13cH][13cH]1 1P00GVQD [0,0,0,0,0,0|2,0,0]=2 101 B7R1.3 Oc1ccccc1 1P0000NN [0,0,0,0,0,0|2,0,0]=2 102 B7R1.3 Oc1ccccn1 1P003UF8 [0,0,0,0,0,0|3,0,0]=3 103 B7R1.3 Oc1ccccn1 1P003UIP [0,0,0,0,0,0|3,0,0]=3 104 B7R1.3 Oc1cccnc1 1P003K1M [0,0,0,0,0,0|3,0,0]=3 105 B7R1.3 Oc1cccnn1 1P00DEIH [0,0,0,0,0,0|4,0,0]=4 106 B7R1.3 Oc1ccncc1 1P0034J8 [0,0,0,0,0,0|1,0,0]=1 107 B7R1.3 Oc1ccncn1 1P003M0J [0,0,0,0,0,0|2,0,0]=2 108 B7R1.3 Oc1ccnnc1 1P002JFR [0,0,0,0,0,0|2,0,0]=2 109 B7R1.3 Oc1cnccn1 1P000N6P [0,0,0,0,0,0|4,0,0]=4 110 B7R1.3 Oc1cncnc1 1P002TRI [0,0,0,0,0,0|4,0,0]=4 111 B7R1.3 Oc1ncccn1 1P003HWR [0,0,0,0,0,0|4,0,0]=4 112 B7R1.3 Oc1ncccn1 1P00DGHM [0,0,0,0,0,0|4,0,0]=4 113 B7R1.3 Pc1ccccc1 1P003U5W [0,0,0,0,0,0|1,1,0]=2 114 B7R1.3 S=c1cccc[nH]1 1P002TDH [0,0,0,0,0,0|3,0,0]=3 115 B7R1.3 S=c1cccn[nH]1 1P002W4Y [0,0,0,0,0,0|4,0,0]=4 116 B7R1.3 S=c1ccnc[nH]1 1P001KWU [0,0,0,0,0,0|2,0,0]=2 117 B7R1.3 S=c1nccc[nH]1 1P001KWV [0,0,0,0,0,0|4,0,0]=4 118 B7R1.3 Sc1cccnc1 1P001SU2 [0,0,0,0,0,0|3,0,0]=3 119 B7R1.3 Sc1ccncc1 1P003MH8 [0,0,0,0,0,0|1,0,0]=1 120 B7R1.3 Sc1cnccn1 1P003HZ3 [0,0,0,0,0,0|4,0,0]=4 121 B7R1.3 Sc1ncccn1 1P000W8T [0,0,0,0,0,0|4,0,0]=4 122 B7R1.3 [15NH2]c1ccccc1 1P00FDEF [0,0,0,0,0,0|1,0,0]=1 123 B7R1.3 [BH3-][n+]1ccccc1 1P003OZK [0,0,0,0,0,0|3,0,0]=3 124 B7R1.3 [NH3+]c1ccccc1 1P00DL00 [0,0,0,0,0,0|1,0,1]=2 125 B7R1.3 [O-][n+]1ccccc1 1P00360I [0,0,0,0,0,0|3,0,0]=3 126 B7R1.3 [O-][n+]1ccccn1 1P001DSO [0,0,0,0,0,0|4,0,0]=4 127 B7R1.3 [O-][n+]1ccncc1 1P006XB5 [0,0,0,0,0,0|2,0,0]=2 128 B7R1.3 [O]c1cncnc1 1P002VWK [0,0,0,0,0,0|4,0,0]=4 129 B7R1.3 [S-]c1ccccc1 1P00BLKE [0,0,0,0,0,0|2,0,0]=2 130 B7R1.3 [SeH]c1ccccc1 1P003U6T [0,0,0,0,0,0|2,0,0]=2 131 B7R1.3 [SiH3]c1ccccc1 1P0039OY [0,0,0,0,0,0|2,0,0]=2 132 B6R1.1 C1=CCC=CC1 1P003E40 [1,0,0,0,0,0|1,0,1]=3 133 B6R1.1 C1CC=CC=C1 1P00E9LK [1,0,0,0,0,0|1,0,1]=3 134 B6R1.1 [13cH]1[13cH][13cH][13cH][13cH][13cH]1 1P00C19H [1,0,0,0,0,0|1,0,0]=2 135 B6R1.1 c1[c-]cccc1 1P003VM5 [1,0,0,0,0,0|1,0,0]=2 136 B6R1.1 c1[c-]cccc1 1P01EBEV [1,0,0,0,0,0|1,0,0]=2 137 B6R1.1 c1[c]cccc1 1P003OQP [1,0,0,0,0,0|1,0,0]=2 138 B6R1.1 c1[c]cccc1 1P00C85G [1,0,0,0,0,0|1,0,0]=2 139 B6R1.1 c1ccc[nH+]c1 1P01FFZ4 [1,0,0,0,0,0|0,0,1]=2 140 B6R1.1 c1ccc[o+]c1 1P01X6D0 [1,0,0,0,0,0|1,0,0]=2 141 B6R1.1 c1ccccc1 1P000X4T [1,0,0,0,0,0|1,0,0]=2 142 B6R1.1 c1ccccc1 1P00I7TI [1,0,0,0,0,0|1,0,0]=2 143 B6R1.1 c1cccnc1 1P001LMB [1,0,0,0,0,0|0,0,0]=1 144 B6R1.1 c1cccnc1 1P001LVP [1,0,0,0,0,0|0,0,0]=1 145 B6R1.1 c1cccnc1 1P001P9C [1,0,0,0,0,0|0,0,0]=1 146 B6R1.1 c1cccnc1 1P002H86 [1,0,0,0,0,0|0,0,0]=1 147 B6R1.1 c1cccnc1 1P002T3E [1,0,0,0,0,0|0,0,0]=1 148 B6R1.1 c1cccnc1 1P002TJT [1,0,0,0,0,0|0,0,0]=1 149 B6R1.1 c1cccnc1 1P00360F [1,0,0,0,0,0|0,0,0]=1 150 B6R1.1 c1cccnc1 1P00360J [1,0,0,0,0,0|0,0,0]=1 151 B6R1.1 c1cccnc1 1P003UJB [1,0,0,0,0,0|0,0,0]=1 152 B6R1.1 c1cccnc1 1P00ACBP [1,0,0,0,0,0|0,0,0]=1 153 B6R1.1 c1cccnc1 1P00ADJU [1,0,0,0,0,0|0,0,0]=1 154 B6R1.1 c1cccnc1 1P00DE7T [1,0,0,0,0,0|0,0,0]=1 155 B6R1.1 c1cccnc1 1P00E9FY [1,0,0,0,0,0|0,0,0]=1 156 B6R1.1 c1cccnc1 1P01QOUU [1,0,0,0,0,0|0,0,0]=1 157 B6R1.1 c1ccncn1 1P003UJJ [1,0,0,0,0,0|1,0,0]=2 158 B6R1.1 c1ccnnc1 1P00360E [1,0,0,0,0,0|1,0,0]=2 159 B6R1.1 c1ccnnc1 1P00E9DW [1,0,0,0,0,0|1,0,0]=2 160 B6R1.1 n1ccncc1 1P002VMV [1,0,0,0,0,0|1,0,0]=2 161 B6R1.1 n1cncnc1 1P002VMI [1,0,0,0,0,0|2,0,0]=3 162 B6R1.1 n1ncnnc1 1P002VMG [1,0,0,0,0,0|3,0,0]=4 163 B8R1.2 BrCc1ccccc1 1P0000N4 [0,1,0,0,0,0|2,0,0]=3 164 B8R1.2 BrCc1ccccn1 1P00BC33 [0,1,0,0,0,0|3,0,0]=4 165 B8R1.2 BrCc1cccnc1 1P0033XF [0,1,0,0,0,0|3,0,0]=4 166 B8R1.2 BrCc1ccncc1 1P00349W [0,1,0,0,0,0|1,0,0]=2 167 B8R1.2 BrCc1ccncn1 1P0013LN [0,1,0,0,0,0|2,0,0]=3 168 B8R1.2 BrCc1ccnnc1 1P01V2SC [0,1,0,0,0,0|2,0,0]=3 169 B8R1.2 Br[Mg]c1ccccc1 1P0000NW [0,1,0,0,0,0|2,0,0]=3 170 B8R1.2 Br[Se]c1ccccc1 1P00399Q [0,1,0,0,0,0|2,0,0]=3 171 B8R1.2 C#Cc1ccccc1 1P0037R1 [0,1,0,0,0,0|2,0,0]=3 172 B8R1.2 C#Cc1ccccn1 1P003HOZ [0,1,0,0,0,0|3,0,0]=4 173 B8R1.2 C#Cc1cccnc1 1P002QXU [0,1,0,0,0,0|3,0,0]=4 174 B8R1.2 C#Cc1ccncc1 1P002QXV [0,1,0,0,0,0|1,0,0]=2 175 B8R1.2 C#Cc1ccncc1 1P0034HI [0,1,0,0,0,0|1,0,0]=2 176 B8R1.2 C#Cc1ccncn1 1P000PRI [0,1,0,0,0,0|2,0,0]=3 177 B8R1.2 C=C[n+]1ccccc1 1P01EWMV [0,1,0,0,0,0|3,0,0]=4 178 B8R1.2 C=Cc1ccccc1 1P0000N1 [0,1,0,0,0,0|2,0,0]=3 179 B8R1.2 C=Cc1ccccc1 1P00C4A8 [0,1,0,0,0,0|2,0,0]=3 180 B8R1.2 C=Cc1cccnc1 1P003491 [0,1,0,0,0,0|3,0,0]=4 181 B8R1.2 C=Cc1ccncc1 1P0000N0 [0,1,0,0,0,0|1,0,0]=2 182 B8R1.2 CC[n+]1ccccc1 1P002F4L [0,1,0,0,0,0|3,0,0]=4 183 B8R1.2 CC[n+]1ccccc1 1P002M2C [0,1,0,0,0,0|3,0,0]=4 184 B8R1.2 CC[n+]1ccccc1 1P00CL4T [0,1,0,0,0,0|3,0,0]=4 185 B8R1.2 CCc1ccccc1 1P0000N2 [0,1,0,0,0,0|2,0,0]=3 186 B8R1.2 CCc1ccccn1 1P0000NJ [0,1,0,0,0,0|3,0,0]=4 187 B8R1.2 CCc1cccnc1 1P00DE9B [0,1,0,0,0,0|3,0,0]=4 188 B8R1.2 CCc1ccncc1 1P003LT3 [0,1,0,0,0,0|1,0,0]=2 189 B8R1.2 CCc1ccncn1 1P0030XP [0,1,0,0,0,0|2,0,0]=3 190 B8R1.2 CNc1ccccc1 1P0000NT [0,1,0,0,0,0|1,0,0]=2 191 B8R1.2 CNc1ccccc1 1P003TNS [0,1,0,0,0,0|1,0,0]=2 192 B8R1.2 CNc1ccccn1 1P003TP7 [0,1,0,0,0,0|2,0,0]=3 193 B8R1.2 CNc1cccnc1 1P00289C [0,1,0,0,0,0|2,0,0]=3 194 B8R1.2 CNc1cccnn1 1P00DM46 [0,1,0,0,0,0|3,0,0]=4 195 B8R1.2 CNc1ccncc1 1P007CLZ [0,1,0,0,0,0|0,0,0]=1 196 B8R1.2 CNc1ccncn1 1P00CCF5 [0,1,0,0,0,0|1,0,0]=2 197 B8R1.2 CNc1ccnnc1 1P0035V9 [0,1,0,0,0,0|1,0,0]=2 198 B8R1.2 CNc1cnccn1 1P00CL7Z [0,1,0,0,0,0|3,0,0]=4 199 B8R1.2 CNc1cncnc1 1P00CMNJ [0,1,0,0,0,0|3,0,0]=4 200 B8R1.2 CNc1ncccn1 1P00H1G9 [0,1,0,0,0,0|3,0,0]=4 201 B8R1.2 COc1ccccc1 1P0000NO [0,1,0,0,0,0|2,0,0]=3 202 B8R1.2 COc1ccccn1 1P001TWH [0,1,0,0,0,0|3,0,0]=4 203 B8R1.2 COc1cccnc1 1P00347L [0,1,0,0,0,0|3,0,0]=4 204 B8R1.2 COc1ccncc1 1P003M5N [0,1,0,0,0,0|1,0,0]=2 205 B8R1.2 COc1ccncn1 1P00EFLG [0,1,0,0,0,0|2,0,0]=3 206 B8R1.2 COc1ccnnc1 1P002JGU [0,1,0,0,0,0|2,0,0]=3 207 B8R1.2 CSc1ccccc1 1P0000NM [0,1,0,0,0,0|2,0,0]=3 208 B8R1.2 CSc1ccccn1 1P00AP6U [0,1,0,0,0,0|3,0,0]=4 209 B8R1.2 CSc1cccnc1 1P002H17 [0,1,0,0,0,0|3,0,0]=4 210 B8R1.2 CSc1ccncc1 1P00CCG6 [0,1,0,0,0,0|1,0,0]=2 211 B8R1.2 CSc1ncncn1 1P01Q3RJ [0,1,0,0,0,0|3,0,0]=4 212 B8R1.2 C[SiH2]c1ccccc1 1P005JR8 [0,1,0,0,0,0|2,0,0]=3 213 B8R1.2 ClCc1ccccn1 1P0033BZ [0,1,0,0,0,0|3,0,0]=4 214 B8R1.2 ClCc1ccccn1 1P0073L5 [0,1,0,0,0,0|3,0,0]=4 215 B8R1.2 ClCc1cccnc1 1P005WS5 [0,1,0,0,0,0|3,0,0]=4 216 B8R1.2 ClCc1ccncc1 1P0023Y0 [0,1,0,0,0,0|1,0,0]=2 217 B8R1.2 ClCc1ccncn1 1P00349Y [0,1,0,0,0,0|2,0,0]=3 218 B8R1.2 ClCc1ccnnc1 1P028UKA [0,1,0,0,0,0|2,0,0]=3 219 B8R1.2 Cl[Mg]c1ccccc1 1P0000NV [0,1,0,0,0,0|2,0,0]=3 220 B8R1.2 Cl[Se]c1ccccc1 1P0035XY [0,1,0,0,0,0|2,0,0]=3 221 B8R1.2 FCc1cccnc1 1P004R6V [0,1,0,0,0,0|3,0,0]=4 222 B8R1.2 FCc1ccncc1 1P004SSU [0,1,0,0,0,0|1,0,0]=2 223 B8R1.2 ICc1ccccc1 1P0037QF [0,1,0,0,0,0|2,0,0]=3 224 B8R1.2 ICc1cccnc1 1P005TG6 [0,1,0,0,0,0|3,0,0]=4 225 B8R1.2 ICc1ccncc1 1P001AK8 [0,1,0,0,0,0|1,0,0]=2 226 B8R1.2 N#Cc1ccccc1 1P0000MW [0,1,0,0,0,0|1,0,1]=3 227 B8R1.2 N#Cc1ccccc1 1P001LN2 [0,1,0,0,0,0|1,0,1]=3 228 B8R1.2 N#Cc1ccccc1 1P003OQS [0,1,0,0,0,0|1,0,1]=3 229 B8R1.2 N#Cc1ccccn1 1P0000NK [0,1,0,0,0,0|2,0,1]=4 230 B8R1.2 N#Cc1cccnc1 1P0000O0 [0,1,0,0,0,0|2,0,1]=4 231 B8R1.2 N#Cc1ccncc1 1P0000MV [0,1,0,0,0,0|0,0,1]=2 232 B8R1.2 N#Cc1ccncn1 1P003LQB [0,1,0,0,0,0|1,0,1]=3 233 B8R1.2 N#Cc1ccnnc1 1P0061S0 [0,1,0,0,0,0|1,0,1]=3 234 B8R1.2 N#[N+]c1ccccc1 1P00CLKS [0,1,0,0,0,0|1,0,1]=3 235 B8R1.2 NCc1ccccc1 1P0000MX [0,1,0,0,0,0|1,0,0]=2 236 B8R1.2 NCc1ccccc1 1P003OLG [0,1,0,0,0,0|1,0,0]=2 237 B8R1.2 NCc1ccccc1 1P00BYUK [0,1,0,0,0,0|1,0,0]=2 238 B8R1.2 NCc1ccccc1 1P00DH5Y [0,1,0,0,0,0|1,0,0]=2 239 B8R1.2 NCc1ccccn1 1P003IDS [0,1,0,0,0,0|2,0,0]=3 240 B8R1.2 NCc1cccnc1 1P003UIR [0,1,0,0,0,0|2,0,0]=3 241 B8R1.2 NCc1cccnc1 1P01XEWA [0,1,0,0,0,0|2,0,0]=3 242 B8R1.2 NCc1cccnn1 1P00GS3J [0,1,0,0,0,0|3,0,0]=4 243 B8R1.2 NCc1cccnn1 1P01JUG1 [0,1,0,0,0,0|3,0,0]=4 244 B8R1.2 NCc1ccncc1 1P0034LV [0,1,0,0,0,0|0,0,0]=1 245 B8R1.2 NCc1ccncc1 1P00ED63 [0,1,0,0,0,0|0,0,0]=1 246 B8R1.2 NCc1ccncn1 1P000A6H [0,1,0,0,0,0|1,0,0]=2 247 B8R1.2 NCc1ccncn1 1P0038A7 [0,1,0,0,0,0|1,0,0]=2 248 B8R1.2 NCc1ccncn1 1P00EMBN [0,1,0,0,0,0|1,0,0]=2 249 B8R1.2 NCc1ccnnc1 1P003AHQ [0,1,0,0,0,0|1,0,0]=2 250 B8R1.2 NCc1ccnnc1 1P006ZTS [0,1,0,0,0,0|1,0,0]=2 251 B8R1.2 NCc1cnccn1 1P002CZT [0,1,0,0,0,0|3,0,0]=4 252 B8R1.2 NCc1cnccn1 1P00397Q [0,1,0,0,0,0|3,0,0]=4 253 B8R1.2 NCc1cncnc1 1P002RBY [0,1,0,0,0,0|3,0,0]=4 254 B8R1.2 NCc1cncnc1 1P00ILSS [0,1,0,0,0,0|3,0,0]=4 255 B8R1.2 NCc1ncccn1 1P001ILN [0,1,0,0,0,0|3,0,0]=4 256 B8R1.2 NCc1ncccn1 1P0033KZ [0,1,0,0,0,0|3,0,0]=4 257 B8R1.2 NCc1ncccn1 1P005HA7 [0,1,0,0,0,0|3,0,0]=4 258 B8R1.2 NCc1nccnc1 1P00HE98 [0,1,0,0,0,0|3,0,0]=4 259 B8R1.2 NNc1ccccc1 1P0000NR [0,1,0,0,0,0|1,0,0]=2 260 B8R1.2 NNc1ccccc1 1P0035XW [0,1,0,0,0,0|1,0,0]=2 261 B8R1.2 NNc1ccccc1 1P003U6F [0,1,0,0,0,0|1,0,0]=2 262 B8R1.2 NNc1ccccn1 1P003HU7 [0,1,0,0,0,0|2,0,0]=3 263 B8R1.2 NNc1ccccn1 1P00DIES [0,1,0,0,0,0|2,0,0]=3 264 B8R1.2 NNc1ccccn1 1P00I9B1 [0,1,0,0,0,0|2,0,0]=3 265 B8R1.2 NNc1cccnc1 1P0037EA [0,1,0,0,0,0|2,0,0]=3 266 B8R1.2 NNc1cccnc1 1P00398X [0,1,0,0,0,0|2,0,0]=3 267 B8R1.2 NNc1cccnc1 1P003JZP [0,1,0,0,0,0|2,0,0]=3 268 B8R1.2 NNc1cccnn1 1P000E2H [0,1,0,0,0,0|3,0,0]=4 269 B8R1.2 NNc1ccncc1 1P002JZO [0,1,0,0,0,0|0,0,0]=1 270 B8R1.2 NNc1ccncc1 1P01DFTQ [0,1,0,0,0,0|0,0,0]=1 271 B8R1.2 NNc1ccncc1 1P01FD3X [0,1,0,0,0,0|0,0,0]=1 272 B8R1.2 NNc1ccncn1 1P003B7Q [0,1,0,0,0,0|1,0,0]=2 273 B8R1.2 NNc1ccncn1 1P01APGO [0,1,0,0,0,0|1,0,0]=2 274 B8R1.2 NNc1ccnnc1 1P028LF6 [0,1,0,0,0,0|1,0,0]=2 275 B8R1.2 NNc1cncnc1 1P01BA7I [0,1,0,0,0,0|3,0,0]=4 276 B8R1.2 NNc1ncccn1 1P0039KN [0,1,0,0,0,0|3,0,0]=4 277 B8R1.2 NNc1ncccn1 1P00J3ST [0,1,0,0,0,0|3,0,0]=4 278 B8R1.2 NOc1ccccc1 1P0037K5 [0,1,0,0,0,0|1,0,0]=2 279 B8R1.2 N\N=c/1\cncc[nH]1 1P00394I [0,1,0,0,0,0|3,0,0]=4 280 B8R1.2 O=Cc1ccccn1 1P0033WE [0,1,0,0,0,0|3,0,0]=4 281 B8R1.2 O=Cc1cccnc1 1P00348S [0,1,0,0,0,0|3,0,0]=4 282 B8R1.2 O=Cc1ccncc1 1P0034LU [0,1,0,0,0,0|1,0,0]=2 283 B8R1.2 O=Cc1ccncc1 1P003MH5 [0,1,0,0,0,0|1,0,0]=2 284 B8R1.2 O=Cc1ccncn1 1P00360K [0,1,0,0,0,0|2,0,0]=3 285 B8R1.2 O=Cc1ccnnc1 1P0037UD [0,1,0,0,0,0|2,0,0]=3 286 B8R1.2 O=Nc1ccccc1 1P003AHD [0,1,0,0,0,0|1,0,1]=3 287 B8R1.2 O=Nc1ccccn1 1P004ZQ7 [0,1,0,0,0,0|2,0,1]=4 288 B8R1.2 O=[As]c1ccccc1 1P003U68 [0,1,0,0,0,0|1,1,0]=3 289 B8R1.2 O=[I]c1ccccc1 1P0037R0 [0,1,0,0,0,0|2,0,0]=3 290 B8R1.2 OCc1ccccc1 1P0000MS [0,1,0,0,0,0|2,0,0]=3 291 B8R1.2 OCc1ccccn1 1P003UIQ [0,1,0,0,0,0|3,0,0]=4 292 B8R1.2 OCc1cccnc1 1P0000NZ [0,1,0,0,0,0|3,0,0]=4 293 B8R1.2 OCc1ccncc1 1P0034J2 [0,1,0,0,0,0|1,0,0]=2 294 B8R1.2 OCc1ccncc1 1P00IBZH [0,1,0,0,0,0|1,0,0]=2 295 B8R1.2 OCc1ccncn1 1P00BXTK [0,1,0,0,0,0|2,0,0]=3 296 B8R1.2 OCc1ccnnc1 1P00DBTI [0,1,0,0,0,0|2,0,0]=3 297 B8R1.2 ONc1ccccc1 1P0000NP [0,1,0,0,0,0|1,0,0]=2 298 B8R1.2 ONc1ccccc1 1P00G4MK [0,1,0,0,0,0|1,0,0]=2 299 B8R1.2 SCc1ccccc1 1P0000O1 [0,1,0,0,0,0|2,0,0]=3 300 B8R1.2 SCc1ccccn1 1P0029Y2 [0,1,0,0,0,0|3,0,0]=4 301 B8R1.2 SCc1cccnc1 1P0024X6 [0,1,0,0,0,0|3,0,0]=4 302 B8R1.2 SCc1ccncc1 1P0023XZ [0,1,0,0,0,0|1,0,0]=2 303 B8R1.2 [C-]#[N+]c1ccccc1 1P006IKG [0,1,0,0,0,0|1,0,1]=3 304 B8R1.2 [Mg+]Cc1ccccc1 1P005L1K [0,1,0,0,0,0|2,0,0]=3 305 B8R1.3 Brc1ccc(=O)[nH]c1 1P01FT0W [0,1,0,0,0,0|3,0,0]=4 306 B8R1.3 Brc1ccc(=O)oc1 1P002CSH [0,1,0,0,0,0|3,0,0]=4 307 B8R1.3 Brc1ccc(cc1)Br 1P00333D [0,1,0,0,0,0|2,0,0]=3 308 B8R1.3 Brc1ccc(cc1)I 1P00336K [0,1,0,0,0,0|2,0,0]=3 309 B8R1.3 Brc1ccc(cn1)Br 1P0033GS [0,1,0,0,0,0|3,0,0]=4 310 B8R1.3 Brc1ccc(cn1)C 1P0033MK [0,1,0,0,0,0|3,0,0]=4 311 B8R1.3 Brc1ccc(cn1)Cl 1P003H65 [0,1,0,0,0,0|3,0,0]=4 312 B8R1.3 Brc1ccc(cn1)F 1P0033MD [0,1,0,0,0,0|3,0,0]=4 313 B8R1.3 Brc1ccc(cn1)I 1P003H6M [0,1,0,0,0,0|3,0,0]=4 314 B8R1.3 Brc1ccc(cn1)N 1P0034ND [0,1,0,0,0,0|2,0,0]=3 315 B8R1.3 Brc1ccc(cn1)O 1P0037PB [0,1,0,0,0,0|3,0,0]=4 316 B8R1.3 Brc1cnc(nc1)N 1P0033KA [0,1,0,0,0,0|3,0,0]=4 317 B8R1.3 Cc1cc[n+](cc1)C 1P001YMS [0,1,0,0,0,0|1,0,1]=3 318 B8R1.3 Cc1cc[n+](cc1)C 1P002MBZ [0,1,0,0,0,0|1,0,1]=3 319 B8R1.3 Cc1ccc(=O)[nH]c1 1P0001YV [0,1,0,0,0,0|3,0,0]=4 320 B8R1.3 Cc1ccc(cc1)Br 1P0038GM [0,1,0,0,0,0|2,0,0]=3 321 B8R1.3 Cc1ccc(cc1)C 1P003608 [0,1,0,0,0,0|2,0,0]=3 322 B8R1.3 Cc1ccc(cc1)Cl 1P003LPB [0,1,0,0,0,0|2,0,0]=3 323 B8R1.3 Cc1ccc(cc1)F 1P003U4A [0,1,0,0,0,0|2,0,0]=3 324 B8R1.3 Cc1ccc(cc1)I 1P0034JN [0,1,0,0,0,0|2,0,0]=3 325 B8R1.3 Cc1ccc(cc1)I 1P007BGQ [0,1,0,0,0,0|2,0,0]=3 326 B8R1.3 Cc1ccc(cc1)N 1P003605 [0,1,0,0,0,0|1,0,0]=2 327 B8R1.3 Cc1ccc(cc1)N 1P003UHX [0,1,0,0,0,0|1,0,0]=2 328 B8R1.3 Cc1ccc(cc1)O 1P003U0X [0,1,0,0,0,0|2,0,0]=3 329 B8R1.3 Cc1ccc(cc1)S 1P003604 [0,1,0,0,0,0|2,0,0]=3 330 B8R1.3 Cc1ccc(cc1)[Mg+] 1P003UI4 [0,1,0,0,0,0|2,0,0]=3 331 B8R1.3 Cc1ccc(cn1)Br 1P0034OK [0,1,0,0,0,0|3,0,0]=4 332 B8R1.3 Cc1ccc(cn1)C 1P0033HD [0,1,0,0,0,0|3,0,0]=4 333 B8R1.3 Cc1ccc(cn1)Cl 1P003707 [0,1,0,0,0,0|3,0,0]=4 334 B8R1.3 Cc1ccc(cn1)F 1P0038JB [0,1,0,0,0,0|3,0,0]=4 335 B8R1.3 Cc1ccc(cn1)I 1P005Y11 [0,1,0,0,0,0|3,0,0]=4 336 B8R1.3 Cc1ccc(cn1)N 1P003MU7 [0,1,0,0,0,0|2,0,0]=3 337 B8R1.3 Cc1ccc(cn1)O 1P003K0R [0,1,0,0,0,0|3,0,0]=4 338 B8R1.3 Cc1ccc(cn1)[S-] 1P01FLFN [0,1,0,0,0,0|3,0,0]=4 339 B8R1.3 Cc1ccc(nn1)N 1P003420 [0,1,0,0,0,0|3,0,0]=4 340 B8R1.3 Cc1cnc(nc1)N 1P00DC10 [0,1,0,0,0,0|3,0,0]=4 341 B8R1.3 Cc1ncc(nc1)N 1P003ND3 [0,1,0,0,0,0|3,0,0]=4 342 B8R1.3 Clc1ccc(=O)[nH]c1 1P003N3L [0,1,0,0,0,0|3,0,0]=4 343 B8R1.3 Clc1ccc(=S)[nH]c1 1P003N5K [0,1,0,0,0,0|3,0,0]=4 344 B8R1.3 Clc1ccc(cc1)Br 1P003LGI [0,1,0,0,0,0|2,0,0]=3 345 B8R1.3 Clc1ccc(cc1)Cl 1P00333H [0,1,0,0,0,0|2,0,0]=3 346 B8R1.3 Clc1ccc(cc1)I 1P003EOU [0,1,0,0,0,0|2,0,0]=3 347 B8R1.3 Clc1ccc(cn1)Br 1P0034O8 [0,1,0,0,0,0|3,0,0]=4 348 B8R1.3 Clc1ccc(cn1)C 1P0039DK [0,1,0,0,0,0|3,0,0]=4 349 B8R1.3 Clc1ccc(cn1)Cl 1P001SM7 [0,1,0,0,0,0|3,0,0]=4 350 B8R1.3 Clc1ccc(cn1)F 1P003HFF [0,1,0,0,0,0|3,0,0]=4 351 B8R1.3 Clc1ccc(cn1)I 1P003HFQ [0,1,0,0,0,0|3,0,0]=4 352 B8R1.3 Clc1ccc(cn1)N 1P0037RK [0,1,0,0,0,0|2,0,0]=3 353 B8R1.3 Clc1ccc(cn1)O 1P0033P0 [0,1,0,0,0,0|3,0,0]=4 354 B8R1.3 Clc1cnc(nc1)N 1P00D8IX [0,1,0,0,0,0|3,0,0]=4 355 B8R1.3 Fc1ccc(=N)[nH]c1 1P003GXR [0,1,0,0,0,0|2,0,1]=4 356 B8R1.3 Fc1ccc(cc1)Br 1P00336J [0,1,0,0,0,0|2,0,0]=3 357 B8R1.3 Fc1ccc(cc1)Cl 1P007FJJ [0,1,0,0,0,0|2,0,0]=3 358 B8R1.3 Fc1ccc(cc1)F 1P00IA3R [0,1,0,0,0,0|2,0,0]=3 359 B8R1.3 Fc1ccc(cc1)I 1P0034I3 [0,1,0,0,0,0|2,0,0]=3 360 B8R1.3 Fc1ccc(cc1)S 1P0034ID [0,1,0,0,0,0|2,0,0]=3 361 B8R1.3 Fc1ccc(cn1)Br 1P003HQQ [0,1,0,0,0,0|3,0,0]=4 362 B8R1.3 Fc1ccc(cn1)C 1P002OMU [0,1,0,0,0,0|3,0,0]=4 363 B8R1.3 Fc1ccc(cn1)Cl 1P0034PI [0,1,0,0,0,0|3,0,0]=4 364 B8R1.3 Fc1ccc(cn1)F 1P003GF6 [0,1,0,0,0,0|3,0,0]=4 365 B8R1.3 Fc1ccc(cn1)I 1P00APXU [0,1,0,0,0,0|3,0,0]=4 366 B8R1.3 Fc1ccc(cn1)N 1P0024K6 [0,1,0,0,0,0|2,0,0]=3 367 B8R1.3 Fc1ccc(cn1)O 1P0033RZ [0,1,0,0,0,0|3,0,0]=4 368 B8R1.3 Fc1cnc(nc1)N 1P001YHL [0,1,0,0,0,0|3,0,0]=4 369 B8R1.3 Ic1ccc(=O)[nH]c1 1P007MAM [0,1,0,0,0,0|3,0,0]=4 370 B8R1.3 Ic1ccc(cc1)I 1P00333Q [0,1,0,0,0,0|2,0,0]=3 371 B8R1.3 Ic1ccc(cn1)Br 1P003806 [0,1,0,0,0,0|3,0,0]=4 372 B8R1.3 Ic1ccc(cn1)C 1P00BFPI [0,1,0,0,0,0|3,0,0]=4 373 B8R1.3 Ic1ccc(cn1)Cl 1P00BD18 [0,1,0,0,0,0|3,0,0]=4 374 B8R1.3 Ic1ccc(cn1)F 1P001RXK [0,1,0,0,0,0|3,0,0]=4 375 B8R1.3 Ic1ccc(cn1)I 1P000CBM [0,1,0,0,0,0|3,0,0]=4 376 B8R1.3 Ic1ccc(cn1)N 1P003MTZ [0,1,0,0,0,0|2,0,0]=3 377 B8R1.3 Ic1ccc(cn1)O 1P000Z9C [0,1,0,0,0,0|3,0,0]=4 378 B8R1.3 Ic1cnc(nc1)N 1P001K46 [0,1,0,0,0,0|3,0,0]=4 379 B8R1.3 Nc1ccc(=O)[nH]n1 1P003NJN [0,1,0,0,0,0|3,0,0]=4 380 B8R1.3 Nc1ccc(cc1)Br 1P0039G2 [0,1,0,0,0,0|1,0,0]=2 381 B8R1.3 Nc1ccc(cc1)Br 1P00ED8O [0,1,0,0,0,0|1,0,0]=2 382 B8R1.3 Nc1ccc(cc1)Cl 1P0034GG [0,1,0,0,0,0|1,0,0]=2 383 B8R1.3 Nc1ccc(cc1)Cl 1P00I49K [0,1,0,0,0,0|1,0,0]=2 384 B8R1.3 Nc1ccc(cc1)F 1P0038F1 [0,1,0,0,0,0|1,0,0]=2 385 B8R1.3 Nc1ccc(cc1)F 1P00BG1J [0,1,0,0,0,0|1,0,0]=2 386 B8R1.3 Nc1ccc(cc1)I 1P0034JH [0,1,0,0,0,0|1,0,0]=2 387 B8R1.3 Nc1ccc(cc1)N 1P001TMX [0,1,0,0,0,0|1,0,0]=2 388 B8R1.3 Nc1ccc(cc1)N 1P003336 [0,1,0,0,0,0|1,0,0]=2 389 B8R1.3 Nc1ccc(cc1)N 1P003E4B [0,1,0,0,0,0|1,0,0]=2 390 B8R1.3 Nc1ccc(cc1)N 1P01DHV3 [0,1,0,0,0,0|1,0,0]=2 391 B8R1.3 Nc1ccc(cc1)O 1P0034DF [0,1,0,0,0,0|1,0,0]=2 392 B8R1.3 Nc1ccc(cc1)O 1P00IBM3 [0,1,0,0,0,0|1,0,0]=2 393 B8R1.3 Nc1ccc(cc1)S 1P000PND [0,1,0,0,0,0|1,0,0]=2 394 B8R1.3 Nc1ccc(cn1)Br 1P0033K9 [0,1,0,0,0,0|2,0,0]=3 395 B8R1.3 Nc1ccc(cn1)C 1P003GY3 [0,1,0,0,0,0|2,0,0]=3 396 B8R1.3 Nc1ccc(cn1)Cl 1P0033KG [0,1,0,0,0,0|2,0,0]=3 397 B8R1.3 Nc1ccc(cn1)I 1P002ACG [0,1,0,0,0,0|2,0,0]=3 398 B8R1.3 Nc1ccc(cn1)N 1P003UJ0 [0,1,0,0,0,0|2,0,0]=3 399 B8R1.3 Nc1ccc(cn1)N 1P00BC5O [0,1,0,0,0,0|2,0,0]=3 400 B8R1.3 Nc1ccc(cn1)O 1P0034SD [0,1,0,0,0,0|2,0,0]=3 401 B8R1.3 Nc1ccc(cn1)O 1P0036WS [0,1,0,0,0,0|2,0,0]=3 402 B8R1.3 Nc1ccc(cn1)O 1P01KZDN [0,1,0,0,0,0|2,0,0]=3 403 B8R1.3 Nc1ccc(nn1)Br 1P0036R6 [0,1,0,0,0,0|3,0,0]=4 404 B8R1.3 Nc1ccc(nn1)Cl 1P003NNM [0,1,0,0,0,0|3,0,0]=4 405 B8R1.3 Nc1ccc(nn1)F 1P007CER [0,1,0,0,0,0|3,0,0]=4 406 B8R1.3 Nc1ccc(nn1)I 1P002H2L [0,1,0,0,0,0|3,0,0]=4 407 B8R1.3 Nc1ccc(nn1)N 1P00EGBP [0,1,0,0,0,0|3,0,0]=4 408 B8R1.3 Nc1ccc(nn1)O 1P01ADKG [0,1,0,0,0,0|3,0,0]=4 409 B8R1.3 Nc1cnc(nc1)Br 1P00ED1R [0,1,0,0,0,0|3,0,0]=4 410 B8R1.3 Nc1cnc(nc1)C 1P003MU8 [0,1,0,0,0,0|3,0,0]=4 411 B8R1.3 Nc1cnc(nc1)Cl 1P0034NG [0,1,0,0,0,0|3,0,0]=4 412 B8R1.3 Nc1cnc(nc1)F 1P00E9OS [0,1,0,0,0,0|3,0,0]=4 413 B8R1.3 Nc1cnc(nc1)I 1P01JPJ7 [0,1,0,0,0,0|3,0,0]=4 414 B8R1.3 Nc1ncc(cn1)N 1P007OGK [0,1,0,0,0,0|3,0,0]=4 415 B8R1.3 Nc1ncc(nc1)Br 1P003GXE [0,1,0,0,0,0|3,0,0]=4 416 B8R1.3 Nc1ncc(nc1)Cl 1P0033KF [0,1,0,0,0,0|3,0,0]=4 417 B8R1.3 Nc1ncc(nc1)F 1P0281L5 [0,1,0,0,0,0|3,0,0]=4 418 B8R1.3 Nc1ncc(nc1)I 1P0036QW [0,1,0,0,0,0|3,0,0]=4 419 B8R1.3 Nc1ncc(nc1)N 1P001REY [0,1,0,0,0,0|3,0,0]=4 420 B8R1.3 Nc1ncc(nc1)N 1P005I0L [0,1,0,0,0,0|3,0,0]=4 421 B8R1.3 O=C1C=CC(=O)C=C1 1P009L3D [0,1,0,0,0,0|2,0,0]=3 422 B8R1.3 Oc1ccc(=O)[nH]c1 1P00DEMJ [0,1,0,0,0,0|3,0,0]=4 423 B8R1.3 Oc1ccc(cc1)Br 1P0038P9 [0,1,0,0,0,0|2,0,0]=3 424 B8R1.3 Oc1ccc(cc1)Cl 1P000PNE [0,1,0,0,0,0|2,0,0]=3 425 B8R1.3 Oc1ccc(cc1)Cl 1P0034GW [0,1,0,0,0,0|2,0,0]=3 426 B8R1.3 Oc1ccc(cc1)F 1P0034I5 [0,1,0,0,0,0|2,0,0]=3 427 B8R1.3 Oc1ccc(cc1)I 1P00DZGL [0,1,0,0,0,0|2,0,0]=3 428 B8R1.3 Oc1ccc(cc1)O 1P003RFM [0,1,0,0,0,0|2,0,0]=3 429 B8R1.3 Oc1ccc(cc1)O 1P0084A5 [0,1,0,0,0,0|2,0,0]=3 430 B8R1.3 Oc1ccc(cc1)S 1P003M2L [0,1,0,0,0,0|2,0,0]=3 431 B8R1.3 Oc1ccc(cc1)[NH3+] 1P00ILXP [0,1,0,0,0,0|1,0,1]=3 432 B8R1.3 Oc1ccc(cn1)Br 1P0033T3 [0,1,0,0,0,0|3,0,0]=4 433 B8R1.3 Oc1ccc(cn1)C 1P0068BS [0,1,0,0,0,0|3,0,0]=4 434 B8R1.3 Oc1ccc(cn1)F 1P00I9MG [0,1,0,0,0,0|3,0,0]=4 435 B8R1.3 Oc1ccc(cn1)I 1P01FVCZ [0,1,0,0,0,0|3,0,0]=4 436 B8R1.3 Oc1ccc(cn1)N 1P0077NO [0,1,0,0,0,0|2,0,0]=3 437 B8R1.3 Oc1ccc(cn1)N 1P00I734 [0,1,0,0,0,0|2,0,0]=3 438 B8R1.3 Oc1cnc(nc1)N 1P007ZBH [0,1,0,0,0,0|3,0,0]=4 439 B8R1.3 Sc1ccc(cc1)Br 1P0034FI [0,1,0,0,0,0|2,0,0]=3 440 B8R1.3 Sc1ccc(cc1)Cl 1P0034H5 [0,1,0,0,0,0|2,0,0]=3 441 B8R1.3 Sc1ccc(cc1)I 1P00DME4 [0,1,0,0,0,0|2,0,0]=3 442 B8R1.3 Sc1ccc(cc1)S 1P003E30 [0,1,0,0,0,0|2,0,0]=3 443 B8R1.3 Sc1ccc(cn1)Br 1P00EGLR [0,1,0,0,0,0|3,0,0]=4 444 B8R1.3 Sc1ccc(cn1)C 1P007TI4 [0,1,0,0,0,0|3,0,0]=4 445 B8R1.3 Sc1ccc(cn1)F 1P01X1P9 [0,1,0,0,0,0|3,0,0]=4 446 B8R1.3 [O-][n+]1cc[n+](cc1)[O-] 1P007OFF [0,1,0,0,0,0|2,0,1]=4 447 B8R1.3 [O-][n+]1ccc(cc1)Br 1P0038KR [0,1,0,0,0,0|1,0,1]=3 448 B8R1.3 [O-][n+]1ccc(cc1)C 1P0001YW [0,1,0,0,0,0|1,0,1]=3 449 B8R1.3 [O-][n+]1ccc(cc1)Cl 1P003LP0 [0,1,0,0,0,0|1,0,1]=3 450 B8R1.3 [O-][n+]1ccc(cc1)F 1P000N1Q [0,1,0,0,0,0|1,0,1]=3 451 B8R1.3 [O-][n+]1ccc(cc1)N 1P01BIVP [0,1,0,0,0,0|0,0,1]=2 452 B8R1.3 [O-][n+]1ccc(cc1)O 1P006GBX [0,1,0,0,0,0|1,0,1]=3 453 B8R1.3 [S-]c1ccc(cc1)C 1P003M7Y [0,1,0,0,0,0|2,0,0]=3 454 B8R1.4 Brc1cc[nH]c(=O)n1 1P00DL8O [0,1,0,0,0,0|2,0,1]=4 455 B8R1.4 Brc1cccc(c1)Br 1P0038GG [0,1,0,0,0,0|2,0,0]=3 456 B8R1.4 Brc1cccc(c1)I 1P00336D [0,1,0,0,0,0|2,0,0]=3 457 B8R1.4 Brc1cccc(n1)Br 1P0033HP [0,1,0,0,0,0|3,0,0]=4 458 B8R1.4 Brc1cccc(n1)I 1P002NMA [0,1,0,0,0,0|3,0,0]=4 459 B8R1.4 Brc1ccnc(c1)Br 1P00IAV6 [0,1,0,0,0,0|1,0,0]=2 460 B8R1.4 Brc1ccnc(c1)C 1P003LDY [0,1,0,0,0,0|1,0,0]=2 461 B8R1.4 Brc1ccnc(c1)C 1P00J1W2 [0,1,0,0,0,0|1,0,0]=2 462 B8R1.4 Brc1ccnc(c1)Cl 1P0034DY [0,1,0,0,0,0|1,0,0]=2 463 B8R1.4 Brc1ccnc(c1)F 1P000Y6T [0,1,0,0,0,0|1,0,0]=2 464 B8R1.4 Brc1ccnc(c1)I 1P0002PZ [0,1,0,0,0,0|1,0,0]=2 465 B8R1.4 Brc1ccnc(c1)N 1P0033JW [0,1,0,0,0,0|1,0,0]=2 466 B8R1.4 Brc1ccnc(c1)O 1P0034E6 [0,1,0,0,0,0|1,0,0]=2 467 B8R1.4 Brc1ccnc(n1)Br 1P00BYDM [0,1,0,0,0,0|2,0,0]=3 468 B8R1.4 Brc1ccnc(n1)C 1P007TD4 [0,1,0,0,0,0|2,0,0]=3 469 B8R1.4 Brc1ccnc(n1)Cl 1P0038U8 [0,1,0,0,0,0|2,0,0]=3 470 B8R1.4 Brc1ccnc(n1)F 1P009MBT [0,1,0,0,0,0|2,0,0]=3 471 B8R1.4 Brc1ccnc(n1)N 1P00C7KA [0,1,0,0,0,0|2,0,0]=3 472 B8R1.4 Brc1ccoc(=O)c1 1P003HU4 [0,1,0,0,0,0|2,0,0]=3 473 B8R1.4 Brc1cncc(c1)Br 1P0033ZU [0,1,0,0,0,0|3,0,0]=4 474 B8R1.4 Brc1cncc(c1)I 1P002NGQ [0,1,0,0,0,0|3,0,0]=4 475 B8R1.4 Brc1cnnc(c1)Br 1P000PSJ [0,1,0,0,0,0|2,0,0]=3 476 B8R1.4 Brc1cnnc(c1)C 1P028F5O [0,1,0,0,0,0|2,0,0]=3 477 B8R1.4 Brc1cnnc(c1)Cl 1P000PSK [0,1,0,0,0,0|2,0,0]=3 478 B8R1.4 Brc1cnnc(c1)N 1P008ZIS [0,1,0,0,0,0|2,0,0]=3 479 B8R1.4 Brc1ncnc(c1)Br 1P0034C0 [0,1,0,0,0,0|2,0,0]=3 480 B8R1.4 CC1=CN=NC(=O)C1 1P0096LQ [0,1,0,0,0,0|2,0,1]=4 481 B8R1.4 C[n+]1cccc(c1)Br 1P00C80C [0,1,0,0,0,0|3,0,0]=4 482 B8R1.4 C[n+]1cccc(c1)Cl 1P01EWVP [0,1,0,0,0,0|3,0,0]=4 483 B8R1.4 C[n+]1cccc(c1)I 1P01FCKC [0,1,0,0,0,0|3,0,0]=4 484 B8R1.4 C[n+]1cccc(c1)N 1P01EXSA [0,1,0,0,0,0|2,0,0]=3 485 B8R1.4 C[n+]1ccnc(c1)Cl 1P01EW2I [0,1,0,0,0,0|2,0,0]=3 486 B8R1.4 Cc1cc(=O)[nH]nc1 1P003NC4 [0,1,0,0,0,0|2,0,1]=4 487 B8R1.4 Cc1cc[nH]c(=S)n1 1P003HYQ [0,1,0,0,0,0|2,0,1]=4 488 B8R1.4 Cc1cccc(=O)[nH]1 1P00I6PQ [0,1,0,0,0,0|3,0,0]=4 489 B8R1.4 Cc1cccc(=O)[nH]1 1P01A5YK [0,1,0,0,0,0|3,0,0]=4 490 B8R1.4 Cc1cccc(c1)Br 1P003JM4 [0,1,0,0,0,0|2,0,0]=3 491 B8R1.4 Cc1cccc(c1)C 1P0035QQ [0,1,0,0,0,0|2,0,0]=3 492 B8R1.4 Cc1cccc(c1)Cl 1P00345C [0,1,0,0,0,0|2,0,0]=3 493 B8R1.4 Cc1cccc(c1)F 1P00I7FR [0,1,0,0,0,0|2,0,0]=3 494 B8R1.4 Cc1cccc(c1)I 1P003K2K [0,1,0,0,0,0|2,0,0]=3 495 B8R1.4 Cc1cccc(c1)N 1P00348Z [0,1,0,0,0,0|1,0,0]=2 496 B8R1.4 Cc1cccc(c1)N 1P003SN3 [0,1,0,0,0,0|1,0,0]=2 497 B8R1.4 Cc1cccc(c1)O 1P003RX9 [0,1,0,0,0,0|2,0,0]=3 498 B8R1.4 Cc1cccc(c1)S 1P003K79 [0,1,0,0,0,0|2,0,0]=3 499 B8R1.4 Cc1cccc(n1)Br 1P003H7Q [0,1,0,0,0,0|3,0,0]=4 500 B8R1.4 Cc1cccc(n1)C 1P0033IS [0,1,0,0,0,0|3,0,0]=4 501 B8R1.4 Cc1cccc(n1)Cl 1P003HHO [0,1,0,0,0,0|3,0,0]=4 502 B8R1.4 Cc1cccc(n1)F 1P003HRV [0,1,0,0,0,0|3,0,0]=4 503 B8R1.4 Cc1cccc(n1)I 1P00EAYX [0,1,0,0,0,0|3,0,0]=4 504 B8R1.4 Cc1cccc(n1)N 1P0024B7 [0,1,0,0,0,0|2,0,0]=3 505 B8R1.4 Cc1cccc(n1)S 1P003HYW [0,1,0,0,0,0|3,0,0]=4 506 B8R1.4 Cc1ccnc(=O)[nH]1 1P0033T2 [0,1,0,0,0,0|2,0,0]=3 507 B8R1.4 Cc1ccnc(c1)Br 1P003H5D [0,1,0,0,0,0|1,0,0]=2 508 B8R1.4 Cc1ccnc(c1)C 1P0039FY [0,1,0,0,0,0|1,0,0]=2 509 B8R1.4 Cc1ccnc(c1)Cl 1P003HEL [0,1,0,0,0,0|1,0,0]=2 510 B8R1.4 Cc1ccnc(c1)F 1P003HQB [0,1,0,0,0,0|1,0,0]=2 511 B8R1.4 Cc1ccnc(c1)I 1P00BG0M [0,1,0,0,0,0|1,0,0]=2 512 B8R1.4 Cc1ccnc(c1)N 1P003GW8 [0,1,0,0,0,0|1,0,0]=2 513 B8R1.4 Cc1ccnc(c1)O 1P003HVA [0,1,0,0,0,0|1,0,0]=2 514 B8R1.4 Cc1ccnc(c1)S 1P0076M3 [0,1,0,0,0,0|1,0,0]=2 515 B8R1.4 Cc1ccnc(n1)Br 1P000V75 [0,1,0,0,0,0|2,0,0]=3 516 B8R1.4 Cc1ccnc(n1)C 1P009I3B [0,1,0,0,0,0|2,0,0]=3 517 B8R1.4 Cc1ccnc(n1)Cl 1P000URR [0,1,0,0,0,0|2,0,0]=3 518 B8R1.4 Cc1ccnc(n1)I 1P000P6W [0,1,0,0,0,0|2,0,0]=3 519 B8R1.4 Cc1ccnc(n1)N 1P003GW9 [0,1,0,0,0,0|2,0,0]=3 520 B8R1.4 Cc1ccnc(n1)O 1P006UK2 [0,1,0,0,0,0|2,0,0]=3 521 B8R1.4 Cc1ccnc(n1)S 1P00CI6Y [0,1,0,0,0,0|2,0,0]=3 522 B8R1.4 Cc1cncc(c1)Br 1P00I78L [0,1,0,0,0,0|3,0,0]=4 523 B8R1.4 Cc1cncc(c1)C 1P00IAZ1 [0,1,0,0,0,0|3,0,0]=4 524 B8R1.4 Cc1cncc(c1)Cl 1P002GA6 [0,1,0,0,0,0|3,0,0]=4 525 B8R1.4 Cc1cncc(c1)F 1P003JXJ [0,1,0,0,0,0|3,0,0]=4 526 B8R1.4 Cc1cncc(c1)I 1P00AKYW [0,1,0,0,0,0|3,0,0]=4 527 B8R1.4 Cc1cncc(c1)N 1P00BYXN [0,1,0,0,0,0|2,0,0]=3 528 B8R1.4 Cc1cncc(c1)N 1P00H8HS [0,1,0,0,0,0|2,0,0]=3 529 B8R1.4 Cc1cncc(c1)O 1P00346N [0,1,0,0,0,0|3,0,0]=4 530 B8R1.4 Cc1cncc(n1)N 1P003GZE [0,1,0,0,0,0|3,0,0]=4 531 B8R1.4 Cc1cnnc(c1)Cl 1P00414T [0,1,0,0,0,0|2,0,0]=3 532 B8R1.4 Cc1cnnc(c1)I 1P01DZB7 [0,1,0,0,0,0|2,0,0]=3 533 B8R1.4 Cc1cnnc(c1)N 1P001JQC [0,1,0,0,0,0|2,0,0]=3 534 B8R1.4 Cc1cnnc(n1)N 1P00F45K [0,1,0,0,0,0|3,0,0]=4 535 B8R1.4 Cc1nc[nH]c(=O)c1 1P00BXVE [0,1,0,0,0,0|2,0,0]=3 536 B8R1.4 Cc1nc[nH]c(=O)c1 1P027YSW [0,1,0,0,0,0|2,0,0]=3 537 B8R1.4 Cc1nc[nH]c(=S)c1 1P00DYAU [0,1,0,0,0,0|2,0,0]=3 538 B8R1.4 Cc1nccc(=N)[nH]1 1P00GATC [0,1,0,0,0,0|1,0,1]=3 539 B8R1.4 Cc1nccc(=O)[nH]1 1P002C6Y [0,1,0,0,0,0|2,0,0]=3 540 B8R1.4 Cc1ncnc(c1)Br 1P00375E [0,1,0,0,0,0|2,0,0]=3 541 B8R1.4 Cc1ncnc(c1)C 1P001OOH [0,1,0,0,0,0|2,0,0]=3 542 B8R1.4 Cc1ncnc(c1)Cl 1P0034KF [0,1,0,0,0,0|2,0,0]=3 543 B8R1.4 Cc1ncnc(c1)I 1P01ALSV [0,1,0,0,0,0|2,0,0]=3 544 B8R1.4 Cc1ncnc(c1)N 1P00I78P [0,1,0,0,0,0|1,0,0]=2 545 B8R1.4 Cc1ncnc(c1)O 1P001PCL [0,1,0,0,0,0|2,0,0]=3 546 B8R1.4 Cc1ncnc(n1)Cl 1P00DJSL [0,1,0,0,0,0|3,0,0]=4 547 B8R1.4 Cc1ncnc(n1)N 1P00CEV9 [0,1,0,0,0,0|2,0,0]=3 548 B8R1.4 Clc1cc(=O)[nH]nc1 1P003N5G [0,1,0,0,0,0|2,0,1]=4 549 B8R1.4 Clc1cc[nH]c(=O)n1 1P00G8FV [0,1,0,0,0,0|2,0,1]=4 550 B8R1.4 Clc1cccc(=O)[nH]1 1P001YRQ [0,1,0,0,0,0|3,0,0]=4 551 B8R1.4 Clc1cccc(c1)Br 1P00343G [0,1,0,0,0,0|2,0,0]=3 552 B8R1.4 Clc1cccc(c1)Cl 1P00332A [0,1,0,0,0,0|2,0,0]=3 553 B8R1.4 Clc1cccc(c1)I 1P0032P0 [0,1,0,0,0,0|2,0,0]=3 554 B8R1.4 Clc1cccc(n1)Br 1P00D8GQ [0,1,0,0,0,0|3,0,0]=4 555 B8R1.4 Clc1cccc(n1)Cl 1P0033I1 [0,1,0,0,0,0|3,0,0]=4 556 B8R1.4 Clc1cccc(n1)I 1P0037YD [0,1,0,0,0,0|3,0,0]=4 557 B8R1.4 Clc1ccnc(c1)Br 1P002LYR [0,1,0,0,0,0|1,0,0]=2 558 B8R1.4 Clc1ccnc(c1)C 1P003LKU [0,1,0,0,0,0|1,0,0]=2 559 B8R1.4 Clc1ccnc(c1)Cl 1P002TQX [0,1,0,0,0,0|1,0,0]=2 560 B8R1.4 Clc1ccnc(c1)F 1P00BZZP [0,1,0,0,0,0|1,0,0]=2 561 B8R1.4 Clc1ccnc(c1)I 1P002LYQ [0,1,0,0,0,0|1,0,0]=2 562 B8R1.4 Clc1ccnc(c1)N 1P002BO7 [0,1,0,0,0,0|1,0,0]=2 563 B8R1.4 Clc1ccnc(c1)O 1P00397T [0,1,0,0,0,0|1,0,0]=2 564 B8R1.4 Clc1ccnc(n1)Br 1P0036RF [0,1,0,0,0,0|2,0,0]=3 565 B8R1.4 Clc1ccnc(n1)C 1P00D9MU [0,1,0,0,0,0|2,0,0]=3 566 B8R1.4 Clc1ccnc(n1)Cl 1P0033FY [0,1,0,0,0,0|2,0,0]=3 567 B8R1.4 Clc1ccnc(n1)F 1P00E2DY [0,1,0,0,0,0|2,0,0]=3 568 B8R1.4 Clc1ccnc(n1)I 1P01FHUV [0,1,0,0,0,0|2,0,0]=3 569 B8R1.4 Clc1ccnc(n1)N 1P00I8AQ [0,1,0,0,0,0|2,0,0]=3 570 B8R1.4 Clc1ccoc(=O)c1 1P01ALG0 [0,1,0,0,0,0|2,0,0]=3 571 B8R1.4 Clc1cncc(c1)Br 1P003433 [0,1,0,0,0,0|3,0,0]=4 572 B8R1.4 Clc1cncc(c1)Cl 1P002P2J [0,1,0,0,0,0|3,0,0]=4 573 B8R1.4 Clc1cncc(c1)I 1P003JQ7 [0,1,0,0,0,0|3,0,0]=4 574 B8R1.4 Clc1cnnc(c1)Br 1P01UQHM [0,1,0,0,0,0|2,0,0]=3 575 B8R1.4 Clc1cnnc(c1)C 1P01PAXQ [0,1,0,0,0,0|2,0,0]=3 576 B8R1.4 Clc1cnnc(c1)Cl 1P0033ZZ [0,1,0,0,0,0|2,0,0]=3 577 B8R1.4 Clc1cnnc(c1)N 1P000WT2 [0,1,0,0,0,0|2,0,0]=3 578 B8R1.4 Clc1nccc(=O)[nH]1 1P003A7W [0,1,0,0,0,0|2,0,0]=3 579 B8R1.4 Clc1ncnc(c1)Cl 1P000IZZ [0,1,0,0,0,0|2,0,0]=3 580 B8R1.4 Clc1ncnc(c1)I 1P00C1IX [0,1,0,0,0,0|2,0,0]=3 581 B8R1.4 Clc1ncnc(n1)Cl 1P0033FK [0,1,0,0,0,0|3,0,0]=4 582 B8R1.4 Fc1cc(=O)[nH]nc1 1P01B7XD [0,1,0,0,0,0|2,0,1]=4 583 B8R1.4 Fc1cc[nH]c(=O)c1 1P005UC3 [0,1,0,0,0,0|1,0,1]=3 584 B8R1.4 Fc1cccc(c1)Br 1P00336C [0,1,0,0,0,0|2,0,0]=3 585 B8R1.4 Fc1cccc(c1)Cl 1P00IKX6 [0,1,0,0,0,0|2,0,0]=3 586 B8R1.4 Fc1cccc(c1)F 1P00I7T0 [0,1,0,0,0,0|2,0,0]=3 587 B8R1.4 Fc1cccc(c1)I 1P003384 [0,1,0,0,0,0|2,0,0]=3 588 B8R1.4 Fc1cccc(c1)S 1P003467 [0,1,0,0,0,0|2,0,0]=3 589 B8R1.4 Fc1cccc(n1)Br 1P001JEO [0,1,0,0,0,0|3,0,0]=4 590 B8R1.4 Fc1cccc(n1)Cl 1P002KDX [0,1,0,0,0,0|3,0,0]=4 591 B8R1.4 Fc1cccc(n1)F 1P001NQB [0,1,0,0,0,0|3,0,0]=4 592 B8R1.4 Fc1ccnc(c1)Br 1P0033M2 [0,1,0,0,0,0|1,0,0]=2 593 B8R1.4 Fc1ccnc(c1)C 1P0038X5 [0,1,0,0,0,0|1,0,0]=2 594 B8R1.4 Fc1ccnc(c1)Cl 1P003HDV [0,1,0,0,0,0|1,0,0]=2 595 B8R1.4 Fc1ccnc(c1)F 1P00BXW3 [0,1,0,0,0,0|1,0,0]=2 596 B8R1.4 Fc1ccnc(c1)I 1P01XDP3 [0,1,0,0,0,0|1,0,0]=2 597 B8R1.4 Fc1ccnc(c1)N 1P003GVZ [0,1,0,0,0,0|1,0,0]=2 598 B8R1.4 Fc1ccnc(c1)N 1P01B5I0 [0,1,0,0,0,0|1,0,0]=2 599 B8R1.4 Fc1ccnc(n1)Br 1P0097AB [0,1,0,0,0,0|2,0,0]=3 600 B8R1.4 Fc1ccnc(n1)Cl 1P00CJAP [0,1,0,0,0,0|2,0,0]=3 601 B8R1.4 Fc1ccnc(n1)F 1P00BDNZ [0,1,0,0,0,0|2,0,0]=3 602 B8R1.4 Fc1ccnc(n1)N 1P00IKAG [0,1,0,0,0,0|2,0,0]=3 603 B8R1.4 Fc1cncc(c1)Br 1P0032QZ [0,1,0,0,0,0|3,0,0]=4 604 B8R1.4 Fc1cncc(c1)Cl 1P006W8W [0,1,0,0,0,0|3,0,0]=4 605 B8R1.4 Fc1cncc(c1)F 1P003J3V [0,1,0,0,0,0|3,0,0]=4 606 B8R1.4 Fc1cncc(c1)I 1P00374U [0,1,0,0,0,0|3,0,0]=4 607 B8R1.4 Fc1cnnc(c1)Cl 1P028QZF [0,1,0,0,0,0|2,0,0]=3 608 B8R1.4 Fc1cnnc(c1)F 1P028518 [0,1,0,0,0,0|2,0,0]=3 609 B8R1.4 Fc1ncnc(c1)Br 1P023PKL [0,1,0,0,0,0|2,0,0]=3 610 B8R1.4 Fc1ncnc(c1)Cl 1P00DGM1 [0,1,0,0,0,0|2,0,0]=3 611 B8R1.4 Fc1ncnc(c1)F 1P00C1LC [0,1,0,0,0,0|2,0,0]=3 612 B8R1.4 Ic1cc(=O)[nH]nc1 1P0038VR [0,1,0,0,0,0|2,0,1]=4 613 B8R1.4 Ic1cc[nH]c(=O)c1 1P004XC8 [0,1,0,0,0,0|1,0,1]=3 614 B8R1.4 Ic1cccc(c1)I 1P00332E [0,1,0,0,0,0|2,0,0]=3 615 B8R1.4 Ic1cccc(n1)I 1P00DA07 [0,1,0,0,0,0|3,0,0]=4 616 B8R1.4 Ic1ccnc(c1)Br 1P0002PW [0,1,0,0,0,0|1,0,0]=2 617 B8R1.4 Ic1ccnc(c1)C 1P007PF1 [0,1,0,0,0,0|1,0,0]=2 618 B8R1.4 Ic1ccnc(c1)Cl 1P0033ON [0,1,0,0,0,0|1,0,0]=2 619 B8R1.4 Ic1ccnc(c1)F 1P0033RQ [0,1,0,0,0,0|1,0,0]=2 620 B8R1.4 Ic1ccnc(c1)I 1P0056X9 [0,1,0,0,0,0|1,0,0]=2 621 B8R1.4 Ic1ccnc(c1)N 1P00DGDV [0,1,0,0,0,0|1,0,0]=2 622 B8R1.4 Ic1ccnc(n1)Br 1P00HAJK [0,1,0,0,0,0|2,0,0]=3 623 B8R1.4 Ic1ccnc(n1)C 1P00IDV7 [0,1,0,0,0,0|2,0,0]=3 624 B8R1.4 Ic1ccnc(n1)Cl 1P00I88J [0,1,0,0,0,0|2,0,0]=3 625 B8R1.4 Ic1ccnc(n1)F 1P01DZGE [0,1,0,0,0,0|2,0,0]=3 626 B8R1.4 Ic1ccnc(n1)I 1P002SUH [0,1,0,0,0,0|2,0,0]=3 627 B8R1.4 Ic1ccnc(n1)N 1P005234 [0,1,0,0,0,0|2,0,0]=3 628 B8R1.4 Ic1cncc(c1)I 1P00DGOK [0,1,0,0,0,0|3,0,0]=4 629 B8R1.4 Ic1cnnc(c1)I 1P01RZ34 [0,1,0,0,0,0|2,0,0]=3 630 B8R1.4 Ic1ncnc(c1)I 1P00AQN3 [0,1,0,0,0,0|2,0,0]=3 631 B8R1.4 N=c1cc[nH]c(=N)[nH]1 1P00HYTN [0,1,0,0,0,0|1,0,2]=4 632 B8R1.4 NC1=CC(=O)CCC1 1P003JB4 [0,1,0,0,0,0|1,0,2]=4 633 B8R1.4 Nc1cc(=O)[nH]nc1 1P00436N [0,1,0,0,0,0|1,0,1]=3 634 B8R1.4 Nc1cc[nH]c(=O)c1 1P00I85D [0,1,0,0,0,0|0,0,1]=2 635 B8R1.4 Nc1cccc(=O)[nH]1 1P003GZ7 [0,1,0,0,0,0|2,0,0]=3 636 B8R1.4 Nc1cccc(c1)Br 1P0037HY [0,1,0,0,0,0|1,0,0]=2 637 B8R1.4 Nc1cccc(c1)Cl 1P00344V [0,1,0,0,0,0|1,0,0]=2 638 B8R1.4 Nc1cccc(c1)Cl 1P003JQY [0,1,0,0,0,0|1,0,0]=2 639 B8R1.4 Nc1cccc(c1)F 1P0037S5 [0,1,0,0,0,0|1,0,0]=2 640 B8R1.4 Nc1cccc(c1)I 1P003474 [0,1,0,0,0,0|1,0,0]=2 641 B8R1.4 Nc1cccc(c1)N 1P003DZB [0,1,0,0,0,0|1,0,0]=2 642 B8R1.4 Nc1cccc(c1)N 1P003SN0 [0,1,0,0,0,0|1,0,0]=2 643 B8R1.4 Nc1cccc(c1)N 1P00IN03 [0,1,0,0,0,0|1,0,0]=2 644 B8R1.4 Nc1cccc(c1)O 1P003JEJ [0,1,0,0,0,0|1,0,0]=2 645 B8R1.4 Nc1cccc(c1)O 1P003JEK [0,1,0,0,0,0|1,0,0]=2 646 B8R1.4 Nc1cccc(c1)O 1P00IC9M [0,1,0,0,0,0|1,0,0]=2 647 B8R1.4 Nc1cccc(c1)S 1P002M3F [0,1,0,0,0,0|1,0,0]=2 648 B8R1.4 Nc1cccc(n1)Br 1P002BO6 [0,1,0,0,0,0|2,0,0]=3 649 B8R1.4 Nc1cccc(n1)Cl 1P003GYY [0,1,0,0,0,0|2,0,0]=3 650 B8R1.4 Nc1cccc(n1)F 1P001RT3 [0,1,0,0,0,0|2,0,0]=3 651 B8R1.4 Nc1cccc(n1)I 1P0049TH [0,1,0,0,0,0|2,0,0]=3 652 B8R1.4 Nc1cccc(n1)I 1P0290TM [0,1,0,0,0,0|2,0,0]=3 653 B8R1.4 Nc1cccc(n1)N 1P001G6V [0,1,0,0,0,0|2,0,0]=3 654 B8R1.4 Nc1cccc(n1)N 1P007YE7 [0,1,0,0,0,0|2,0,0]=3 655 B8R1.4 Nc1cccc(n1)O 1P009907 [0,1,0,0,0,0|2,0,0]=3 656 B8R1.4 Nc1cccc(n1)O 1P00EJ34 [0,1,0,0,0,0|2,0,0]=3 657 B8R1.4 Nc1ccnc(=O)[nH]1 1P003551 [0,1,0,0,0,0|1,0,0]=2 658 B8R1.4 Nc1ccnc(c1)Br 1P008PDO [0,1,0,0,0,0|0,0,0]=1 659 B8R1.4 Nc1ccnc(c1)C 1P003L5H [0,1,0,0,0,0|0,0,0]=1 660 B8R1.4 Nc1ccnc(c1)Cl 1P001JSL [0,1,0,0,0,0|0,0,0]=1 661 B8R1.4 Nc1ccnc(c1)F 1P0076RG [0,1,0,0,0,0|0,0,0]=1 662 B8R1.4 Nc1ccnc(c1)I 1P0049B4 [0,1,0,0,0,0|0,0,0]=1 663 B8R1.4 Nc1ccnc(c1)N 1P003UIZ [0,1,0,0,0,0|0,0,0]=1 664 B8R1.4 Nc1ccnc(c1)O 1P00EJV9 [0,1,0,0,0,0|0,0,0]=1 665 B8R1.4 Nc1ccnc(n1)Br 1P000C3K [0,1,0,0,0,0|1,0,0]=2 666 B8R1.4 Nc1ccnc(n1)C 1P005AMT [0,1,0,0,0,0|1,0,0]=2 667 B8R1.4 Nc1ccnc(n1)Cl 1P0034CS [0,1,0,0,0,0|1,0,0]=2 668 B8R1.4 Nc1ccnc(n1)F 1P006R5D [0,1,0,0,0,0|1,0,0]=2 669 B8R1.4 Nc1ccnc(n1)S 1P00BYPV [0,1,0,0,0,0|1,0,0]=2 670 B8R1.4 Nc1cn[nH]c(=O)n1 1P00H052 [0,1,0,0,0,0|2,0,1]=4 671 B8R1.4 Nc1cncc(c1)Br 1P003MYS [0,1,0,0,0,0|2,0,0]=3 672 B8R1.4 Nc1cncc(c1)Cl 1P00BDAV [0,1,0,0,0,0|2,0,0]=3 673 B8R1.4 Nc1cncc(c1)F 1P002L2C [0,1,0,0,0,0|2,0,0]=3 674 B8R1.4 Nc1cncc(c1)I 1P003NA0 [0,1,0,0,0,0|2,0,0]=3 675 B8R1.4 Nc1cncc(c1)N 1P00396A [0,1,0,0,0,0|2,0,0]=3 676 B8R1.4 Nc1cncc(c1)N 1P01EKHM [0,1,0,0,0,0|2,0,0]=3 677 B8R1.4 Nc1cncc(c1)N 1P02836T [0,1,0,0,0,0|2,0,0]=3 678 B8R1.4 Nc1cncc(c1)O 1P00I7HX [0,1,0,0,0,0|2,0,0]=3 679 B8R1.4 Nc1cncc(n1)Br 1P0037JP [0,1,0,0,0,0|3,0,0]=4 680 B8R1.4 Nc1cncc(n1)Cl 1P0033PC [0,1,0,0,0,0|3,0,0]=4 681 B8R1.4 Nc1cncc(n1)F 1P019DIS [0,1,0,0,0,0|3,0,0]=4 682 B8R1.4 Nc1cncc(n1)N 1P00137A [0,1,0,0,0,0|3,0,0]=4 683 B8R1.4 Nc1cncc(n1)N 1P0033HL [0,1,0,0,0,0|3,0,0]=4 684 B8R1.4 Nc1cncc(n1)O 1P009QDG [0,1,0,0,0,0|3,0,0]=4 685 B8R1.4 Nc1cnnc(c1)Br 1P019GEG [0,1,0,0,0,0|1,0,0]=2 686 B8R1.4 Nc1cnnc(c1)C 1P01C6ZT [0,1,0,0,0,0|1,0,0]=2 687 B8R1.4 Nc1cnnc(c1)Cl 1P002VSC [0,1,0,0,0,0|1,0,0]=2 688 B8R1.4 Nc1cnnc(c1)F 1P028YQV [0,1,0,0,0,0|1,0,0]=2 689 B8R1.4 Nc1cnnc(c1)I 1P028VLK [0,1,0,0,0,0|1,0,0]=2 690 B8R1.4 Nc1cnnc(c1)N 1P028087 [0,1,0,0,0,0|1,0,0]=2 691 B8R1.4 Nc1cnnc(n1)C 1P009T5V [0,1,0,0,0,0|2,0,0]=3 692 B8R1.4 Nc1nc(=O)cc[nH]1 1P003RKF [0,1,0,0,0,0|2,0,1]=4 693 B8R1.4 Nc1nc[nH]c(=N)c1 1P00G2XU [0,1,0,0,0,0|1,0,1]=3 694 B8R1.4 Nc1nc[nH]c(=O)c1 1P000IZY [0,1,0,0,0,0|1,0,1]=3 695 B8R1.4 Nc1ncnc(=O)[nH]1 1P00IHY0 [0,1,0,0,0,0|2,0,0]=3 696 B8R1.4 Nc1ncnc(c1)Br 1P000HR2 [0,1,0,0,0,0|1,0,0]=2 697 B8R1.4 Nc1ncnc(c1)Cl 1P0034D5 [0,1,0,0,0,0|1,0,0]=2 698 B8R1.4 Nc1ncnc(c1)F 1P00E2DW [0,1,0,0,0,0|1,0,0]=2 699 B8R1.4 Nc1ncnc(c1)I 1P00DJJO [0,1,0,0,0,0|1,0,0]=2 700 B8R1.4 Nc1ncnc(c1)N 1P003KZL [0,1,0,0,0,0|1,0,0]=2 701 B8R1.4 Nc1ncnc(n1)Cl 1P00G5FZ [0,1,0,0,0,0|2,0,0]=3 702 B8R1.4 Nc1ncnc(n1)N 1P00I9IL [0,1,0,0,0,0|2,0,0]=3 703 B8R1.4 Nc1ncnc(n1)S 1P00CMEH [0,1,0,0,0,0|2,0,0]=3 704 B8R1.4 O=C1CC=CC(=O)O1 1P0037LX [0,1,0,0,0,0|3,0,0]=4 705 B8R1.4 O=C1CC=NC(=C1)Cl 1P00AOZG [0,1,0,0,0,0|1,0,1]=3 706 B8R1.4 O=C1NC=CC(=O)C1 1P01KKXV [0,1,0,0,0,0|1,0,2]=4 707 B8R1.4 O=C1OC=CC(=O)C1 1P0038JQ [0,1,0,0,0,0|2,0,1]=4 708 B8R1.4 O=c1cc[15nH][13c](=O)[15nH]1 1P0023EO [0,1,0,0,0,0|2,0,1]=4 709 B8R1.4 O=c1cc[nH]c(=O)[nH]1 1P00368Z [0,1,0,0,0,0|2,0,1]=4 710 B8R1.4 O=c1cc[nH]c(=S)[nH]1 1P001G6U [0,1,0,0,0,0|2,0,1]=4 711 B8R1.4 O=c1cc[nH]c(=[Se])[nH]1 1P00B386 [0,1,0,0,0,0|2,0,1]=4 712 B8R1.4 O=c1cc[nH]c(c1)Br 1P00DRAQ [0,1,0,0,0,0|1,0,1]=3 713 B8R1.4 O=c1ccoc(c1)C 1P00F0CB [0,1,0,0,0,0|2,0,0]=3 714 B8R1.4 O=c1nc[nH]c(=O)[nH]1 1P003750 [0,1,0,0,0,0|3,0,0]=4 715 B8R1.4 O=c1nc[nH]c(c1)Br 1P0038G2 [0,1,0,0,0,0|2,0,0]=3 716 B8R1.4 O=c1nc[nH]c(c1)Cl 1P0038AD [0,1,0,0,0,0|2,0,0]=3 717 B8R1.4 O=c1nc[nH]c(c1)S 1P00IBM4 [0,1,0,0,0,0|2,0,0]=3 718 B8R1.4 Oc1cc[nH]c(=O)c1 1P00IM7P [0,1,0,0,0,0|1,0,1]=3 719 B8R1.4 Oc1cccc(=O)[nH]1 1P0038Q5 [0,1,0,0,0,0|3,0,0]=4 720 B8R1.4 Oc1cccc(c1)Br 1P00343M [0,1,0,0,0,0|2,0,0]=3 721 B8R1.4 Oc1cccc(c1)Cl 1P0038GE [0,1,0,0,0,0|2,0,0]=3 722 B8R1.4 Oc1cccc(c1)F 1P00346A [0,1,0,0,0,0|2,0,0]=3 723 B8R1.4 Oc1cccc(c1)I 1P003K2F [0,1,0,0,0,0|2,0,0]=3 724 B8R1.4 Oc1cccc(c1)O 1P00332D [0,1,0,0,0,0|2,0,0]=3 725 B8R1.4 Oc1cccc(c1)S 1P00346Z [0,1,0,0,0,0|2,0,0]=3 726 B8R1.4 Oc1cccc(n1)Br 1P003H7L [0,1,0,0,0,0|3,0,0]=4 727 B8R1.4 Oc1cccc(n1)Cl 1P005NIM [0,1,0,0,0,0|3,0,0]=4 728 B8R1.4 Oc1cccc(n1)F 1P006YCB [0,1,0,0,0,0|3,0,0]=4 729 B8R1.4 Oc1cccc(n1)I 1P01DED2 [0,1,0,0,0,0|3,0,0]=4 730 B8R1.4 Oc1cccc(n1)O 1P003GLI [0,1,0,0,0,0|3,0,0]=4 731 B8R1.4 Oc1ccnc(c1)Br 1P0037ZM [0,1,0,0,0,0|1,0,0]=2 732 B8R1.4 Oc1ccnc(c1)C 1P0034IL [0,1,0,0,0,0|1,0,0]=2 733 B8R1.4 Oc1ccnc(c1)Cl 1P001ZK8 [0,1,0,0,0,0|1,0,0]=2 734 B8R1.4 Oc1ccnc(c1)F 1P007PF0 [0,1,0,0,0,0|1,0,0]=2 735 B8R1.4 Oc1ccnc(c1)N 1P003GW0 [0,1,0,0,0,0|1,0,0]=2 736 B8R1.4 Oc1ccnc(c1)N 1P003GW1 [0,1,0,0,0,0|1,0,0]=2 737 B8R1.4 Oc1ccnc(c1)O 1P003GA0 [0,1,0,0,0,0|1,0,0]=2 738 B8R1.4 Oc1ccnc(n1)C 1P0062KT [0,1,0,0,0,0|2,0,0]=3 739 B8R1.4 Oc1ccnc(n1)C 1P01KJLN [0,1,0,0,0,0|2,0,0]=3 740 B8R1.4 Oc1ccnc(n1)N 1P000310 [0,1,0,0,0,0|2,0,0]=3 741 B8R1.4 Oc1cncc(c1)Br 1P003436 [0,1,0,0,0,0|3,0,0]=4 742 B8R1.4 Oc1cncc(c1)Cl 1P003N4S [0,1,0,0,0,0|3,0,0]=4 743 B8R1.4 Oc1cncc(c1)F 1P002KMO [0,1,0,0,0,0|3,0,0]=4 744 B8R1.4 Oc1cncc(c1)I 1P00BGNK [0,1,0,0,0,0|3,0,0]=4 745 B8R1.4 Oc1cncc(c1)O 1P00C79T [0,1,0,0,0,0|3,0,0]=4 746 B8R1.4 Oc1cnnc(c1)Cl 1P001H43 [0,1,0,0,0,0|2,0,0]=3 747 B8R1.4 Oc1cnnc(c1)O 1P00AMX3 [0,1,0,0,0,0|2,0,0]=3 748 B8R1.4 Oc1cnnc(n1)O 1P003DRS [0,1,0,0,0,0|3,0,0]=4 749 B8R1.4 Oc1nc[nH]c(=O)c1 1P000IZX [0,1,0,0,0,0|2,0,0]=3 750 B8R1.4 S=c1cc[nH]c(=O)[nH]1 1P0034M8 [0,1,0,0,0,0|2,0,1]=4 751 B8R1.4 S=c1cc[nH]c(=S)[nH]1 1P002D01 [0,1,0,0,0,0|2,0,1]=4 752 B8R1.4 Sc1cc[nH]c(=O)c1 1P0282DR [0,1,0,0,0,0|1,0,1]=3 753 B8R1.4 Sc1cccc(c1)Br 1P003JM3 [0,1,0,0,0,0|2,0,0]=3 754 B8R1.4 Sc1cccc(c1)Cl 1P003JSI [0,1,0,0,0,0|2,0,0]=3 755 B8R1.4 Sc1cccc(c1)I 1P01BL0D [0,1,0,0,0,0|2,0,0]=3 756 B8R1.4 Sc1cccc(c1)S 1P00331W [0,1,0,0,0,0|2,0,0]=3 757 B8R1.4 Sc1cncc(c1)Br 1P00DKMY [0,1,0,0,0,0|3,0,0]=4 758 B8R1.4 Sc1cncc(c1)Br 1P01XDEC [0,1,0,0,0,0|3,0,0]=4 759 B8R1.4 [O-][n+]1cccc(c1)Br 1P00BDV5 [0,1,0,0,0,0|3,0,0]=4 760 B8R1.4 [O-][n+]1cccc(c1)C 1P0001YU [0,1,0,0,0,0|3,0,0]=4 761 B8R1.4 [O-][n+]1cccc(c1)Cl 1P00752K [0,1,0,0,0,0|3,0,0]=4 762 B8R1.4 [O-][n+]1cccc(c1)F 1P003JYF [0,1,0,0,0,0|3,0,0]=4 763 B8R1.4 [O-][n+]1cccc(c1)I 1P00KGSS [0,1,0,0,0,0|3,0,0]=4 764 B8R1.4 [O-][n+]1cccc(c1)N 1P01B7G3 [0,1,0,0,0,0|2,0,0]=3 765 B8R1.4 [O-][n+]1cccc(c1)O 1P003KCX [0,1,0,0,0,0|3,0,0]=4 766 B8R1.4 [O-][n+]1ccnc(c1)Cl 1P005PF0 [0,1,0,0,0,0|2,0,0]=3 767 B8R1.4 [O-]c1ccnc(n1)Cl 1P027ULQ [0,1,0,0,0,0|2,0,0]=3 768 B8R1.4 [S-]c1ccnc(c1)C 1P01FLFM [0,1,0,0,0,0|1,0,0]=2 769 B8R1.4 c1([2H])cccc(c1)Br 1P01FG20 [0,1,0,0,0,0|2,0,0]=3 770 B8R1.5 Brc1cccc[n+]1[O-] 1P002J72 [0,1,0,0,0,0|3,0,0]=4 771 B8R1.5 Brc1cccc[n+]1[O-] 1P0033NN [0,1,0,0,0,0|3,0,0]=4 772 B8R1.5 Brc1cccc[n+]1[O-] 1P003H9N [0,1,0,0,0,0|3,0,0]=4 773 B8R1.5 Brc1ccccc1Br 1P0039HG [0,1,0,0,0,0|2,0,0]=3 774 B8R1.5 Brc1ccccc1I 1P003364 [0,1,0,0,0,0|2,0,0]=3 775 B8R1.5 Brc1cccnc1C 1P00342P [0,1,0,0,0,0|3,0,0]=4 776 B8R1.5 Brc1cccnc1Cl 1P0033O3 [0,1,0,0,0,0|3,0,0]=4 777 B8R1.5 Brc1cccnc1F 1P00I7MV [0,1,0,0,0,0|3,0,0]=4 778 B8R1.5 Brc1cccnc1I 1P00BZY8 [0,1,0,0,0,0|3,0,0]=4 779 B8R1.5 Brc1cccnc1N 1P006ZHT [0,1,0,0,0,0|2,0,0]=3 780 B8R1.5 Brc1cccnc1O 1P00342L [0,1,0,0,0,0|3,0,0]=4 781 B8R1.5 Brc1cccnc1S 1P00FGR1 [0,1,0,0,0,0|3,0,0]=4 782 B8R1.5 Brc1ccncc1I 1P0069LC [0,1,0,0,0,0|1,0,0]=2 783 B8R1.5 Brc1ccnnc1C 1P028Z3K [0,1,0,0,0,0|2,0,0]=3 784 B8R1.5 Brc1cnc[nH]c1=O 1P002BR3 [0,1,0,0,0,0|2,0,0]=3 785 B8R1.5 Brc1cnc[nH]c1=O 1P006DLU [0,1,0,0,0,0|2,0,0]=3 786 B8R1.5 Brc1cnccc1Br 1P006ZPB [0,1,0,0,0,0|1,0,0]=2 787 B8R1.5 Brc1cnccc1Br 1P028AT2 [0,1,0,0,0,0|1,0,0]=2 788 B8R1.5 Brc1cnccc1I 1P0036Q5 [0,1,0,0,0,0|1,0,0]=2 789 B8R1.5 Brc1cncnc1C 1P007YVW [0,1,0,0,0,0|2,0,0]=3 790 B8R1.5 Brc1cncnc1Cl 1P00172I [0,1,0,0,0,0|2,0,0]=3 791 B8R1.5 Brc1cncnc1Cl 1P0037J3 [0,1,0,0,0,0|2,0,0]=3 792 B8R1.5 Brc1cncnc1F 1P028WZH [0,1,0,0,0,0|2,0,0]=3 793 B8R1.5 Brc1cncnc1N 1P007YVV [0,1,0,0,0,0|1,0,0]=2 794 B8R1.5 Brc1cnncc1Br 1P0167G8 [0,1,0,0,0,0|2,0,0]=3 795 B8R1.5 Brc1ncccc1Br 1P0033E8 [0,1,0,0,0,0|3,0,0]=4 796 B8R1.5 C[n+]1cccnc1N 1P01EX4U [0,1,0,0,0,0|3,0,0]=4 797 B8R1.5 Cc1cccc[n+]1C 1P008F0C [0,1,0,0,0,0|3,0,0]=4 798 B8R1.5 Cc1cccc[n+]1N 1P005AF9 [0,1,0,0,0,0|2,0,0]=3 799 B8R1.5 Cc1cccc[n+]1[O-] 1P0033W7 [0,1,0,0,0,0|3,0,0]=4 800 B8R1.5 Cc1ccccc1Br 1P0033NP [0,1,0,0,0,0|2,0,0]=3 801 B8R1.5 Cc1ccccc1Cl 1P0060OI [0,1,0,0,0,0|2,0,0]=3 802 B8R1.5 Cc1ccccc1F 1P0060O5 [0,1,0,0,0,0|2,0,0]=3 803 B8R1.5 Cc1ccccc1I 1P003HXP [0,1,0,0,0,0|2,0,0]=3 804 B8R1.5 Cc1ccccc1N 1P003TYU [0,1,0,0,0,0|1,0,0]=2 805 B8R1.5 Cc1ccccc1O 1P005GSC [0,1,0,0,0,0|2,0,0]=3 806 B8R1.5 Cc1ccccc1S 1P001358 [0,1,0,0,0,0|2,0,0]=3 807 B8R1.5 Cc1cccnc1Br 1P003H3T [0,1,0,0,0,0|3,0,0]=4 808 B8R1.5 Cc1cccnc1Cl 1P003HCR [0,1,0,0,0,0|3,0,0]=4 809 B8R1.5 Cc1cccnc1F 1P002OMV [0,1,0,0,0,0|3,0,0]=4 810 B8R1.5 Cc1cccnc1I 1P006ZIM [0,1,0,0,0,0|3,0,0]=4 811 B8R1.5 Cc1cccnc1N 1P003GUI [0,1,0,0,0,0|2,0,0]=3 812 B8R1.5 Cc1cccnc1O 1P006L3K [0,1,0,0,0,0|3,0,0]=4 813 B8R1.5 Cc1ccn[nH]c1=O 1P00C094 [0,1,0,0,0,0|2,0,0]=3 814 B8R1.5 Cc1ccncc1Br 1P00342Z [0,1,0,0,0,0|1,0,0]=2 815 B8R1.5 Cc1ccncc1Cl 1P00344K [0,1,0,0,0,0|1,0,0]=2 816 B8R1.5 Cc1ccncc1F 1P00I8AH [0,1,0,0,0,0|1,0,0]=2 817 B8R1.5 Cc1ccncc1I 1P00CHQ4 [0,1,0,0,0,0|1,0,0]=2 818 B8R1.5 Cc1ccncc1N 1P00341P [0,1,0,0,0,0|1,0,0]=2 819 B8R1.5 Cc1ccncc1O 1P003K0L [0,1,0,0,0,0|1,0,0]=2 820 B8R1.5 Cc1ccnnc1Br 1P001H7G [0,1,0,0,0,0|2,0,0]=3 821 B8R1.5 Cc1ccnnc1Cl 1P005MDO [0,1,0,0,0,0|2,0,0]=3 822 B8R1.5 Cc1ccnnc1N 1P003JCM [0,1,0,0,0,0|2,0,0]=3 823 B8R1.5 Cc1cnccc1Br 1P0034EI [0,1,0,0,0,0|1,0,0]=2 824 B8R1.5 Cc1cnccc1Br 1P00HF33 [0,1,0,0,0,0|1,0,0]=2 825 B8R1.5 Cc1cnccc1C 1P00E9VT [0,1,0,0,0,0|1,0,0]=2 826 B8R1.5 Cc1cnccc1Cl 1P001Y9Y [0,1,0,0,0,0|1,0,0]=2 827 B8R1.5 Cc1cnccc1Cl 1P003LLP [0,1,0,0,0,0|1,0,0]=2 828 B8R1.5 Cc1cnccc1F 1P002VYO [0,1,0,0,0,0|1,0,0]=2 829 B8R1.5 Cc1cnccc1I 1P01ELGO [0,1,0,0,0,0|1,0,0]=2 830 B8R1.5 Cc1cnccc1N 1P002CC8 [0,1,0,0,0,0|0,0,0]=1 831 B8R1.5 Cc1cnccc1O 1P00347V [0,1,0,0,0,0|1,0,0]=2 832 B8R1.5 Cc1cncnc1Br 1P000P75 [0,1,0,0,0,0|2,0,0]=3 833 B8R1.5 Cc1cncnc1Cl 1P00DB4W [0,1,0,0,0,0|2,0,0]=3 834 B8R1.5 Cc1cncnc1N 1P0037ZT [0,1,0,0,0,0|1,0,0]=2 835 B8R1.5 Cc1cncnc1O 1P007URT [0,1,0,0,0,0|2,0,0]=3 836 B8R1.5 Cc1cnncc1N 1P00H51F [0,1,0,0,0,0|1,0,0]=2 837 B8R1.5 Cc1cnncc1N 1P01KY6Y [0,1,0,0,0,0|1,0,0]=2 838 B8R1.5 Cc1ncccc1C 1P003G1A [0,1,0,0,0,0|3,0,0]=4 839 B8R1.5 Cc1nccnc1N 1P002BXP [0,1,0,0,0,0|3,0,0]=4 840 B8R1.5 Cc1nccnc1N 1P01FJXT [0,1,0,0,0,0|3,0,0]=4 841 B8R1.5 Cc1nnccc1C 1P01AMA9 [0,1,0,0,0,0|2,0,0]=3 842 B8R1.5 Cc1nncnc1O 1P00HZ45 [0,1,0,0,0,0|3,0,0]=4 843 B8R1.5 Clc1cccc[n+]1C 1P007ZDT [0,1,0,0,0,0|3,0,0]=4 844 B8R1.5 Clc1cccc[n+]1[O-] 1P00291L [0,1,0,0,0,0|3,0,0]=4 845 B8R1.5 Clc1cccc[n+]1[O-] 1P0033QB [0,1,0,0,0,0|3,0,0]=4 846 B8R1.5 Clc1ccccc1Cl 1P00331E [0,1,0,0,0,0|2,0,0]=3 847 B8R1.5 Clc1ccccc1I 1P00337B [0,1,0,0,0,0|2,0,0]=3 848 B8R1.5 Clc1cccnc1Br 1P0033LM [0,1,0,0,0,0|3,0,0]=4 849 B8R1.5 Clc1cccnc1C 1P008RBW [0,1,0,0,0,0|3,0,0]=4 850 B8R1.5 Clc1cccnc1F 1P003JNM [0,1,0,0,0,0|3,0,0]=4 851 B8R1.5 Clc1cccnc1I 1P0036XU [0,1,0,0,0,0|3,0,0]=4 852 B8R1.5 Clc1cccnc1N 1P003GU5 [0,1,0,0,0,0|2,0,0]=3 853 B8R1.5 Clc1cccnc1O 1P003JS9 [0,1,0,0,0,0|3,0,0]=4 854 B8R1.5 Clc1cccnc1S 1P00EJOL [0,1,0,0,0,0|3,0,0]=4 855 B8R1.5 Clc1ccn[nH]c1=O 1P001Y07 [0,1,0,0,0,0|2,0,0]=3 856 B8R1.5 Clc1ccncc1Br 1P00238J [0,1,0,0,0,0|1,0,0]=2 857 B8R1.5 Clc1ccncc1Br 1P0038DU [0,1,0,0,0,0|1,0,0]=2 858 B8R1.5 Clc1ccncc1I 1P003LLL [0,1,0,0,0,0|1,0,0]=2 859 B8R1.5 Clc1ccncc1I 1P01DMJT [0,1,0,0,0,0|1,0,0]=2 860 B8R1.5 Clc1ccnnc1C 1P027OIV [0,1,0,0,0,0|2,0,0]=3 861 B8R1.5 Clc1ccnnc1N 1P01JWN7 [0,1,0,0,0,0|2,0,0]=3 862 B8R1.5 Clc1cnc[nH]c1=S 1P0288KI [0,1,0,0,0,0|2,0,0]=3 863 B8R1.5 Clc1cnccc1Br 1P005Z31 [0,1,0,0,0,0|1,0,0]=2 864 B8R1.5 Clc1cnccc1Cl 1P00DECZ [0,1,0,0,0,0|1,0,0]=2 865 B8R1.5 Clc1cnccc1I 1P008NQC [0,1,0,0,0,0|1,0,0]=2 866 B8R1.5 Clc1cncnc1Br 1P000SCL [0,1,0,0,0,0|2,0,0]=3 867 B8R1.5 Clc1cncnc1C 1P00DF1Z [0,1,0,0,0,0|2,0,0]=3 868 B8R1.5 Clc1cncnc1N 1P0004JZ [0,1,0,0,0,0|1,0,0]=2 869 B8R1.5 Clc1cncnc1O 1P00DL92 [0,1,0,0,0,0|2,0,0]=3 870 B8R1.5 Clc1cnncc1Cl 1P000MQH [0,1,0,0,0,0|2,0,0]=3 871 B8R1.5 Clc1cnncc1Cl 1P00DCB3 [0,1,0,0,0,0|2,0,0]=3 872 B8R1.5 Clc1ncccc1Cl 1P0033ED [0,1,0,0,0,0|3,0,0]=4 873 B8R1.5 Clc1ncncc1Cl 1P0037HT [0,1,0,0,0,0|2,0,0]=3 874 B8R1.5 Clc1nnccc1Cl 1P001Y06 [0,1,0,0,0,0|2,0,0]=3 875 B8R1.5 FC1=C(C)C=C=C[N]1 1P00BYXD [0,1,0,0,0,0|3,0,0]=4 876 B8R1.5 Fc1cccc[n+]1C 1P01BDFY [0,1,0,0,0,0|3,0,0]=4 877 B8R1.5 Fc1ccccc1Br 1P0033N6 [0,1,0,0,0,0|2,0,0]=3 878 B8R1.5 Fc1ccccc1Cl 1P003A36 [0,1,0,0,0,0|2,0,0]=3 879 B8R1.5 Fc1ccccc1I 1P003ESK [0,1,0,0,0,0|2,0,0]=3 880 B8R1.5 Fc1ccccc1S 1P0033SM [0,1,0,0,0,0|2,0,0]=3 881 B8R1.5 Fc1cccnc1Br 1P0033LP [0,1,0,0,0,0|3,0,0]=4 882 B8R1.5 Fc1cccnc1C 1P001R2T [0,1,0,0,0,0|3,0,0]=4 883 B8R1.5 Fc1cccnc1Cl 1P003HC6 [0,1,0,0,0,0|3,0,0]=4 884 B8R1.5 Fc1cccnc1I 1P001E78 [0,1,0,0,0,0|3,0,0]=4 885 B8R1.5 Fc1cccnc1N 1P003GU9 [0,1,0,0,0,0|2,0,0]=3 886 B8R1.5 Fc1cccnc1O 1P003JVS [0,1,0,0,0,0|3,0,0]=4 887 B8R1.5 Fc1ccncc1Br 1P000DU4 [0,1,0,0,0,0|1,0,0]=2 888 B8R1.5 Fc1ccncc1Cl 1P00496H [0,1,0,0,0,0|1,0,0]=2 889 B8R1.5 Fc1cnc[nH]c1=O 1P00377B [0,1,0,0,0,0|2,0,0]=3 890 B8R1.5 Fc1cnccc1Br 1P000HQI [0,1,0,0,0,0|1,0,0]=2 891 B8R1.5 Fc1cnccc1Br 1P00387U [0,1,0,0,0,0|1,0,0]=2 892 B8R1.5 Fc1cnccc1Cl 1P000IW9 [0,1,0,0,0,0|1,0,0]=2 893 B8R1.5 Fc1cnccc1Cl 1P0034G5 [0,1,0,0,0,0|1,0,0]=2 894 B8R1.5 Fc1cnccc1F 1P0038VF [0,1,0,0,0,0|1,0,0]=2 895 B8R1.5 Fc1cnccc1I 1P00345U [0,1,0,0,0,0|1,0,0]=2 896 B8R1.5 Fc1cnccc1S 1P01DYY6 [0,1,0,0,0,0|1,0,0]=2 897 B8R1.5 Fc1cncnc1Br 1P000285 [0,1,0,0,0,0|2,0,0]=3 898 B8R1.5 Fc1cncnc1Cl 1P00BYYI [0,1,0,0,0,0|2,0,0]=3 899 B8R1.5 Fc1cncnc1I 1P0285JN [0,1,0,0,0,0|2,0,0]=3 900 B8R1.5 Fc1cncnc1N 1P00370Z [0,1,0,0,0,0|1,0,0]=2 901 B8R1.5 Fc1ncccc1F 1P001NQA [0,1,0,0,0,0|3,0,0]=4 902 B8R1.5 Fc1ncncc1F 1P0292X9 [0,1,0,0,0,0|2,0,0]=3 903 B8R1.5 Ic1ccccc1I 1P00E950 [0,1,0,0,0,0|2,0,0]=3 904 B8R1.5 Ic1cccnc1Br 1P002UAK [0,1,0,0,0,0|3,0,0]=4 905 B8R1.5 Ic1cccnc1C 1P001NKR [0,1,0,0,0,0|3,0,0]=4 906 B8R1.5 Ic1cccnc1Cl 1P003HCE [0,1,0,0,0,0|3,0,0]=4 907 B8R1.5 Ic1cccnc1F 1P000AOS [0,1,0,0,0,0|3,0,0]=4 908 B8R1.5 Ic1cccnc1N 1P003K2I [0,1,0,0,0,0|2,0,0]=3 909 B8R1.5 Ic1cccnc1O 1P008ZKZ [0,1,0,0,0,0|3,0,0]=4 910 B8R1.5 Ic1cnccc1I 1P01KLJE [0,1,0,0,0,0|1,0,0]=2 911 B8R1.5 Ic1cncnc1Br 1P001MPL [0,1,0,0,0,0|2,0,0]=3 912 B8R1.5 Ic1cncnc1C 1P00H1F1 [0,1,0,0,0,0|2,0,0]=3 913 B8R1.5 Ic1cncnc1Cl 1P0037F7 [0,1,0,0,0,0|2,0,0]=3 914 B8R1.5 Ic1cncnc1F 1P027XFL [0,1,0,0,0,0|2,0,0]=3 915 B8R1.5 Ic1cncnc1N 1P006NO5 [0,1,0,0,0,0|1,0,0]=2 916 B8R1.5 Ic1cncnc1O 1P00DEV9 [0,1,0,0,0,0|2,0,0]=3 917 B8R1.5 Ic1ncccc1I 1P003FZY [0,1,0,0,0,0|3,0,0]=4 918 B8R1.5 Nc1cccc[n+]1C 1P005VX6 [0,1,0,0,0,0|2,0,0]=3 919 B8R1.5 Nc1cccc[n+]1[O-] 1P001GYV [0,1,0,0,0,0|2,0,0]=3 920 B8R1.5 Nc1ccccc1Br 1P0033MQ [0,1,0,0,0,0|1,0,0]=2 921 B8R1.5 Nc1ccccc1Br 1P003H80 [0,1,0,0,0,0|1,0,0]=2 922 B8R1.5 Nc1ccccc1Cl 1P0033PQ [0,1,0,0,0,0|1,0,0]=2 923 B8R1.5 Nc1ccccc1Cl 1P003HI4 [0,1,0,0,0,0|1,0,0]=2 924 B8R1.5 Nc1ccccc1F 1P0033SA [0,1,0,0,0,0|1,0,0]=2 925 B8R1.5 Nc1ccccc1F 1P00DC77 [0,1,0,0,0,0|1,0,0]=2 926 B8R1.5 Nc1ccccc1I 1P003HXD [0,1,0,0,0,0|1,0,0]=2 927 B8R1.5 Nc1ccccc1N 1P0035WA [0,1,0,0,0,0|1,0,0]=2 928 B8R1.5 Nc1ccccc1N 1P003TY8 [0,1,0,0,0,0|1,0,0]=2 929 B8R1.5 Nc1ccccc1O 1P00FAMG [0,1,0,0,0,0|1,0,0]=2 930 B8R1.5 Nc1ccccc1O 1P00I9LJ [0,1,0,0,0,0|1,0,0]=2 931 B8R1.5 Nc1cccnc1Br 1P003JB2 [0,1,0,0,0,0|2,0,0]=3 932 B8R1.5 Nc1cccnc1C 1P00341I [0,1,0,0,0,0|2,0,0]=3 933 B8R1.5 Nc1cccnc1Cl 1P003HBX [0,1,0,0,0,0|2,0,0]=3 934 B8R1.5 Nc1cccnc1F 1P001RT2 [0,1,0,0,0,0|2,0,0]=3 935 B8R1.5 Nc1cccnc1I 1P002KMR [0,1,0,0,0,0|2,0,0]=3 936 B8R1.5 Nc1cccnc1O 1P00IB08 [0,1,0,0,0,0|2,0,0]=3 937 B8R1.5 Nc1cccnc1O 1P01A8IE [0,1,0,0,0,0|2,0,0]=3 938 B8R1.5 Nc1ccn[nH]c1=O 1P00DGSD [0,1,0,0,0,0|1,0,0]=2 939 B8R1.5 Nc1ccncc1Br 1P0034CX [0,1,0,0,0,0|0,0,0]=1 940 B8R1.5 Nc1ccncc1Cl 1P002BO8 [0,1,0,0,0,0|0,0,0]=1 941 B8R1.5 Nc1ccncc1F 1P003L66 [0,1,0,0,0,0|0,0,0]=1 942 B8R1.5 Nc1ccncc1I 1P003L6A [0,1,0,0,0,0|0,0,0]=1 943 B8R1.5 Nc1ccncc1O 1P003AUC [0,1,0,0,0,0|0,0,0]=1 944 B8R1.5 Nc1ccncc1O 1P003L68 [0,1,0,0,0,0|0,0,0]=1 945 B8R1.5 Nc1ccncc1O 1P008WTQ [0,1,0,0,0,0|0,0,0]=1 946 B8R1.5 Nc1ccnnc1C 1P01A5Q6 [0,1,0,0,0,0|1,0,0]=2 947 B8R1.5 Nc1ccnnc1Cl 1P00DIBS [0,1,0,0,0,0|1,0,0]=2 948 B8R1.5 Nc1cnc[nH]c1=O 1P0038XW [0,1,0,0,0,0|2,0,0]=3 949 B8R1.5 Nc1cnccc1Br 1P00I532 [0,1,0,0,0,0|1,0,0]=2 950 B8R1.5 Nc1cnccc1Cl 1P002ACF [0,1,0,0,0,0|1,0,0]=2 951 B8R1.5 Nc1cnccc1F 1P01BBYC [0,1,0,0,0,0|1,0,0]=2 952 B8R1.5 Nc1cnccc1I 1P0038HQ [0,1,0,0,0,0|1,0,0]=2 953 B8R1.5 Nc1cnccc1N 1P003IW5 [0,1,0,0,0,0|0,0,0]=1 954 B8R1.5 Nc1cnccc1O 1P00954L [0,1,0,0,0,0|1,0,0]=2 955 B8R1.5 Nc1cnccc1S 1P00H1LW [0,1,0,0,0,0|1,0,0]=2 956 B8R1.5 Nc1cncnc1Br 1P0053HJ [0,1,0,0,0,0|2,0,0]=3 957 B8R1.5 Nc1cncnc1C 1P00C0LQ [0,1,0,0,0,0|2,0,0]=3 958 B8R1.5 Nc1cncnc1Cl 1P00D9C5 [0,1,0,0,0,0|2,0,0]=3 959 B8R1.5 Nc1cncnc1I 1P00H1KQ [0,1,0,0,0,0|2,0,0]=3 960 B8R1.5 Nc1cncnc1O 1P008WYI [0,1,0,0,0,0|2,0,0]=3 961 B8R1.5 Nc1cnncc1Br 1P00DICJ [0,1,0,0,0,0|1,0,0]=2 962 B8R1.5 Nc1cnncc1Cl 1P0037TD [0,1,0,0,0,0|1,0,0]=2 963 B8R1.5 Nc1cnncc1N 1P002WJ5 [0,1,0,0,0,0|1,0,0]=2 964 B8R1.5 Nc1ncccc1N 1P00396H [0,1,0,0,0,0|2,0,0]=3 965 B8R1.5 Nc1nccnc1Br 1P007P84 [0,1,0,0,0,0|3,0,0]=4 966 B8R1.5 Nc1nccnc1Cl 1P003GU4 [0,1,0,0,0,0|3,0,0]=4 967 B8R1.5 Nc1nccnc1F 1P019DIR [0,1,0,0,0,0|3,0,0]=4 968 B8R1.5 Nc1nccnc1I 1P007G5N [0,1,0,0,0,0|3,0,0]=4 969 B8R1.5 Nc1nccnc1N 1P000WG1 [0,1,0,0,0,0|3,0,0]=4 970 B8R1.5 Nc1ncncc1N 1P001405 [0,1,0,0,0,0|1,0,0]=2 971 B8R1.5 Nc1ncncc1N 1P01A7IH [0,1,0,0,0,0|1,0,0]=2 972 B8R1.5 Nc1ncncc1N 1P01FYMI [0,1,0,0,0,0|1,0,0]=2 973 B8R1.5 O=c1[nH]cccc1C 1P0001Z2 [0,1,0,0,0,0|3,0,0]=4 974 B8R1.5 O=c1[nH]cccc1I 1P01FPD4 [0,1,0,0,0,0|3,0,0]=4 975 B8R1.5 O=c1[nH]cccc1N 1P003AA1 [0,1,0,0,0,0|2,0,0]=3 976 B8R1.5 O=c1[nH]ccnc1N 1P003JEO [0,1,0,0,0,0|3,0,0]=4 977 B8R1.5 O=c1cc[nH]cc1N 1P00IBMU [0,1,0,0,0,0|1,0,1]=3 978 B8R1.5 O=c1ccccn1C 1P0032P3 [0,1,0,0,0,0|3,0,0]=4 979 B8R1.5 O=c1ccccn1O 1P00G61C [0,1,0,0,0,0|3,0,0]=4 980 B8R1.5 O=c1ccocc1O 1P003K0A [0,1,0,0,0,0|2,0,0]=3 981 B8R1.5 O=c1occcc1Br 1P002CSI [0,1,0,0,0,0|3,0,0]=4 982 B8R1.5 O=c1occcc1O 1P0038A5 [0,1,0,0,0,0|3,0,0]=4 983 B8R1.5 Oc1c[nH]cnc1=O 1P01K5EN [0,1,0,0,0,0|2,0,1]=4 984 B8R1.5 Oc1cccc[n+]1[O-] 1P000ZZ3 [0,1,0,0,0,0|3,0,0]=4 985 B8R1.5 Oc1ccccc1Br 1P003A35 [0,1,0,0,0,0|2,0,0]=3 986 B8R1.5 Oc1ccccc1Cl 1P003HJP [0,1,0,0,0,0|2,0,0]=3 987 B8R1.5 Oc1ccccc1F 1P003HSS [0,1,0,0,0,0|2,0,0]=3 988 B8R1.5 Oc1ccccc1O 1P000QI9 [0,1,0,0,0,0|2,0,0]=3 989 B8R1.5 Oc1ccccc1O 1P01HPCV [0,1,0,0,0,0|2,0,0]=3 990 B8R1.5 Oc1ccccc1S 1P003HZ2 [0,1,0,0,0,0|2,0,0]=3 991 B8R1.5 Oc1cccnc1Br 1P0033LQ [0,1,0,0,0,0|3,0,0]=4 992 B8R1.5 Oc1cccnc1C 1P00346K [0,1,0,0,0,0|3,0,0]=4 993 B8R1.5 Oc1cccnc1Cl 1P0033O5 [0,1,0,0,0,0|3,0,0]=4 994 B8R1.5 Oc1cccnc1F 1P0020B6 [0,1,0,0,0,0|3,0,0]=4 995 B8R1.5 Oc1cccnc1I 1P003HX4 [0,1,0,0,0,0|3,0,0]=4 996 B8R1.5 Oc1cccnc1N 1P003GUC [0,1,0,0,0,0|2,0,0]=3 997 B8R1.5 Oc1ccncc1Br 1P003JIN [0,1,0,0,0,0|1,0,0]=2 998 B8R1.5 Oc1ccncc1Cl 1P003JOW [0,1,0,0,0,0|1,0,0]=2 999 B8R1.5 Oc1ccncc1F 1P0036K6 [0,1,0,0,0,0|1,0,0]=2 1000 B8R1.5 Oc1ccncc1I 1P003K2J [0,1,0,0,0,0|1,0,0]=2 1001 B8R1.5 Oc1ccnnc1Cl 1P0014KA [0,1,0,0,0,0|2,0,0]=3 1002 B8R1.5 Oc1ccnnc1N 1P002QN4 [0,1,0,0,0,0|2,0,0]=3 1003 B8R1.5 Oc1cnc[nH]c1=N 1P00DIFU [0,1,0,0,0,0|1,0,1]=3 1004 B8R1.5 Oc1cnc[nH]c1=O 1P001QMI [0,1,0,0,0,0|2,0,0]=3 1005 B8R1.5 Oc1cnccc1Br 1P001SX1 [0,1,0,0,0,0|1,0,0]=2 1006 B8R1.5 Oc1cnccc1Cl 1P0034G7 [0,1,0,0,0,0|1,0,0]=2 1007 B8R1.5 Oc1cnccc1I 1P002H4K [0,1,0,0,0,0|1,0,0]=2 1008 B8R1.5 Oc1cnccc1O 1P00063S [0,1,0,0,0,0|1,0,0]=2 1009 B8R1.5 Oc1cncnc1C 1P0004JY [0,1,0,0,0,0|2,0,0]=3 1010 B8R1.5 Oc1cnncc1Br 1P01KX79 [0,1,0,0,0,0|2,0,0]=3 1011 B8R1.5 Oc1cnncc1Br 1P028MSV [0,1,0,0,0,0|2,0,0]=3 1012 B8R1.5 Oc1cnncc1Cl 1P000MOM [0,1,0,0,0,0|2,0,0]=3 1013 B8R1.5 Oc1ncccc1O 1P0036P2 [0,1,0,0,0,0|3,0,0]=4 1014 B8R1.5 S=C1C=CN=CC1C 1P019DS7 [0,1,0,0,0,0|1,0,1]=3 1015 B8R1.5 S=c1[nH]cccc1C 1P0076M2 [0,1,0,0,0,0|3,0,0]=4 1016 B8R1.5 S=c1[nH]cccc1F 1P01BDFB [0,1,0,0,0,0|3,0,0]=4 1017 B8R1.5 S=c1[nH]cccc1N 1P00C6TQ [0,1,0,0,0,0|2,0,0]=3 1018 B8R1.5 S=c1[nH]cccc1O 1P002MAZ [0,1,0,0,0,0|3,0,0]=4 1019 B8R1.5 S=c1ccccn1O 1P008SNF [0,1,0,0,0,0|3,0,0]=4 1020 B8R1.5 S=c1ccccn1O 1P00HTTH [0,1,0,0,0,0|3,0,0]=4 1021 B8R1.5 S=c1ccccn1[O-] 1P00HYQ0 [0,1,0,0,0,0|3,0,0]=4 1022 B8R1.5 Sc1cccc[n+]1[O-] 1P003IDU [0,1,0,0,0,0|3,0,0]=4 1023 B8R1.5 Sc1ccccc1Br 1P003H9T [0,1,0,0,0,0|2,0,0]=3 1024 B8R1.5 Sc1ccccc1Cl 1P0033QH [0,1,0,0,0,0|2,0,0]=3 1025 B8R1.5 Sc1ccccc1I 1P00CMOS [0,1,0,0,0,0|2,0,0]=3 1026 B8R1.5 Sc1ccccc1S 1P0021E0 [0,1,0,0,0,0|2,0,0]=3 1027 B8R1.5 Sc1ccncc1Br 1P00G47E [0,1,0,0,0,0|1,0,0]=2 1028 B8R1.5 Sc1ccncc1Cl 1P01BIHD [0,1,0,0,0,0|1,0,0]=2 1029 B8R1.5 [O-]c1ccccc1C 1P00E08C [0,1,0,0,0,0|2,0,0]=3 1030 B8R1.5 [S-]c1cccc[n+]1[O-] 1P00I7Z0 [0,1,0,0,0,0|3,0,0]=4 1031 B6R0.4 C=CC=CC(=O)O 1P00IBIF [0,0,1,0,0,0|3,0,0]=4 1032 B6R0.4 C=C\C=C/C(=O)O 1P01DEBA [0,0,1,0,0,0|3,0,0]=4 1033 B6R0.4 C=C\C=C\C(=O)O 1P0070UZ [0,0,1,0,0,0|3,0,0]=4 1034 B6R0.4 NC\C=C\C(=O)N 1P028GOU [0,0,1,0,0,0|3,0,0]=4 1035 B6R0.4 NN=CNC(=O)N 1P0025CB [0,0,1,0,0,0|3,0,0]=4 1036 B6R0.4 NN=CNC(=S)N 1P002LST [0,0,1,0,0,0|3,0,0]=4 1037 B6R0.6 C\C=C\C=C\CN 1P01DWZV [0,0,1,0,0,0|1,0,2]=4 1038 B8R2.25 c1ccc2c(c1)C2 1P00E0DR [0,0,0,1,0,0|2,0,0]=3 1039 B8R2.34 C1=CC2CC1C=C2 1P000KKR [0,0,0,1,0,0|2,0,1]=4 1040 B8R2.34 C1=CC2CC1C=C2 1P0032PZ [0,0,0,1,0,0|2,0,1]=4 1041 B8R2.34 C1=CC2CC1C=C2 1P009GH9 [0,0,0,1,0,0|2,0,1]=4 1042 B6R1.2 Br[C-]1C=CC=C1 1P000XDE [0,0,0,0,1,0|1,0,1]=3 1043 B6R1.2 Br[C-]1C=CC=C1 1P000ZJA [0,0,0,0,1,0|1,0,1]=3 1044 B6R1.2 Brc1c[nH]nc1 1P002JKA [0,0,0,0,1,0|2,0,0]=3 1045 B6R1.2 Brc1c[nH]nn1 1P00AMIC [0,0,0,0,1,0|3,0,0]=4 1046 B6R1.2 Brc1cc[nH]n1 1P001L55 [0,0,0,0,1,0|2,0,1]=4 1047 B6R1.2 Brc1cccs1 1P0001YI [0,0,0,0,1,0|2,0,0]=3 1048 B6R1.2 Brc1ccn[nH]1 1P008UPN [0,0,0,0,1,0|2,0,0]=3 1049 B6R1.2 Brc1ccno1 1P0008UV [0,0,0,0,1,0|2,0,0]=3 1050 B6R1.2 Brc1ccns1 1P003847 [0,0,0,0,1,0|2,0,0]=3 1051 B6R1.2 Brc1ccon1 1P008TPD [0,0,0,0,1,0|3,0,0]=4 1052 B6R1.2 Brc1ccsn1 1P0037J9 [0,0,0,0,1,0|3,0,0]=4 1053 B6R1.2 Brc1cn[nH]n1 1P01K0JE [0,0,0,0,1,0|3,0,0]=4 1054 B6R1.2 Brc1cnc[nH]1 1P002MDC [0,0,0,0,1,0|2,0,0]=3 1055 B6R1.2 Brc1cnco1 1P0094A7 [0,0,0,0,1,0|2,0,0]=3 1056 B6R1.2 Brc1cnco1 1P01B653 [0,0,0,0,1,0|2,0,0]=3 1057 B6R1.2 Brc1cncs1 1P00309V [0,0,0,0,1,0|2,0,0]=3 1058 B6R1.2 Brc1cnn[nH]1 1P003ATS [0,0,0,0,1,0|3,0,0]=4 1059 B6R1.2 Brc1cnns1 1P028OEX [0,0,0,0,1,0|3,0,0]=4 1060 B6R1.2 Brc1cocc1 1P00343I [0,0,0,0,1,0|2,0,0]=3 1061 B6R1.2 Brc1cocn1 1P009WUS [0,0,0,0,1,0|3,0,0]=4 1062 B6R1.2 Brc1cocn1 1P01B6N4 [0,0,0,0,1,0|3,0,0]=4 1063 B6R1.2 Brc1conc1 1P00375F [0,0,0,0,1,0|2,0,0]=3 1064 B6R1.2 Brc1cscc1 1P00343T [0,0,0,0,1,0|2,0,0]=3 1065 B6R1.2 Brc1cscn1 1P0034FH [0,0,0,0,1,0|3,0,0]=4 1066 B6R1.2 Brc1csnc1 1P0038M0 [0,0,0,0,1,0|2,0,0]=3 1067 B6R1.2 Brc1ncc[nH]1 1P0038GT [0,0,0,0,1,0|3,0,0]=4 1068 B6R1.2 Brc1ncc[nH]1 1P01ELJO [0,0,0,0,1,0|3,0,0]=4 1069 B6R1.2 Brc1ncco1 1P000O9T [0,0,0,0,1,0|3,0,0]=4 1070 B6R1.2 Brc1ncco1 1P01AC0E [0,0,0,0,1,0|3,0,0]=4 1071 B6R1.2 Brc1nccs1 1P00309X [0,0,0,0,1,0|3,0,0]=4 1072 B6R1.2 Brc1ncn[nH]1 1P00AXLQ [0,0,0,0,1,0|3,0,0]=4 1073 B6R1.2 Brc1ncns1 1P00DIBD [0,0,0,0,1,0|3,0,0]=4 1074 B6R1.2 Brc1nnc[nH]1 1P01EARC [0,0,0,0,1,0|3,0,0]=4 1075 B6R1.2 Brc1nnco1 1P019EDG [0,0,0,0,1,0|3,0,0]=4 1076 B6R1.2 Brc1nncs1 1P0033LG [0,0,0,0,1,0|3,0,0]=4 1077 B6R1.2 C1C=NNC1=O 1P00134X [0,0,0,0,1,0|2,0,1]=4 1078 B6R1.2 C1C=NOC1=O 1P0082VF [0,0,0,0,1,0|2,0,1]=4 1079 B6R1.2 C1N=CSC1=S 1P009QOQ [0,0,0,0,1,0|2,0,1]=4 1080 B6R1.2 C1NC(=O)C=C1 1P0037XN [0,0,0,0,1,0|2,0,1]=4 1081 B6R1.2 C1OC(=O)C=C1 1P0037VR [0,0,0,0,1,0|2,0,1]=4 1082 B6R1.2 C1OC=CC1=O 1P01HH13 [0,0,0,0,1,0|2,0,1]=4 1083 B6R1.2 C1SC(=O)C=C1 1P00CB5Q [0,0,0,0,1,0|2,0,1]=4 1084 B6R1.2 C[C-]1C=CC=C1 1P000ZBQ [0,0,0,0,1,0|1,0,1]=3 1085 B6R1.2 Cc1[n-]ccn1 1P00EFKI [0,0,0,0,1,0|3,0,0]=4 1086 B6R1.2 Cc1c[nH+][nH]c1 1P00DF5M [0,0,0,0,1,0|2,0,1]=4 1087 B6R1.2 Cc1c[nH]cc1 1P00347O [0,0,0,0,1,0|1,0,1]=3 1088 B6R1.2 Cc1c[nH]cn1 1P0034KA [0,0,0,0,1,0|2,0,1]=4 1089 B6R1.2 Cc1c[nH]nc1 1P0034KB [0,0,0,0,1,0|2,0,0]=3 1090 B6R1.2 Cc1cc[nH]n1 1P001L8I [0,0,0,0,1,0|2,0,1]=4 1091 B6R1.2 Cc1ccc[nH]1 1P0036CQ [0,0,0,0,1,0|2,0,0]=3 1092 B6R1.2 Cc1ccco1 1P003I5W [0,0,0,0,1,0|2,0,0]=3 1093 B6R1.2 Cc1ccn[nH]1 1P00GV5F [0,0,0,0,1,0|2,0,0]=3 1094 B6R1.2 Cc1ccn[nH]1 1P00HFKT [0,0,0,0,1,0|2,0,0]=3 1095 B6R1.2 Cc1ccno1 1P0034RJ [0,0,0,0,1,0|2,0,0]=3 1096 B6R1.2 Cc1ccns1 1P00FD3O [0,0,0,0,1,0|2,0,0]=3 1097 B6R1.2 Cc1ccon1 1P0031XW [0,0,0,0,1,0|3,0,0]=4 1098 B6R1.2 Cc1cn[nH]n1 1P002GA1 [0,0,0,0,1,0|3,0,0]=4 1099 B6R1.2 Cc1cnc[nH]1 1P002MX4 [0,0,0,0,1,0|2,0,0]=3 1100 B6R1.2 Cc1cnco1 1P0037GR [0,0,0,0,1,0|2,0,0]=3 1101 B6R1.2 Cc1cncs1 1P003ND8 [0,0,0,0,1,0|2,0,0]=3 1102 B6R1.2 Cc1cnn[nH]1 1P002VA9 [0,0,0,0,1,0|3,0,0]=4 1103 B6R1.2 Cc1cnon1 1P002SJZ [0,0,0,0,1,0|3,0,0]=4 1104 B6R1.2 Cc1cocc1 1P003K7Y [0,0,0,0,1,0|2,0,0]=3 1105 B6R1.2 Cc1cocn1 1P00376B [0,0,0,0,1,0|3,0,0]=4 1106 B6R1.2 Cc1conc1 1P00EDTH [0,0,0,0,1,0|2,0,0]=3 1107 B6R1.2 Cc1cscc1 1P0037J4 [0,0,0,0,1,0|2,0,0]=3 1108 B6R1.2 Cc1cscn1 1P0034KU [0,0,0,0,1,0|3,0,0]=4 1109 B6R1.2 Cc1csnc1 1P00FFVP [0,0,0,0,1,0|2,0,0]=3 1110 B6R1.2 Cc1csnn1 1P0023VD [0,0,0,0,1,0|3,0,0]=4 1111 B6R1.2 Cc1ncc[nH]1 1P0033UW [0,0,0,0,1,0|3,0,0]=4 1112 B6R1.2 Cc1ncc[nH]1 1P01FPHT [0,0,0,0,1,0|3,0,0]=4 1113 B6R1.2 Cc1ncco1 1P002MBP [0,0,0,0,1,0|3,0,0]=4 1114 B6R1.2 Cc1nccs1 1P003I7G [0,0,0,0,1,0|3,0,0]=4 1115 B6R1.2 Cc1nnco1 1P0033UG [0,0,0,0,1,0|3,0,0]=4 1116 B6R1.2 Clc1c[nH]nc1 1P001RBV [0,0,0,0,1,0|2,0,0]=3 1117 B6R1.2 Clc1cc[nH]n1 1P0039E9 [0,0,0,0,1,0|2,0,1]=4 1118 B6R1.2 Clc1cccs1 1P0033WN [0,0,0,0,1,0|2,0,0]=3 1119 B6R1.2 Clc1ccn[nH]1 1P00H1ES [0,0,0,0,1,0|2,0,0]=3 1120 B6R1.2 Clc1ccon1 1P005DEE [0,0,0,0,1,0|3,0,0]=4 1121 B6R1.2 Clc1ccsn1 1P001ID4 [0,0,0,0,1,0|3,0,0]=4 1122 B6R1.2 Clc1cnc[nH]1 1P001RQY [0,0,0,0,1,0|2,0,0]=3 1123 B6R1.2 Clc1cncs1 1P01B60F [0,0,0,0,1,0|2,0,0]=3 1124 B6R1.2 Clc1cnns1 1P00BYEY [0,0,0,0,1,0|3,0,0]=4 1125 B6R1.2 Clc1cnsn1 1P00J3EE [0,0,0,0,1,0|3,0,0]=4 1126 B6R1.2 Clc1cscc1 1P0038PL [0,0,0,0,1,0|2,0,0]=3 1127 B6R1.2 Clc1cscn1 1P003LP9 [0,0,0,0,1,0|3,0,0]=4 1128 B6R1.2 Clc1csnc1 1P002QQB [0,0,0,0,1,0|2,0,0]=3 1129 B6R1.2 Clc1ncc[nH]1 1P001TQY [0,0,0,0,1,0|3,0,0]=4 1130 B6R1.2 Clc1ncco1 1P01C0J0 [0,0,0,0,1,0|3,0,0]=4 1131 B6R1.2 Clc1nccs1 1P00309Y [0,0,0,0,1,0|3,0,0]=4 1132 B6R1.2 Clc1ncns1 1P007AF2 [0,0,0,0,1,0|3,0,0]=4 1133 B6R1.2 Clc1nncs1 1P00DIEM [0,0,0,0,1,0|3,0,0]=4 1134 B6R1.2 Cn1cccc1 1P003TMI [0,0,0,0,1,0|2,0,0]=3 1135 B6R1.2 Cn1cccn1 1P003EXX [0,0,0,0,1,0|3,0,0]=4 1136 B6R1.2 Cn1ccnn1 1P0036FO [0,0,0,0,1,0|3,0,0]=4 1137 B6R1.2 Cn1cncc1 1P001NMJ [0,0,0,0,1,0|2,0,0]=3 1138 B6R1.2 Cn1cncc1 1P007BCU [0,0,0,0,1,0|2,0,0]=3 1139 B6R1.2 Cn1cncn1 1P003EXL [0,0,0,0,1,0|3,0,0]=4 1140 B6R1.2 Cn1cnnc1 1P0092FW [0,0,0,0,1,0|3,0,0]=4 1141 B6R1.2 Fc1c[nH]nc1 1P0036N9 [0,0,0,0,1,0|2,0,0]=3 1142 B6R1.2 Fc1c[nH]nc1 1P00I3ON [0,0,0,0,1,0|2,0,0]=3 1143 B6R1.2 Fc1cc[nH]n1 1P001L54 [0,0,0,0,1,0|2,0,1]=4 1144 B6R1.2 Fc1cccs1 1P00BYBL [0,0,0,0,1,0|2,0,0]=3 1145 B6R1.2 Fc1cnc[nH]1 1P007K08 [0,0,0,0,1,0|2,0,0]=3 1146 B6R1.2 Fc1cocc1 1P0292CG [0,0,0,0,1,0|2,0,0]=3 1147 B6R1.2 Fc1cscc1 1P003268 [0,0,0,0,1,0|2,0,0]=3 1148 B6R1.2 Fc1ncc[nH]1 1P00CM2R [0,0,0,0,1,0|3,0,0]=4 1149 B6R1.2 Fc1nccs1 1P00BI23 [0,0,0,0,1,0|3,0,0]=4 1150 B6R1.2 Fc1ncn[nH]1 1P00CLJL [0,0,0,0,1,0|3,0,0]=4 1151 B6R1.2 Ic1c[nH]cn1 1P0034JK [0,0,0,0,1,0|2,0,1]=4 1152 B6R1.2 Ic1c[nH]nc1 1P003M1M [0,0,0,0,1,0|2,0,0]=3 1153 B6R1.2 Ic1cc[nH]n1 1P00037Y [0,0,0,0,1,0|2,0,1]=4 1154 B6R1.2 Ic1cccs1 1P0033TX [0,0,0,0,1,0|2,0,0]=3 1155 B6R1.2 Ic1ccn[nH]1 1P0038Q7 [0,0,0,0,1,0|2,0,0]=3 1156 B6R1.2 Ic1ccns1 1P00J3CN [0,0,0,0,1,0|2,0,0]=3 1157 B6R1.2 Ic1cnco1 1P027WF8 [0,0,0,0,1,0|2,0,0]=3 1158 B6R1.2 Ic1cncs1 1P009R22 [0,0,0,0,1,0|2,0,0]=3 1159 B6R1.2 Ic1cnn[nH]1 1P01BK7I [0,0,0,0,1,0|3,0,0]=4 1160 B6R1.2 Ic1cocn1 1P01BJ4G [0,0,0,0,1,0|3,0,0]=4 1161 B6R1.2 Ic1conc1 1P004YU2 [0,0,0,0,1,0|2,0,0]=3 1162 B6R1.2 Ic1cscc1 1P00860K [0,0,0,0,1,0|2,0,0]=3 1163 B6R1.2 Ic1cscn1 1P01BUQT [0,0,0,0,1,0|3,0,0]=4 1164 B6R1.2 Ic1csnc1 1P00DCN7 [0,0,0,0,1,0|2,0,0]=3 1165 B6R1.2 Ic1csnn1 1P028QT4 [0,0,0,0,1,0|3,0,0]=4 1166 B6R1.2 Ic1ncc[nH]1 1P00309S [0,0,0,0,1,0|3,0,0]=4 1167 B6R1.2 Ic1ncco1 1P00IF7W [0,0,0,0,1,0|3,0,0]=4 1168 B6R1.2 Ic1nccs1 1P00309W [0,0,0,0,1,0|3,0,0]=4 1169 B6R1.2 Ic1nncs1 1P00CB6F [0,0,0,0,1,0|3,0,0]=4 1170 B6R1.2 N=c1[nH]cc[nH]1 1P00CM2O [0,0,0,0,1,0|2,0,1]=4 1171 B6R1.2 N=c1[nH]nc[nH]1 1P01JAEN [0,0,0,0,1,0|2,0,1]=4 1172 B6R1.2 N=c1scc[nH]1 1P00IK6V [0,0,0,0,1,0|2,0,1]=4 1173 B6R1.2 NC1=CCNN1 1P01C548 [0,0,0,0,1,0|1,0,2]=4 1174 B6R1.2 NC1C=CN=N1 1P009BAP [0,0,0,0,1,0|1,0,1]=3 1175 B6R1.2 NC1CC=CC1 1P003A3K [0,0,0,0,1,0|0,0,3]=4 1176 B6R1.2 NC1CCC=C1 1P00J3BD [0,0,0,0,1,0|0,0,3]=4 1177 B6R1.2 N[C-]1C=CC=C1 1P000XDB [0,0,0,0,1,0|0,0,1]=2 1178 B6R1.2 N[C@@H]1CCC=C1 1P028TVE [0,0,0,0,1,0|0,0,3]=4 1179 B6R1.2 N[C@H]1CCC=C1 1P028U0L [0,0,0,0,1,0|0,0,3]=4 1180 B6R1.2 Nc1c[nH]cc1 1P003AMF [0,0,0,0,1,0|0,0,1]=2 1181 B6R1.2 Nc1c[nH]nc1 1P002VTR [0,0,0,0,1,0|1,0,0]=2 1182 B6R1.2 Nc1c[nH]nc1 1P0074MC [0,0,0,0,1,0|1,0,0]=2 1183 B6R1.2 Nc1c[nH]nc1 1P0092UA [0,0,0,0,1,0|1,0,0]=2 1184 B6R1.2 Nc1c[nH]nn1 1P00C2F7 [0,0,0,0,1,0|2,0,0]=3 1185 B6R1.2 Nc1ccn[nH]1 1P00I0ST [0,0,0,0,1,0|1,0,0]=2 1186 B6R1.2 Nc1ccno1 1P001ES2 [0,0,0,0,1,0|1,0,0]=2 1187 B6R1.2 Nc1ccns1 1P003AW8 [0,0,0,0,1,0|1,0,0]=2 1188 B6R1.2 Nc1ccon1 1P0020K7 [0,0,0,0,1,0|2,0,0]=3 1189 B6R1.2 Nc1cn[nH]n1 1P00J1V3 [0,0,0,0,1,0|2,0,0]=3 1190 B6R1.2 Nc1cnc[nH]1 1P000S6U [0,0,0,0,1,0|1,0,0]=2 1191 B6R1.2 Nc1cncs1 1P0025NE [0,0,0,0,1,0|1,0,0]=2 1192 B6R1.2 Nc1cncs1 1P0034NP [0,0,0,0,1,0|1,0,0]=2 1193 B6R1.2 Nc1cnns1 1P0034N4 [0,0,0,0,1,0|2,0,0]=3 1194 B6R1.2 Nc1cnon1 1P00646W [0,0,0,0,1,0|2,0,0]=3 1195 B6R1.2 Nc1cnsn1 1P01A0F4 [0,0,0,0,1,0|2,0,0]=3 1196 B6R1.2 Nc1conc1 1P008RI0 [0,0,0,0,1,0|1,0,0]=2 1197 B6R1.2 Nc1conc1 1P008U89 [0,0,0,0,1,0|1,0,0]=2 1198 B6R1.2 Nc1cscc1 1P00BFOP [0,0,0,0,1,0|1,0,0]=2 1199 B6R1.2 Nc1cscn1 1P0025NF [0,0,0,0,1,0|2,0,0]=3 1200 B6R1.2 Nc1csnc1 1P0037IR [0,0,0,0,1,0|1,0,0]=2 1201 B6R1.2 Nc1csnc1 1P00EIUC [0,0,0,0,1,0|1,0,0]=2 1202 B6R1.2 Nc1csnc1 1P01B2JY [0,0,0,0,1,0|1,0,0]=2 1203 B6R1.2 Nc1csnn1 1P01BEQH [0,0,0,0,1,0|2,0,0]=3 1204 B6R1.2 Nc1nc[nH]c1 1P0039YW [0,0,0,0,1,0|1,0,1]=3 1205 B6R1.2 Nc1ncc[nH]1 1P001KWS [0,0,0,0,1,0|2,0,0]=3 1206 B6R1.2 Nc1ncc[nH]1 1P00338E [0,0,0,0,1,0|2,0,0]=3 1207 B6R1.2 Nc1ncco1 1P0033L1 [0,0,0,0,1,0|2,0,0]=3 1208 B6R1.2 Nc1nccs1 1P00IBBT [0,0,0,0,1,0|2,0,0]=3 1209 B6R1.2 Nc1ncns1 1P001RDR [0,0,0,0,1,0|2,0,0]=3 1210 B6R1.2 Nc1ncns1 1P003DRQ [0,0,0,0,1,0|2,0,0]=3 1211 B6R1.2 Nc1ncns1 1P008QCV [0,0,0,0,1,0|2,0,0]=3 1212 B6R1.2 Nc1nnc[nH]1 1P00EIW3 [0,0,0,0,1,0|2,0,0]=3 1213 B6R1.2 Nc1nnco1 1P00CJA5 [0,0,0,0,1,0|2,0,0]=3 1214 B6R1.2 Nc1nncs1 1P0033JF [0,0,0,0,1,0|2,0,0]=3 1215 B6R1.2 Nc1nnn[nH]1 1P0034N7 [0,0,0,0,1,0|3,0,0]=4 1216 B6R1.2 Nc1nnns1 1P00FEDF [0,0,0,0,1,0|3,0,0]=4 1217 B6R1.2 Nc1nocn1 1P00D4NZ [0,0,0,0,1,0|3,0,0]=4 1218 B6R1.2 Nc1scnc1 1P01C520 [0,0,0,0,1,0|1,0,0]=2 1219 B6R1.2 Nn1cccc1 1P00G2U0 [0,0,0,0,1,0|1,0,0]=2 1220 B6R1.2 Nn1cccn1 1P00CL92 [0,0,0,0,1,0|2,0,0]=3 1221 B6R1.2 Nn1ccnn1 1P0036O7 [0,0,0,0,1,0|2,0,0]=3 1222 B6R1.2 Nn1ccnn1 1P01AVE6 [0,0,0,0,1,0|2,0,0]=3 1223 B6R1.2 Nn1cncc1 1P003959 [0,0,0,0,1,0|1,0,0]=2 1224 B6R1.2 Nn1cncc1 1P0039HI [0,0,0,0,1,0|1,0,0]=2 1225 B6R1.2 Nn1cncn1 1P002QLD [0,0,0,0,1,0|2,0,0]=3 1226 B6R1.2 Nn1cnnc1 1P003L42 [0,0,0,0,1,0|2,0,0]=3 1227 B6R1.2 O=C1N=NC=N1 1P00BXUB [0,0,0,0,1,0|3,0,0]=4 1228 B6R1.2 O=c1[nH]cc[nH]1 1P003E0I [0,0,0,0,1,0|3,0,0]=4 1229 B6R1.2 O=c1cc[nH][nH]1 1P00134W [0,0,0,0,1,0|2,0,1]=4 1230 B6R1.2 O=c1cco[nH]1 1P00ED6J [0,0,0,0,1,0|3,0,0]=4 1231 B6R1.2 O=c1ccs[nH]1 1P0001YJ [0,0,0,0,1,0|3,0,0]=4 1232 B6R1.2 O=c1occ[nH]1 1P002UML [0,0,0,0,1,0|3,0,0]=4 1233 B6R1.2 O=c1occo1 1P003VS7 [0,0,0,0,1,0|3,0,0]=4 1234 B6R1.2 O=c1ocn[nH]1 1P00J30X [0,0,0,0,1,0|3,0,0]=4 1235 B6R1.2 O=c1scc[nH]1 1P00F3MD [0,0,0,0,1,0|3,0,0]=4 1236 B6R1.2 O=c1scn[nH]1 1P004Y70 [0,0,0,0,1,0|3,0,0]=4 1237 B6R1.2 Oc1c[nH]cn1 1P0063WX [0,0,0,0,1,0|2,0,1]=4 1238 B6R1.2 Oc1c[nH]nc1 1P0034J7 [0,0,0,0,1,0|2,0,0]=3 1239 B6R1.2 Oc1c[nH]nc1 1P00J2QO [0,0,0,0,1,0|2,0,0]=3 1240 B6R1.2 Oc1c[nH]nn1 1P00848B [0,0,0,0,1,0|3,0,0]=4 1241 B6R1.2 Oc1cc[nH]n1 1P00EIV8 [0,0,0,0,1,0|2,0,1]=4 1242 B6R1.2 Oc1cccs1 1P007WJZ [0,0,0,0,1,0|2,0,0]=3 1243 B6R1.2 Oc1ccn[nH]1 1P00EF5X [0,0,0,0,1,0|2,0,0]=3 1244 B6R1.2 Oc1cnsn1 1P00F041 [0,0,0,0,1,0|3,0,0]=4 1245 B6R1.2 Oc1conc1 1P00G9VS [0,0,0,0,1,0|2,0,0]=3 1246 B6R1.2 Oc1cscc1 1P007DIM [0,0,0,0,1,0|2,0,0]=3 1247 B6R1.2 Oc1nccs1 1P00G7GQ [0,0,0,0,1,0|3,0,0]=4 1248 B6R1.2 Oc1ncn[nH]1 1P0017LF [0,0,0,0,1,0|3,0,0]=4 1249 B6R1.2 On1cccn1 1P0056CG [0,0,0,0,1,0|3,0,0]=4 1250 B6R1.2 S=c1[nH]cc[nH]1 1P003BPF [0,0,0,0,1,0|3,0,0]=4 1251 B6R1.2 S=c1ccss1 1P01E558 [0,0,0,0,1,0|3,0,0]=4 1252 B6R1.2 S=c1scc[nH]1 1P00E939 [0,0,0,0,1,0|3,0,0]=4 1253 B6R1.2 S=c1sccs1 1P003BGZ [0,0,0,0,1,0|3,0,0]=4 1254 B6R1.2 Sc1c[nH]nc1 1P0221KR [0,0,0,0,1,0|2,0,0]=3 1255 B6R1.2 Sc1c[nH]nn1 1P003UQZ [0,0,0,0,1,0|3,0,0]=4 1256 B6R1.2 Sc1cc[nH]n1 1P028LHX [0,0,0,0,1,0|2,0,1]=4 1257 B6R1.2 Sc1cccs1 1P003IEZ [0,0,0,0,1,0|2,0,0]=3 1258 B6R1.2 Sc1cscc1 1P00589C [0,0,0,0,1,0|2,0,0]=3 1259 B6R1.2 Sc1nccs1 1P00IDP6 [0,0,0,0,1,0|3,0,0]=4 1260 B6R1.2 Sc1nncs1 1P003HYN [0,0,0,0,1,0|3,0,0]=4 1261 B6R1.2 [Fe]C1=CC=CC1 1P003PMR [0,0,0,0,1,0|1,0,1]=3 1262 B6R1.2 [Li]C1C=CC=C1 1P001XS4 [0,0,0,0,1,0|1,0,1]=3 1263 B6R1.2 [Mn]C1=CC=CC1 1P003PMS [0,0,0,0,1,0|1,0,1]=3 1264 B6R1.2 [S-]c1cnns1 1P00G2O4 [0,0,0,0,1,0|3,0,0]=4 1265 B6R1.2 [Tl]C1=CC=CC1 1P00C19M [0,0,0,0,1,0|1,0,1]=3 1266 B8R1.22 O=C1C=CCCC=C1 1P01DYXN [0,0,0,0,0,1|2,0,0]=3 1267 B8R1.22 O=c1cccccc1 1P003VPZ [0,0,0,0,0,1|2,0,0]=3 1268 B5R0.1 CC=CC(=O)N 1P002NE7 [1,0,1,0,0,0|1,0,1]=4 1269 B5R0.1 C\C=C\C(=O)N 1P00EF6M [1,0,1,0,0,0|1,0,1]=4 1270 B5R0.1 NC(=O)CN=C 1P003SKE [1,0,1,0,0,0|1,0,1]=4 1271 B5R0.1 NC(=O)NC=C 1P0080RL [1,0,1,0,0,0|2,0,0]=4 1272 B5R0.1 NC(=O)\C=C/Br 1P028CL9 [1,0,1,0,0,0|2,0,0]=4 1273 B5R0.1 NC(=O)\C=C\Cl 1P01EWSO [1,0,1,0,0,0|2,0,0]=4 1274 B5R0.2 C=CCCC=C 1P003E7G [1,0,1,0,0,0|1,0,1]=4 1275 B5R0.2 C=CCCC=C 1P003P92 [1,0,1,0,0,0|1,0,1]=4 1276 B5R0.2 NC\C=C\C=C 1P01FIJ9 [1,0,1,0,0,0|0,0,1]=3 1277 B5R0.3 C=CC(C=C)O 1P0060YF [1,0,1,0,0,0|1,0,1]=4 1278 B7R0.2 C\C(=C\C(=O)O)\C=C 1P01EMNE [0,1,1,0,0,0|2,0,0]=4 1279 B7R0.7 C=COC(=O)C=CC 1P001LJB [0,1,1,0,0,0|2,0,0]=4 1280 B7R1.1 BrCc1c[nH]nc1 1P01BAG9 [0,1,0,0,1,0|2,0,0]=4 1281 B7R1.1 BrCc1cccs1 1P003A54 [0,1,0,0,1,0|2,0,0]=4 1282 B7R1.1 BrCc1ccno1 1P005IU1 [0,1,0,0,1,0|2,0,0]=4 1283 B7R1.1 BrCc1ccns1 1P00BNV7 [0,1,0,0,1,0|2,0,0]=4 1284 B7R1.1 BrCc1cnco1 1P000X8S [0,1,0,0,1,0|2,0,0]=4 1285 B7R1.1 BrCc1cncs1 1P00IJOS [0,1,0,0,1,0|2,0,0]=4 1286 B7R1.1 BrCc1cocc1 1P00ED8I [0,1,0,0,1,0|2,0,0]=4 1287 B7R1.1 BrCc1conc1 1P00E9OI [0,1,0,0,1,0|2,0,0]=4 1288 B7R1.1 C#C[C-]1C=CC=C1 1P000X4W [0,1,0,0,1,0|1,0,1]=4 1289 B7R1.1 C#Cc1c[nH]nc1 1P003AFJ [0,1,0,0,1,0|2,0,0]=4 1290 B7R1.1 C#Cc1cccs1 1P0038AO [0,1,0,0,1,0|2,0,0]=4 1291 B7R1.1 C#Cc1ccn[nH]1 1P00BJWR [0,1,0,0,1,0|2,0,0]=4 1292 B7R1.1 C#Cc1ccns1 1P01C36A [0,1,0,0,1,0|2,0,0]=4 1293 B7R1.1 C#Cc1cnc[nH]1 1P00EM44 [0,1,0,0,1,0|2,0,0]=4 1294 B7R1.1 C#Cc1cnco1 1P01DRZ2 [0,1,0,0,1,0|2,0,0]=4 1295 B7R1.1 C#Cc1cncs1 1P004NIS [0,1,0,0,1,0|2,0,0]=4 1296 B7R1.1 C#Cc1cocc1 1P00DGD0 [0,1,0,0,1,0|2,0,0]=4 1297 B7R1.1 C#Cc1cscc1 1P003JVK [0,1,0,0,1,0|2,0,0]=4 1298 B7R1.1 C#Cc1csnc1 1P01EN98 [0,1,0,0,1,0|2,0,0]=4 1299 B7R1.1 C=C[C-]1C=CC=C1 1P000X4U [0,1,0,0,1,0|1,0,1]=4 1300 B7R1.1 C=Cc1c[nH]nc1 1P027OES [0,1,0,0,1,0|2,0,0]=4 1301 B7R1.1 C=Cc1ccco1 1P001LLL [0,1,0,0,1,0|2,0,0]=4 1302 B7R1.1 C=Cc1cccs1 1P002FXU [0,1,0,0,1,0|2,0,0]=4 1303 B7R1.1 C=Cc1cncs1 1P01BRJP [0,1,0,0,1,0|2,0,0]=4 1304 B7R1.1 C=Cc1cscc1 1P0012UB [0,1,0,0,1,0|2,0,0]=4 1305 B7R1.1 C=Cn1cccc1 1P0080L9 [0,1,0,0,1,0|2,0,0]=4 1306 B7R1.1 CC[C-]1C=CC=C1 1P000XD7 [0,1,0,0,1,0|1,0,1]=4 1307 B7R1.1 CC[C-]1C=CC=C1 1P000XD9 [0,1,0,0,1,0|1,0,1]=4 1308 B7R1.1 CCc1c[nH]cc1 1P00APDI [0,1,0,0,1,0|1,0,1]=4 1309 B7R1.1 CCc1c[nH]nc1 1P00B6AX [0,1,0,0,1,0|2,0,0]=4 1310 B7R1.1 CCc1ccc[nH]1 1P0033RK [0,1,0,0,1,0|2,0,0]=4 1311 B7R1.1 CCc1ccco1 1P003HOB [0,1,0,0,1,0|2,0,0]=4 1312 B7R1.1 CCc1cccs1 1P003HOV [0,1,0,0,1,0|2,0,0]=4 1313 B7R1.1 CCc1cnc[nH]1 1P001J1R [0,1,0,0,1,0|2,0,0]=4 1314 B7R1.1 CCc1cnco1 1P007IH6 [0,1,0,0,1,0|2,0,0]=4 1315 B7R1.1 CCc1cscc1 1P0027I2 [0,1,0,0,1,0|2,0,0]=4 1316 B7R1.1 CCc1csnc1 1P01BYG2 [0,1,0,0,1,0|2,0,0]=4 1317 B7R1.1 CCn1cccc1 1P00EBJW [0,1,0,0,1,0|2,0,0]=4 1318 B7R1.1 CCn1cncc1 1P003ES2 [0,1,0,0,1,0|2,0,0]=4 1319 B7R1.1 CNc1c[nH]nc1 1P019TPX [0,1,0,0,1,0|1,0,0]=3 1320 B7R1.1 CNc1cc[nH]n1 1P00E6KF [0,1,0,0,1,0|1,0,1]=4 1321 B7R1.1 CNc1ccon1 1P00HS5D [0,1,0,0,1,0|2,0,0]=4 1322 B7R1.1 CNc1ccon1 1P00IAF9 [0,1,0,0,1,0|2,0,0]=4 1323 B7R1.1 CNc1ccsn1 1P028UZC [0,1,0,0,1,0|2,0,0]=4 1324 B7R1.1 CNc1cnn[nH]1 1P0282XF [0,1,0,0,1,0|2,0,0]=4 1325 B7R1.1 CNc1cscc1 1P01B2HP [0,1,0,0,1,0|1,0,0]=3 1326 B7R1.1 CNc1ncc[nH]1 1P01BE1C [0,1,0,0,1,0|2,0,0]=4 1327 B7R1.1 CNc1ncco1 1P0039ZY [0,1,0,0,1,0|2,0,0]=4 1328 B7R1.1 CNc1nccs1 1P00EGBN [0,1,0,0,1,0|2,0,0]=4 1329 B7R1.1 CNc1nnco1 1P01BTTZ [0,1,0,0,1,0|2,0,0]=4 1330 B7R1.1 CNc1nncs1 1P00I84C [0,1,0,0,1,0|2,0,0]=4 1331 B7R1.1 CNn1cccc1 1P02902L [0,1,0,0,1,0|1,0,0]=3 1332 B7R1.1 COc1c[nH]nc1 1P001LPP [0,1,0,0,1,0|2,0,0]=4 1333 B7R1.1 COc1c[nH]nc1 1P01B6QU [0,1,0,0,1,0|2,0,0]=4 1334 B7R1.1 COc1cccs1 1P001YI0 [0,1,0,0,1,0|2,0,0]=4 1335 B7R1.1 COc1cscc1 1P0021M3 [0,1,0,0,1,0|2,0,0]=4 1336 B7R1.1 CSc1c[nH]nc1 1P009JTI [0,1,0,0,1,0|2,0,0]=4 1337 B7R1.1 CSc1ccc[nH]1 1P01ID3L [0,1,0,0,1,0|2,0,0]=4 1338 B7R1.1 CSc1ccco1 1P000WBV [0,1,0,0,1,0|2,0,0]=4 1339 B7R1.1 CSc1cccs1 1P0033CD [0,1,0,0,1,0|2,0,0]=4 1340 B7R1.1 CSc1cncs1 1P01BU59 [0,1,0,0,1,0|2,0,0]=4 1341 B7R1.1 CSc1cscc1 1P002JFX [0,1,0,0,1,0|2,0,0]=4 1342 B7R1.1 ClCc1c[nH]nc1 1P001U3B [0,1,0,0,1,0|2,0,0]=4 1343 B7R1.1 ClCc1cccs1 1P005XFR [0,1,0,0,1,0|2,0,0]=4 1344 B7R1.1 ClCc1ccno1 1P00ECFK [0,1,0,0,1,0|2,0,0]=4 1345 B7R1.1 ClCc1ccns1 1P0078AS [0,1,0,0,1,0|2,0,0]=4 1346 B7R1.1 ClCc1cnco1 1P007W6B [0,1,0,0,1,0|2,0,0]=4 1347 B7R1.1 ClCc1cncs1 1P009I1Z [0,1,0,0,1,0|2,0,0]=4 1348 B7R1.1 ClCc1cncs1 1P00DCWM [0,1,0,0,1,0|2,0,0]=4 1349 B7R1.1 ClCc1cscc1 1P00C23C [0,1,0,0,1,0|2,0,0]=4 1350 B7R1.1 ClCc1csnc1 1P01DX9B [0,1,0,0,1,0|2,0,0]=4 1351 B7R1.1 N#Cc1c[nH]cc1 1P006ADD [0,1,0,0,1,0|0,0,2]=4 1352 B7R1.1 N#Cc1c[nH]nc1 1P00338L [0,1,0,0,1,0|1,0,1]=4 1353 B7R1.1 N#Cc1ccco1 1P003BOZ [0,1,0,0,1,0|1,0,1]=4 1354 B7R1.1 N#Cc1cccs1 1P0001Y6 [0,1,0,0,1,0|1,0,1]=4 1355 B7R1.1 N#Cc1cocc1 1P003JYX [0,1,0,0,1,0|1,0,1]=4 1356 B7R1.1 N#Cc1conc1 1P00FALK [0,1,0,0,1,0|1,0,1]=4 1357 B7R1.1 N#Cc1cscc1 1P001V4K [0,1,0,0,1,0|1,0,1]=4 1358 B7R1.1 N#Cc1csnc1 1P00CLGC [0,1,0,0,1,0|1,0,1]=4 1359 B7R1.1 N#Cn1cncc1 1P00BZ96 [0,1,0,0,1,0|1,0,1]=4 1360 B7R1.1 NCc1c[nH]cc1 1P008B5V [0,1,0,0,1,0|0,0,1]=3 1361 B7R1.1 NCc1c[nH]cn1 1P00FFS6 [0,1,0,0,1,0|1,0,1]=4 1362 B7R1.1 NCc1c[nH]nc1 1P000EI2 [0,1,0,0,1,0|1,0,0]=3 1363 B7R1.1 NCc1cc[nH]n1 1P00398P [0,1,0,0,1,0|1,0,1]=4 1364 B7R1.1 NCc1ccc[nH]1 1P0033BP [0,1,0,0,1,0|1,0,0]=3 1365 B7R1.1 NCc1ccc[nH]1 1P006SOC [0,1,0,0,1,0|1,0,0]=3 1366 B7R1.1 NCc1ccco1 1P00IBDE [0,1,0,0,1,0|1,0,0]=3 1367 B7R1.1 NCc1cccs1 1P002V4I [0,1,0,0,1,0|1,0,0]=3 1368 B7R1.1 NCc1ccn[nH]1 1P008UV1 [0,1,0,0,1,0|1,0,0]=3 1369 B7R1.1 NCc1ccno1 1P0037YF [0,1,0,0,1,0|1,0,0]=3 1370 B7R1.1 NCc1ccno1 1P007323 [0,1,0,0,1,0|1,0,0]=3 1371 B7R1.1 NCc1ccns1 1P01B6TZ [0,1,0,0,1,0|1,0,0]=3 1372 B7R1.1 NCc1ccns1 1P01B6V6 [0,1,0,0,1,0|1,0,0]=3 1373 B7R1.1 NCc1ccon1 1P00811U [0,1,0,0,1,0|2,0,0]=4 1374 B7R1.1 NCc1ccon1 1P009337 [0,1,0,0,1,0|2,0,0]=4 1375 B7R1.1 NCc1ccsn1 1P0076B9 [0,1,0,0,1,0|2,0,0]=4 1376 B7R1.1 NCc1cnco1 1P000PTG [0,1,0,0,1,0|1,0,0]=3 1377 B7R1.1 NCc1cncs1 1P001WDD [0,1,0,0,1,0|1,0,0]=3 1378 B7R1.1 NCc1cncs1 1P00811W [0,1,0,0,1,0|1,0,0]=3 1379 B7R1.1 NCc1cnn[nH]1 1P0003MG [0,1,0,0,1,0|2,0,0]=4 1380 B7R1.1 NCc1cnn[nH]1 1P007Q84 [0,1,0,0,1,0|2,0,0]=4 1381 B7R1.1 NCc1cnns1 1P028N1M [0,1,0,0,1,0|2,0,0]=4 1382 B7R1.1 NCc1cnns1 1P028QZG [0,1,0,0,1,0|2,0,0]=4 1383 B7R1.1 NCc1cnon1 1P01EIHR [0,1,0,0,1,0|2,0,0]=4 1384 B7R1.1 NCc1cnsn1 1P01BB8F [0,1,0,0,1,0|2,0,0]=4 1385 B7R1.1 NCc1cocc1 1P0038AA [0,1,0,0,1,0|1,0,0]=3 1386 B7R1.1 NCc1cocc1 1P009BQA [0,1,0,0,1,0|1,0,0]=3 1387 B7R1.1 NCc1cocn1 1P0039FL [0,1,0,0,1,0|2,0,0]=4 1388 B7R1.1 NCc1cocn1 1P00DG0B [0,1,0,0,1,0|2,0,0]=4 1389 B7R1.1 NCc1conc1 1P001ZPV [0,1,0,0,1,0|1,0,0]=3 1390 B7R1.1 NCc1cscc1 1P000GRT [0,1,0,0,1,0|1,0,0]=3 1391 B7R1.1 NCc1cscc1 1P002V4H [0,1,0,0,1,0|1,0,0]=3 1392 B7R1.1 NCc1cscn1 1P000E2I [0,1,0,0,1,0|2,0,0]=4 1393 B7R1.1 NCc1cscn1 1P001WF7 [0,1,0,0,1,0|2,0,0]=4 1394 B7R1.1 NCc1csnc1 1P01FJYB [0,1,0,0,1,0|1,0,0]=3 1395 B7R1.1 NCc1csnc1 1P01FJYC [0,1,0,0,1,0|1,0,0]=3 1396 B7R1.1 NCc1csnn1 1P00VVY0 [0,1,0,0,1,0|2,0,0]=4 1397 B7R1.1 NCc1nc[nH]c1 1P0038XO [0,1,0,0,1,0|1,0,1]=4 1398 B7R1.1 NCc1ncc[nH]1 1P001A1F [0,1,0,0,1,0|2,0,0]=4 1399 B7R1.1 NCc1ncc[nH]1 1P003A7Q [0,1,0,0,1,0|2,0,0]=4 1400 B7R1.1 NCc1ncco1 1P0038HB [0,1,0,0,1,0|2,0,0]=4 1401 B7R1.1 NCc1ncco1 1P028B4B [0,1,0,0,1,0|2,0,0]=4 1402 B7R1.1 NCc1nccs1 1P0033BR [0,1,0,0,1,0|2,0,0]=4 1403 B7R1.1 NCc1nccs1 1P0037J6 [0,1,0,0,1,0|2,0,0]=4 1404 B7R1.1 NCc1nccs1 1P00G4H4 [0,1,0,0,1,0|2,0,0]=4 1405 B7R1.1 NCc1ncn[nH]1 1P000PYO [0,1,0,0,1,0|2,0,0]=4 1406 B7R1.1 NCc1ncn[nH]1 1P00EAG9 [0,1,0,0,1,0|2,0,0]=4 1407 B7R1.1 NCc1ncn[nH]1 1P00H3I1 [0,1,0,0,1,0|2,0,0]=4 1408 B7R1.1 NCc1ncno1 1P01FJYD [0,1,0,0,1,0|2,0,0]=4 1409 B7R1.1 NCc1ncsc1 1P00J1AF [0,1,0,0,1,0|2,0,0]=4 1410 B7R1.1 NCc1nn[nH]c1 1P027PDD [0,1,0,0,1,0|2,0,0]=4 1411 B7R1.1 NCc1nnco1 1P001950 [0,1,0,0,1,0|2,0,0]=4 1412 B7R1.1 NCc1ocnc1 1P009I2F [0,1,0,0,1,0|1,0,0]=3 1413 B7R1.1 NCc1scnc1 1P0015PG [0,1,0,0,1,0|1,0,0]=3 1414 B7R1.1 NCc1scnn1 1P01BSDS [0,1,0,0,1,0|2,0,0]=4 1415 B7R1.1 NNc1nccs1 1P007JQK [0,1,0,0,1,0|2,0,0]=4 1416 B7R1.1 NNc1ncns1 1P0287PI [0,1,0,0,1,0|2,0,0]=4 1417 B7R1.1 NNc1nnc[nH]1 1P01E8XT [0,1,0,0,1,0|2,0,0]=4 1418 B7R1.1 O=C[C-]1C=CC=C1 1P000X4V [0,1,0,0,1,0|1,0,1]=4 1419 B7R1.1 O=Cc1c[nH]cc1 1P00360O [0,1,0,0,1,0|1,0,1]=4 1420 B7R1.1 O=Cc1c[nH]nc1 1P000Q03 [0,1,0,0,1,0|2,0,0]=4 1421 B7R1.1 O=Cc1c[nH]nc1 1P0036BF [0,1,0,0,1,0|2,0,0]=4 1422 B7R1.1 O=Cc1ccc[nH]1 1P0001Y8 [0,1,0,0,1,0|2,0,0]=4 1423 B7R1.1 O=Cc1ccc[se]1 1P002QYK [0,1,0,0,1,0|2,0,0]=4 1424 B7R1.1 O=Cc1ccco1 1P0033SN [0,1,0,0,1,0|2,0,0]=4 1425 B7R1.1 O=Cc1cccs1 1P0039RD [0,1,0,0,1,0|2,0,0]=4 1426 B7R1.1 O=Cc1ccn[nH]1 1P003EVE [0,1,0,0,1,0|2,0,0]=4 1427 B7R1.1 O=Cc1ccno1 1P00ABVW [0,1,0,0,1,0|2,0,0]=4 1428 B7R1.1 O=Cc1ccns1 1P00395A [0,1,0,0,1,0|2,0,0]=4 1429 B7R1.1 O=Cc1cnc[nH]1 1P00309Z [0,1,0,0,1,0|2,0,0]=4 1430 B7R1.1 O=Cc1cnco1 1P007RNX [0,1,0,0,1,0|2,0,0]=4 1431 B7R1.1 O=Cc1cncs1 1P0001Y5 [0,1,0,0,1,0|2,0,0]=4 1432 B7R1.1 O=Cc1cocc1 1P003JYV [0,1,0,0,1,0|2,0,0]=4 1433 B7R1.1 O=Cc1conc1 1P00EAG3 [0,1,0,0,1,0|2,0,0]=4 1434 B7R1.1 O=Cc1cscc1 1P00348X [0,1,0,0,1,0|2,0,0]=4 1435 B7R1.1 O=Cc1csnc1 1P005H6H [0,1,0,0,1,0|2,0,0]=4 1436 B7R1.1 OC[C-]1C=CC=C1 1P000XDA [0,1,0,0,1,0|1,0,1]=4 1437 B7R1.1 OC[C-]1C=CC=C1 1P000ZBP [0,1,0,0,1,0|1,0,1]=4 1438 B7R1.1 OCc1c[nH]cc1 1P00FVQG [0,1,0,0,1,0|1,0,1]=4 1439 B7R1.1 OCc1c[nH]nc1 1P002RF9 [0,1,0,0,1,0|2,0,0]=4 1440 B7R1.1 OCc1ccco1 1P003R60 [0,1,0,0,1,0|2,0,0]=4 1441 B7R1.1 OCc1cccs1 1P003BQJ [0,1,0,0,1,0|2,0,0]=4 1442 B7R1.1 OCc1ccno1 1P006AUF [0,1,0,0,1,0|2,0,0]=4 1443 B7R1.1 OCc1ccns1 1P00ACUC [0,1,0,0,1,0|2,0,0]=4 1444 B7R1.1 OCc1cnco1 1P000X8T [0,1,0,0,1,0|2,0,0]=4 1445 B7R1.1 OCc1cncs1 1P0034R1 [0,1,0,0,1,0|2,0,0]=4 1446 B7R1.1 OCc1cocc1 1P0072QO [0,1,0,0,1,0|2,0,0]=4 1447 B7R1.1 OCc1conc1 1P0038JR [0,1,0,0,1,0|2,0,0]=4 1448 B7R1.1 OCc1cscc1 1P003KDJ [0,1,0,0,1,0|2,0,0]=4 1449 B7R1.1 OCc1csnc1 1P00BAEG [0,1,0,0,1,0|2,0,0]=4 1450 B7R1.1 SCc1ccc[nH]1 1P01DX9D [0,1,0,0,1,0|2,0,0]=4 1451 B7R1.1 SCc1ccco1 1P003R61 [0,1,0,0,1,0|2,0,0]=4 1452 B7R1.1 SCc1cccs1 1P003IEO [0,1,0,0,1,0|2,0,0]=4 1453 B7R1.1 SCc1ccno1 1P020M66 [0,1,0,0,1,0|2,0,0]=4 1454 B7R1.1 SCc1cncs1 1P028027 [0,1,0,0,1,0|2,0,0]=4 1455 B7R1.1 SCc1cocc1 1P01Q6AT [0,1,0,0,1,0|2,0,0]=4 1456 B7R1.1 SCc1conc1 1P028BD5 [0,1,0,0,1,0|2,0,0]=4 1457 B7R1.1 SCc1cscc1 1P001V2D [0,1,0,0,1,0|2,0,0]=4 1458 B7R1.1 c1cnoc1C#N 1P00FFST [0,1,0,0,1,0|1,0,1]=4 1459 B7R1.1 c1ncoc1C#N 1P00FEG2 [0,1,0,0,1,0|1,0,1]=4 1460 B7R1.1 c1ncsc1C#N 1P007MOG [0,1,0,0,1,0|1,0,1]=4 1461 B7R1.2 Brc1[nH]nc(c1)Br 1P00ILLJ [0,1,0,0,1,0|2,0,0]=4 1462 B7R1.2 Brc1ccc([se]1)Br 1P0021HJ [0,1,0,0,1,0|2,0,0]=4 1463 B7R1.2 Brc1ccc(o1)Br 1P0033GQ [0,1,0,0,1,0|2,0,0]=4 1464 B7R1.2 Brc1ccc(s1)Br 1P003GDK [0,1,0,0,1,0|2,0,0]=4 1465 B7R1.2 Brc1ccc(s1)I 1P002Z2N [0,1,0,0,1,0|2,0,0]=4 1466 B7R1.2 Brc1cnc([nH]1)C 1P001TQX [0,1,0,0,1,0|2,0,0]=4 1467 B7R1.2 Brc1cnc([nH]1)I 1P0240J1 [0,1,0,0,1,0|2,0,0]=4 1468 B7R1.2 Brc1cnc(o1)C 1P01AD3O [0,1,0,0,1,0|2,0,0]=4 1469 B7R1.2 Brc1cnc(s1)C 1P003MYG [0,1,0,0,1,0|2,0,0]=4 1470 B7R1.2 Brc1cnc(s1)Cl 1P00309U [0,1,0,0,1,0|2,0,0]=4 1471 B7R1.2 Brc1cnc(s1)I 1P0094WD [0,1,0,0,1,0|2,0,0]=4 1472 B7R1.2 Brc1cnc(s1)N 1P000PRN [0,1,0,0,1,0|2,0,0]=4 1473 B7R1.2 Brc1cnc(s1)N 1P007NH8 [0,1,0,0,1,0|2,0,0]=4 1474 B7R1.2 Brc1cnc(s1)N 1P00IBAQ [0,1,0,0,1,0|2,0,0]=4 1475 B7R1.2 Brc1csc(c1)C 1P002YT6 [0,1,0,0,1,0|2,0,0]=4 1476 B7R1.2 Brc1csc(c1)Cl 1P0037TQ [0,1,0,0,1,0|2,0,0]=4 1477 B7R1.2 Brc1csc(c1)I 1P00ICX3 [0,1,0,0,1,0|2,0,0]=4 1478 B7R1.2 Brc1csc(n1)N 1P0034FG [0,1,0,0,1,0|2,0,0]=4 1479 B7R1.2 Brc1n[nH]c(c1)C 1P00EISV [0,1,0,0,1,0|2,0,0]=4 1480 B7R1.2 Brc1n[nH]c(c1)Cl 1P01CAM0 [0,1,0,0,1,0|2,0,0]=4 1481 B7R1.2 Brc1n[nH]c(c1)N 1P003A9H [0,1,0,0,1,0|1,0,0]=3 1482 B7R1.2 Brc1ncc([nH]1)Br 1P00390Z [0,1,0,0,1,0|2,0,0]=4 1483 B7R1.2 Brc1ncc(s1)Br 1P00BYXF [0,1,0,0,1,0|2,0,0]=4 1484 B7R1.2 Brc1noc(c1)C 1P003871 [0,1,0,0,1,0|2,0,0]=4 1485 B7R1.2 Brc1nsc(n1)N 1P0084SC [0,1,0,0,1,0|2,0,0]=4 1486 B7R1.2 Brc1scc(c1)Br 1P0033FJ [0,1,0,0,1,0|2,0,0]=4 1487 B7R1.2 CC1=CC(=O)N=N1 1P01HFI0 [0,1,0,0,1,0|2,0,0]=4 1488 B7R1.2 CC1=NN=C(C1)N 1P0008X3 [0,1,0,0,1,0|1,0,1]=4 1489 B7R1.2 CN1N=CC(=C1)S 1P01FWVE [0,1,0,0,1,0|2,0,0]=4 1490 B7R1.2 C[n+]1cn(cn1)N 1P0078O2 [0,1,0,0,1,0|2,0,0]=4 1491 B7R1.2 Cc1[nH]cc(c1)C 1P0036EO [0,1,0,0,1,0|1,0,1]=4 1492 B7R1.2 Cc1[nH]nc(c1)C 1P00340B [0,1,0,0,1,0|2,0,0]=4 1493 B7R1.2 Cc1c[nH]c(n1)N 1P00FB1G [0,1,0,0,1,0|2,0,0]=4 1494 B7R1.2 Cc1ccc([nH]1)C 1P0033H9 [0,1,0,0,1,0|2,0,0]=4 1495 B7R1.2 Cc1ccc(o1)Br 1P000LMO [0,1,0,0,1,0|2,0,0]=4 1496 B7R1.2 Cc1ccc(o1)C 1P00IBHV [0,1,0,0,1,0|2,0,0]=4 1497 B7R1.2 Cc1ccc(s1)Br 1P003H6V [0,1,0,0,1,0|2,0,0]=4 1498 B7R1.2 Cc1ccc(s1)C 1P0037FV [0,1,0,0,1,0|2,0,0]=4 1499 B7R1.2 Cc1ccc(s1)Cl 1P003BNY [0,1,0,0,1,0|2,0,0]=4 1500 B7R1.2 Cc1ccc(s1)I 1P001VNL [0,1,0,0,1,0|2,0,0]=4 1501 B7R1.2 Cc1ccc(s1)O 1P01DWX2 [0,1,0,0,1,0|2,0,0]=4 1502 B7R1.2 Cc1ccc(s1)S 1P00D0KV [0,1,0,0,1,0|2,0,0]=4 1503 B7R1.2 Cc1ccn(c1)C 1P01BKQP [0,1,0,0,1,0|1,0,1]=4 1504 B7R1.2 Cc1ccn(c1)N 1P024RJW [0,1,0,0,1,0|1,0,0]=3 1505 B7R1.2 Cc1cnc([nH]1)Br 1P002NCF [0,1,0,0,1,0|2,0,0]=4 1506 B7R1.2 Cc1cnc([nH]1)Cl 1P01ZYD1 [0,1,0,0,1,0|2,0,0]=4 1507 B7R1.2 Cc1cnc([nH]1)N 1P008U4V [0,1,0,0,1,0|2,0,0]=4 1508 B7R1.2 Cc1cnc(o1)Br 1P009D83 [0,1,0,0,1,0|2,0,0]=4 1509 B7R1.2 Cc1cnc(o1)Cl 1P01EIR2 [0,1,0,0,1,0|2,0,0]=4 1510 B7R1.2 Cc1cnc(o1)I 1P027TXE [0,1,0,0,1,0|2,0,0]=4 1511 B7R1.2 Cc1cnc(o1)N 1P003846 [0,1,0,0,1,0|2,0,0]=4 1512 B7R1.2 Cc1cnc(s1)Br 1P0033ML [0,1,0,0,1,0|2,0,0]=4 1513 B7R1.2 Cc1cnc(s1)Cl 1P00I6ZQ [0,1,0,0,1,0|2,0,0]=4 1514 B7R1.2 Cc1cnc(s1)F 1P003AHM [0,1,0,0,1,0|2,0,0]=4 1515 B7R1.2 Cc1cnc(s1)I 1P00G9TC [0,1,0,0,1,0|2,0,0]=4 1516 B7R1.2 Cc1cnc(s1)N 1P003GY4 [0,1,0,0,1,0|2,0,0]=4 1517 B7R1.2 Cc1cnc(s1)N 1P01D9HV [0,1,0,0,1,0|2,0,0]=4 1518 B7R1.2 Cc1cnn(c1)C 1P003E5J [0,1,0,0,1,0|2,0,0]=4 1519 B7R1.2 Cc1coc(n1)N 1P00I7J9 [0,1,0,0,1,0|2,0,0]=4 1520 B7R1.2 Cc1csc(c1)Br 1P00DIEK [0,1,0,0,1,0|2,0,0]=4 1521 B7R1.2 Cc1csc(c1)N 1P001FKH [0,1,0,0,1,0|1,0,0]=3 1522 B7R1.2 Cc1csc(c1)N 1P00H1HI [0,1,0,0,1,0|1,0,0]=3 1523 B7R1.2 Cc1csc(c1)S 1P01BJTY [0,1,0,0,1,0|2,0,0]=4 1524 B7R1.2 Cc1csc(n1)N 1P001SAV [0,1,0,0,1,0|2,0,0]=4 1525 B7R1.2 Cc1csc(n1)N 1P003GWA [0,1,0,0,1,0|2,0,0]=4 1526 B7R1.2 Cc1n[nH]c(c1)Br 1P00EISX [0,1,0,0,1,0|2,0,0]=4 1527 B7R1.2 Cc1n[nH]c(c1)N 1P00I5JL [0,1,0,0,1,0|1,0,0]=3 1528 B7R1.2 Cc1n[nH]c(c1)O 1P0011IB [0,1,0,0,1,0|2,0,0]=4 1529 B7R1.2 Cc1n[nH]c(n1)N 1P002NE8 [0,1,0,0,1,0|2,0,0]=4 1530 B7R1.2 Cc1n[nH]c(n1)N 1P00J7SY [0,1,0,0,1,0|2,0,0]=4 1531 B7R1.2 Cc1ncc(o1)C 1P002MBO [0,1,0,0,1,0|2,0,0]=4 1532 B7R1.2 Cc1ncc(s1)C 1P0038D4 [0,1,0,0,1,0|2,0,0]=4 1533 B7R1.2 Cc1nnc([nH]1)N 1P0039N2 [0,1,0,0,1,0|2,0,0]=4 1534 B7R1.2 Cc1nnc(o1)N 1P00D9EM [0,1,0,0,1,0|2,0,0]=4 1535 B7R1.2 Cc1nnc(s1)N 1P00845C [0,1,0,0,1,0|2,0,0]=4 1536 B7R1.2 Cc1noc(c1)Br 1P000T5G [0,1,0,0,1,0|2,0,0]=4 1537 B7R1.2 Cc1noc(c1)Cl 1P01A225 [0,1,0,0,1,0|2,0,0]=4 1538 B7R1.2 Cc1noc(c1)I 1P000RWK [0,1,0,0,1,0|2,0,0]=4 1539 B7R1.2 Cc1noc(c1)N 1P001ES3 [0,1,0,0,1,0|1,0,0]=3 1540 B7R1.2 Cc1noc(c1)O 1P019SLV [0,1,0,0,1,0|2,0,0]=4 1541 B7R1.2 Cc1noc(n1)N 1P0038EI [0,1,0,0,1,0|2,0,0]=4 1542 B7R1.2 Cc1nsc(c1)Br 1P002A8D [0,1,0,0,1,0|2,0,0]=4 1543 B7R1.2 Cc1nsc(c1)Cl 1P00C1RP [0,1,0,0,1,0|2,0,0]=4 1544 B7R1.2 Cc1nsc(c1)I 1P00BGK5 [0,1,0,0,1,0|2,0,0]=4 1545 B7R1.2 Cc1nsc(c1)N 1P003A0Z [0,1,0,0,1,0|1,0,0]=3 1546 B7R1.2 Cc1nsc(c1)N 1P006WQP [0,1,0,0,1,0|1,0,0]=3 1547 B7R1.2 Cc1nsc(n1)N 1P0020BM [0,1,0,0,1,0|2,0,0]=4 1548 B7R1.2 Cc1occ(c1)C 1P00CVZ8 [0,1,0,0,1,0|2,0,0]=4 1549 B7R1.2 Cc1onc(c1)C 1P003J5N [0,1,0,0,1,0|2,0,0]=4 1550 B7R1.2 Cc1scc(c1)C 1P00E9VH [0,1,0,0,1,0|2,0,0]=4 1551 B7R1.2 Clc1ccc(s1)Br 1P002WQS [0,1,0,0,1,0|2,0,0]=4 1552 B7R1.2 Clc1ccc(s1)Cl 1P003GEI [0,1,0,0,1,0|2,0,0]=4 1553 B7R1.2 Clc1ccc(s1)I 1P002WOU [0,1,0,0,1,0|2,0,0]=4 1554 B7R1.2 Clc1cnc(s1)Br 1P00AMFV [0,1,0,0,1,0|2,0,0]=4 1555 B7R1.2 Clc1cnc(s1)C 1P01BBPJ [0,1,0,0,1,0|2,0,0]=4 1556 B7R1.2 Clc1cnc(s1)F 1P0291R4 [0,1,0,0,1,0|2,0,0]=4 1557 B7R1.2 Clc1cnc(s1)N 1P003GXI [0,1,0,0,1,0|2,0,0]=4 1558 B7R1.2 Clc1csc(c1)Br 1P00I6LU [0,1,0,0,1,0|2,0,0]=4 1559 B7R1.2 Clc1csc(c1)I 1P028AXN [0,1,0,0,1,0|2,0,0]=4 1560 B7R1.2 Clc1csc(n1)N 1P003LP8 [0,1,0,0,1,0|2,0,0]=4 1561 B7R1.2 Clc1n[nH]c(c1)C 1P001RM2 [0,1,0,0,1,0|2,0,0]=4 1562 B7R1.2 Clc1ncc([nH]1)Cl 1P0293E4 [0,1,0,0,1,0|2,0,0]=4 1563 B7R1.2 Clc1ncc(s1)Cl 1P00ANA1 [0,1,0,0,1,0|2,0,0]=4 1564 B7R1.2 Clc1nsc(n1)N 1P01K1EQ [0,1,0,0,1,0|2,0,0]=4 1565 B7R1.2 Clc1scc(c1)Cl 1P027EOK [0,1,0,0,1,0|2,0,0]=4 1566 B7R1.2 Cn1cc(cn1)Br 1P001QEF [0,1,0,0,1,0|2,0,0]=4 1567 B7R1.2 Cn1cc(cn1)Cl 1P003LIS [0,1,0,0,1,0|2,0,0]=4 1568 B7R1.2 Cn1cc(cn1)F 1P01JWK7 [0,1,0,0,1,0|2,0,0]=4 1569 B7R1.2 Cn1cc(cn1)I 1P003M0U [0,1,0,0,1,0|2,0,0]=4 1570 B7R1.2 Cn1cc(cn1)N 1P000X5K [0,1,0,0,1,0|1,0,0]=3 1571 B7R1.2 Cn1cc(cn1)N 1P003L4D [0,1,0,0,1,0|1,0,0]=3 1572 B7R1.2 Cn1cc(cn1)O 1P003AKQ [0,1,0,0,1,0|2,0,0]=4 1573 B7R1.2 Cn1cc(cn1)O 1P01AFQM [0,1,0,0,1,0|2,0,0]=4 1574 B7R1.2 Cn1cc(nc1)Br 1P003LBQ [0,1,0,0,1,0|2,0,0]=4 1575 B7R1.2 Cn1cc(nc1)I 1P0034JD [0,1,0,0,1,0|2,0,0]=4 1576 B7R1.2 Cn1cc(nc1)N 1P0036FQ [0,1,0,0,1,0|1,0,1]=4 1577 B7R1.2 Cn1ccc(c1)N 1P000JBD [0,1,0,0,1,0|0,0,1]=3 1578 B7R1.2 Cn1ccc(n1)N 1P002F0L [0,1,0,0,1,0|1,0,1]=4 1579 B7R1.2 Cn1cnc(c1)C 1P00EDBF [0,1,0,0,1,0|2,0,0]=4 1580 B7R1.2 Cn1nc(cn1)N 1P00GWBG [0,1,0,0,1,0|2,0,0]=4 1581 B7R1.2 Cn1nc(cn1)N 1P00J1MZ [0,1,0,0,1,0|2,0,0]=4 1582 B7R1.2 Cn1nnc(c1)N 1P0060JQ [0,1,0,0,1,0|2,0,0]=4 1583 B7R1.2 Cn1nnc(c1)N 1P00GYH3 [0,1,0,0,1,0|2,0,0]=4 1584 B7R1.2 Fc1ccc(s1)Br 1P00CRCX [0,1,0,0,1,0|2,0,0]=4 1585 B7R1.2 Fc1ccc(s1)I 1P01APFB [0,1,0,0,1,0|2,0,0]=4 1586 B7R1.2 Fc1cnc(s1)Br 1P0095WU [0,1,0,0,1,0|2,0,0]=4 1587 B7R1.2 Fc1cnc(s1)N 1P005K4Z [0,1,0,0,1,0|2,0,0]=4 1588 B7R1.2 Fc1cnc(s1)N 1P006TUC [0,1,0,0,1,0|2,0,0]=4 1589 B7R1.2 Fc1csc(c1)Br 1P00CA59 [0,1,0,0,1,0|2,0,0]=4 1590 B7R1.2 Ic1ccc(s1)I 1P003GFD [0,1,0,0,1,0|2,0,0]=4 1591 B7R1.2 Ic1cnc([nH]1)C 1P0036ZU [0,1,0,0,1,0|2,0,0]=4 1592 B7R1.2 Ic1cnc(o1)C 1P027ZEI [0,1,0,0,1,0|2,0,0]=4 1593 B7R1.2 Ic1cnc(s1)Br 1P007VCH [0,1,0,0,1,0|2,0,0]=4 1594 B7R1.2 Ic1cnc(s1)C 1P01BK7H [0,1,0,0,1,0|2,0,0]=4 1595 B7R1.2 Ic1cnc(s1)Cl 1P020LTQ [0,1,0,0,1,0|2,0,0]=4 1596 B7R1.2 Ic1csc(c1)C 1P001VNM [0,1,0,0,1,0|2,0,0]=4 1597 B7R1.2 Ic1csc(c1)Cl 1P00NK34 [0,1,0,0,1,0|2,0,0]=4 1598 B7R1.2 Ic1n[nH]c(c1)C 1P006I46 [0,1,0,0,1,0|2,0,0]=4 1599 B7R1.2 Ic1ncc([nH]1)I 1P002G12 [0,1,0,0,1,0|2,0,0]=4 1600 B7R1.2 NC1=CC(=O)CC1 1P002W78 [0,1,0,0,1,0|0,0,2]=4 1601 B7R1.2 Nc1[nH][nH]c(=O)c1 1P002VZO [0,1,0,0,1,0|1,0,1]=4 1602 B7R1.2 Nc1[nH]nc(c1)N 1P001VV5 [0,1,0,0,1,0|1,0,0]=3 1603 B7R1.2 Nc1[nH]nc(n1)N 1P001DL0 [0,1,0,0,1,0|2,0,0]=4 1604 B7R1.2 Nc1cc(=O)[nH]o1 1P005GYW [0,1,0,0,1,0|1,0,1]=4 1605 B7R1.2 Nc1cnc(s1)C 1P00417S [0,1,0,0,1,0|1,0,0]=3 1606 B7R1.2 Nc1cnn(c1)C 1P003EXV [0,1,0,0,1,0|1,0,0]=3 1607 B7R1.2 Nc1csc(c1)Br 1P01LOUQ [0,1,0,0,1,0|1,0,0]=3 1608 B7R1.2 Nc1csc(c1)C 1P00BGJR [0,1,0,0,1,0|1,0,0]=3 1609 B7R1.2 Nc1csc(c1)Cl 1P001DBG [0,1,0,0,1,0|1,0,0]=3 1610 B7R1.2 Nc1csc(n1)Br 1P0038D7 [0,1,0,0,1,0|2,0,0]=4 1611 B7R1.2 Nc1csc(n1)C 1P0022AG [0,1,0,0,1,0|2,0,0]=4 1612 B7R1.2 Nc1n[nH]c(c1)C 1P00BCWR [0,1,0,0,1,0|1,0,1]=4 1613 B7R1.2 Nc1n[nH]c(c1)Cl 1P00IH99 [0,1,0,0,1,0|1,0,1]=4 1614 B7R1.2 Nc1n[nH]c(c1)F 1P000HKP [0,1,0,0,1,0|1,0,1]=4 1615 B7R1.2 Nc1n[nH]c(c1)O 1P003418 [0,1,0,0,1,0|1,0,1]=4 1616 B7R1.2 Nc1ncn(c1)C 1P0013KD [0,1,0,0,1,0|1,0,1]=4 1617 B7R1.2 Nc1nnc(s1)Br 1P0033K4 [0,1,0,0,1,0|2,0,0]=4 1618 B7R1.2 Nc1nnc(s1)Cl 1P00CAFL [0,1,0,0,1,0|2,0,0]=4 1619 B7R1.2 Nc1nnc(s1)N 1P002YN2 [0,1,0,0,1,0|2,0,0]=4 1620 B7R1.2 Nc1nnc(s1)S 1P0034N5 [0,1,0,0,1,0|2,0,0]=4 1621 B7R1.2 Nc1noc(c1)C 1P003JDC [0,1,0,0,1,0|2,0,0]=4 1622 B7R1.2 Nc1nsc(c1)C 1P01AMKD [0,1,0,0,1,0|2,0,0]=4 1623 B7R1.2 Nc1onc(c1)N 1P01A8LY [0,1,0,0,1,0|1,0,0]=3 1624 B7R1.2 Nc1scc(n1)N 1P00FHHM [0,1,0,0,1,0|2,0,0]=4 1625 B7R1.2 Nc1snc(n1)N 1P00CII6 [0,1,0,0,1,0|2,0,0]=4 1626 B7R1.2 Nn1cc(cn1)Br 1P0017RI [0,1,0,0,1,0|2,0,0]=4 1627 B7R1.2 O=C1C=CC(=O)C1 1P003LQK [0,1,0,0,1,0|1,0,1]=4 1628 B7R1.2 O=C1C=CC(=O)N1 1P0035L0 [0,1,0,0,1,0|2,0,0]=4 1629 B7R1.2 O=C1C=CC(=O)O1 1P0035KZ [0,1,0,0,1,0|2,0,0]=4 1630 B7R1.2 O=C1C=CC(=O)O1 1P01G8TR [0,1,0,0,1,0|2,0,0]=4 1631 B7R1.2 Oc1ccc(s1)Br 1P000WET [0,1,0,0,1,0|2,0,0]=4 1632 B7R1.2 Oc1csc(n1)N 1P0068D4 [0,1,0,0,1,0|2,0,0]=4 1633 B7R1.2 Oc1n[nH]c(c1)C 1P001L0T [0,1,0,0,1,0|2,0,0]=4 1634 B7R1.2 Oc1n[nH]c(c1)N 1P01KKIY [0,1,0,0,1,0|1,0,0]=3 1635 B7R1.2 On1cc(cn1)I 1P004HFY [0,1,0,0,1,0|2,0,0]=4 1636 B7R1.2 Sc1csc(c1)C 1P01Q2WP [0,1,0,0,1,0|2,0,0]=4 1637 B7R1.4 Brc1[nH]cnc1Br 1P002MDA [0,1,0,0,1,0|2,0,0]=4 1638 B7R1.4 Brc1c[nH]nc1C 1P0018FJ [0,1,0,0,1,0|2,0,0]=4 1639 B7R1.4 Brc1c[nH]nc1Cl 1P01DZQB [0,1,0,0,1,0|2,0,0]=4 1640 B7R1.4 Brc1c[nH]nc1F 1P00HTVS [0,1,0,0,1,0|2,0,0]=4 1641 B7R1.4 Brc1c[nH]nc1I 1P01FUBW [0,1,0,0,1,0|2,0,0]=4 1642 B7R1.4 Brc1c[nH]nc1N 1P001VFL [0,1,0,0,1,0|1,0,1]=4 1643 B7R1.4 Brc1ccoc1C 1P004W05 [0,1,0,0,1,0|2,0,0]=4 1644 B7R1.4 Brc1ccoc1I 1P01BK7D [0,1,0,0,1,0|2,0,0]=4 1645 B7R1.4 Brc1ccsc1C 1P00307X [0,1,0,0,1,0|2,0,0]=4 1646 B7R1.4 Brc1ccsc1Cl 1P003JGW [0,1,0,0,1,0|2,0,0]=4 1647 B7R1.4 Brc1ccsc1I 1P00EIUZ [0,1,0,0,1,0|2,0,0]=4 1648 B7R1.4 Brc1cnoc1C 1P00FBVU [0,1,0,0,1,0|2,0,0]=4 1649 B7R1.4 Brc1cnoc1N 1P028S8E [0,1,0,0,1,0|1,0,0]=3 1650 B7R1.4 Brc1cnsc1C 1P01A0EI [0,1,0,0,1,0|2,0,0]=4 1651 B7R1.4 Brc1cnsc1N 1P028LCE [0,1,0,0,1,0|1,0,0]=3 1652 B7R1.4 Brc1cnsc1N 1P028TE8 [0,1,0,0,1,0|1,0,0]=3 1653 B7R1.4 Brc1cocc1Br 1P003IWC [0,1,0,0,1,0|2,0,0]=4 1654 B7R1.4 Brc1conc1C 1P008Z60 [0,1,0,0,1,0|2,0,0]=4 1655 B7R1.4 Brc1conc1O 1P00CZMB [0,1,0,0,1,0|2,0,0]=4 1656 B7R1.4 Brc1cscc1Br 1P0033YX [0,1,0,0,1,0|2,0,0]=4 1657 B7R1.4 Brc1cscc1C 1P00307Z [0,1,0,0,1,0|2,0,0]=4 1658 B7R1.4 Brc1cscc1Cl 1P00I7MM [0,1,0,0,1,0|2,0,0]=4 1659 B7R1.4 Brc1cscc1N 1P00I28H [0,1,0,0,1,0|1,0,0]=3 1660 B7R1.4 Brc1csnc1C 1P006JMD [0,1,0,0,1,0|2,0,0]=4 1661 B7R1.4 Brc1csnc1N 1P0290IR [0,1,0,0,1,0|2,0,0]=4 1662 B7R1.4 Brc1csnc1O 1P028ND6 [0,1,0,0,1,0|2,0,0]=4 1663 B7R1.4 Brc1n[nH]cc1Br 1P00ELYM [0,1,0,0,1,0|2,0,0]=4 1664 B7R1.4 Brc1ncoc1C 1P023P88 [0,1,0,0,1,0|2,0,0]=4 1665 B7R1.4 Brc1ncsc1C 1P0010UV [0,1,0,0,1,0|2,0,0]=4 1666 B7R1.4 Brc1nnsc1N 1P028EOP [0,1,0,0,1,0|2,0,0]=4 1667 B7R1.4 Brc1nscc1Br 1P0287Y6 [0,1,0,0,1,0|2,0,0]=4 1668 B7R1.4 Brc1sccc1Br 1P0033E9 [0,1,0,0,1,0|2,0,0]=4 1669 B7R1.4 Brc1scnc1Br 1P005MHD [0,1,0,0,1,0|2,0,0]=4 1670 B7R1.4 Cc1[nH]ccc1C 1P0037Y2 [0,1,0,0,1,0|1,0,1]=4 1671 B7R1.4 Cc1[nH]cnc1C 1P002MD8 [0,1,0,0,1,0|2,0,0]=4 1672 B7R1.4 Cc1[nH]cnc1C 1P00I9ZF [0,1,0,0,1,0|2,0,0]=4 1673 B7R1.4 Cc1[nH]cnc1C 1P00IEBV [0,1,0,0,1,0|2,0,0]=4 1674 B7R1.4 Cc1c[nH]cc1C 1P0036WU [0,1,0,0,1,0|1,0,1]=4 1675 B7R1.4 Cc1c[nH]nc1Br 1P003ATK [0,1,0,0,1,0|2,0,0]=4 1676 B7R1.4 Cc1c[nH]nc1Cl 1P01AN5U [0,1,0,0,1,0|2,0,0]=4 1677 B7R1.4 Cc1c[nH]nc1N 1P00JGGO [0,1,0,0,1,0|1,0,1]=4 1678 B7R1.4 Cc1c[nH]nc1O 1P00J2YC [0,1,0,0,1,0|2,0,0]=4 1679 B7R1.4 Cc1ccsc1Br 1P003H3U [0,1,0,0,1,0|2,0,0]=4 1680 B7R1.4 Cc1ccsc1Cl 1P003HCL [0,1,0,0,1,0|2,0,0]=4 1681 B7R1.4 Cc1ccsc1I 1P001VNK [0,1,0,0,1,0|2,0,0]=4 1682 B7R1.4 Cc1ccsc1S 1P01BKP7 [0,1,0,0,1,0|2,0,0]=4 1683 B7R1.4 Cc1cn[nH]c1I 1P00I53R [0,1,0,0,1,0|2,0,0]=4 1684 B7R1.4 Cc1cn[nH]c1N 1P00ECEX [0,1,0,0,1,0|1,0,0]=3 1685 B7R1.4 Cc1cnoc1N 1P00C7EK [0,1,0,0,1,0|1,0,0]=3 1686 B7R1.4 Cc1cnsc1Br 1P00DK9L [0,1,0,0,1,0|2,0,0]=4 1687 B7R1.4 Cc1cnsc1N 1P028G8J [0,1,0,0,1,0|1,0,0]=3 1688 B7R1.4 Cc1cocc1C 1P002K4Z [0,1,0,0,1,0|2,0,0]=4 1689 B7R1.4 Cc1conc1Br 1P027WND [0,1,0,0,1,0|2,0,0]=4 1690 B7R1.4 Cc1conc1N 1P0020K6 [0,1,0,0,1,0|2,0,0]=4 1691 B7R1.4 Cc1cscc1C 1P00E9CW [0,1,0,0,1,0|2,0,0]=4 1692 B7R1.4 Cc1n[nH]cc1C 1P0028XH [0,1,0,0,1,0|2,0,0]=4 1693 B7R1.4 Cc1n[nH]cc1C 1P007LJF [0,1,0,0,1,0|2,0,0]=4 1694 B7R1.4 Cc1nc[nH]c1Br 1P001QH3 [0,1,0,0,1,0|2,0,0]=4 1695 B7R1.4 Cc1nc[nH]c1I 1P001QH4 [0,1,0,0,1,0|2,0,0]=4 1696 B7R1.4 Cc1nc[nH]c1N 1P003L6T [0,1,0,0,1,0|1,0,0]=3 1697 B7R1.4 Cc1ncoc1Br 1P01B34H [0,1,0,0,1,0|2,0,0]=4 1698 B7R1.4 Cc1ncsc1Br 1P0034OT [0,1,0,0,1,0|2,0,0]=4 1699 B7R1.4 Cc1ncsc1N 1P00FWA1 [0,1,0,0,1,0|1,0,0]=3 1700 B7R1.4 Cc1ncsc1N 1P01B26U [0,1,0,0,1,0|1,0,0]=3 1701 B7R1.4 Cc1nn[nH]c1N 1P01B5US [0,1,0,0,1,0|2,0,0]=4 1702 B7R1.4 Cc1nnsc1N 1P01DX13 [0,1,0,0,1,0|2,0,0]=4 1703 B7R1.4 Cc1occc1C 1P001LXH [0,1,0,0,1,0|2,0,0]=4 1704 B7R1.4 Cc1ocnc1C 1P002J27 [0,1,0,0,1,0|2,0,0]=4 1705 B7R1.4 Cc1scnc1C 1P0034BY [0,1,0,0,1,0|2,0,0]=4 1706 B7R1.4 Clc1[nH]cnc1Cl 1P001RQZ [0,1,0,0,1,0|2,0,0]=4 1707 B7R1.4 Clc1c[nH]nc1C 1P001RBU [0,1,0,0,1,0|2,0,0]=4 1708 B7R1.4 Clc1c[nH]nc1N 1P000T09 [0,1,0,0,1,0|1,0,1]=4 1709 B7R1.4 Clc1c[nH]nc1N 1P00DGO0 [0,1,0,0,1,0|1,0,1]=4 1710 B7R1.4 Clc1ccsc1Br 1P005RPO [0,1,0,0,1,0|2,0,0]=4 1711 B7R1.4 Clc1ccsc1C 1P007WBT [0,1,0,0,1,0|2,0,0]=4 1712 B7R1.4 Clc1ccsc1I 1P01BK8D [0,1,0,0,1,0|2,0,0]=4 1713 B7R1.4 Clc1cn[nH]c1Br 1P01JVAR [0,1,0,0,1,0|2,0,0]=4 1714 B7R1.4 Clc1cnoc1N 1P028P5S [0,1,0,0,1,0|1,0,0]=3 1715 B7R1.4 Clc1cscc1N 1P00E9G7 [0,1,0,0,1,0|1,0,0]=3 1716 B7R1.4 Clc1cscc1N 1P01KLJO [0,1,0,0,1,0|1,0,0]=3 1717 B7R1.4 Clc1nc[nH]c1Br 1P0020H3 [0,1,0,0,1,0|2,0,0]=4 1718 B7R1.4 Clc1nc[nH]c1C 1P004LHE [0,1,0,0,1,0|2,0,0]=4 1719 B7R1.4 Clc1sccc1Cl 1P003FYK [0,1,0,0,1,0|2,0,0]=4 1720 B7R1.4 Cn1ccnc1Br 1P003H2T [0,1,0,0,1,0|2,0,0]=4 1721 B7R1.4 Cn1ccnc1C 1P001ZQM [0,1,0,0,1,0|2,0,0]=4 1722 B7R1.4 Cn1ccnc1Cl 1P00BD1D [0,1,0,0,1,0|2,0,0]=4 1723 B7R1.4 Cn1ccnc1I 1P007CDV [0,1,0,0,1,0|2,0,0]=4 1724 B7R1.4 Cn1ccnc1N 1P001KWR [0,1,0,0,1,0|2,0,0]=4 1725 B7R1.4 Cn1ccnc1N 1P0039WI [0,1,0,0,1,0|2,0,0]=4 1726 B7R1.4 Cn1ccnc1S 1P00IB3Q [0,1,0,0,1,0|2,0,0]=4 1727 B7R1.4 Cn1cncc1Br 1P0001YC [0,1,0,0,1,0|2,0,0]=4 1728 B7R1.4 Cn1cncc1C 1P01A0LS [0,1,0,0,1,0|2,0,0]=4 1729 B7R1.4 Cn1cncc1Cl 1P003N2H [0,1,0,0,1,0|2,0,0]=4 1730 B7R1.4 Cn1cncc1I 1P00FAWG [0,1,0,0,1,0|2,0,0]=4 1731 B7R1.4 Cn1cncc1N 1P001REF [0,1,0,0,1,0|1,0,0]=3 1732 B7R1.4 Cn1cncc1N 1P00FFRY [0,1,0,0,1,0|1,0,0]=3 1733 B7R1.4 Cn1cnnc1N 1P001E7R [0,1,0,0,1,0|2,0,0]=4 1734 B7R1.4 Cn1cnnc1N 1P007WZ7 [0,1,0,0,1,0|2,0,0]=4 1735 B7R1.4 Cn1cnnc1N 1P01ACJY [0,1,0,0,1,0|2,0,0]=4 1736 B7R1.4 Cn1nccc1Br 1P0038FI [0,1,0,0,1,0|2,0,0]=4 1737 B7R1.4 Cn1nccc1C 1P005MKD [0,1,0,0,1,0|2,0,0]=4 1738 B7R1.4 Cn1nccc1Cl 1P00CL8T [0,1,0,0,1,0|2,0,0]=4 1739 B7R1.4 Cn1nccc1I 1P00C8NB [0,1,0,0,1,0|2,0,0]=4 1740 B7R1.4 Cn1nccc1N 1P000ISJ [0,1,0,0,1,0|1,0,0]=3 1741 B7R1.4 Cn1nccc1O 1P003AIK [0,1,0,0,1,0|2,0,0]=4 1742 B7R1.4 Cn1nccc1O 1P003EXW [0,1,0,0,1,0|2,0,0]=4 1743 B7R1.4 Cn1ncnc1N 1P001QBF [0,1,0,0,1,0|2,0,0]=4 1744 B7R1.4 Cn1nncc1N 1P002PFT [0,1,0,0,1,0|2,0,0]=4 1745 B7R1.4 Cn1nncc1N 1P0290FX [0,1,0,0,1,0|2,0,0]=4 1746 B7R1.4 Fc1c[nH]cc1F 1P000QNK [0,1,0,0,1,0|1,0,1]=4 1747 B7R1.4 Fc1c[nH]nc1Br 1P01JUPK [0,1,0,0,1,0|2,0,0]=4 1748 B7R1.4 Fc1ccsc1Cl 1P028ZDK [0,1,0,0,1,0|2,0,0]=4 1749 B7R1.4 Fc1ccsc1I 1P027VPP [0,1,0,0,1,0|2,0,0]=4 1750 B7R1.4 Fc1cn[nH]c1N 1P01BESP [0,1,0,0,1,0|1,0,0]=3 1751 B7R1.4 Fc1nc[nH]c1Br 1P00I1OI [0,1,0,0,1,0|2,0,0]=4 1752 B7R1.4 Ic1[nH]cnc1I 1P001QH2 [0,1,0,0,1,0|2,0,0]=4 1753 B7R1.4 Ic1c[nH]nc1Br 1P00CEPL [0,1,0,0,1,0|2,0,0]=4 1754 B7R1.4 Ic1c[nH]nc1C 1P001QDK [0,1,0,0,1,0|2,0,0]=4 1755 B7R1.4 Ic1c[nH]nc1Cl 1P01PW3U [0,1,0,0,1,0|2,0,0]=4 1756 B7R1.4 Ic1c[nH]nc1F 1P020JQK [0,1,0,0,1,0|2,0,0]=4 1757 B7R1.4 Ic1ccsc1Br 1P00BGJV [0,1,0,0,1,0|2,0,0]=4 1758 B7R1.4 Ic1cn[nH]c1N 1P00GAHS [0,1,0,0,1,0|1,0,0]=3 1759 B7R1.4 Ic1cnoc1C 1P005HNQ [0,1,0,0,1,0|2,0,0]=4 1760 B7R1.4 Ic1cnoc1N 1P01B5SN [0,1,0,0,1,0|1,0,0]=3 1761 B7R1.4 Ic1cocc1C 1P01ANWT [0,1,0,0,1,0|2,0,0]=4 1762 B7R1.4 Ic1cscc1Br 1P005B28 [0,1,0,0,1,0|2,0,0]=4 1763 B7R1.4 Ic1csnc1Br 1P01ELTX [0,1,0,0,1,0|2,0,0]=4 1764 B7R1.4 Ic1csnc1N 1P01FJ2X [0,1,0,0,1,0|2,0,0]=4 1765 B7R1.4 Ic1csnc1N 1P01FJ2Y [0,1,0,0,1,0|2,0,0]=4 1766 B7R1.4 Ic1ncoc1C 1P028TLC [0,1,0,0,1,0|2,0,0]=4 1767 B7R1.4 Ic1nonc1N 1P001QVY [0,1,0,0,1,0|2,0,0]=4 1768 B7R1.4 Ic1sccc1I 1P002GL1 [0,1,0,0,1,0|2,0,0]=4 1769 B7R1.4 Nc1c[nH]nc1Br 1P009X00 [0,1,0,0,1,0|1,0,0]=3 1770 B7R1.4 Nc1c[nH]nc1C 1P000JZM [0,1,0,0,1,0|1,0,0]=3 1771 B7R1.4 Nc1c[nH]nc1C 1P007B6V [0,1,0,0,1,0|1,0,0]=3 1772 B7R1.4 Nc1c[nH]nc1Cl 1P008UTO [0,1,0,0,1,0|1,0,0]=3 1773 B7R1.4 Nc1c[nH]nc1Cl 1P00EL0C [0,1,0,0,1,0|1,0,0]=3 1774 B7R1.4 Nc1ccsc1Br 1P00IKUH [0,1,0,0,1,0|1,0,0]=3 1775 B7R1.4 Nc1ccsc1C 1P01BRMN [0,1,0,0,1,0|1,0,0]=3 1776 B7R1.4 Nc1ccsc1Cl 1P01AGQV [0,1,0,0,1,0|1,0,0]=3 1777 B7R1.4 Nc1cn[nH]c1C 1P00G5R0 [0,1,0,0,1,0|1,0,0]=3 1778 B7R1.4 Nc1cnoc1C 1P0002LG [0,1,0,0,1,0|1,0,0]=3 1779 B7R1.4 Nc1cnoc1C 1P004I86 [0,1,0,0,1,0|1,0,0]=3 1780 B7R1.4 Nc1cnsc1Br 1P01B2VU [0,1,0,0,1,0|1,0,0]=3 1781 B7R1.4 Nc1cnsc1Br 1P028ANF [0,1,0,0,1,0|1,0,0]=3 1782 B7R1.4 Nc1cnsc1C 1P0284VU [0,1,0,0,1,0|1,0,0]=3 1783 B7R1.4 Nc1conc1C 1P00CJB5 [0,1,0,0,1,0|1,0,0]=3 1784 B7R1.4 Nc1conc1C 1P01C5S8 [0,1,0,0,1,0|1,0,0]=3 1785 B7R1.4 Nc1cscc1C 1P00CCYZ [0,1,0,0,1,0|1,0,0]=3 1786 B7R1.4 Nc1cscc1N 1P003V9A [0,1,0,0,1,0|1,0,0]=3 1787 B7R1.4 Nc1cscc1N 1P008MOQ [0,1,0,0,1,0|1,0,0]=3 1788 B7R1.4 Nc1csnc1Br 1P028SVW [0,1,0,0,1,0|1,0,0]=3 1789 B7R1.4 Nc1csnc1C 1P01EIGO [0,1,0,0,1,0|1,0,0]=3 1790 B7R1.4 Nc1n[nH]cc1N 1P001VFK [0,1,0,0,1,0|1,0,0]=3 1791 B7R1.4 Nc1n[nH]cc1N 1P00HZ8F [0,1,0,0,1,0|1,0,0]=3 1792 B7R1.4 Nc1ncsc1C 1P01BVRP [0,1,0,0,1,0|2,0,0]=4 1793 B7R1.4 Nc1ncsc1C 1P01BVRQ [0,1,0,0,1,0|2,0,0]=4 1794 B7R1.4 Nc1nonc1C 1P00255Q [0,1,0,0,1,0|2,0,0]=4 1795 B7R1.4 Nc1nonc1N 1P00330W [0,1,0,0,1,0|2,0,0]=4 1796 B7R1.4 Nc1nsnc1N 1P00DT4H [0,1,0,0,1,0|2,0,0]=4 1797 B7R1.4 Nn1cccc1C 1P028FJN [0,1,0,0,1,0|1,0,0]=3 1798 B7R1.4 Nn1cn[nH]c1=O 1P0001YA [0,1,0,0,1,0|2,0,0]=4 1799 B7R1.4 Nn1cn[nH]c1=S 1P003A7X [0,1,0,0,1,0|2,0,0]=4 1800 B7R1.4 Nn1cnnc1C 1P00J2TQ [0,1,0,0,1,0|2,0,0]=4 1801 B7R1.4 Nn1cnnc1N 1P019OH2 [0,1,0,0,1,0|2,0,0]=4 1802 B7R1.4 Nn1cnnc1S 1P028LQV [0,1,0,0,1,0|2,0,0]=4 1803 B7R1.4 O=C1OCC=C1N 1P00I73J [0,1,0,0,1,0|1,0,1]=4 1804 B7R1.4 O=c1[nH][nH]cc1N 1P01AMNR [0,1,0,0,1,0|1,0,1]=4 1805 B7R1.4 Oc1cnoc1C 1P027UVL [0,1,0,0,1,0|2,0,0]=4 1806 B7R1.4 Sc1ccoc1C 1P002W7D [0,1,0,0,1,0|2,0,0]=4 1807 B9R1.5 Clc1cccccc1=O 1P00CA25 [0,1,0,0,0,1|2,0,0]=4 1808 B9R1.5 Fc1cccccc1=O 1P0284ZS [0,1,0,0,0,1|2,0,0]=4 1809 B9R1.5 Nc1cccccc1=O 1P00ELGF [0,1,0,0,0,1|1,0,0]=3 1810 B9R1.5 Oc1cccccc1=O 1P003AT6 [0,1,0,0,0,1|2,0,0]=4 1811 B9R1.1 BrCc1ccc(cc1)Br 1P0034EX [0,2,0,0,0,0|2,0,0]=4 1812 B9R1.1 BrCc1ccc(cc1)C 1P003M85 [0,2,0,0,0,0|2,0,0]=4 1813 B9R1.1 BrCc1ccc(cc1)Cl 1P0036O0 [0,2,0,0,0,0|2,0,0]=4 1814 B9R1.1 BrCc1ccc(cc1)F 1P0034I2 [0,2,0,0,0,0|2,0,0]=4 1815 B9R1.1 BrCc1ccc(cc1)I 1P001S36 [0,2,0,0,0,0|2,0,0]=4 1816 B9R1.1 BrCc1ccc(cc1)N 1P00ED7U [0,2,0,0,0,0|1,0,0]=3 1817 B9R1.1 BrCc1ccc(nc1)N 1P01B29T [0,2,0,0,0,0|2,0,0]=4 1818 B9R1.1 Brc1ccc(cc1)[N+]#N 1P003LG6 [0,2,0,0,0,0|1,0,1]=4 1819 B9R1.1 Brc1ccc(cc1)[N+]#[C-] 1P00BZ3W [0,2,0,0,0,0|1,0,1]=4 1820 B9R1.1 C#Cc1ccc(cc1)Br 1P0038WU [0,2,0,0,0,0|2,0,0]=4 1821 B9R1.1 C#Cc1ccc(cc1)C 1P003LTB [0,2,0,0,0,0|2,0,0]=4 1822 B9R1.1 C#Cc1ccc(cc1)F 1P0034I8 [0,2,0,0,0,0|2,0,0]=4 1823 B9R1.1 C#Cc1ccc(cc1)I 1P005J01 [0,2,0,0,0,0|2,0,0]=4 1824 B9R1.1 C#Cc1ccc(cc1)N 1P0034HG [0,2,0,0,0,0|1,0,0]=3 1825 B9R1.1 C#Cc1ccc(cc1)O 1P00BFTX [0,2,0,0,0,0|2,0,0]=4 1826 B9R1.1 C#Cc1ccc(cn1)N 1P00A0YZ [0,2,0,0,0,0|2,0,0]=4 1827 B9R1.1 C#Cc1ccc(nc1)N 1P008K1E [0,2,0,0,0,0|2,0,0]=4 1828 B9R1.1 C=Cc1cc[n+](cc1)C 1P023Z9O [0,2,0,0,0,0|1,0,1]=4 1829 B9R1.1 C=Cc1ccc(cc1)Br 1P0029MX [0,2,0,0,0,0|2,0,0]=4 1830 B9R1.1 C=Cc1ccc(cc1)C 1P003M9D [0,2,0,0,0,0|2,0,0]=4 1831 B9R1.1 C=Cc1ccc(cc1)Cl 1P0038SY [0,2,0,0,0,0|2,0,0]=4 1832 B9R1.1 C=Cc1ccc(cc1)F 1P00I8EG [0,2,0,0,0,0|2,0,0]=4 1833 B9R1.1 C=Cc1ccc(cc1)I 1P002NYE [0,2,0,0,0,0|2,0,0]=4 1834 B9R1.1 C=Cc1ccc(cc1)N 1P0038QW [0,2,0,0,0,0|1,0,0]=3 1835 B9R1.1 C=Cc1ccc(cc1)O 1P002T1L [0,2,0,0,0,0|2,0,0]=4 1836 B9R1.1 CC[n+]1ccc(cc1)C 1P0036F3 [0,2,0,0,0,0|1,0,1]=4 1837 B9R1.1 CCc1cc[n+](cc1)[O-] 1P003LT4 [0,2,0,0,0,0|1,0,1]=4 1838 B9R1.1 CCc1ccc(cc1)Br 1P001QP9 [0,2,0,0,0,0|2,0,0]=4 1839 B9R1.1 CCc1ccc(cc1)C 1P003LT6 [0,2,0,0,0,0|2,0,0]=4 1840 B9R1.1 CCc1ccc(cc1)Cl 1P00337G [0,2,0,0,0,0|2,0,0]=4 1841 B9R1.1 CCc1ccc(cc1)F 1P003ERU [0,2,0,0,0,0|2,0,0]=4 1842 B9R1.1 CCc1ccc(cc1)I 1P003ERV [0,2,0,0,0,0|2,0,0]=4 1843 B9R1.1 CCc1ccc(cc1)N 1P003LSI [0,2,0,0,0,0|1,0,0]=3 1844 B9R1.1 CCc1ccc(cc1)O 1P000KDC [0,2,0,0,0,0|2,0,0]=4 1845 B9R1.1 CCc1ccc(cc1)S 1P003LT5 [0,2,0,0,0,0|2,0,0]=4 1846 B9R1.1 CCc1ccc(cn1)N 1P000TDY [0,2,0,0,0,0|2,0,0]=4 1847 B9R1.1 CCc1ccc(nc1)N 1P002BZF [0,2,0,0,0,0|2,0,0]=4 1848 B9R1.1 CNc1ccc(cc1)C 1P0034AC [0,2,0,0,0,0|1,0,0]=3 1849 B9R1.1 CNc1ccc(cc1)Cl 1P003270 [0,2,0,0,0,0|1,0,0]=3 1850 B9R1.1 CNc1ccc(cc1)Cl 1P003LO9 [0,2,0,0,0,0|1,0,0]=3 1851 B9R1.1 CNc1ccc(cc1)F 1P003LWA [0,2,0,0,0,0|1,0,0]=3 1852 B9R1.1 CNc1ccc(cc1)I 1P00IB6M [0,2,0,0,0,0|1,0,0]=3 1853 B9R1.1 CNc1ccc(cc1)I 1P019GFT [0,2,0,0,0,0|1,0,0]=3 1854 B9R1.1 CNc1ccc(cc1)N 1P00DF30 [0,2,0,0,0,0|1,0,0]=3 1855 B9R1.1 CNc1ccc(cc1)N 1P00IBGX [0,2,0,0,0,0|1,0,0]=3 1856 B9R1.1 CNc1ccc(cc1)O 1P001MOT [0,2,0,0,0,0|1,0,0]=3 1857 B9R1.1 CNc1ccc(cc1)O 1P003M7V [0,2,0,0,0,0|1,0,0]=3 1858 B9R1.1 CNc1ccc(cc1)S 1P01BL04 [0,2,0,0,0,0|1,0,0]=3 1859 B9R1.1 CNc1ccc(cn1)Br 1P0054DA [0,2,0,0,0,0|2,0,0]=4 1860 B9R1.1 CNc1ccc(cn1)C 1P00DKLV [0,2,0,0,0,0|2,0,0]=4 1861 B9R1.1 CNc1ccc(cn1)Cl 1P007433 [0,2,0,0,0,0|2,0,0]=4 1862 B9R1.1 CNc1ccc(cn1)I 1P00BK8S [0,2,0,0,0,0|2,0,0]=4 1863 B9R1.1 CNc1ccc(cn1)N 1P008V2F [0,2,0,0,0,0|2,0,0]=4 1864 B9R1.1 CNc1ccc(cn1)N 1P00BEJL [0,2,0,0,0,0|2,0,0]=4 1865 B9R1.1 CNc1ccc(cn1)N 1P01FATH [0,2,0,0,0,0|2,0,0]=4 1866 B9R1.1 CNc1ccc(nc1)Br 1P00941T [0,2,0,0,0,0|2,0,0]=4 1867 B9R1.1 CNc1ccc(nc1)C 1P00943F [0,2,0,0,0,0|2,0,0]=4 1868 B9R1.1 CNc1ccc(nc1)Cl 1P008UXG [0,2,0,0,0,0|2,0,0]=4 1869 B9R1.1 CNc1ccc(nc1)F 1P00AOFA [0,2,0,0,0,0|2,0,0]=4 1870 B9R1.1 CNc1ccc(nc1)N 1P019SL4 [0,2,0,0,0,0|2,0,0]=4 1871 B9R1.1 COc1cc[n+](cc1)[O-] 1P002JKL [0,2,0,0,0,0|1,0,1]=4 1872 B9R1.1 COc1cc[n+](cc1)[O-] 1P003M5O [0,2,0,0,0,0|1,0,1]=4 1873 B9R1.1 COc1ccc(cc1)Br 1P0039GO [0,2,0,0,0,0|2,0,0]=4 1874 B9R1.1 COc1ccc(cc1)C 1P003M7W [0,2,0,0,0,0|2,0,0]=4 1875 B9R1.1 COc1ccc(cc1)Cl 1P003LMY [0,2,0,0,0,0|2,0,0]=4 1876 B9R1.1 COc1ccc(cc1)F 1P0034HW [0,2,0,0,0,0|2,0,0]=4 1877 B9R1.1 COc1ccc(cc1)I 1P003M17 [0,2,0,0,0,0|2,0,0]=4 1878 B9R1.1 COc1ccc(cc1)N 1P0028TX [0,2,0,0,0,0|1,0,0]=3 1879 B9R1.1 COc1ccc(cc1)N 1P0035WX [0,2,0,0,0,0|1,0,0]=3 1880 B9R1.1 COc1ccc(cc1)O 1P001MOS [0,2,0,0,0,0|2,0,0]=4 1881 B9R1.1 COc1ccc(cn1)N 1P0033U7 [0,2,0,0,0,0|2,0,0]=4 1882 B9R1.1 COc1ccc(nc1)N 1P0005LO [0,2,0,0,0,0|2,0,0]=4 1883 B9R1.1 CSc1ccc(cc1)Br 1P003LHW [0,2,0,0,0,0|2,0,0]=4 1884 B9R1.1 CSc1ccc(cc1)C 1P003CD6 [0,2,0,0,0,0|2,0,0]=4 1885 B9R1.1 CSc1ccc(cc1)Cl 1P000KDA [0,2,0,0,0,0|2,0,0]=4 1886 B9R1.1 CSc1ccc(cc1)F 1P003LX0 [0,2,0,0,0,0|2,0,0]=4 1887 B9R1.1 CSc1ccc(cc1)I 1P00BY6Q [0,2,0,0,0,0|2,0,0]=4 1888 B9R1.1 CSc1ccc(cc1)N 1P003KPS [0,2,0,0,0,0|1,0,0]=3 1889 B9R1.1 CSc1ccc(cc1)O 1P0034AH [0,2,0,0,0,0|2,0,0]=4 1890 B9R1.1 CSc1ccc(cc1)S 1P003KQA [0,2,0,0,0,0|2,0,0]=4 1891 B9R1.1 CSc1ccc(cn1)N 1P00CFUQ [0,2,0,0,0,0|2,0,0]=4 1892 B9R1.1 CSc1ccc(nc1)N 1P008P9S [0,2,0,0,0,0|2,0,0]=4 1893 B9R1.1 ClCc1ccc(cc1)Br 1P003LG2 [0,2,0,0,0,0|2,0,0]=4 1894 B9R1.1 ClCc1ccc(cc1)C 1P007GSP [0,2,0,0,0,0|2,0,0]=4 1895 B9R1.1 ClCc1ccc(cc1)Cl 1P0039GP [0,2,0,0,0,0|2,0,0]=4 1896 B9R1.1 ClCc1ccc(cc1)F 1P003LVW [0,2,0,0,0,0|2,0,0]=4 1897 B9R1.1 ClCc1ccc(cc1)I 1P00DCW1 [0,2,0,0,0,0|2,0,0]=4 1898 B9R1.1 ClCc1ccc(nc1)N 1P01EIRM [0,2,0,0,0,0|2,0,0]=4 1899 B9R1.1 Cl\N=C\1/C=CC(=O)C=C1 1P003TD5 [0,2,0,0,0,0|1,0,1]=4 1900 B9R1.1 Clc1ccc(cc1)[N+]#N 1P01BKQZ [0,2,0,0,0,0|1,0,1]=4 1901 B9R1.1 Clc1ccc(cc1)[N+]#[C-] 1P002HE4 [0,2,0,0,0,0|1,0,1]=4 1902 B9R1.1 FCc1ccc(cc1)Br 1P00DL86 [0,2,0,0,0,0|2,0,0]=4 1903 B9R1.1 Fc1ccc(cc1)[N+]#N 1P00D9HV [0,2,0,0,0,0|1,0,1]=4 1904 B9R1.1 Fc1ccc(cc1)[N+]#[C-] 1P007OPG [0,2,0,0,0,0|1,0,1]=4 1905 B9R1.1 ICc1ccc(cc1)Br 1P01B2VK [0,2,0,0,0,0|2,0,0]=4 1906 B9R1.1 ICc1ccc(cc1)Cl 1P01C1RU [0,2,0,0,0,0|2,0,0]=4 1907 B9R1.1 Ic1ccc(cc1)[N+]#N 1P01BKR0 [0,2,0,0,0,0|1,0,1]=4 1908 B9R1.1 N#Cc1cc[n+](cc1)C 1P000J5O [0,2,0,0,0,0|0,0,2]=4 1909 B9R1.1 N#Cc1cc[n+](cc1)[O-] 1P001LUD [0,2,0,0,0,0|0,0,2]=4 1910 B9R1.1 N#Cc1ccc(cc1)Br 1P0034EV [0,2,0,0,0,0|1,0,1]=4 1911 B9R1.1 N#Cc1ccc(cc1)C 1P007GS8 [0,2,0,0,0,0|1,0,1]=4 1912 B9R1.1 N#Cc1ccc(cc1)Cl 1P003LNC [0,2,0,0,0,0|1,0,1]=4 1913 B9R1.1 N#Cc1ccc(cc1)F 1P000PNR [0,2,0,0,0,0|1,0,1]=4 1914 B9R1.1 N#Cc1ccc(cc1)I 1P00311V [0,2,0,0,0,0|1,0,1]=4 1915 B9R1.1 N#Cc1ccc(cc1)N 1P0034H9 [0,2,0,0,0,0|1,0,0]=3 1916 B9R1.1 N#Cc1ccc(cc1)O 1P0034IS [0,2,0,0,0,0|1,0,1]=4 1917 B9R1.1 N#Cc1ccc(cc1)S 1P00398E [0,2,0,0,0,0|1,0,1]=4 1918 B9R1.1 N#Cc1ccc(cn1)N 1P003MV8 [0,2,0,0,0,0|2,0,0]=4 1919 B9R1.1 N#Cc1ccc(nc1)N 1P00I8N3 [0,2,0,0,0,0|2,0,0]=4 1920 B9R1.1 NCc1ccc(=O)[nH]c1 1P003MNG [0,2,0,0,0,0|2,0,0]=4 1921 B9R1.1 NCc1ccc(cc1)Br 1P002SK4 [0,2,0,0,0,0|1,0,0]=3 1922 B9R1.1 NCc1ccc(cc1)Br 1P0034EY [0,2,0,0,0,0|1,0,0]=3 1923 B9R1.1 NCc1ccc(cc1)C 1P007GSC [0,2,0,0,0,0|1,0,0]=3 1924 B9R1.1 NCc1ccc(cc1)Cl 1P0034GM [0,2,0,0,0,0|1,0,0]=3 1925 B9R1.1 NCc1ccc(cc1)Cl 1P00CMJJ [0,2,0,0,0,0|1,0,0]=3 1926 B9R1.1 NCc1ccc(cc1)F 1P001CDZ [0,2,0,0,0,0|1,0,0]=3 1927 B9R1.1 NCc1ccc(cc1)F 1P00FB8G [0,2,0,0,0,0|1,0,0]=3 1928 B9R1.1 NCc1ccc(cc1)I 1P003M1E [0,2,0,0,0,0|1,0,0]=3 1929 B9R1.1 NCc1ccc(cc1)I 1P003M1F [0,2,0,0,0,0|1,0,0]=3 1930 B9R1.1 NCc1ccc(cc1)N 1P003L7R [0,2,0,0,0,0|1,0,0]=3 1931 B9R1.1 NCc1ccc(cc1)N 1P00DE7Z [0,2,0,0,0,0|1,0,0]=3 1932 B9R1.1 NCc1ccc(cc1)O 1P0002CY [0,2,0,0,0,0|1,0,0]=3 1933 B9R1.1 NCc1ccc(cc1)O 1P0069EG [0,2,0,0,0,0|1,0,0]=3 1934 B9R1.1 NCc1ccc(cc1)O 1P00GSKB [0,2,0,0,0,0|1,0,0]=3 1935 B9R1.1 NCc1ccc(cc1)O 1P00IM7V [0,2,0,0,0,0|1,0,0]=3 1936 B9R1.1 NCc1ccc(cc1)S 1P01FKXD [0,2,0,0,0,0|1,0,0]=3 1937 B9R1.1 NCc1ccc(cn1)Br 1P000M47 [0,2,0,0,0,0|2,0,0]=4 1938 B9R1.1 NCc1ccc(cn1)Br 1P000NSJ [0,2,0,0,0,0|2,0,0]=4 1939 B9R1.1 NCc1ccc(cn1)Br 1P001ZTJ [0,2,0,0,0,0|2,0,0]=4 1940 B9R1.1 NCc1ccc(cn1)C 1P001W8Q [0,2,0,0,0,0|2,0,0]=4 1941 B9R1.1 NCc1ccc(cn1)C 1P00D9BM [0,2,0,0,0,0|2,0,0]=4 1942 B9R1.1 NCc1ccc(cn1)C 1P00J1OP [0,2,0,0,0,0|2,0,0]=4 1943 B9R1.1 NCc1ccc(cn1)Cl 1P000P3Q [0,2,0,0,0,0|2,0,0]=4 1944 B9R1.1 NCc1ccc(cn1)Cl 1P00FB1Q [0,2,0,0,0,0|2,0,0]=4 1945 B9R1.1 NCc1ccc(cn1)Cl 1P00GWHG [0,2,0,0,0,0|2,0,0]=4 1946 B9R1.1 NCc1ccc(cn1)F 1P003FFL [0,2,0,0,0,0|2,0,0]=4 1947 B9R1.1 NCc1ccc(cn1)I 1P027W72 [0,2,0,0,0,0|2,0,0]=4 1948 B9R1.1 NCc1ccc(cn1)N 1P0055YJ [0,2,0,0,0,0|2,0,0]=4 1949 B9R1.1 NCc1ccc(cn1)N 1P00IHOK [0,2,0,0,0,0|2,0,0]=4 1950 B9R1.1 NCc1ccc(cn1)O 1P000XNW [0,2,0,0,0,0|2,0,0]=4 1951 B9R1.1 NCc1ccc(cn1)O 1P028RPU [0,2,0,0,0,0|2,0,0]=4 1952 B9R1.1 NCc1ccc(nc1)Br 1P000NSI [0,2,0,0,0,0|2,0,0]=4 1953 B9R1.1 NCc1ccc(nc1)Br 1P007Q3R [0,2,0,0,0,0|2,0,0]=4 1954 B9R1.1 NCc1ccc(nc1)C 1P00EEYH [0,2,0,0,0,0|2,0,0]=4 1955 B9R1.1 NCc1ccc(nc1)C 1P00I8VC [0,2,0,0,0,0|2,0,0]=4 1956 B9R1.1 NCc1ccc(nc1)Cl 1P00ARA3 [0,2,0,0,0,0|2,0,0]=4 1957 B9R1.1 NCc1ccc(nc1)Cl 1P00IKCY [0,2,0,0,0,0|2,0,0]=4 1958 B9R1.1 NCc1ccc(nc1)F 1P002ARS [0,2,0,0,0,0|2,0,0]=4 1959 B9R1.1 NCc1ccc(nc1)I 1P027Y1N [0,2,0,0,0,0|2,0,0]=4 1960 B9R1.1 NCc1ccc(nc1)N 1P001PLB [0,2,0,0,0,0|2,0,0]=4 1961 B9R1.1 NCc1ccc(nc1)N 1P00BFS2 [0,2,0,0,0,0|2,0,0]=4 1962 B9R1.1 NCc1ccc(nc1)O 1P01AJNO [0,2,0,0,0,0|2,0,0]=4 1963 B9R1.1 NNc1ccc(cc1)Br 1P0034FB [0,2,0,0,0,0|1,0,0]=3 1964 B9R1.1 NNc1ccc(cc1)Br 1P00EAW1 [0,2,0,0,0,0|1,0,0]=3 1965 B9R1.1 NNc1ccc(cc1)C 1P0036LJ [0,2,0,0,0,0|1,0,0]=3 1966 B9R1.1 NNc1ccc(cc1)C 1P00DESK [0,2,0,0,0,0|1,0,0]=3 1967 B9R1.1 NNc1ccc(cc1)Cl 1P001DWX [0,2,0,0,0,0|1,0,0]=3 1968 B9R1.1 NNc1ccc(cc1)Cl 1P003LOR [0,2,0,0,0,0|1,0,0]=3 1969 B9R1.1 NNc1ccc(cc1)Cl 1P007WRK [0,2,0,0,0,0|1,0,0]=3 1970 B9R1.1 NNc1ccc(cc1)F 1P0034I9 [0,2,0,0,0,0|1,0,0]=3 1971 B9R1.1 NNc1ccc(cc1)F 1P00I7SM [0,2,0,0,0,0|1,0,0]=3 1972 B9R1.1 NNc1ccc(cc1)I 1P000W3L [0,2,0,0,0,0|1,0,0]=3 1973 B9R1.1 NNc1ccc(cc1)I 1P00EL3Q [0,2,0,0,0,0|1,0,0]=3 1974 B9R1.1 NNc1ccc(cc1)O 1P0291QT [0,2,0,0,0,0|1,0,0]=3 1975 B9R1.1 NNc1ccc(cn1)Br 1P003HU6 [0,2,0,0,0,0|2,0,0]=4 1976 B9R1.1 NNc1ccc(cn1)C 1P00DEJR [0,2,0,0,0,0|2,0,0]=4 1977 B9R1.1 NNc1ccc(cn1)C 1P00HVIX [0,2,0,0,0,0|2,0,0]=4 1978 B9R1.1 NNc1ccc(cn1)Cl 1P00BEHW [0,2,0,0,0,0|2,0,0]=4 1979 B9R1.1 NNc1ccc(cn1)Cl 1P01K21L [0,2,0,0,0,0|2,0,0]=4 1980 B9R1.1 NNc1ccc(cn1)F 1P001DZV [0,2,0,0,0,0|2,0,0]=4 1981 B9R1.1 NNc1ccc(cn1)F 1P009X08 [0,2,0,0,0,0|2,0,0]=4 1982 B9R1.1 NNc1ccc(nc1)Br 1P000TVP [0,2,0,0,0,0|2,0,0]=4 1983 B9R1.1 NNc1ccc(nc1)C 1P003UIV [0,2,0,0,0,0|2,0,0]=4 1984 B9R1.1 NNc1ccc(nc1)C 1P028DYO [0,2,0,0,0,0|2,0,0]=4 1985 B9R1.1 NNc1ccc(nc1)Cl 1P001DZW [0,2,0,0,0,0|2,0,0]=4 1986 B9R1.1 NNc1ccc(nc1)F 1P00H108 [0,2,0,0,0,0|2,0,0]=4 1987 B9R1.1 NNc1ccc(nc1)F 1P028K4X [0,2,0,0,0,0|2,0,0]=4 1988 B9R1.1 NOc1ccc(cc1)Br 1P01BJDR [0,2,0,0,0,0|1,0,0]=3 1989 B9R1.1 NOc1ccc(cc1)Cl 1P01B746 [0,2,0,0,0,0|1,0,0]=3 1990 B9R1.1 NOc1ccc(cc1)F 1P01C1SZ [0,2,0,0,0,0|1,0,0]=3 1991 B9R1.1 O=Cc1cc[n+](cc1)C 1P01DWCI [0,2,0,0,0,0|1,0,1]=4 1992 B9R1.1 O=Cc1ccc(cc1)Br 1P0034ER [0,2,0,0,0,0|2,0,0]=4 1993 B9R1.1 O=Cc1ccc(cc1)C 1P003UHG [0,2,0,0,0,0|2,0,0]=4 1994 B9R1.1 O=Cc1ccc(cc1)Cl 1P0034GH [0,2,0,0,0,0|2,0,0]=4 1995 B9R1.1 O=Cc1ccc(cc1)F 1P0034HX [0,2,0,0,0,0|2,0,0]=4 1996 B9R1.1 O=Cc1ccc(cc1)I 1P003M18 [0,2,0,0,0,0|2,0,0]=4 1997 B9R1.1 O=Cc1ccc(cc1)N 1P00IV1I [0,2,0,0,0,0|1,0,0]=3 1998 B9R1.1 O=Cc1ccc(cc1)O 1P000KDB [0,2,0,0,0,0|2,0,0]=4 1999 B9R1.1 O=Cc1ccc(cc1)S 1P0037B5 [0,2,0,0,0,0|2,0,0]=4 2000 B9R1.1 O=Cc1ccc(cn1)N 1P0095PU [0,2,0,0,0,0|2,0,0]=4 2001 B9R1.1 O=Cc1ccc(nc1)N 1P001REZ [0,2,0,0,0,0|2,0,0]=4 2002 B9R1.1 O=Cc1ccc(nc1)N 1P00668Q [0,2,0,0,0,0|2,0,0]=4 2003 B9R1.1 O=Nc1ccc(cc1)Br 1P00CPA7 [0,2,0,0,0,0|1,0,1]=4 2004 B9R1.1 OCc1cc[n+](cc1)C 1P00EJQG [0,2,0,0,0,0|1,0,1]=4 2005 B9R1.1 OCc1cc[n+](cc1)[O-] 1P003MHD [0,2,0,0,0,0|1,0,1]=4 2006 B9R1.1 OCc1ccc(cc1)Br 1P003LGD [0,2,0,0,0,0|2,0,0]=4 2007 B9R1.1 OCc1ccc(cc1)C 1P003M84 [0,2,0,0,0,0|2,0,0]=4 2008 B9R1.1 OCc1ccc(cc1)Cl 1P003LNJ [0,2,0,0,0,0|2,0,0]=4 2009 B9R1.1 OCc1ccc(cc1)F 1P003LVV [0,2,0,0,0,0|2,0,0]=4 2010 B9R1.1 OCc1ccc(cc1)I 1P0024MX [0,2,0,0,0,0|2,0,0]=4 2011 B9R1.1 OCc1ccc(cc1)N 1P00IBGW [0,2,0,0,0,0|1,0,0]=3 2012 B9R1.1 OCc1ccc(cc1)O 1P0034IT [0,2,0,0,0,0|2,0,0]=4 2013 B9R1.1 OCc1ccc(cc1)S 1P0037SK [0,2,0,0,0,0|2,0,0]=4 2014 B9R1.1 OCc1ccc(cn1)N 1P003MTL [0,2,0,0,0,0|2,0,0]=4 2015 B9R1.1 OCc1ccc(nc1)N 1P008S78 [0,2,0,0,0,0|2,0,0]=4 2016 B9R1.1 ONc1ccc(cc1)C 1P00F3HV [0,2,0,0,0,0|1,0,0]=3 2017 B9R1.1 ONc1ccc(cc1)F 1P0076XK [0,2,0,0,0,0|1,0,0]=3 2018 B9R1.1 SCc1ccc(cc1)Br 1P003LGE [0,2,0,0,0,0|2,0,0]=4 2019 B9R1.1 SCc1ccc(cc1)C 1P003M88 [0,2,0,0,0,0|2,0,0]=4 2020 B9R1.1 SCc1ccc(cc1)Cl 1P0034GJ [0,2,0,0,0,0|2,0,0]=4 2021 B9R1.1 SCc1ccc(cc1)F 1P001RI5 [0,2,0,0,0,0|2,0,0]=4 2022 B9R1.1 SCc1ccc(cc1)I 1P028LXK [0,2,0,0,0,0|2,0,0]=4 2023 B9R1.2 BrC1=CC=CC(=N1)CN 1P01FWU4 [0,2,0,0,0,0|2,0,0]=4 2024 B9R1.2 BrCc1cc[nH]c(=N)c1 1P00IEJC [0,2,0,0,0,0|1,0,1]=4 2025 B9R1.2 BrCc1cccc(c1)Br 1P003JKT [0,2,0,0,0,0|2,0,0]=4 2026 B9R1.2 BrCc1cccc(c1)C 1P003K7H [0,2,0,0,0,0|2,0,0]=4 2027 B9R1.2 BrCc1cccc(c1)Cl 1P003JR7 [0,2,0,0,0,0|2,0,0]=4 2028 B9R1.2 BrCc1cccc(c1)F 1P003469 [0,2,0,0,0,0|2,0,0]=4 2029 B9R1.2 BrCc1cccc(c1)I 1P003DJ8 [0,2,0,0,0,0|2,0,0]=4 2030 B9R1.2 BrCc1cccc(c1)O 1P005WI3 [0,2,0,0,0,0|2,0,0]=4 2031 B9R1.2 BrCc1cccc(n1)N 1P01BD5Y [0,2,0,0,0,0|2,0,0]=4 2032 B9R1.2 BrCc1ccnc(c1)Br 1P0036WE [0,2,0,0,0,0|1,0,0]=3 2033 B9R1.2 BrCc1ccnc(c1)Br 1P00D1BL [0,2,0,0,0,0|1,0,0]=3 2034 B9R1.2 BrCc1ccnc(c1)C 1P01EM94 [0,2,0,0,0,0|1,0,0]=3 2035 B9R1.2 BrCc1ccnc(c1)Cl 1P003KN7 [0,2,0,0,0,0|1,0,0]=3 2036 B9R1.2 BrCc1ccnc(c1)F 1P00EM9M [0,2,0,0,0,0|1,0,0]=3 2037 B9R1.2 BrCc1nccc(c1)Br 1P0096AI [0,2,0,0,0,0|1,0,0]=3 2038 B9R1.2 Brc1cc(C=C)ncc1 1P00DMJL [0,2,0,0,0,0|1,0,0]=3 2039 B9R1.2 Brc1cc(C=O)ncc1 1P00104V [0,2,0,0,0,0|1,0,0]=3 2040 B9R1.2 Brc1cc(C=O)ncn1 1P01FSQP [0,2,0,0,0,0|2,0,0]=4 2041 B9R1.2 Brc1cc(cnn1)C#N 1P027WZ9 [0,2,0,0,0,0|1,0,1]=4 2042 B9R1.2 Brc1cc(ncc1)C#N 1P003HKR [0,2,0,0,0,0|1,0,0]=3 2043 B9R1.2 Brc1cc(ncn1)C#N 1P01BCC4 [0,2,0,0,0,0|1,0,1]=4 2044 B9R1.2 Brc1ccnc(n1)C#N 1P000C36 [0,2,0,0,0,0|2,0,0]=4 2045 B9R1.2 C#Cc1cc[nH]c(=N)c1 1P019F6Y [0,2,0,0,0,0|1,0,1]=4 2046 B9R1.2 C#Cc1cc[nH]c(=O)c1 1P01FSQC [0,2,0,0,0,0|1,0,1]=4 2047 B9R1.2 C#Cc1cccc(c1)Br 1P003JLK [0,2,0,0,0,0|2,0,0]=4 2048 B9R1.2 C#Cc1cccc(c1)C 1P005WI8 [0,2,0,0,0,0|2,0,0]=4 2049 B9R1.2 C#Cc1cccc(c1)Cl 1P003JRX [0,2,0,0,0,0|2,0,0]=4 2050 B9R1.2 C#Cc1cccc(c1)F 1P00346C [0,2,0,0,0,0|2,0,0]=4 2051 B9R1.2 C#Cc1cccc(c1)N 1P002JCX [0,2,0,0,0,0|1,0,0]=3 2052 B9R1.2 C#Cc1cccc(c1)N 1P003JVF [0,2,0,0,0,0|1,0,0]=3 2053 B9R1.2 C#Cc1cccc(c1)O 1P003JVJ [0,2,0,0,0,0|2,0,0]=4 2054 B9R1.2 C#Cc1cccc(n1)N 1P00BAOZ [0,2,0,0,0,0|2,0,0]=4 2055 B9R1.2 C#Cc1ccnc(c1)Br 1P000PTI [0,2,0,0,0,0|1,0,0]=3 2056 B9R1.2 C#Cc1ccnc(c1)C 1P0030IU [0,2,0,0,0,0|1,0,0]=3 2057 B9R1.2 C#Cc1ccnc(c1)Cl 1P005WT7 [0,2,0,0,0,0|1,0,0]=3 2058 B9R1.2 C#Cc1ccnc(c1)F 1P00JT0L [0,2,0,0,0,0|1,0,0]=3 2059 B9R1.2 C#Cc1ccnc(n1)Br 1P028QE4 [0,2,0,0,0,0|2,0,0]=4 2060 B9R1.2 C#Cc1ccnc(n1)Cl 1P00C76G [0,2,0,0,0,0|2,0,0]=4 2061 B9R1.2 C#Cc1ccnc(n1)N 1P008Y6H [0,2,0,0,0,0|2,0,0]=4 2062 B9R1.2 C#Cc1nncc(c1)C 1P027VAG [0,2,0,0,0,0|2,0,0]=4 2063 B9R1.2 C=Cc1cccc(c1)Br 1P0029O1 [0,2,0,0,0,0|2,0,0]=4 2064 B9R1.2 C=Cc1cccc(c1)C 1P0000ON [0,2,0,0,0,0|2,0,0]=4 2065 B9R1.2 C=Cc1cccc(c1)Cl 1P0029O2 [0,2,0,0,0,0|2,0,0]=4 2066 B9R1.2 C=Cc1cccc(c1)F 1P00BYPO [0,2,0,0,0,0|2,0,0]=4 2067 B9R1.2 C=Cc1cccc(c1)I 1P00I98Z [0,2,0,0,0,0|2,0,0]=4 2068 B9R1.2 C=Cc1cccc(c1)N 1P003KDV [0,2,0,0,0,0|1,0,0]=3 2069 B9R1.2 C=Cc1cccc(c1)O 1P00EFDF [0,2,0,0,0,0|2,0,0]=4 2070 B9R1.2 C=Cc1ccnc(c1)Br 1P0068I0 [0,2,0,0,0,0|1,0,0]=3 2071 B9R1.2 C=Cc1ccnc(c1)F 1P00DKNA [0,2,0,0,0,0|1,0,0]=3 2072 B9R1.2 CCc1cc(=O)[nH]cn1 1P000N4E [0,2,0,0,0,0|2,0,0]=4 2073 B9R1.2 CCc1cc(Br)ccn1 1P001PG2 [0,2,0,0,0,0|1,0,0]=3 2074 B9R1.2 CCc1cc(Br)ncn1 1P01AJ42 [0,2,0,0,0,0|2,0,0]=4 2075 B9R1.2 CCc1cc(Cl)ncn1 1P001H4U [0,2,0,0,0,0|2,0,0]=4 2076 B9R1.2 CCc1cc(Cl)nnc1 1P01DZKU [0,2,0,0,0,0|2,0,0]=4 2077 B9R1.2 CCc1cc(N)ccn1 1P00DGSU [0,2,0,0,0,0|0,0,0]=2 2078 B9R1.2 CCc1cc(N)cnc1 1P0092A4 [0,2,0,0,0,0|2,0,0]=4 2079 B9R1.2 CCc1cc(N)ncn1 1P004UL8 [0,2,0,0,0,0|1,0,0]=3 2080 B9R1.2 CCc1cc[nH]c(=O)c1 1P01HJV9 [0,2,0,0,0,0|1,0,1]=4 2081 B9R1.2 CCc1cccc(c1)C 1P00345O [0,2,0,0,0,0|2,0,0]=4 2082 B9R1.2 CCc1cccc(c1)Cl 1P00E960 [0,2,0,0,0,0|2,0,0]=4 2083 B9R1.2 CCc1cccc(c1)F 1P005KEQ [0,2,0,0,0,0|2,0,0]=4 2084 B9R1.2 CCc1cccc(c1)I 1P002FVF [0,2,0,0,0,0|2,0,0]=4 2085 B9R1.2 CCc1cccc(c1)N 1P00345L [0,2,0,0,0,0|1,0,0]=3 2086 B9R1.2 CCc1cccc(c1)O 1P003JVD [0,2,0,0,0,0|2,0,0]=4 2087 B9R1.2 CCc1cccc(c1)S 1P00EC7S [0,2,0,0,0,0|2,0,0]=4 2088 B9R1.2 CCc1cccc(n1)N 1P003NNZ [0,2,0,0,0,0|2,0,0]=4 2089 B9R1.2 CCc1ccnc(c1)Br 1P00IA74 [0,2,0,0,0,0|1,0,0]=3 2090 B9R1.2 CCc1ccnc(c1)Cl 1P00C9HG [0,2,0,0,0,0|1,0,0]=3 2091 B9R1.2 CCc1ccnc(c1)N 1P00383Q [0,2,0,0,0,0|1,0,0]=3 2092 B9R1.2 CCc1ccnc(n1)Cl 1P002HN6 [0,2,0,0,0,0|2,0,0]=4 2093 B9R1.2 CCc1ccnc(n1)N 1P0094C6 [0,2,0,0,0,0|2,0,0]=4 2094 B9R1.2 CCc1nc(Cl)ccn1 1P009IDQ [0,2,0,0,0,0|2,0,0]=4 2095 B9R1.2 CCc1nc(N)ncn1 1P01A4SB [0,2,0,0,0,0|2,0,0]=4 2096 B9R1.2 CCc1nc(O)ccn1 1P00AI8S [0,2,0,0,0,0|2,0,0]=4 2097 B9R1.2 CN=c1[nH]ccc(c1)C 1P00DKLU [0,2,0,0,0,0|1,0,1]=4 2098 B9R1.2 CNc1cc(=O)[nH]nc1 1P019TGI [0,2,0,0,0,0|1,0,1]=4 2099 B9R1.2 CNc1cc(=O)[nH]nc1 1P01EJIK [0,2,0,0,0,0|1,0,1]=4 2100 B9R1.2 CNc1cc(Br)ccn1 1P00DKLE [0,2,0,0,0,0|1,0,0]=3 2101 B9R1.2 CNc1cc(Br)cnc1 1P003AL0 [0,2,0,0,0,0|2,0,0]=4 2102 B9R1.2 CNc1cc(Br)ncn1 1P01AVG3 [0,2,0,0,0,0|1,0,0]=3 2103 B9R1.2 CNc1cc(Cl)ccn1 1P00G2NA [0,2,0,0,0,0|1,0,0]=3 2104 B9R1.2 CNc1cc(Cl)ncn1 1P00FC0H [0,2,0,0,0,0|1,0,0]=3 2105 B9R1.2 CNc1cc(Cl)nnc1 1P01DZC5 [0,2,0,0,0,0|1,0,0]=3 2106 B9R1.2 CNc1cc(F)ccn1 1P00A16T [0,2,0,0,0,0|1,0,0]=3 2107 B9R1.2 CNc1cc(N)ccn1 1P009X0L [0,2,0,0,0,0|0,0,0]=2 2108 B9R1.2 CNc1cc(N)ncn1 1P00FGIG [0,2,0,0,0,0|1,0,0]=3 2109 B9R1.2 CNc1cc(O)ncn1 1P0083JN [0,2,0,0,0,0|1,0,0]=3 2110 B9R1.2 CNc1cc[nH]c(=O)n1 1P01AG09 [0,2,0,0,0,0|1,0,1]=4 2111 B9R1.2 CNc1cccc(c1)Br 1P003TMD [0,2,0,0,0,0|1,0,0]=3 2112 B9R1.2 CNc1cccc(c1)Br 1P00FEPZ [0,2,0,0,0,0|1,0,0]=3 2113 B9R1.2 CNc1cccc(c1)C 1P003TOM [0,2,0,0,0,0|1,0,0]=3 2114 B9R1.2 CNc1cccc(c1)Cl 1P003JRL [0,2,0,0,0,0|1,0,0]=3 2115 B9R1.2 CNc1cccc(c1)Cl 1P003JRM [0,2,0,0,0,0|1,0,0]=3 2116 B9R1.2 CNc1cccc(c1)F 1P002BI5 [0,2,0,0,0,0|1,0,0]=3 2117 B9R1.2 CNc1cccc(c1)F 1P00AN6L [0,2,0,0,0,0|1,0,0]=3 2118 B9R1.2 CNc1cccc(c1)I 1P00F5KV [0,2,0,0,0,0|1,0,0]=3 2119 B9R1.2 CNc1cccc(c1)I 1P01S6IV [0,2,0,0,0,0|1,0,0]=3 2120 B9R1.2 CNc1cccc(c1)N 1P00DKBG [0,2,0,0,0,0|1,0,0]=3 2121 B9R1.2 CNc1cccc(c1)O 1P001F0G [0,2,0,0,0,0|1,0,0]=3 2122 B9R1.2 CNc1cccc(c1)S 1P028M43 [0,2,0,0,0,0|1,0,0]=3 2123 B9R1.2 CNc1cccc(n1)Br 1P0088O5 [0,2,0,0,0,0|2,0,0]=4 2124 B9R1.2 CNc1cccc(n1)C 1P01AJJZ [0,2,0,0,0,0|2,0,0]=4 2125 B9R1.2 CNc1cccc(n1)Cl 1P00437Y [0,2,0,0,0,0|2,0,0]=4 2126 B9R1.2 CNc1cccc(n1)F 1P00CLTI [0,2,0,0,0,0|2,0,0]=4 2127 B9R1.2 CNc1cccc(n1)N 1P00GALK [0,2,0,0,0,0|2,0,0]=4 2128 B9R1.2 CNc1cccc(n1)O 1P00BU94 [0,2,0,0,0,0|2,0,0]=4 2129 B9R1.2 CNc1ccnc(c1)Br 1P00G9FU [0,2,0,0,0,0|0,0,0]=2 2130 B9R1.2 CNc1ccnc(c1)Br 1P028RRH [0,2,0,0,0,0|0,0,0]=2 2131 B9R1.2 CNc1ccnc(c1)F 1P01KKLM [0,2,0,0,0,0|0,0,0]=2 2132 B9R1.2 CNc1ccnc(n1)Br 1P01KKQM [0,2,0,0,0,0|1,0,0]=3 2133 B9R1.2 CNc1ccnc(n1)C 1P00D1QH [0,2,0,0,0,0|1,0,0]=3 2134 B9R1.2 CNc1ccnc(n1)Cl 1P00FB90 [0,2,0,0,0,0|1,0,0]=3 2135 B9R1.2 CNc1cncc(c1)C 1P01KHHK [0,2,0,0,0,0|2,0,0]=4 2136 B9R1.2 CNc1nc(Br)ccn1 1P0074X3 [0,2,0,0,0,0|2,0,0]=4 2137 B9R1.2 CNc1nc(Cl)ccn1 1P00C1MU [0,2,0,0,0,0|2,0,0]=4 2138 B9R1.2 CNc1nc(N)ccn1 1P00C1RI [0,2,0,0,0,0|1,0,0]=3 2139 B9R1.2 CNc1nccc(c1)C 1P019S75 [0,2,0,0,0,0|1,0,0]=3 2140 B9R1.2 CNc1nccc(n1)C 1P00B5G7 [0,2,0,0,0,0|2,0,0]=4 2141 B9R1.2 CNc1ncnc(c1)C 1P00E31Y [0,2,0,0,0,0|1,0,0]=3 2142 B9R1.2 COc1cc(=O)[nH]cn1 1P00EYFD [0,2,0,0,0,0|2,0,0]=4 2143 B9R1.2 COc1cc(Br)ccn1 1P00027I [0,2,0,0,0,0|1,0,0]=3 2144 B9R1.2 COc1cc(Br)ncn1 1P005LBC [0,2,0,0,0,0|2,0,0]=4 2145 B9R1.2 COc1cc(Cl)ccn1 1P0033U6 [0,2,0,0,0,0|1,0,0]=3 2146 B9R1.2 COc1cc(Cl)ncn1 1P002TQW [0,2,0,0,0,0|2,0,0]=4 2147 B9R1.2 COc1cc(Cl)nnc1 1P000LEP [0,2,0,0,0,0|2,0,0]=4 2148 B9R1.2 COc1cc(F)ccn1 1P00360G [0,2,0,0,0,0|1,0,0]=3 2149 B9R1.2 COc1cc(F)ncn1 1P00E2DV [0,2,0,0,0,0|2,0,0]=4 2150 B9R1.2 COc1cc(I)ccn1 1P0034JF [0,2,0,0,0,0|1,0,0]=3 2151 B9R1.2 COc1cc(I)ncn1 1P00APKX [0,2,0,0,0,0|2,0,0]=4 2152 B9R1.2 COc1cc(N)ccn1 1P0034CU [0,2,0,0,0,0|0,0,0]=2 2153 B9R1.2 COc1cc(N)cnc1 1P003JDA [0,2,0,0,0,0|2,0,0]=4 2154 B9R1.2 COc1cc(N)ncn1 1P00ICF2 [0,2,0,0,0,0|1,0,0]=3 2155 B9R1.2 COc1cc(O)ccn1 1P00FCFK [0,2,0,0,0,0|1,0,0]=3 2156 B9R1.2 COc1cc(S)ccn1 1P028W86 [0,2,0,0,0,0|1,0,0]=3 2157 B9R1.2 COc1cc[nH]c(=O)c1 1P00D8H9 [0,2,0,0,0,0|1,0,1]=4 2158 B9R1.2 COc1cccc(c1)Br 1P003JKL [0,2,0,0,0,0|2,0,0]=4 2159 B9R1.2 COc1cccc(c1)C 1P0000OJ [0,2,0,0,0,0|2,0,0]=4 2160 B9R1.2 COc1cccc(c1)Cl 1P003JQZ [0,2,0,0,0,0|2,0,0]=4 2161 B9R1.2 COc1cccc(c1)F 1P003JXQ [0,2,0,0,0,0|2,0,0]=4 2162 B9R1.2 COc1cccc(c1)I 1P003K27 [0,2,0,0,0,0|2,0,0]=4 2163 B9R1.2 COc1cccc(c1)N 1P003RX0 [0,2,0,0,0,0|1,0,0]=3 2164 B9R1.2 COc1cccc(c1)N 1P00IA0Z [0,2,0,0,0,0|1,0,0]=3 2165 B9R1.2 COc1cccc(c1)O 1P001MO6 [0,2,0,0,0,0|2,0,0]=4 2166 B9R1.2 COc1cccc(c1)S 1P001OLM [0,2,0,0,0,0|2,0,0]=4 2167 B9R1.2 COc1cccc(n1)N 1P0027BO [0,2,0,0,0,0|2,0,0]=4 2168 B9R1.2 COc1ccnc(c1)Br 1P0041ZQ [0,2,0,0,0,0|1,0,0]=3 2169 B9R1.2 COc1ccnc(c1)C 1P006XU2 [0,2,0,0,0,0|1,0,0]=3 2170 B9R1.2 COc1ccnc(c1)Cl 1P00AP4E [0,2,0,0,0,0|1,0,0]=3 2171 B9R1.2 COc1ccnc(c1)F 1P0021S2 [0,2,0,0,0,0|1,0,0]=3 2172 B9R1.2 COc1ccnc(c1)N 1P0006S9 [0,2,0,0,0,0|1,0,0]=3 2173 B9R1.2 COc1ccnc(n1)Br 1P00H7YB [0,2,0,0,0,0|2,0,0]=4 2174 B9R1.2 COc1ccnc(n1)C 1P005RCN [0,2,0,0,0,0|2,0,0]=4 2175 B9R1.2 COc1ccnc(n1)Cl 1P007OST [0,2,0,0,0,0|2,0,0]=4 2176 B9R1.2 COc1ccnc(n1)F 1P00772D [0,2,0,0,0,0|2,0,0]=4 2177 B9R1.2 COc1ccnc(n1)I 1P002SUG [0,2,0,0,0,0|2,0,0]=4 2178 B9R1.2 COc1ccnc(n1)N 1P001O07 [0,2,0,0,0,0|2,0,0]=4 2179 B9R1.2 COc1nc(Br)ccn1 1P00H6PR [0,2,0,0,0,0|2,0,0]=4 2180 B9R1.2 COc1nc(Cl)ccn1 1P00388H [0,2,0,0,0,0|2,0,0]=4 2181 B9R1.2 COc1nc(N)ccn1 1P00C823 [0,2,0,0,0,0|1,0,0]=3 2182 B9R1.2 COc1nc(N)ncn1 1P00HCTT [0,2,0,0,0,0|2,0,0]=4 2183 B9R1.2 COc1nccc(=O)[nH]1 1P006VNT [0,2,0,0,0,0|2,0,0]=4 2184 B9R1.2 COc1nccc(c1)C 1P0003HE [0,2,0,0,0,0|1,0,0]=3 2185 B9R1.2 COc1nccc(n1)C 1P001CEL [0,2,0,0,0,0|2,0,0]=4 2186 B9R1.2 COc1nncc(c1)Cl 1P01XFP3 [0,2,0,0,0,0|2,0,0]=4 2187 B9R1.2 COc1nncc(c1)N 1P01QHU7 [0,2,0,0,0,0|1,0,0]=3 2188 B9R1.2 CSc1cc(Br)ncn1 1P0094GP [0,2,0,0,0,0|2,0,0]=4 2189 B9R1.2 CSc1cc(Cl)ccn1 1P00CL7Q [0,2,0,0,0,0|1,0,0]=3 2190 B9R1.2 CSc1cc(Cl)ncn1 1P003LMD [0,2,0,0,0,0|2,0,0]=4 2191 B9R1.2 CSc1cc(I)ncn1 1P00IG1J [0,2,0,0,0,0|2,0,0]=4 2192 B9R1.2 CSc1cc(N)ccn1 1P003L4L [0,2,0,0,0,0|0,0,0]=2 2193 B9R1.2 CSc1cc(N)ccn1 1P01BV4Y [0,2,0,0,0,0|0,0,0]=2 2194 B9R1.2 CSc1cc(N)cnc1 1P00CGZQ [0,2,0,0,0,0|2,0,0]=4 2195 B9R1.2 CSc1cc(N)ncn1 1P0029LA [0,2,0,0,0,0|1,0,0]=3 2196 B9R1.2 CSc1cc(O)ccn1 1P01EMTA [0,2,0,0,0,0|1,0,0]=3 2197 B9R1.2 CSc1cccc(c1)Br 1P003JLZ [0,2,0,0,0,0|2,0,0]=4 2198 B9R1.2 CSc1cccc(c1)Cl 1P003JSF [0,2,0,0,0,0|2,0,0]=4 2199 B9R1.2 CSc1cccc(c1)F 1P003JYJ [0,2,0,0,0,0|2,0,0]=4 2200 B9R1.2 CSc1cccc(c1)I 1P000UUQ [0,2,0,0,0,0|2,0,0]=4 2201 B9R1.2 CSc1cccc(c1)N 1P0026DI [0,2,0,0,0,0|1,0,0]=3 2202 B9R1.2 CSc1cccc(c1)O 1P00C8UY [0,2,0,0,0,0|2,0,0]=4 2203 B9R1.2 CSc1cccc(n1)N 1P01BBLS [0,2,0,0,0,0|2,0,0]=4 2204 B9R1.2 CSc1ccnc(c1)Cl 1P00670J [0,2,0,0,0,0|1,0,0]=3 2205 B9R1.2 CSc1ccnc(c1)N 1P00CJHF [0,2,0,0,0,0|1,0,0]=3 2206 B9R1.2 CSc1ccnc(n1)Cl 1P00DEZR [0,2,0,0,0,0|2,0,0]=4 2207 B9R1.2 CSc1ccnc(n1)I 1P01DXLN [0,2,0,0,0,0|2,0,0]=4 2208 B9R1.2 CSc1ccnc(n1)N 1P00856J [0,2,0,0,0,0|2,0,0]=4 2209 B9R1.2 CSc1cncc(c1)N 1P01C2IP [0,2,0,0,0,0|2,0,0]=4 2210 B9R1.2 CSc1nc(Br)ccn1 1P00IJZN [0,2,0,0,0,0|2,0,0]=4 2211 B9R1.2 CSc1nc(Cl)ccn1 1P006YDL [0,2,0,0,0,0|2,0,0]=4 2212 B9R1.2 CSc1nc(I)ccn1 1P007C8S [0,2,0,0,0,0|2,0,0]=4 2213 B9R1.2 CSc1nc(N)ccn1 1P006ZL8 [0,2,0,0,0,0|1,0,0]=3 2214 B9R1.2 CSc1nc(N)ncn1 1P00C2FW [0,2,0,0,0,0|2,0,0]=4 2215 B9R1.2 CSc1nccc(=O)[nH]1 1P003FKH [0,2,0,0,0,0|2,0,0]=4 2216 B9R1.2 CSc1nccc(n1)C 1P001CEI [0,2,0,0,0,0|2,0,0]=4 2217 B9R1.2 Cc1cc(C=C)ncc1 1P001BT8 [0,2,0,0,0,0|1,0,0]=3 2218 B9R1.2 Cc1cc(C=O)ncc1 1P003M99 [0,2,0,0,0,0|1,0,0]=3 2219 B9R1.2 Cc1cc(C=O)ncn1 1P009RCX [0,2,0,0,0,0|2,0,0]=4 2220 B9R1.2 Cc1cc(CCl)ncc1 1P005R6Z [0,2,0,0,0,0|1,0,0]=3 2221 B9R1.2 Cc1cc(CCl)ncn1 1P019D0O [0,2,0,0,0,0|2,0,0]=4 2222 B9R1.2 Cc1cc(CN)cnc1 1P0055YH [0,2,0,0,0,0|2,0,0]=4 2223 B9R1.2 Cc1cc(CN)cnc1 1P00HXPI [0,2,0,0,0,0|2,0,0]=4 2224 B9R1.2 Cc1cc(CN)ncc1 1P000P3N [0,2,0,0,0,0|1,0,0]=3 2225 B9R1.2 Cc1cc(CN)ncc1 1P000U56 [0,2,0,0,0,0|1,0,0]=3 2226 B9R1.2 Cc1cc(CN)ncn1 1P00K0GF [0,2,0,0,0,0|1,0,0]=3 2227 B9R1.2 Cc1cc(CO)ncc1 1P00BYNN [0,2,0,0,0,0|1,0,0]=3 2228 B9R1.2 Cc1cc(CO)ncn1 1P005K5A [0,2,0,0,0,0|2,0,0]=4 2229 B9R1.2 Cc1cc(NN)ncc1 1P007151 [0,2,0,0,0,0|1,0,0]=3 2230 B9R1.2 Cc1cc(NN)ncc1 1P00J3E9 [0,2,0,0,0,0|1,0,0]=3 2231 B9R1.2 Cc1cc(NN)ncn1 1P00CYDB [0,2,0,0,0,0|1,0,0]=3 2232 B9R1.2 Cc1cc(ncc1)C#C 1P0030IV [0,2,0,0,0,0|1,0,0]=3 2233 B9R1.2 Cc1cc(ncc1)C#N 1P001T2L [0,2,0,0,0,0|1,0,0]=3 2234 B9R1.2 Cc1ccnc(n1)C#C 1P018PQY [0,2,0,0,0,0|2,0,0]=4 2235 B9R1.2 Cc1ccnc(n1)C#N 1P003M74 [0,2,0,0,0,0|2,0,0]=4 2236 B9R1.2 Cc1ccnc(n1)C=O 1P00ILN9 [0,2,0,0,0,0|2,0,0]=4 2237 B9R1.2 Cc1ccnc(n1)CCl 1P005Q7E [0,2,0,0,0,0|2,0,0]=4 2238 B9R1.2 Cc1ccnc(n1)CN 1P0026AY [0,2,0,0,0,0|2,0,0]=4 2239 B9R1.2 Cc1ccnc(n1)CO 1P007LEM [0,2,0,0,0,0|2,0,0]=4 2240 B9R1.2 Cc1ccnc(n1)NN 1P01XFG6 [0,2,0,0,0,0|2,0,0]=4 2241 B9R1.2 ClCc1cc(Br)ccn1 1P0001KM [0,2,0,0,0,0|1,0,0]=3 2242 B9R1.2 ClCc1cc[nH]c(=O)c1 1P009QH3 [0,2,0,0,0,0|1,0,1]=4 2243 B9R1.2 ClCc1cccc(c1)Br 1P003JKU [0,2,0,0,0,0|2,0,0]=4 2244 B9R1.2 ClCc1cccc(c1)C 1P003K7I [0,2,0,0,0,0|2,0,0]=4 2245 B9R1.2 ClCc1cccc(c1)Cl 1P0034WS [0,2,0,0,0,0|2,0,0]=4 2246 B9R1.2 ClCc1cccc(c1)F 1P003JXZ [0,2,0,0,0,0|2,0,0]=4 2247 B9R1.2 ClCc1cccc(c1)I 1P00EE36 [0,2,0,0,0,0|2,0,0]=4 2248 B9R1.2 ClCc1cccc(c1)N 1P01ALW2 [0,2,0,0,0,0|1,0,0]=3 2249 B9R1.2 ClCc1cccc(c1)O 1P00EE37 [0,2,0,0,0,0|2,0,0]=4 2250 B9R1.2 ClCc1ccnc(c1)Br 1P00IEJB [0,2,0,0,0,0|1,0,0]=3 2251 B9R1.2 ClCc1ccnc(c1)Cl 1P0006N4 [0,2,0,0,0,0|1,0,0]=3 2252 B9R1.2 ClCc1ccnc(c1)Cl 1P0094A6 [0,2,0,0,0,0|1,0,0]=3 2253 B9R1.2 ClCc1ccnc(c1)F 1P00B9BA [0,2,0,0,0,0|1,0,0]=3 2254 B9R1.2 ClCc1ccnc(c1)N 1P003GUW [0,2,0,0,0,0|1,0,0]=3 2255 B9R1.2 ClCc1ccnc(n1)C 1P00H1HD [0,2,0,0,0,0|2,0,0]=4 2256 B9R1.2 ClCc1ccnc(n1)Cl 1P003HD0 [0,2,0,0,0,0|2,0,0]=4 2257 B9R1.2 ClCc1nccc(=O)[nH]1 1P006ARJ [0,2,0,0,0,0|2,0,0]=4 2258 B9R1.2 ClCc1nccc(c1)Cl 1P0005WR [0,2,0,0,0,0|1,0,0]=3 2259 B9R1.2 ClCc1nccc(c1)Cl 1P000J59 [0,2,0,0,0,0|1,0,0]=3 2260 B9R1.2 ClCc1nccc(n1)Cl 1P00CJFG [0,2,0,0,0,0|2,0,0]=4 2261 B9R1.2 ClCc1ncnc(c1)Cl 1P004NYS [0,2,0,0,0,0|2,0,0]=4 2262 B9R1.2 Clc1cc(C=C)ncc1 1P0068T3 [0,2,0,0,0,0|1,0,0]=3 2263 B9R1.2 Clc1cc(C=O)ncc1 1P003LP1 [0,2,0,0,0,0|1,0,0]=3 2264 B9R1.2 Clc1cc(C=O)ncn1 1P019D1U [0,2,0,0,0,0|2,0,0]=4 2265 B9R1.2 Clc1cc(CBr)ncc1 1P01E7ZN [0,2,0,0,0,0|1,0,0]=3 2266 B9R1.2 Clc1cc(cnn1)C#N 1P01C3HT [0,2,0,0,0,0|1,0,1]=4 2267 B9R1.2 Clc1cc(ncc1)C#N 1P002GC7 [0,2,0,0,0,0|1,0,0]=3 2268 B9R1.2 Clc1cc(ncn1)C#C 1P028WJZ [0,2,0,0,0,0|2,0,0]=4 2269 B9R1.2 Clc1cc(ncn1)C#N 1P003ACL [0,2,0,0,0,0|1,0,1]=4 2270 B9R1.2 Clc1ccnc(n1)C#N 1P0038TT [0,2,0,0,0,0|2,0,0]=4 2271 B9R1.2 Clc1ccnc(n1)C=O 1P01DL3X [0,2,0,0,0,0|2,0,0]=4 2272 B9R1.2 FCc1cccc(c1)Br 1P01JKXE [0,2,0,0,0,0|2,0,0]=4 2273 B9R1.2 FCc1cccc(c1)I 1P01C30N [0,2,0,0,0,0|2,0,0]=4 2274 B9R1.2 FCc1cccc(c1)N 1P003IOW [0,2,0,0,0,0|1,0,0]=3 2275 B9R1.2 Fc1cc(C=C)ncc1 1P028XRN [0,2,0,0,0,0|1,0,0]=3 2276 B9R1.2 Fc1cc(C=O)ncc1 1P008ZJK [0,2,0,0,0,0|1,0,0]=3 2277 B9R1.2 Fc1cc(CBr)ncc1 1P01KLG4 [0,2,0,0,0,0|1,0,0]=3 2278 B9R1.2 Fc1cc(CCl)ncc1 1P01BJOB [0,2,0,0,0,0|1,0,0]=3 2279 B9R1.2 Fc1cc(cnn1)C#N 1P0285E7 [0,2,0,0,0,0|1,0,1]=4 2280 B9R1.2 Fc1cc(ncc1)C#C 1P01KL8L [0,2,0,0,0,0|1,0,0]=3 2281 B9R1.2 Fc1cc(ncc1)C#N 1P008H6V [0,2,0,0,0,0|1,0,0]=3 2282 B9R1.2 ICc1cccc(c1)Cl 1P005V3N [0,2,0,0,0,0|2,0,0]=4 2283 B9R1.2 N#Cc1cc[nH]c(=O)c1 1P00374Y [0,2,0,0,0,0|0,0,2]=4 2284 B9R1.2 N#Cc1cccc(c1)Br 1P00343F [0,2,0,0,0,0|1,0,1]=4 2285 B9R1.2 N#Cc1cccc(c1)C 1P00IBF3 [0,2,0,0,0,0|1,0,1]=4 2286 B9R1.2 N#Cc1cccc(c1)Cl 1P00344X [0,2,0,0,0,0|1,0,1]=4 2287 B9R1.2 N#Cc1cccc(c1)F 1P003JXW [0,2,0,0,0,0|1,0,1]=4 2288 B9R1.2 N#Cc1cccc(c1)I 1P003K2A [0,2,0,0,0,0|1,0,1]=4 2289 B9R1.2 N#Cc1cccc(c1)N 1P006YMU [0,2,0,0,0,0|1,0,0]=3 2290 B9R1.2 N#Cc1cccc(c1)O 1P003JT1 [0,2,0,0,0,0|1,0,1]=4 2291 B9R1.2 N#Cc1cccc(c1)S 1P019Z6E [0,2,0,0,0,0|1,0,1]=4 2292 B9R1.2 N#Cc1cccc(n1)N 1P003GZ0 [0,2,0,0,0,0|2,0,0]=4 2293 B9R1.2 N#Cc1ccnc(c1)Br 1P003H4P [0,2,0,0,0,0|0,0,1]=3 2294 B9R1.2 N#Cc1ccnc(c1)C 1P0039CH [0,2,0,0,0,0|0,0,1]=3 2295 B9R1.2 N#Cc1ccnc(c1)Cl 1P0033OQ [0,2,0,0,0,0|0,0,1]=3 2296 B9R1.2 N#Cc1ccnc(c1)F 1P0036G3 [0,2,0,0,0,0|0,0,1]=3 2297 B9R1.2 N#Cc1ccnc(c1)I 1P000FRT [0,2,0,0,0,0|0,0,1]=3 2298 B9R1.2 N#Cc1ccnc(c1)N 1P0033JZ [0,2,0,0,0,0|0,0,1]=3 2299 B9R1.2 N#Cc1ccnc(c1)S 1P00A7LZ [0,2,0,0,0,0|0,0,1]=3 2300 B9R1.2 N#Cc1ccnc(n1)Br 1P0074X2 [0,2,0,0,0,0|1,0,1]=4 2301 B9R1.2 N#Cc1ccnc(n1)C 1P00EIVL [0,2,0,0,0,0|1,0,1]=4 2302 B9R1.2 N#Cc1ccnc(n1)Cl 1P003HK6 [0,2,0,0,0,0|1,0,1]=4 2303 B9R1.2 N#Cc1ccnc(n1)N 1P00C8TG [0,2,0,0,0,0|1,0,1]=4 2304 B9R1.2 N#Cc1nncc(c1)C 1P001559 [0,2,0,0,0,0|2,0,0]=4 2305 B9R1.2 N#Cc1nncc(c1)N 1P01EKAE [0,2,0,0,0,0|1,0,0]=3 2306 B9R1.2 NCc1[nH]ccc(=O)c1 1P00J1X6 [0,2,0,0,0,0|1,0,1]=4 2307 B9R1.2 NCc1cc(=O)nc[nH]1 1P02848E [0,2,0,0,0,0|1,0,0]=3 2308 B9R1.2 NCc1cc(Br)ccn1 1P0036UF [0,2,0,0,0,0|1,0,0]=3 2309 B9R1.2 NCc1cc(Br)cnc1 1P0038KX [0,2,0,0,0,0|2,0,0]=4 2310 B9R1.2 NCc1cc(Cl)ccn1 1P0022S5 [0,2,0,0,0,0|1,0,0]=3 2311 B9R1.2 NCc1cc(Cl)cnc1 1P00196S [0,2,0,0,0,0|2,0,0]=4 2312 B9R1.2 NCc1cc(F)cnc1 1P002O92 [0,2,0,0,0,0|2,0,0]=4 2313 B9R1.2 NCc1cc(F)cnc1 1P00IEIR [0,2,0,0,0,0|2,0,0]=4 2314 B9R1.2 NCc1cc(O)cnc1 1P000MC8 [0,2,0,0,0,0|2,0,0]=4 2315 B9R1.2 NCc1cc[nH]c(=N)n1 1P01DFMC [0,2,0,0,0,0|1,0,1]=4 2316 B9R1.2 NCc1cc[nH]c(=O)c1 1P006BTS [0,2,0,0,0,0|0,0,1]=3 2317 B9R1.2 NCc1cc[nH]c(=O)c1 1P009I31 [0,2,0,0,0,0|0,0,1]=3 2318 B9R1.2 NCc1cc[nH]c(=O)c1 1P01JVQ8 [0,2,0,0,0,0|0,0,1]=3 2319 B9R1.2 NCc1ccc[n+](c1)[O-] 1P01BSKK [0,2,0,0,0,0|2,0,0]=4 2320 B9R1.2 NCc1ccc[n+](c1)[O-] 1P01EIK3 [0,2,0,0,0,0|2,0,0]=4 2321 B9R1.2 NCc1cccc(=O)[nH]1 1P01A4RU [0,2,0,0,0,0|2,0,0]=4 2322 B9R1.2 NCc1cccc(=O)[nH]1 1P01KLL7 [0,2,0,0,0,0|2,0,0]=4 2323 B9R1.2 NCc1cccc(c1)Br 1P0008LR [0,2,0,0,0,0|1,0,0]=3 2324 B9R1.2 NCc1cccc(c1)Br 1P003JKW [0,2,0,0,0,0|1,0,0]=3 2325 B9R1.2 NCc1cccc(c1)C 1P0000OM [0,2,0,0,0,0|1,0,0]=3 2326 B9R1.2 NCc1cccc(c1)Cl 1P003JR8 [0,2,0,0,0,0|1,0,0]=3 2327 B9R1.2 NCc1cccc(c1)F 1P0000OL [0,2,0,0,0,0|1,0,0]=3 2328 B9R1.2 NCc1cccc(c1)F 1P01K78D [0,2,0,0,0,0|1,0,0]=3 2329 B9R1.2 NCc1cccc(c1)I 1P003K2D [0,2,0,0,0,0|1,0,0]=3 2330 B9R1.2 NCc1cccc(c1)I 1P00I7SX [0,2,0,0,0,0|1,0,0]=3 2331 B9R1.2 NCc1cccc(c1)N 1P003JDZ [0,2,0,0,0,0|1,0,0]=3 2332 B9R1.2 NCc1cccc(c1)O 1P0011H8 [0,2,0,0,0,0|1,0,0]=3 2333 B9R1.2 NCc1cccc(c1)O 1P003IMZ [0,2,0,0,0,0|1,0,0]=3 2334 B9R1.2 NCc1cccc(n1)Br 1P0074ZD [0,2,0,0,0,0|2,0,0]=4 2335 B9R1.2 NCc1cccc(n1)Br 1P00GSVK [0,2,0,0,0,0|2,0,0]=4 2336 B9R1.2 NCc1cccc(n1)Br 1P01FJ5Z [0,2,0,0,0,0|2,0,0]=4 2337 B9R1.2 NCc1cccc(n1)C 1P0012KB [0,2,0,0,0,0|2,0,0]=4 2338 B9R1.2 NCc1cccc(n1)C 1P004RKH [0,2,0,0,0,0|2,0,0]=4 2339 B9R1.2 NCc1cccc(n1)C 1P006OMB [0,2,0,0,0,0|2,0,0]=4 2340 B9R1.2 NCc1cccc(n1)Cl 1P001ONV [0,2,0,0,0,0|2,0,0]=4 2341 B9R1.2 NCc1cccc(n1)Cl 1P00AOJ9 [0,2,0,0,0,0|2,0,0]=4 2342 B9R1.2 NCc1cccc(n1)Cl 1P01BCK3 [0,2,0,0,0,0|2,0,0]=4 2343 B9R1.2 NCc1cccc(n1)F 1P000P2X [0,2,0,0,0,0|2,0,0]=4 2344 B9R1.2 NCc1cccc(n1)F 1P001ILO [0,2,0,0,0,0|2,0,0]=4 2345 B9R1.2 NCc1cccc(n1)N 1P001XQU [0,2,0,0,0,0|2,0,0]=4 2346 B9R1.2 NCc1cccc(n1)N 1P01CAT0 [0,2,0,0,0,0|2,0,0]=4 2347 B9R1.2 NCc1cccc(n1)O 1P01DEY1 [0,2,0,0,0,0|2,0,0]=4 2348 B9R1.2 NCc1ccnc(c1)Br 1P004XV2 [0,2,0,0,0,0|0,0,0]=2 2349 B9R1.2 NCc1ccnc(c1)Br 1P01BW3U [0,2,0,0,0,0|0,0,0]=2 2350 B9R1.2 NCc1ccnc(c1)Br 1P01EE6S [0,2,0,0,0,0|0,0,0]=2 2351 B9R1.2 NCc1ccnc(c1)C 1P00A0HX [0,2,0,0,0,0|0,0,0]=2 2352 B9R1.2 NCc1ccnc(c1)C 1P00IILX [0,2,0,0,0,0|0,0,0]=2 2353 B9R1.2 NCc1ccnc(c1)Cl 1P001KSS [0,2,0,0,0,0|0,0,0]=2 2354 B9R1.2 NCc1ccnc(c1)Cl 1P006G2L [0,2,0,0,0,0|0,0,0]=2 2355 B9R1.2 NCc1ccnc(c1)Cl 1P01C3Q0 [0,2,0,0,0,0|0,0,0]=2 2356 B9R1.2 NCc1ccnc(c1)F 1P00FDO6 [0,2,0,0,0,0|0,0,0]=2 2357 B9R1.2 NCc1ccnc(c1)F 1P01BRHN [0,2,0,0,0,0|0,0,0]=2 2358 B9R1.2 NCc1ccnc(c1)N 1P002CH8 [0,2,0,0,0,0|0,0,0]=2 2359 B9R1.2 NCc1ccnc(c1)O 1P01A90Q [0,2,0,0,0,0|0,0,0]=2 2360 B9R1.2 NCc1ccnc(n1)C 1P00C4D0 [0,2,0,0,0,0|1,0,0]=3 2361 B9R1.2 NCc1ccnc(n1)C 1P0285AS [0,2,0,0,0,0|1,0,0]=3 2362 B9R1.2 NCc1ccnc(n1)Cl 1P00HTVQ [0,2,0,0,0,0|1,0,0]=3 2363 B9R1.2 NCc1ccnc(n1)N 1P019L2Q [0,2,0,0,0,0|1,0,0]=3 2364 B9R1.2 NCc1cncc(c1)Br 1P008SBV [0,2,0,0,0,0|2,0,0]=4 2365 B9R1.2 NCc1cncc(c1)C 1P027OFD [0,2,0,0,0,0|2,0,0]=4 2366 B9R1.2 NCc1cncc(c1)Cl 1P009XZW [0,2,0,0,0,0|2,0,0]=4 2367 B9R1.2 NCc1cncc(c1)N 1P00EF6P [0,2,0,0,0,0|2,0,0]=4 2368 B9R1.2 NCc1cncc(c1)O 1P028V18 [0,2,0,0,0,0|2,0,0]=4 2369 B9R1.2 NCc1nc(Cl)ccn1 1P01DY84 [0,2,0,0,0,0|2,0,0]=4 2370 B9R1.2 NCc1nc[nH]c(=O)c1 1P000TWF [0,2,0,0,0,0|1,0,1]=4 2371 B9R1.2 NCc1nccc(=O)[nH]1 1P01C58R [0,2,0,0,0,0|2,0,0]=4 2372 B9R1.2 NCc1nccc(c1)Br 1P0001JX [0,2,0,0,0,0|1,0,0]=3 2373 B9R1.2 NCc1nccc(c1)C 1P00I7JX [0,2,0,0,0,0|1,0,0]=3 2374 B9R1.2 NCc1nccc(c1)F 1P00AAS2 [0,2,0,0,0,0|1,0,0]=3 2375 B9R1.2 NCc1nccc(c1)N 1P01EKJ0 [0,2,0,0,0,0|0,0,0]=2 2376 B9R1.2 NCc1nccc(n1)C 1P001AL8 [0,2,0,0,0,0|2,0,0]=4 2377 B9R1.2 NCc1nccc(n1)N 1P01A0N6 [0,2,0,0,0,0|1,0,0]=3 2378 B9R1.2 NCc1nccc(n1)N 1P024SPK [0,2,0,0,0,0|1,0,0]=3 2379 B9R1.2 NCc1nncc(c1)C 1P0026TO [0,2,0,0,0,0|2,0,0]=4 2380 B9R1.2 NN=c1cccc([nH]1)C 1P008Y49 [0,2,0,0,0,0|2,0,0]=4 2381 B9R1.2 NNc1cc(Br)ccn1 1P0006N2 [0,2,0,0,0,0|1,0,0]=3 2382 B9R1.2 NNc1cc(Br)cnc1 1P00G8MJ [0,2,0,0,0,0|2,0,0]=4 2383 B9R1.2 NNc1cc(Br)ncn1 1P01B43L [0,2,0,0,0,0|1,0,0]=3 2384 B9R1.2 NNc1cc(F)cnc1 1P01JX7A [0,2,0,0,0,0|2,0,0]=4 2385 B9R1.2 NNc1cc(I)ccn1 1P00943H [0,2,0,0,0,0|1,0,0]=3 2386 B9R1.2 NNc1cc(O)ncn1 1P00C2G6 [0,2,0,0,0,0|1,0,0]=3 2387 B9R1.2 NNc1cc[nH]c(=O)c1 1P00957K [0,2,0,0,0,0|0,0,1]=3 2388 B9R1.2 NNc1cccc(c1)Br 1P00343O [0,2,0,0,0,0|1,0,0]=3 2389 B9R1.2 NNc1cccc(c1)C 1P003484 [0,2,0,0,0,0|1,0,0]=3 2390 B9R1.2 NNc1cccc(c1)C 1P003SN5 [0,2,0,0,0,0|1,0,0]=3 2391 B9R1.2 NNc1cccc(c1)Cl 1P002MPK [0,2,0,0,0,0|1,0,0]=3 2392 B9R1.2 NNc1cccc(c1)Cl 1P003JRY [0,2,0,0,0,0|1,0,0]=3 2393 B9R1.2 NNc1cccc(c1)F 1P002YAH [0,2,0,0,0,0|1,0,0]=3 2394 B9R1.2 NNc1cccc(c1)F 1P00FBTT [0,2,0,0,0,0|1,0,0]=3 2395 B9R1.2 NNc1cccc(c1)O 1P00GAL3 [0,2,0,0,0,0|1,0,0]=3 2396 B9R1.2 NNc1cccc(c1)O 1P01B79V [0,2,0,0,0,0|1,0,0]=3 2397 B9R1.2 NNc1cccc(n1)Br 1P003H7K [0,2,0,0,0,0|2,0,0]=4 2398 B9R1.2 NNc1cccc(n1)Br 1P00J300 [0,2,0,0,0,0|2,0,0]=4 2399 B9R1.2 NNc1cccc(n1)C 1P00DDPS [0,2,0,0,0,0|2,0,0]=4 2400 B9R1.2 NNc1cccc(n1)C 1P00J2JN [0,2,0,0,0,0|2,0,0]=4 2401 B9R1.2 NNc1cccc(n1)Cl 1P003HH9 [0,2,0,0,0,0|2,0,0]=4 2402 B9R1.2 NNc1ccnc(c1)Br 1P01ADAI [0,2,0,0,0,0|0,0,0]=2 2403 B9R1.2 NNc1ccnc(c1)C 1P00J221 [0,2,0,0,0,0|0,0,0]=2 2404 B9R1.2 NNc1ccnc(c1)C 1P01BVOB [0,2,0,0,0,0|0,0,0]=2 2405 B9R1.2 NNc1ccnc(c1)Cl 1P005GEI [0,2,0,0,0,0|0,0,0]=2 2406 B9R1.2 NNc1ccnc(c1)F 1P008ISO [0,2,0,0,0,0|0,0,0]=2 2407 B9R1.2 NNc1ccnc(n1)Cl 1P006UCE [0,2,0,0,0,0|1,0,0]=3 2408 B9R1.2 NNc1cncc(c1)Br 1P009KEQ [0,2,0,0,0,0|2,0,0]=4 2409 B9R1.2 NNc1cncc(c1)C 1P0284S0 [0,2,0,0,0,0|2,0,0]=4 2410 B9R1.2 NNc1ncnc(n1)N 1P01EKH6 [0,2,0,0,0,0|2,0,0]=4 2411 B9R1.2 NOc1cccc(c1)Br 1P028VDB [0,2,0,0,0,0|1,0,0]=3 2412 B9R1.2 NOc1cccc(c1)Cl 1P024WNO [0,2,0,0,0,0|1,0,0]=3 2413 B9R1.2 N\N=c/1\cc(Cl)cc[nH]1 1P0033AX [0,2,0,0,0,0|1,0,1]=4 2414 B9R1.2 N\N=c\1/cc(Cl)nc[nH]1 1P00IAQD [0,2,0,0,0,0|1,0,0]=3 2415 B9R1.2 N\N=c\1/cccc([nH]1)F 1P008MLV [0,2,0,0,0,0|2,0,0]=4 2416 B9R1.2 Nc1cc(C=C)ncc1 1P0006QG [0,2,0,0,0,0|0,0,0]=2 2417 B9R1.2 Nc1cc(CBr)cnc1 1P01KLTB [0,2,0,0,0,0|2,0,0]=4 2418 B9R1.2 Nc1cc(CO)cnc1 1P00DEEH [0,2,0,0,0,0|2,0,0]=4 2419 B9R1.2 Nc1cc(CO)ncc1 1P0001GT [0,2,0,0,0,0|0,0,0]=2 2420 B9R1.2 Nc1cc(CO)ncc1 1P00A3VD [0,2,0,0,0,0|0,0,0]=2 2421 B9R1.2 Nc1cc(cnc1)C#C 1P00FE6Q [0,2,0,0,0,0|2,0,0]=4 2422 B9R1.2 Nc1cc(cnc1)C#N 1P003MUJ [0,2,0,0,0,0|2,0,0]=4 2423 B9R1.2 Nc1cc(cnn1)C#N 1P01EBNB [0,2,0,0,0,0|1,0,1]=4 2424 B9R1.2 Nc1cc(ncc1)C#C 1P006IAF [0,2,0,0,0,0|0,0,0]=2 2425 B9R1.2 Nc1cc(ncc1)C#C 1P00HUTT [0,2,0,0,0,0|0,0,0]=2 2426 B9R1.2 Nc1cc(ncc1)C#N 1P006TZF [0,2,0,0,0,0|0,0,0]=2 2427 B9R1.2 Nc1cc(ncn1)C#N 1P01BE4W [0,2,0,0,0,0|1,0,0]=3 2428 B9R1.2 Nc1ccnc(n1)C#N 1P002OWT [0,2,0,0,0,0|1,0,0]=3 2429 B9R1.2 Nc1ccnc(n1)CCl 1P008M4R [0,2,0,0,0,0|1,0,0]=3 2430 B9R1.2 Nc1ccnc(n1)CCl 1P01BHRC [0,2,0,0,0,0|1,0,0]=3 2431 B9R1.2 Nc1ccnc(n1)CO 1P027PA4 [0,2,0,0,0,0|1,0,0]=3 2432 B9R1.2 O=Cc1cc[nH]c(=O)c1 1P002HFI [0,2,0,0,0,0|1,0,1]=4 2433 B9R1.2 O=Cc1cccc(c1)Br 1P00343C [0,2,0,0,0,0|2,0,0]=4 2434 B9R1.2 O=Cc1cccc(c1)C 1P003K77 [0,2,0,0,0,0|2,0,0]=4 2435 B9R1.2 O=Cc1cccc(c1)Cl 1P00IAWD [0,2,0,0,0,0|2,0,0]=4 2436 B9R1.2 O=Cc1cccc(c1)F 1P003465 [0,2,0,0,0,0|2,0,0]=4 2437 B9R1.2 O=Cc1cccc(c1)I 1P003475 [0,2,0,0,0,0|2,0,0]=4 2438 B9R1.2 O=Cc1cccc(c1)N 1P000X9L [0,2,0,0,0,0|1,0,0]=3 2439 B9R1.2 O=Cc1cccc(c1)O 1P0000OK [0,2,0,0,0,0|2,0,0]=4 2440 B9R1.2 O=Cc1cccc(c1)S 1P01A8YV [0,2,0,0,0,0|2,0,0]=4 2441 B9R1.2 O=Cc1cccc(n1)N 1P00CBAY [0,2,0,0,0,0|2,0,0]=4 2442 B9R1.2 O=Cc1ccnc(c1)Br 1P003H5M [0,2,0,0,0,0|1,0,0]=3 2443 B9R1.2 O=Cc1ccnc(c1)C 1P0037DJ [0,2,0,0,0,0|1,0,0]=3 2444 B9R1.2 O=Cc1ccnc(c1)Cl 1P000448 [0,2,0,0,0,0|1,0,0]=3 2445 B9R1.2 O=Cc1ccnc(c1)Cl 1P000K6W [0,2,0,0,0,0|1,0,0]=3 2446 B9R1.2 O=Cc1ccnc(c1)F 1P00104Q [0,2,0,0,0,0|1,0,0]=3 2447 B9R1.2 O=Cc1ccnc(n1)C 1P0002D1 [0,2,0,0,0,0|2,0,0]=4 2448 B9R1.2 O=Cc1ccnc(n1)Cl 1P00IIPN [0,2,0,0,0,0|2,0,0]=4 2449 B9R1.2 OCc1cc(=N)[nH]cn1 1P00DLDW [0,2,0,0,0,0|1,0,1]=4 2450 B9R1.2 OCc1cc(=O)[nH]cn1 1P0003SE [0,2,0,0,0,0|2,0,0]=4 2451 B9R1.2 OCc1cc(Br)ccn1 1P00103V [0,2,0,0,0,0|1,0,0]=3 2452 B9R1.2 OCc1cc(Cl)ccn1 1P003CC4 [0,2,0,0,0,0|1,0,0]=3 2453 B9R1.2 OCc1cc(Cl)ccn1 1P00J1WS [0,2,0,0,0,0|1,0,0]=3 2454 B9R1.2 OCc1cc(Cl)ncn1 1P00084K [0,2,0,0,0,0|2,0,0]=4 2455 B9R1.2 OCc1cc(F)ccn1 1P00HH5P [0,2,0,0,0,0|1,0,0]=3 2456 B9R1.2 OCc1cc[nH]c(=O)c1 1P000XX1 [0,2,0,0,0,0|1,0,1]=4 2457 B9R1.2 OCc1cccc(c1)Br 1P001QQM [0,2,0,0,0,0|2,0,0]=4 2458 B9R1.2 OCc1cccc(c1)C 1P003K7G [0,2,0,0,0,0|2,0,0]=4 2459 B9R1.2 OCc1cccc(c1)Cl 1P003JR6 [0,2,0,0,0,0|2,0,0]=4 2460 B9R1.2 OCc1cccc(c1)F 1P003JXY [0,2,0,0,0,0|2,0,0]=4 2461 B9R1.2 OCc1cccc(c1)I 1P003K2C [0,2,0,0,0,0|2,0,0]=4 2462 B9R1.2 OCc1cccc(c1)N 1P0039D9 [0,2,0,0,0,0|1,0,0]=3 2463 B9R1.2 OCc1cccc(c1)O 1P003K0Z [0,2,0,0,0,0|2,0,0]=4 2464 B9R1.2 OCc1cccc(c1)S 1P00566D [0,2,0,0,0,0|2,0,0]=4 2465 B9R1.2 OCc1cccc(n1)N 1P003NJ2 [0,2,0,0,0,0|2,0,0]=4 2466 B9R1.2 OCc1ccnc(c1)Br 1P008RSZ [0,2,0,0,0,0|1,0,0]=3 2467 B9R1.2 OCc1ccnc(c1)C 1P007XDG [0,2,0,0,0,0|1,0,0]=3 2468 B9R1.2 OCc1ccnc(c1)Cl 1P00035P [0,2,0,0,0,0|1,0,0]=3 2469 B9R1.2 OCc1ccnc(c1)F 1P00104Y [0,2,0,0,0,0|1,0,0]=3 2470 B9R1.2 OCc1ccnc(c1)N 1P003C2A [0,2,0,0,0,0|1,0,0]=3 2471 B9R1.2 OCc1ccnc(n1)C 1P008T10 [0,2,0,0,0,0|2,0,0]=4 2472 B9R1.2 OCc1ccnc(n1)Cl 1P00CMNH [0,2,0,0,0,0|2,0,0]=4 2473 B9R1.2 OCc1ccnc(n1)N 1P00BFQP [0,2,0,0,0,0|2,0,0]=4 2474 B9R1.2 OCc1nc(Br)ccn1 1P02874M [0,2,0,0,0,0|2,0,0]=4 2475 B9R1.2 OCc1nc(Cl)ccn1 1P0096F4 [0,2,0,0,0,0|2,0,0]=4 2476 B9R1.2 OCc1nccc(=O)[nH]1 1P00CYET [0,2,0,0,0,0|2,0,0]=4 2477 B9R1.2 OCc1nccc(c1)O 1P01DL28 [0,2,0,0,0,0|1,0,0]=3 2478 B9R1.2 OCc1nccc(n1)O 1P028LSQ [0,2,0,0,0,0|2,0,0]=4 2479 B9R1.2 OCc1nncc(c1)C 1P0026U6 [0,2,0,0,0,0|2,0,0]=4 2480 B9R1.2 ONc1ccnc(=O)[nH]1 1P002ANF [0,2,0,0,0,0|1,0,0]=3 2481 B9R1.2 Oc1cc(CCl)ncn1 1P01EMWL [0,2,0,0,0,0|2,0,0]=4 2482 B9R1.2 Oc1cc(ncc1)C#N 1P00DIFJ [0,2,0,0,0,0|1,0,0]=3 2483 B9R1.2 Oc1cc(ncn1)C#N 1P01AG7T [0,2,0,0,0,0|1,0,1]=4 2484 B9R1.2 Oc1ccnc(n1)C#N 1P01AGKE [0,2,0,0,0,0|2,0,0]=4 2485 B9R1.2 SCc1cccc(c1)Br 1P003JKV [0,2,0,0,0,0|2,0,0]=4 2486 B9R1.2 SCc1cccc(c1)C 1P003K7K [0,2,0,0,0,0|2,0,0]=4 2487 B9R1.2 SCc1cccc(c1)Cl 1P00BIQ5 [0,2,0,0,0,0|2,0,0]=4 2488 B9R1.2 SCc1cccc(c1)F 1P00C7RA [0,2,0,0,0,0|2,0,0]=4 2489 B9R1.2 SCc1cccc(c1)I 1P0290H9 [0,2,0,0,0,0|2,0,0]=4 2490 B9R1.2 [C-]#[N+]c1cccc(c1)Br 1P001LP6 [0,2,0,0,0,0|1,0,1]=4 2491 B9R1.2 [C-]#[N+]c1cccc(c1)Cl 1P00CPGW [0,2,0,0,0,0|1,0,1]=4 2492 B9R1.2 [C-]#[N+]c1cccc(c1)F 1P00BLRO [0,2,0,0,0,0|1,0,1]=4 2493 B9R1.6 BrC(=C)c1ccccc1 1P003AO1 [0,2,0,0,0,0|2,0,0]=4 2494 B9R1.6 BrC(=O)c1ccccc1 1P003OJM [0,2,0,0,0,0|2,0,0]=4 2495 B9R1.6 C(=O)([2H])c1ccccc1 1P00CKBV [0,2,0,0,0,0|2,0,0]=4 2496 B9R1.6 CC(=O)c1ccccc1 1P0036AX [0,2,0,0,0,0|2,0,0]=4 2497 B9R1.6 CC(=O)c1ccncc1 1P003L3Q [0,2,0,0,0,0|1,0,0]=3 2498 B9R1.6 CC(=O)c1ccncn1 1P00BYH9 [0,2,0,0,0,0|2,0,0]=4 2499 B9R1.6 CC(=O)c1ccnnc1 1P006VU7 [0,2,0,0,0,0|2,0,0]=4 2500 B9R1.6 CC(c1ccccc1)Br 1P003BVV [0,2,0,0,0,0|2,0,0]=4 2501 B9R1.6 CC(c1ccccc1)C 1P0032S0 [0,2,0,0,0,0|2,0,0]=4 2502 B9R1.6 CC(c1ccccc1)Cl 1P003ENS [0,2,0,0,0,0|2,0,0]=4 2503 B9R1.6 CC(c1ccccc1)N 1P00369W [0,2,0,0,0,0|1,0,0]=3 2504 B9R1.6 CC(c1ccccc1)N 1P009X79 [0,2,0,0,0,0|1,0,0]=3 2505 B9R1.6 CC(c1ccccc1)S 1P003COW [0,2,0,0,0,0|2,0,0]=4 2506 B9R1.6 CC(c1ccccn1)N 1P0039UO [0,2,0,0,0,0|2,0,0]=4 2507 B9R1.6 CC(c1ccccn1)N 1P003DC9 [0,2,0,0,0,0|2,0,0]=4 2508 B9R1.6 CC(c1cccnc1)N 1P000HRO [0,2,0,0,0,0|2,0,0]=4 2509 B9R1.6 CC(c1cccnc1)N 1P003DEG [0,2,0,0,0,0|2,0,0]=4 2510 B9R1.6 CC(c1ccncc1)Br 1P019XJY [0,2,0,0,0,0|1,0,0]=3 2511 B9R1.6 CC(c1ccncc1)C 1P003M2H [0,2,0,0,0,0|1,0,0]=3 2512 B9R1.6 CC(c1ccncc1)Cl 1P0169EG [0,2,0,0,0,0|1,0,0]=3 2513 B9R1.6 CC(c1ccncc1)N 1P001ZXP [0,2,0,0,0,0|0,0,0]=2 2514 B9R1.6 CC(c1ccncc1)N 1P003DHP [0,2,0,0,0,0|0,0,0]=2 2515 B9R1.6 CC(c1ccncc1)N 1P01C1JO [0,2,0,0,0,0|0,0,0]=2 2516 B9R1.6 CC(c1ccncc1)O 1P002NIX [0,2,0,0,0,0|1,0,0]=3 2517 B9R1.6 CC(c1ccncn1)N 1P000P00 [0,2,0,0,0,0|1,0,0]=3 2518 B9R1.6 CC(c1ccnnc1)N 1P0003H4 [0,2,0,0,0,0|1,0,0]=3 2519 B9R1.6 CC(c1ccnnc1)N 1P00HDEA [0,2,0,0,0,0|1,0,0]=3 2520 B9R1.6 CC(c1ccnnc1)O 1P0282XW [0,2,0,0,0,0|2,0,0]=4 2521 B9R1.6 CN(c1ccccc1)C 1P003T1K [0,2,0,0,0,0|1,0,0]=3 2522 B9R1.6 CN(c1ccccc1)N 1P003EY0 [0,2,0,0,0,0|1,0,0]=3 2523 B9R1.6 CN(c1ccccc1)N 1P00EKZW [0,2,0,0,0,0|1,0,0]=3 2524 B9R1.6 CN(c1ccccn1)C 1P003BOB [0,2,0,0,0,0|2,0,0]=4 2525 B9R1.6 CN(c1ccccn1)N 1P00736N [0,2,0,0,0,0|2,0,0]=4 2526 B9R1.6 CN(c1cccnc1)C 1P0075WN [0,2,0,0,0,0|2,0,0]=4 2527 B9R1.6 CN(c1ccncc1)C 1P0034HE [0,2,0,0,0,0|0,0,0]=2 2528 B9R1.6 CN(c1ccncc1)C 1P003LRE [0,2,0,0,0,0|0,0,0]=2 2529 B9R1.6 CN(c1ccncc1)N 1P01E1AT [0,2,0,0,0,0|0,0,0]=2 2530 B9R1.6 CN(c1ccncn1)C 1P00D0M3 [0,2,0,0,0,0|1,0,0]=3 2531 B9R1.6 CP(c1ccccc1)C 1P003Q45 [0,2,0,0,0,0|1,1,0]=4 2532 B9R1.6 CP(c1ccccc1)C 1P00BHDQ [0,2,0,0,0,0|1,1,0]=4 2533 B9R1.6 CP(c1ccncc1)C 1P028LIG [0,2,0,0,0,0|0,1,0]=3 2534 B9R1.6 CS(=O)c1ccccc1 1P000J0D [0,2,0,0,0,0|2,0,0]=4 2535 B9R1.6 C[C@@H](c1ccccc1)N 1P0032WG [0,2,0,0,0,0|1,0,0]=3 2536 B9R1.6 C[C@@H](c1ccccc1)O 1P00HXJL [0,2,0,0,0,0|2,0,0]=4 2537 B9R1.6 C[C@@H](c1ccccc1)S 1P01BVUY [0,2,0,0,0,0|2,0,0]=4 2538 B9R1.6 C[C@@H](c1ccccn1)N 1P002VEV [0,2,0,0,0,0|2,0,0]=4 2539 B9R1.6 C[C@@H](c1ccccn1)N 1P00CJBI [0,2,0,0,0,0|2,0,0]=4 2540 B9R1.6 C[C@@H](c1cccnc1)N 1P002VEU [0,2,0,0,0,0|2,0,0]=4 2541 B9R1.6 C[C@@H](c1cccnc1)N 1P00I8C2 [0,2,0,0,0,0|2,0,0]=4 2542 B9R1.6 C[C@@H](c1ccncc1)N 1P002VET [0,2,0,0,0,0|0,0,0]=2 2543 B9R1.6 C[C@@H](c1ccncc1)N 1P00CNEB [0,2,0,0,0,0|0,0,0]=2 2544 B9R1.6 C[C@@H](c1ccncc1)O 1P003CZI [0,2,0,0,0,0|1,0,0]=3 2545 B9R1.6 C[C@@H](c1ccncn1)O 1P01C1ND [0,2,0,0,0,0|2,0,0]=4 2546 B9R1.6 C[C@H](c1ccccc1)N 1P0032UU [0,2,0,0,0,0|1,0,0]=3 2547 B9R1.6 C[C@H](c1ccccc1)N 1P00BC58 [0,2,0,0,0,0|1,0,0]=3 2548 B9R1.6 C[C@H](c1ccccc1)O 1P0032UN [0,2,0,0,0,0|2,0,0]=4 2549 B9R1.6 C[C@H](c1ccccc1)S 1P01DWTD [0,2,0,0,0,0|2,0,0]=4 2550 B9R1.6 C[C@H](c1ccccn1)N 1P009I22 [0,2,0,0,0,0|2,0,0]=4 2551 B9R1.6 C[C@H](c1ccccn1)N 1P00DBIS [0,2,0,0,0,0|2,0,0]=4 2552 B9R1.6 C[C@H](c1cccnc1)N 1P000DVB [0,2,0,0,0,0|2,0,0]=4 2553 B9R1.6 C[C@H](c1cccnc1)N 1P00CKTS [0,2,0,0,0,0|2,0,0]=4 2554 B9R1.6 C[C@H](c1cccnc1)N 1P00I8C1 [0,2,0,0,0,0|2,0,0]=4 2555 B9R1.6 C[C@H](c1ccncc1)N 1P0004FL [0,2,0,0,0,0|0,0,0]=2 2556 B9R1.6 C[C@H](c1ccncc1)N 1P00DLCH [0,2,0,0,0,0|0,0,0]=2 2557 B9R1.6 C[C@H](c1ccncc1)O 1P002VEW [0,2,0,0,0,0|1,0,0]=3 2558 B9R1.6 C[Si](c1ccccc1)C 1P00358B [0,2,0,0,0,0|2,0,0]=4 2559 B9R1.6 ClB(c1ccccc1)Cl 1P004HX5 [0,2,0,0,0,0|2,0,0]=4 2560 B9R1.6 ClC(=O)c1ccccc1 1P00374M [0,2,0,0,0,0|2,0,0]=4 2561 B9R1.6 ClC(=O)c1ccncc1 1P003RKP [0,2,0,0,0,0|1,0,0]=3 2562 B9R1.6 ClC(=S)c1ccccc1 1P01E7HC [0,2,0,0,0,0|2,0,0]=4 2563 B9R1.6 ClC(c1ccccc1)Cl 1P00IKXY [0,2,0,0,0,0|2,0,0]=4 2564 B9R1.6 ClP(c1ccccc1)Cl 1P0035XX [0,2,0,0,0,0|1,1,0]=4 2565 B9R1.6 ClS(=O)c1ccccc1 1P00DHD9 [0,2,0,0,0,0|2,0,0]=4 2566 B9R1.6 Cl[I](c1ccccc1)Cl 1P0037A2 [0,2,0,0,0,0|2,0,0]=4 2567 B9R1.6 FC(=C)c1ccccc1 1P005W4Z [0,2,0,0,0,0|2,0,0]=4 2568 B9R1.6 FC(=O)c1ccccc1 1P00D8I4 [0,2,0,0,0,0|2,0,0]=4 2569 B9R1.6 FC(c1ccccc1)Br 1P020M24 [0,2,0,0,0,0|2,0,0]=4 2570 B9R1.6 FC(c1ccccc1)F 1P00DCHS [0,2,0,0,0,0|2,0,0]=4 2571 B9R1.6 FC(c1ccncc1)F 1P003KO8 [0,2,0,0,0,0|1,0,0]=3 2572 B9R1.6 NC(=N)c1ccccc1 1P002J4G [0,2,0,0,0,0|1,0,0]=3 2573 B9R1.6 NC(=N)c1ccccc1 1P0034Y8 [0,2,0,0,0,0|1,0,0]=3 2574 B9R1.6 NC(=N)c1ccccc1 1P003OH8 [0,2,0,0,0,0|1,0,0]=3 2575 B9R1.6 NC(=N)c1ccccc1 1P00FJIS [0,2,0,0,0,0|1,0,0]=3 2576 B9R1.6 NC(=N)c1ccccn1 1P0035Y9 [0,2,0,0,0,0|2,0,0]=4 2577 B9R1.6 NC(=N)c1cccnc1 1P002N4J [0,2,0,0,0,0|2,0,0]=4 2578 B9R1.6 NC(=N)c1cccnc1 1P003KCV [0,2,0,0,0,0|2,0,0]=4 2579 B9R1.6 NC(=N)c1cccnc1 1P00EEAY [0,2,0,0,0,0|2,0,0]=4 2580 B9R1.6 NC(=N)c1ccncc1 1P0035IL [0,2,0,0,0,0|0,0,0]=2 2581 B9R1.6 NC(=N)c1ccncc1 1P00EDM3 [0,2,0,0,0,0|0,0,0]=2 2582 B9R1.6 NC(=N)c1ccncn1 1P01B7CQ [0,2,0,0,0,0|1,0,0]=3 2583 B9R1.6 NC(=O)c1ccccc1 1P00DOQ9 [0,2,0,0,0,0|1,0,0]=3 2584 B9R1.6 NC(=O)c1ccccn1 1P003U8O [0,2,0,0,0,0|2,0,0]=4 2585 B9R1.6 NC(=O)c1cccnc1 1P00IKH0 [0,2,0,0,0,0|2,0,0]=4 2586 B9R1.6 NC(=O)c1ccncc1 1P001L8G [0,2,0,0,0,0|0,0,0]=2 2587 B9R1.6 NC(=O)c1ccncn1 1P002WFX [0,2,0,0,0,0|1,0,0]=3 2588 B9R1.6 NC(=O)c1ccnnc1 1P00H1KR [0,2,0,0,0,0|1,0,0]=3 2589 B9R1.6 NC(=S)c1ccccc1 1P00365I [0,2,0,0,0,0|1,0,0]=3 2590 B9R1.6 NC(=S)c1ccccn1 1P00IA0A [0,2,0,0,0,0|2,0,0]=4 2591 B9R1.6 NC(=S)c1cccnc1 1P00I915 [0,2,0,0,0,0|2,0,0]=4 2592 B9R1.6 NC(=S)c1ccncc1 1P003V92 [0,2,0,0,0,0|0,0,0]=2 2593 B9R1.6 NC(=S)c1ccncn1 1P0049JJ [0,2,0,0,0,0|1,0,0]=3 2594 B9R1.6 NC(=S)c1ccnnc1 1P00C81H [0,2,0,0,0,0|1,0,0]=3 2595 B9R1.6 NS(=O)c1ccccc1 1P001SKC [0,2,0,0,0,0|1,0,0]=3 2596 B9R1.6 O=N(=O)c1ccccc1 1P003TLR [0,2,0,0,0,0|1,0,1]=4 2597 B9R1.6 OB(c1ccccc1)O 1P0035XS [0,2,0,0,0,0|2,0,0]=4 2598 B9R1.6 OB(c1ccncc1)O 1P001Z1D [0,2,0,0,0,0|1,0,0]=3 2599 B9R1.6 OB(c1ccncc1)O 1P006O18 [0,2,0,0,0,0|1,0,0]=3 2600 B9R1.6 OB(c1ccncn1)O 1P0038UT [0,2,0,0,0,0|2,0,0]=4 2601 B9R1.6 OC(=O)c1ccccc1 1P0034YN [0,2,0,0,0,0|2,0,0]=4 2602 B9R1.6 OC(=O)c1ccccc1 1P003U1P [0,2,0,0,0,0|2,0,0]=4 2603 B9R1.6 OC(=O)c1ccccc1 1P0080KJ [0,2,0,0,0,0|2,0,0]=4 2604 B9R1.6 OC(=O)c1ccccc1 1P00GSC1 [0,2,0,0,0,0|2,0,0]=4 2605 B9R1.6 OC(=O)c1ccccc1 1P01JV1A [0,2,0,0,0,0|2,0,0]=4 2606 B9R1.6 OC(=O)c1ccncc1 1P0035IK [0,2,0,0,0,0|1,0,0]=3 2607 B9R1.6 OC(=O)c1ccncn1 1P003UJM [0,2,0,0,0,0|2,0,0]=4 2608 B9R1.6 OC(=O)c1ccnnc1 1P0034LS [0,2,0,0,0,0|2,0,0]=4 2609 B9R1.6 OC(=S)c1ccccc1 1P00365J [0,2,0,0,0,0|2,0,0]=4 2610 B9R1.6 OP(=O)c1ccccc1 1P00262L [0,2,0,0,0,0|1,1,0]=4 2611 B9R1.6 OS(=O)c1ccccc1 1P00IBDR [0,2,0,0,0,0|2,0,0]=4 2612 B9R1.6 O[Se](=O)c1ccccc1 1P003OHL [0,2,0,0,0,0|2,0,0]=4 2613 B9R1.6 [O-]C(=O)c1ccccc1 1P001YXL [0,2,0,0,0,0|2,0,0]=4 2614 B9R1.6 [O-]C(=O)c1ccccc1 1P00361Z [0,2,0,0,0,0|2,0,0]=4 2615 B9R1.6 [O-]C(=O)c1ccccc1 1P003OB0 [0,2,0,0,0,0|2,0,0]=4 2616 B9R1.6 [O-]C(=O)c1ccccc1 1P003RRN [0,2,0,0,0,0|2,0,0]=4 2617 B9R1.6 [O-]C(=O)c1ccccc1 1P003UCI [0,2,0,0,0,0|2,0,0]=4 2618 B9R1.6 [O-]C(=O)c1ccccc1 1P003UPU [0,2,0,0,0,0|2,0,0]=4 2619 B9R1.6 [O-]C(=O)c1ccccc1 1P00C9FZ [0,2,0,0,0,0|2,0,0]=4 2620 B9R1.6 [O-]C(=O)c1ccccc1 1P00D9FZ [0,2,0,0,0,0|2,0,0]=4 2621 B9R1.6 [O-]C(=O)c1ccccc1 1P01DORW [0,2,0,0,0,0|2,0,0]=4 2622 B9R1.6 [O-]C(=O)c1ccncc1 1P003US2 [0,2,0,0,0,0|1,0,0]=3 2623 B9R1.6 [O-]C(=O)c1ccncn1 1P0055B7 [0,2,0,0,0,0|2,0,0]=4 2624 B9R1.6 [O-]S(=O)c1ccccc1 1P002RKI [0,2,0,0,0,0|2,0,0]=4 2625 B9R1.6 [O-]S(=O)c1ccccc1 1P00388M [0,2,0,0,0,0|2,0,0]=4 2626 B9R1.6 [O-]S(=O)c1ccccc1 1P004L8X [0,2,0,0,0,0|2,0,0]=4 2627 B9R1.6 [O-]S(=O)c1ccncc1 1P01FNTD [0,2,0,0,0,0|1,0,0]=3 2628 B9R1.6 [O-][N+](=O)c1ccncc1 1P007C8Z [0,2,0,0,0,0|0,0,1]=3 2629 B9R1.8 BrC#Cc1ccccc1 1P00GZ49 [0,2,0,0,0,0|2,0,0]=4 2630 B9R1.8 BrCCc1ccccc1 1P003EKU [0,2,0,0,0,0|2,0,0]=4 2631 B9R1.8 BrCCc1ccncc1 1P01BGQT [0,2,0,0,0,0|1,0,0]=3 2632 B9R1.8 Br\C=C\c1ccccc1 1P003OMN [0,2,0,0,0,0|2,0,0]=4 2633 B9R1.8 C=CCc1ccccc1 1P003O6X [0,2,0,0,0,0|2,0,0]=4 2634 B9R1.8 C=COc1ccccc1 1P005W2F [0,2,0,0,0,0|2,0,0]=4 2635 B9R1.8 C=CSc1ccccc1 1P0023XU [0,2,0,0,0,0|2,0,0]=4 2636 B9R1.8 CC#Cc1ccccc1 1P000515 [0,2,0,0,0,0|2,0,0]=4 2637 B9R1.8 CCCc1ccccc1 1P003UGP [0,2,0,0,0,0|2,0,0]=4 2638 B9R1.8 CCCc1ccncc1 1P003MH0 [0,2,0,0,0,0|1,0,0]=3 2639 B9R1.8 CCNc1ccccc1 1P0035UD [0,2,0,0,0,0|1,0,0]=3 2640 B9R1.8 CCNc1ccccn1 1P003FIU [0,2,0,0,0,0|2,0,0]=4 2641 B9R1.8 CCNc1cccnc1 1P00CN8W [0,2,0,0,0,0|2,0,0]=4 2642 B9R1.8 CCNc1ccncc1 1P00I7EH [0,2,0,0,0,0|0,0,0]=2 2643 B9R1.8 CCNc1ccnnc1 1P01BTY6 [0,2,0,0,0,0|1,0,0]=3 2644 B9R1.8 CCOc1ccccc1 1P003U4U [0,2,0,0,0,0|2,0,0]=4 2645 B9R1.8 CCOc1ccncc1 1P00C0Z1 [0,2,0,0,0,0|1,0,0]=3 2646 B9R1.8 CCSc1ccccc1 1P003QX8 [0,2,0,0,0,0|2,0,0]=4 2647 B9R1.8 CNCc1ccccc1 1P0035T0 [0,2,0,0,0,0|1,0,0]=3 2648 B9R1.8 CNCc1ccccn1 1P002L6V [0,2,0,0,0,0|2,0,0]=4 2649 B9R1.8 CNCc1ccccn1 1P00H9TS [0,2,0,0,0,0|2,0,0]=4 2650 B9R1.8 CNCc1cccnc1 1P003IN0 [0,2,0,0,0,0|2,0,0]=4 2651 B9R1.8 CNCc1cccnc1 1P00JLQD [0,2,0,0,0,0|2,0,0]=4 2652 B9R1.8 CNCc1ccncc1 1P003TOO [0,2,0,0,0,0|0,0,0]=2 2653 B9R1.8 CNCc1ccncc1 1P009DU1 [0,2,0,0,0,0|0,0,0]=2 2654 B9R1.8 CNCc1ccncn1 1P00J3UF [0,2,0,0,0,0|1,0,0]=3 2655 B9R1.8 CNNc1ccccc1 1P00H3DS [0,2,0,0,0,0|1,0,0]=3 2656 B9R1.8 COCc1ccccc1 1P003OL0 [0,2,0,0,0,0|2,0,0]=4 2657 B9R1.8 COCc1ccncc1 1P00FGIA [0,2,0,0,0,0|1,0,0]=3 2658 B9R1.8 CSCc1ccccc1 1P003OL2 [0,2,0,0,0,0|2,0,0]=4 2659 B9R1.8 C\C=C/c1ccccc1 1P003PGJ [0,2,0,0,0,0|2,0,0]=4 2660 B9R1.8 C\C=C\c1ccccc1 1P003VFF [0,2,0,0,0,0|2,0,0]=4 2661 B9R1.8 C\N=C\c1ccccc1 1P003T8J [0,2,0,0,0,0|1,0,1]=4 2662 B9R1.8 ClCCc1ccccc1 1P0032NZ [0,2,0,0,0,0|2,0,0]=4 2663 B9R1.8 ClCCc1ccncc1 1P00G7HW [0,2,0,0,0,0|1,0,0]=3 2664 B9R1.8 ClCSc1ccccc1 1P003PAU [0,2,0,0,0,0|2,0,0]=4 2665 B9R1.8 ClC[SiH2]c1ccccc1 1P001U85 [0,2,0,0,0,0|2,0,0]=4 2666 B9R1.8 IC#Cc1ccccc1 1P006HO6 [0,2,0,0,0,0|2,0,0]=4 2667 B9R1.8 ICCc1ccccc1 1P001ZMC [0,2,0,0,0,0|2,0,0]=4 2668 B9R1.8 N#CCc1ccncc1 1P000W7U [0,2,0,0,0,0|0,0,1]=3 2669 B9R1.8 N#CCc1ccncc1 1P003MHC [0,2,0,0,0,0|0,0,1]=3 2670 B9R1.8 N#CCc1ccncn1 1P00G7GU [0,2,0,0,0,0|1,0,1]=4 2671 B9R1.8 N#CCc1ccnnc1 1P000BGU [0,2,0,0,0,0|1,0,1]=4 2672 B9R1.8 N#CNc1ccccc1 1P00F3HT [0,2,0,0,0,0|1,0,0]=3 2673 B9R1.8 N#COc1ccccc1 1P003U5M [0,2,0,0,0,0|1,0,1]=4 2674 B9R1.8 N#CSc1ccccc1 1P00E15Y [0,2,0,0,0,0|1,0,1]=4 2675 B9R1.8 NCCc1ccccc1 1P001OVX [0,2,0,0,0,0|1,0,0]=3 2676 B9R1.8 NCCc1ccccc1 1P00AL3F [0,2,0,0,0,0|1,0,0]=3 2677 B9R1.8 NCCc1ccccn1 1P0033BC [0,2,0,0,0,0|2,0,0]=4 2678 B9R1.8 NCCc1cccnc1 1P0031LS [0,2,0,0,0,0|2,0,0]=4 2679 B9R1.8 NCCc1cccnc1 1P007RI3 [0,2,0,0,0,0|2,0,0]=4 2680 B9R1.8 NCCc1cccnc1 1P00G4HF [0,2,0,0,0,0|2,0,0]=4 2681 B9R1.8 NCCc1ccncc1 1P0011CE [0,2,0,0,0,0|0,0,0]=2 2682 B9R1.8 NCCc1ccncc1 1P00EB7D [0,2,0,0,0,0|0,0,0]=2 2683 B9R1.8 NCCc1ccncn1 1P00G8NQ [0,2,0,0,0,0|1,0,0]=3 2684 B9R1.8 NCCc1ccnnc1 1P01FJWH [0,2,0,0,0,0|1,0,0]=3 2685 B9R1.8 NNCc1ccccc1 1P002AS6 [0,2,0,0,0,0|1,0,0]=3 2686 B9R1.8 NNCc1ccccc1 1P003OLM [0,2,0,0,0,0|1,0,0]=3 2687 B9R1.8 NNCc1ccccc1 1P00VUSV [0,2,0,0,0,0|1,0,0]=3 2688 B9R1.8 NNCc1ccccn1 1P00BJY5 [0,2,0,0,0,0|2,0,0]=4 2689 B9R1.8 NNCc1ccccn1 1P00IG9V [0,2,0,0,0,0|2,0,0]=4 2690 B9R1.8 NNCc1cccnc1 1P0033XM [0,2,0,0,0,0|2,0,0]=4 2691 B9R1.8 NNCc1cccnc1 1P00EM3P [0,2,0,0,0,0|2,0,0]=4 2692 B9R1.8 NNCc1cccnc1 1P00FT0X [0,2,0,0,0,0|2,0,0]=4 2693 B9R1.8 NNCc1ccncc1 1P00GVVL [0,2,0,0,0,0|0,0,0]=2 2694 B9R1.8 NOCc1ccccc1 1P0035W0 [0,2,0,0,0,0|1,0,0]=3 2695 B9R1.8 NOCc1ccccc1 1P003TWF [0,2,0,0,0,0|1,0,0]=3 2696 B9R1.8 NOCc1ccccn1 1P01C2PM [0,2,0,0,0,0|2,0,0]=4 2697 B9R1.8 NOCc1cccnc1 1P00I7X0 [0,2,0,0,0,0|2,0,0]=4 2698 B9R1.8 N\N=C\c1ccccc1 1P00DGB6 [0,2,0,0,0,0|1,0,0]=3 2699 B9R1.8 O=CCc1ccccc1 1P00170M [0,2,0,0,0,0|2,0,0]=4 2700 B9R1.8 O=CNc1ccccc1 1P003R5D [0,2,0,0,0,0|1,0,0]=3 2701 B9R1.8 O=CNc1ccccn1 1P00C130 [0,2,0,0,0,0|2,0,0]=4 2702 B9R1.8 O=COc1ccccc1 1P0035XN [0,2,0,0,0,0|2,0,0]=4 2703 B9R1.8 O=S=Nc1ccccc1 1P003TUI [0,2,0,0,0,0|1,0,1]=4 2704 B9R1.8 OCCc1ccccc1 1P0033W3 [0,2,0,0,0,0|2,0,0]=4 2705 B9R1.8 OCCc1ccncc1 1P003FL5 [0,2,0,0,0,0|1,0,0]=3 2706 B9R1.8 OCCc1ccncc1 1P00CHZZ [0,2,0,0,0,0|1,0,0]=3 2707 B9R1.8 OCCc1ccncn1 1P005N7W [0,2,0,0,0,0|2,0,0]=4 2708 B9R1.8 ON=Cc1ccncc1 1P003MH3 [0,2,0,0,0,0|0,0,1]=3 2709 B9R1.8 ONCc1ccccc1 1P002ZBQ [0,2,0,0,0,0|1,0,0]=3 2710 B9R1.8 ONCc1ccccc1 1P003920 [0,2,0,0,0,0|1,0,0]=3 2711 B9R1.8 O\N=C/c1ccccc1 1P00EASV [0,2,0,0,0,0|1,0,1]=4 2712 B9R1.8 O\N=C\c1ccccc1 1P003OH6 [0,2,0,0,0,0|1,0,1]=4 2713 B9R1.8 O\N=C\c1ccncc1 1P00AZF2 [0,2,0,0,0,0|0,0,1]=3 2714 B9R1.8 O\N=C\c1ccncn1 1P00954Y [0,2,0,0,0,0|1,0,1]=4 2715 B9R1.8 S=C=Nc1ccccc1 1P003RMC [0,2,0,0,0,0|1,0,1]=4 2716 B9R1.8 S=C=Nc1ccncc1 1P0058C7 [0,2,0,0,0,0|0,0,1]=3 2717 B9R1.8 SCCc1ccccc1 1P00DCX2 [0,2,0,0,0,0|2,0,0]=4 2718 B9R1.8 SCCc1ccncc1 1P003MH7 [0,2,0,0,0,0|1,0,0]=3 2719 B9R1.8 [C-]#[N+]Cc1ccccc1 1P003OKW [0,2,0,0,0,0|1,0,1]=4 2720 B9R1.8 [C-]#[N+]Cc1ccncc1 1P00EBP6 [0,2,0,0,0,0|0,0,1]=3 2721 B9R1.8 [CH2-]\C=C\c1ccccc1 1P0035WW [0,2,0,0,0,0|2,0,0]=4 2722 B9R1.8 [Cu]C#Cc1ccccc1 1P000WOP [0,2,0,0,0,0|2,0,0]=4 2723 B9R1.8 [N-]=[N+]=Cc1ccccc1 1P008PXQ [0,2,0,0,0,0|1,0,1]=4 2724 B9R1.8 [N-]=[N+]=Nc1ccccc1 1P003OEN [0,2,0,0,0,0|1,0,1]=4 2725 B9R1.8 [N-]=[N+]=Nc1ccncc1 1P01BF7Y [0,2,0,0,0,0|0,0,1]=3 2726 B9R1.15 BrCc1ccccc1Br 1P0033MT [0,2,0,0,0,0|2,0,0]=4 2727 B9R1.15 BrCc1ccccc1C 1P0032QO [0,2,0,0,0,0|2,0,0]=4 2728 B9R1.15 BrCc1ccccc1Cl 1P00IB9Q [0,2,0,0,0,0|2,0,0]=4 2729 B9R1.15 BrCc1ccccc1F 1P0033SD [0,2,0,0,0,0|2,0,0]=4 2730 B9R1.15 BrCc1ccccc1I 1P0073H5 [0,2,0,0,0,0|2,0,0]=4 2731 B9R1.15 BrCc1cccnc1N 1P01BH5R [0,2,0,0,0,0|2,0,0]=4 2732 B9R1.15 BrCc1ccncc1Br 1P01BSNB [0,2,0,0,0,0|1,0,0]=3 2733 B9R1.15 BrCc1ccncc1C 1P01KKKR [0,2,0,0,0,0|1,0,0]=3 2734 B9R1.15 BrCc1ccncc1Cl 1P01AD9N [0,2,0,0,0,0|1,0,0]=3 2735 B9R1.15 BrCc1ccncc1F 1P024V4W [0,2,0,0,0,0|1,0,0]=3 2736 B9R1.15 BrCc1cnccc1C 1P0019R7 [0,2,0,0,0,0|1,0,0]=3 2737 B9R1.15 BrCc1cnccc1Cl 1P027ZHG [0,2,0,0,0,0|1,0,0]=3 2738 B9R1.15 BrCc1cnccc1O 1P0291ZL [0,2,0,0,0,0|1,0,0]=3 2739 B9R1.15 Br[Mg]c1ccccc1C 1P00IKYX [0,2,0,0,0,0|2,0,0]=4 2740 B9R1.15 C#Cc1ccccc1Br 1P0033NH [0,2,0,0,0,0|2,0,0]=4 2741 B9R1.15 C#Cc1ccccc1Cl 1P003379 [0,2,0,0,0,0|2,0,0]=4 2742 B9R1.15 C#Cc1ccccc1F 1P003ESB [0,2,0,0,0,0|2,0,0]=4 2743 B9R1.15 C#Cc1ccccc1N 1P00DG3G [0,2,0,0,0,0|1,0,0]=3 2744 B9R1.15 C#Cc1ccccc1O 1P006V78 [0,2,0,0,0,0|2,0,0]=4 2745 B9R1.15 C#Cc1cccnc1N 1P00IC61 [0,2,0,0,0,0|2,0,0]=4 2746 B9R1.15 C#Cc1ccncc1Br 1P023PDN [0,2,0,0,0,0|1,0,0]=3 2747 B9R1.15 C#Cc1ccncc1C 1P01QLIR [0,2,0,0,0,0|1,0,0]=3 2748 B9R1.15 C#Cc1ccncc1Cl 1P01DD7W [0,2,0,0,0,0|1,0,0]=3 2749 B9R1.15 C#Cc1ccncc1F 1P01B9QZ [0,2,0,0,0,0|1,0,0]=3 2750 B9R1.15 C#Cc1cnccc1C 1P00C31H [0,2,0,0,0,0|1,0,0]=3 2751 B9R1.15 C#Cc1cnccc1Cl 1P01C3NO [0,2,0,0,0,0|1,0,0]=3 2752 B9R1.15 C#Cc1cnccc1N 1P01FPD6 [0,2,0,0,0,0|0,0,0]=2 2753 B9R1.15 C#Cc1cncnc1C 1P029019 [0,2,0,0,0,0|2,0,0]=4 2754 B9R1.15 C#Cc1ncccc1N 1P01K10R [0,2,0,0,0,0|2,0,0]=4 2755 B9R1.15 C#Cc1ncncc1Cl 1P0291XJ [0,2,0,0,0,0|2,0,0]=4 2756 B9R1.15 C=Cc1ccccc1Br 1P0029NZ [0,2,0,0,0,0|2,0,0]=4 2757 B9R1.15 C=Cc1ccccc1Cl 1P0029O0 [0,2,0,0,0,0|2,0,0]=4 2758 B9R1.15 C=Cc1ccccc1F 1P0033SL [0,2,0,0,0,0|2,0,0]=4 2759 B9R1.15 C=Cc1ccccc1I 1P006XAK [0,2,0,0,0,0|2,0,0]=4 2760 B9R1.15 C=Cc1ccccc1N 1P0037RP [0,2,0,0,0,0|1,0,0]=3 2761 B9R1.15 C=Cc1ccccc1N 1P00775F [0,2,0,0,0,0|1,0,0]=3 2762 B9R1.15 C=Cc1ccncc1Br 1P028WIA [0,2,0,0,0,0|1,0,0]=3 2763 B9R1.15 C=Cc1ccncc1C 1P01C42S [0,2,0,0,0,0|1,0,0]=3 2764 B9R1.15 CCc1c[nH]ccc1=N 1P01AIO6 [0,2,0,0,0,0|0,0,2]=4 2765 B9R1.15 CCc1ccccc1Br 1P002B7A [0,2,0,0,0,0|2,0,0]=4 2766 B9R1.15 CCc1ccccc1C 1P003HOX [0,2,0,0,0,0|2,0,0]=4 2767 B9R1.15 CCc1ccccc1F 1P00DDKE [0,2,0,0,0,0|2,0,0]=4 2768 B9R1.15 CCc1ccccc1I 1P0024MY [0,2,0,0,0,0|2,0,0]=4 2769 B9R1.15 CCc1ccccc1N 1P0037MR [0,2,0,0,0,0|1,0,0]=3 2770 B9R1.15 CCc1ccccc1S 1P003HO5 [0,2,0,0,0,0|2,0,0]=4 2771 B9R1.15 CCc1cccnc1N 1P00BYMN [0,2,0,0,0,0|2,0,0]=4 2772 B9R1.15 CCc1ccn[nH]c1=O 1P000ZGP [0,2,0,0,0,0|2,0,0]=4 2773 B9R1.15 CCc1ccncc1Br 1P0078N0 [0,2,0,0,0,0|1,0,0]=3 2774 B9R1.15 CCc1ccncc1F 1P0013FK [0,2,0,0,0,0|1,0,0]=3 2775 B9R1.15 CCc1ccncc1N 1P008Z8R [0,2,0,0,0,0|1,0,0]=3 2776 B9R1.15 CCc1cnccc1Br 1P0023NT [0,2,0,0,0,0|1,0,0]=3 2777 B9R1.15 CCc1cnccc1Br 1P00ILG0 [0,2,0,0,0,0|1,0,0]=3 2778 B9R1.15 CCc1cnccc1O 1P00DYDN [0,2,0,0,0,0|1,0,0]=3 2779 B9R1.15 CCc1cncnc1Cl 1P00DC4L [0,2,0,0,0,0|2,0,0]=4 2780 B9R1.15 CCc1ncccc1N 1P01C6YI [0,2,0,0,0,0|2,0,0]=4 2781 B9R1.15 CCc1ncncc1Br 1P0066T5 [0,2,0,0,0,0|2,0,0]=4 2782 B9R1.15 CCc1ncncc1F 1P0013GL [0,2,0,0,0,0|2,0,0]=4 2783 B9R1.15 CCc1ncncc1O 1P028W1X [0,2,0,0,0,0|2,0,0]=4 2784 B9R1.15 CN=c1cc[nH]cc1N 1P00AO6C [0,2,0,0,0,0|0,0,2]=4 2785 B9R1.15 CNc1ccccc1Br 1P003H96 [0,2,0,0,0,0|1,0,0]=3 2786 B9R1.15 CNc1ccccc1Br 1P00IJUS [0,2,0,0,0,0|1,0,0]=3 2787 B9R1.15 CNc1ccccc1C 1P003TP2 [0,2,0,0,0,0|1,0,0]=3 2788 B9R1.15 CNc1ccccc1Cl 1P006I47 [0,2,0,0,0,0|1,0,0]=3 2789 B9R1.15 CNc1ccccc1F 1P002BI4 [0,2,0,0,0,0|1,0,0]=3 2790 B9R1.15 CNc1ccccc1I 1P019XX6 [0,2,0,0,0,0|1,0,0]=3 2791 B9R1.15 CNc1ccccc1N 1P002R3W [0,2,0,0,0,0|1,0,0]=3 2792 B9R1.15 CNc1ccccc1N 1P003T4H [0,2,0,0,0,0|1,0,0]=3 2793 B9R1.15 CNc1ccccc1O 1P0033UU [0,2,0,0,0,0|1,0,0]=3 2794 B9R1.15 CNc1ccccc1O 1P01K0W3 [0,2,0,0,0,0|1,0,0]=3 2795 B9R1.15 CNc1cccnc1Br 1P00GSNK [0,2,0,0,0,0|2,0,0]=4 2796 B9R1.15 CNc1cccnc1C 1P009SR0 [0,2,0,0,0,0|2,0,0]=4 2797 B9R1.15 CNc1cccnc1C 1P01AM0N [0,2,0,0,0,0|2,0,0]=4 2798 B9R1.15 CNc1cccnc1C 1P01FKVI [0,2,0,0,0,0|2,0,0]=4 2799 B9R1.15 CNc1cccnc1Cl 1P00I8HE [0,2,0,0,0,0|2,0,0]=4 2800 B9R1.15 CNc1cccnc1N 1P00ELAM [0,2,0,0,0,0|2,0,0]=4 2801 B9R1.15 CNc1ccncc1Br 1P00G8MG [0,2,0,0,0,0|0,0,0]=2 2802 B9R1.15 CNc1ccncc1C 1P01BE54 [0,2,0,0,0,0|0,0,0]=2 2803 B9R1.15 CNc1ccncc1I 1P00G2A7 [0,2,0,0,0,0|0,0,0]=2 2804 B9R1.15 CNc1ccncc1N 1P028Q65 [0,2,0,0,0,0|0,0,0]=2 2805 B9R1.15 CNc1cnccc1Br 1P01R0KB [0,2,0,0,0,0|1,0,0]=3 2806 B9R1.15 CNc1cnccc1C 1P005RQH [0,2,0,0,0,0|1,0,0]=3 2807 B9R1.15 CNc1cnccc1Cl 1P021R1K [0,2,0,0,0,0|1,0,0]=3 2808 B9R1.15 CNc1cnccc1N 1P00B4SE [0,2,0,0,0,0|0,0,0]=2 2809 B9R1.15 CNc1cnncc1Br 1P028ZY7 [0,2,0,0,0,0|1,0,0]=3 2810 B9R1.15 CNc1ncccc1Br 1P00BDBE [0,2,0,0,0,0|2,0,0]=4 2811 B9R1.15 CNc1ncccc1C 1P00B9IM [0,2,0,0,0,0|2,0,0]=4 2812 B9R1.15 CNc1ncccc1Cl 1P00DKL6 [0,2,0,0,0,0|2,0,0]=4 2813 B9R1.15 CNc1ncccc1F 1P00BJFB [0,2,0,0,0,0|2,0,0]=4 2814 B9R1.15 CNc1ncccc1I 1P000AOR [0,2,0,0,0,0|2,0,0]=4 2815 B9R1.15 CNc1ncccc1N 1P00DEDZ [0,2,0,0,0,0|2,0,0]=4 2816 B9R1.15 CNc1ncccc1N 1P019XCU [0,2,0,0,0,0|2,0,0]=4 2817 B9R1.15 CNc1ncncc1F 1P01BCYC [0,2,0,0,0,0|1,0,0]=3 2818 B9R1.15 CNc1ncncc1I 1P01BHFH [0,2,0,0,0,0|1,0,0]=3 2819 B9R1.15 CNc1ncncc1N 1P00AK2S [0,2,0,0,0,0|1,0,0]=3 2820 B9R1.15 COc1ccccc1Br 1P003H81 [0,2,0,0,0,0|2,0,0]=4 2821 B9R1.15 COc1ccccc1C 1P003I55 [0,2,0,0,0,0|2,0,0]=4 2822 B9R1.15 COc1ccccc1Cl 1P0033PR [0,2,0,0,0,0|2,0,0]=4 2823 B9R1.15 COc1ccccc1F 1P003HS1 [0,2,0,0,0,0|2,0,0]=4 2824 B9R1.15 COc1ccccc1I 1P0033TS [0,2,0,0,0,0|2,0,0]=4 2825 B9R1.15 COc1ccccc1N 1P003TWA [0,2,0,0,0,0|1,0,0]=3 2826 B9R1.15 COc1ccccc1N 1P003TWB [0,2,0,0,0,0|1,0,0]=3 2827 B9R1.15 COc1ccccc1O 1P003AR5 [0,2,0,0,0,0|2,0,0]=4 2828 B9R1.15 COc1ccccc1S 1P0033UE [0,2,0,0,0,0|2,0,0]=4 2829 B9R1.15 COc1cccnc1N 1P0006SA [0,2,0,0,0,0|2,0,0]=4 2830 B9R1.15 COc1ccncc1Br 1P008LO8 [0,2,0,0,0,0|1,0,0]=3 2831 B9R1.15 COc1ccncc1C 1P00IKAY [0,2,0,0,0,0|1,0,0]=3 2832 B9R1.15 COc1ccncc1Cl 1P003WU7 [0,2,0,0,0,0|1,0,0]=3 2833 B9R1.15 COc1ccncc1F 1P0084WY [0,2,0,0,0,0|1,0,0]=3 2834 B9R1.15 COc1ccncc1I 1P0058Y7 [0,2,0,0,0,0|1,0,0]=3 2835 B9R1.15 COc1ccncc1N 1P00BYYL [0,2,0,0,0,0|1,0,0]=3 2836 B9R1.15 COc1ccncc1O 1P007IYM [0,2,0,0,0,0|1,0,0]=3 2837 B9R1.15 COc1ccnnc1Cl 1P00KCV8 [0,2,0,0,0,0|2,0,0]=4 2838 B9R1.15 COc1ccnnc1N 1P01A698 [0,2,0,0,0,0|2,0,0]=4 2839 B9R1.15 COc1cnccc1Br 1P0038MU [0,2,0,0,0,0|1,0,0]=3 2840 B9R1.15 COc1cnccc1I 1P0014UJ [0,2,0,0,0,0|1,0,0]=3 2841 B9R1.15 COc1cnccc1N 1P00DBRZ [0,2,0,0,0,0|0,0,0]=2 2842 B9R1.15 COc1cncnc1Cl 1P00FCPO [0,2,0,0,0,0|2,0,0]=4 2843 B9R1.15 COc1cncnc1N 1P005WSA [0,2,0,0,0,0|1,0,0]=3 2844 B9R1.15 COc1cnncc1N 1P028BUQ [0,2,0,0,0,0|1,0,0]=3 2845 B9R1.15 COc1ncccc1N 1P003I18 [0,2,0,0,0,0|2,0,0]=4 2846 B9R1.15 COc1ncncc1Br 1P00DICH [0,2,0,0,0,0|2,0,0]=4 2847 B9R1.15 COc1ncncc1C 1P00ALUB [0,2,0,0,0,0|2,0,0]=4 2848 B9R1.15 COc1ncncc1Cl 1P000FZI [0,2,0,0,0,0|2,0,0]=4 2849 B9R1.15 COc1ncncc1F 1P008Z73 [0,2,0,0,0,0|2,0,0]=4 2850 B9R1.15 COc1ncncc1I 1P00I4QX [0,2,0,0,0,0|2,0,0]=4 2851 B9R1.15 COc1ncncc1N 1P001ONJ [0,2,0,0,0,0|2,0,0]=4 2852 B9R1.15 COc1nnccc1N 1P009X7F [0,2,0,0,0,0|1,0,0]=3 2853 B9R1.15 CSc1ccccc1Br 1P003H9R [0,2,0,0,0,0|2,0,0]=4 2854 B9R1.15 CSc1ccccc1C 1P001G42 [0,2,0,0,0,0|2,0,0]=4 2855 B9R1.15 CSc1ccccc1Cl 1P0025PI [0,2,0,0,0,0|2,0,0]=4 2856 B9R1.15 CSc1ccccc1F 1P003HSY [0,2,0,0,0,0|2,0,0]=4 2857 B9R1.15 CSc1ccccc1I 1P003HXO [0,2,0,0,0,0|2,0,0]=4 2858 B9R1.15 CSc1ccccc1N 1P003BJ8 [0,2,0,0,0,0|1,0,0]=3 2859 B9R1.15 CSc1ccccc1O 1P003HWT [0,2,0,0,0,0|2,0,0]=4 2860 B9R1.15 CSc1cccnc1N 1P00BB9C [0,2,0,0,0,0|2,0,0]=4 2861 B9R1.15 CSc1ccncc1Br 1P0056GB [0,2,0,0,0,0|1,0,0]=3 2862 B9R1.15 CSc1ccncc1N 1P019YSY [0,2,0,0,0,0|1,0,0]=3 2863 B9R1.15 CSc1cnccc1N 1P01DL3L [0,2,0,0,0,0|0,0,0]=2 2864 B9R1.15 CSc1ncccc1N 1P00J30S [0,2,0,0,0,0|2,0,0]=4 2865 B9R1.15 ClCc1ccccc1Cl 1P003BO7 [0,2,0,0,0,0|2,0,0]=4 2866 B9R1.15 ClCc1ccccc1F 1P003HSB [0,2,0,0,0,0|2,0,0]=4 2867 B9R1.15 ClCc1ccccc1I 1P003DJH [0,2,0,0,0,0|2,0,0]=4 2868 B9R1.15 ClCc1cccnc1N 1P004OOU [0,2,0,0,0,0|2,0,0]=4 2869 B9R1.15 ClCc1cccnc1N 1P00G8NW [0,2,0,0,0,0|2,0,0]=4 2870 B9R1.15 ClCc1ccncc1Br 1P001HOR [0,2,0,0,0,0|1,0,0]=3 2871 B9R1.15 ClCc1ccncc1C 1P008ZLU [0,2,0,0,0,0|1,0,0]=3 2872 B9R1.15 ClCc1ccncc1Cl 1P019SIT [0,2,0,0,0,0|1,0,0]=3 2873 B9R1.15 ClCc1ccncc1F 1P00958P [0,2,0,0,0,0|1,0,0]=3 2874 B9R1.15 ClCc1ccncc1F 1P00HUT4 [0,2,0,0,0,0|1,0,0]=3 2875 B9R1.15 ClCc1cnccc1C 1P001EJT [0,2,0,0,0,0|1,0,0]=3 2876 B9R1.15 ClCc1cnccc1Cl 1P01BD8C [0,2,0,0,0,0|1,0,0]=3 2877 B9R1.15 ClCc1nnccc1C 1P0221HR [0,2,0,0,0,0|2,0,0]=4 2878 B9R1.15 FCc1ccccc1Br 1P01JKVP [0,2,0,0,0,0|2,0,0]=4 2879 B9R1.15 ICc1ccccc1Cl 1P005V3O [0,2,0,0,0,0|2,0,0]=4 2880 B9R1.15 N#Cc1ccccc1Br 1P0029SV [0,2,0,0,0,0|1,0,1]=4 2881 B9R1.15 N#Cc1ccccc1C 1P003A6S [0,2,0,0,0,0|1,0,1]=4 2882 B9R1.15 N#Cc1ccccc1Cl 1P003HIG [0,2,0,0,0,0|1,0,1]=4 2883 B9R1.15 N#Cc1ccccc1F 1P0033SC [0,2,0,0,0,0|1,0,1]=4 2884 B9R1.15 N#Cc1ccccc1I 1P003HXH [0,2,0,0,0,0|1,0,1]=4 2885 B9R1.15 N#Cc1ccccc1N 1P002HEF [0,2,0,0,0,0|1,0,0]=3 2886 B9R1.15 N#Cc1ccccc1O 1P003HVY [0,2,0,0,0,0|1,0,1]=4 2887 B9R1.15 N#Cc1cccnc1N 1P002OUS [0,2,0,0,0,0|2,0,0]=4 2888 B9R1.15 N#Cc1ccncc1Br 1P001BRL [0,2,0,0,0,0|0,0,1]=3 2889 B9R1.15 N#Cc1ccncc1C 1P00G3UF [0,2,0,0,0,0|0,0,1]=3 2890 B9R1.15 N#Cc1ccncc1Cl 1P003JOJ [0,2,0,0,0,0|0,0,1]=3 2891 B9R1.15 N#Cc1ccncc1F 1P000A3A [0,2,0,0,0,0|0,0,1]=3 2892 B9R1.15 N#Cc1ccncc1N 1P003JC6 [0,2,0,0,0,0|0,0,1]=3 2893 B9R1.15 N#Cc1ccncc1O 1P004KDV [0,2,0,0,0,0|0,0,1]=3 2894 B9R1.15 N#Cc1ccnnc1Cl 1P001K41 [0,2,0,0,0,0|1,0,1]=4 2895 B9R1.15 N#Cc1ccnnc1F 1P0283TQ [0,2,0,0,0,0|1,0,1]=4 2896 B9R1.15 N#Cc1ccnnc1N 1P000JGK [0,2,0,0,0,0|1,0,1]=4 2897 B9R1.15 N#Cc1cnccc1Br 1P007Y3B [0,2,0,0,0,0|1,0,0]=3 2898 B9R1.15 N#Cc1cnccc1C 1P00IA6Z [0,2,0,0,0,0|1,0,0]=3 2899 B9R1.15 N#Cc1cnccc1Cl 1P0038TX [0,2,0,0,0,0|1,0,0]=3 2900 B9R1.15 N#Cc1cnccc1F 1P0084X0 [0,2,0,0,0,0|1,0,0]=3 2901 B9R1.15 N#Cc1cnccc1I 1P006WEY [0,2,0,0,0,0|1,0,0]=3 2902 B9R1.15 N#Cc1cnccc1N 1P001QK6 [0,2,0,0,0,0|0,0,0]=2 2903 B9R1.15 N#Cc1cnccc1O 1P00GV46 [0,2,0,0,0,0|1,0,0]=3 2904 B9R1.15 N#Cc1cnccc1S 1P01B5ML [0,2,0,0,0,0|1,0,0]=3 2905 B9R1.15 N#Cc1cncnc1C 1P000GBK [0,2,0,0,0,0|2,0,0]=4 2906 B9R1.15 N#Cc1cncnc1Cl 1P001UPD [0,2,0,0,0,0|2,0,0]=4 2907 B9R1.15 N#Cc1cncnc1F 1P027U00 [0,2,0,0,0,0|2,0,0]=4 2908 B9R1.15 N#Cc1cncnc1N 1P001UPC [0,2,0,0,0,0|1,0,0]=3 2909 B9R1.15 N#Cc1cncnc1O 1P00706R [0,2,0,0,0,0|2,0,0]=4 2910 B9R1.15 N#Cc1ncccc1N 1P003JBA [0,2,0,0,0,0|2,0,0]=4 2911 B9R1.15 N#Cc1ncncc1Br 1P000FYB [0,2,0,0,0,0|1,0,1]=4 2912 B9R1.15 N#Cc1ncncc1C 1P0092LL [0,2,0,0,0,0|1,0,1]=4 2913 B9R1.15 N#Cc1nnccc1C 1P00959O [0,2,0,0,0,0|2,0,0]=4 2914 B9R1.15 N#[N+]c1ccccc1Cl 1P021RNX [0,2,0,0,0,0|1,0,1]=4 2915 B9R1.15 NCc1ccc[nH]c1=O 1P008FIL [0,2,0,0,0,0|2,0,0]=4 2916 B9R1.15 NCc1ccc[nH]c1=O 1P00AI7Z [0,2,0,0,0,0|2,0,0]=4 2917 B9R1.15 NCc1ccccc1Br 1P003H8D [0,2,0,0,0,0|1,0,0]=3 2918 B9R1.15 NCc1ccccc1Br 1P003H8E [0,2,0,0,0,0|1,0,0]=3 2919 B9R1.15 NCc1ccccc1C 1P0037DE [0,2,0,0,0,0|1,0,0]=3 2920 B9R1.15 NCc1ccccc1Cl 1P0033PV [0,2,0,0,0,0|1,0,0]=3 2921 B9R1.15 NCc1ccccc1Cl 1P00BGK2 [0,2,0,0,0,0|1,0,0]=3 2922 B9R1.15 NCc1ccccc1F 1P0033SE [0,2,0,0,0,0|1,0,0]=3 2923 B9R1.15 NCc1ccccc1I 1P007333 [0,2,0,0,0,0|1,0,0]=3 2924 B9R1.15 NCc1ccccc1I 1P00C7RL [0,2,0,0,0,0|1,0,0]=3 2925 B9R1.15 NCc1ccccc1N 1P00DEQ7 [0,2,0,0,0,0|1,0,0]=3 2926 B9R1.15 NCc1ccccc1O 1P003FFO [0,2,0,0,0,0|1,0,0]=3 2927 B9R1.15 NCc1ccccc1O 1P00EIWG [0,2,0,0,0,0|1,0,0]=3 2928 B9R1.15 NCc1ccccc1O 1P01DLDC [0,2,0,0,0,0|1,0,0]=3 2929 B9R1.15 NCc1cccnc1Br 1P002ARU [0,2,0,0,0,0|2,0,0]=4 2930 B9R1.15 NCc1cccnc1Br 1P028CUY [0,2,0,0,0,0|2,0,0]=4 2931 B9R1.15 NCc1cccnc1C 1P00EDWW [0,2,0,0,0,0|2,0,0]=4 2932 B9R1.15 NCc1cccnc1C 1P00IAV8 [0,2,0,0,0,0|2,0,0]=4 2933 B9R1.15 NCc1cccnc1Cl 1P002ARV [0,2,0,0,0,0|2,0,0]=4 2934 B9R1.15 NCc1cccnc1Cl 1P00A0HW [0,2,0,0,0,0|2,0,0]=4 2935 B9R1.15 NCc1cccnc1Cl 1P00AAIK [0,2,0,0,0,0|2,0,0]=4 2936 B9R1.15 NCc1cccnc1F 1P002ART [0,2,0,0,0,0|2,0,0]=4 2937 B9R1.15 NCc1cccnc1F 1P004N9V [0,2,0,0,0,0|2,0,0]=4 2938 B9R1.15 NCc1cccnc1I 1P028H2F [0,2,0,0,0,0|2,0,0]=4 2939 B9R1.15 NCc1cccnc1N 1P001JPL [0,2,0,0,0,0|2,0,0]=4 2940 B9R1.15 NCc1ccncc1Br 1P004CWE [0,2,0,0,0,0|0,0,0]=2 2941 B9R1.15 NCc1ccncc1Br 1P01C11A [0,2,0,0,0,0|0,0,0]=2 2942 B9R1.15 NCc1ccncc1Br 1P01EDYH [0,2,0,0,0,0|0,0,0]=2 2943 B9R1.15 NCc1ccncc1C 1P00665P [0,2,0,0,0,0|0,0,0]=2 2944 B9R1.15 NCc1ccncc1C 1P00IE0H [0,2,0,0,0,0|0,0,0]=2 2945 B9R1.15 NCc1ccncc1Cl 1P00H1FA [0,2,0,0,0,0|0,0,0]=2 2946 B9R1.15 NCc1ccncc1Cl 1P00HHLV [0,2,0,0,0,0|0,0,0]=2 2947 B9R1.15 NCc1ccncc1F 1P008EEF [0,2,0,0,0,0|0,0,0]=2 2948 B9R1.15 NCc1ccncc1F 1P00A0HY [0,2,0,0,0,0|0,0,0]=2 2949 B9R1.15 NCc1ccncc1N 1P001JPK [0,2,0,0,0,0|0,0,0]=2 2950 B9R1.15 NCc1ccncc1O 1P002A71 [0,2,0,0,0,0|0,0,0]=2 2951 B9R1.15 NCc1cnccc1Br 1P00A1FX [0,2,0,0,0,0|1,0,0]=3 2952 B9R1.15 NCc1cnccc1C 1P001JR8 [0,2,0,0,0,0|1,0,0]=3 2953 B9R1.15 NCc1cnccc1C 1P01C1KV [0,2,0,0,0,0|1,0,0]=3 2954 B9R1.15 NCc1cnccc1Cl 1P00K2ZK [0,2,0,0,0,0|1,0,0]=3 2955 B9R1.15 NCc1cnccc1Cl 1P019FAL [0,2,0,0,0,0|1,0,0]=3 2956 B9R1.15 NCc1cnccc1N 1P01AGC1 [0,2,0,0,0,0|0,0,0]=2 2957 B9R1.15 NCc1cnccc1O 1P02056P [0,2,0,0,0,0|1,0,0]=3 2958 B9R1.15 NCc1cncnc1N 1P01A1P3 [0,2,0,0,0,0|1,0,0]=3 2959 B9R1.15 NCc1cncnc1N 1P024TUQ [0,2,0,0,0,0|1,0,0]=3 2960 B9R1.15 NCc1ncccc1Br 1P008XMS [0,2,0,0,0,0|2,0,0]=4 2961 B9R1.15 NCc1ncccc1Br 1P01B5Q6 [0,2,0,0,0,0|2,0,0]=4 2962 B9R1.15 NCc1ncccc1Br 1P01B673 [0,2,0,0,0,0|2,0,0]=4 2963 B9R1.15 NCc1ncccc1C 1P0038IX [0,2,0,0,0,0|2,0,0]=4 2964 B9R1.15 NCc1ncccc1C 1P003AQ0 [0,2,0,0,0,0|2,0,0]=4 2965 B9R1.15 NCc1ncccc1C 1P00IN6R [0,2,0,0,0,0|2,0,0]=4 2966 B9R1.15 NCc1ncccc1Cl 1P007HCB [0,2,0,0,0,0|2,0,0]=4 2967 B9R1.15 NCc1ncccc1Cl 1P00DGS6 [0,2,0,0,0,0|2,0,0]=4 2968 B9R1.15 NCc1ncccc1F 1P000S1P [0,2,0,0,0,0|2,0,0]=4 2969 B9R1.15 NCc1ncccc1F 1P0039LA [0,2,0,0,0,0|2,0,0]=4 2970 B9R1.15 NCc1ncccc1F 1P00CBG3 [0,2,0,0,0,0|2,0,0]=4 2971 B9R1.15 NCc1ncccc1N 1P001JPJ [0,2,0,0,0,0|2,0,0]=4 2972 B9R1.15 NCc1ncccc1O 1P00BBSC [0,2,0,0,0,0|2,0,0]=4 2973 B9R1.15 NCc1ncccc1O 1P01FIC3 [0,2,0,0,0,0|2,0,0]=4 2974 B9R1.15 NCc1nnccc1C 1P0293V7 [0,2,0,0,0,0|2,0,0]=4 2975 B9R1.15 NNc1ccccc1Br 1P001XRH [0,2,0,0,0,0|1,0,0]=3 2976 B9R1.15 NNc1ccccc1Br 1P0033NI [0,2,0,0,0,0|1,0,0]=3 2977 B9R1.15 NNc1ccccc1C 1P003TYZ [0,2,0,0,0,0|1,0,0]=3 2978 B9R1.15 NNc1ccccc1Cl 1P0033Q9 [0,2,0,0,0,0|1,0,0]=3 2979 B9R1.15 NNc1ccccc1F 1P002OLG [0,2,0,0,0,0|1,0,0]=3 2980 B9R1.15 NNc1ccccc1F 1P002YAI [0,2,0,0,0,0|1,0,0]=3 2981 B9R1.15 NNc1ccccc1I 1P00DBVY [0,2,0,0,0,0|1,0,0]=3 2982 B9R1.15 NNc1ccccc1I 1P00EZL5 [0,2,0,0,0,0|1,0,0]=3 2983 B9R1.15 NNc1cccnc1C 1P00IMPU [0,2,0,0,0,0|2,0,0]=4 2984 B9R1.15 NNc1cccnc1Cl 1P000E63 [0,2,0,0,0,0|2,0,0]=4 2985 B9R1.15 NNc1cccnc1F 1P0240I2 [0,2,0,0,0,0|2,0,0]=4 2986 B9R1.15 NNc1ccncc1Br 1P00IN68 [0,2,0,0,0,0|0,0,0]=2 2987 B9R1.15 NNc1ccncc1C 1P008VKW [0,2,0,0,0,0|0,0,0]=2 2988 B9R1.15 NNc1ccncc1C 1P01X5LC [0,2,0,0,0,0|0,0,0]=2 2989 B9R1.15 NNc1ccncc1Cl 1P019ZC5 [0,2,0,0,0,0|0,0,0]=2 2990 B9R1.15 NNc1ccncc1F 1P01B5SR [0,2,0,0,0,0|0,0,0]=2 2991 B9R1.15 NNc1ncccc1Br 1P00DFZM [0,2,0,0,0,0|2,0,0]=4 2992 B9R1.15 NNc1ncccc1C 1P00DDGM [0,2,0,0,0,0|2,0,0]=4 2993 B9R1.15 NNc1ncccc1Cl 1P003JNN [0,2,0,0,0,0|2,0,0]=4 2994 B9R1.15 NNc1ncccc1F 1P0036QS [0,2,0,0,0,0|2,0,0]=4 2995 B9R1.15 NNc1ncccc1N 1P01B6SP [0,2,0,0,0,0|2,0,0]=4 2996 B9R1.15 NNc1ncncc1Cl 1P00AI8U [0,2,0,0,0,0|1,0,0]=3 2997 B9R1.15 NNc1nnccc1C 1P00G7J5 [0,2,0,0,0,0|2,0,0]=4 2998 B9R1.15 NOc1ccccc1Cl 1P01B91N [0,2,0,0,0,0|1,0,0]=3 2999 B9R1.15 NOc1ccccc1Cl 1P01BFN7 [0,2,0,0,0,0|1,0,0]=3 3000 B9R1.15 NOc1ccccc1F 1P01BFN6 [0,2,0,0,0,0|1,0,0]=3 3001 B9R1.15 O=Cc1c[nH]ccc1=N 1P01DU8B [0,2,0,0,0,0|0,0,2]=4 3002 B9R1.15 O=Cc1ccccc1Br 1P003H83 [0,2,0,0,0,0|2,0,0]=4 3003 B9R1.15 O=Cc1ccccc1C 1P0032QN [0,2,0,0,0,0|2,0,0]=4 3004 B9R1.15 O=Cc1ccccc1Cl 1P0033PS [0,2,0,0,0,0|2,0,0]=4 3005 B9R1.15 O=Cc1ccccc1F 1P003HS2 [0,2,0,0,0,0|2,0,0]=4 3006 B9R1.15 O=Cc1ccccc1I 1P002SZ0 [0,2,0,0,0,0|2,0,0]=4 3007 B9R1.15 O=Cc1ccccc1N 1P00I9WT [0,2,0,0,0,0|1,0,0]=3 3008 B9R1.15 O=Cc1cccnc1N 1P0033JT [0,2,0,0,0,0|2,0,0]=4 3009 B9R1.15 O=Cc1ccncc1Br 1P003JII [0,2,0,0,0,0|1,0,0]=3 3010 B9R1.15 O=Cc1ccncc1C 1P005AUA [0,2,0,0,0,0|1,0,0]=3 3011 B9R1.15 O=Cc1ccncc1Cl 1P003JOU [0,2,0,0,0,0|1,0,0]=3 3012 B9R1.15 O=Cc1ccncc1F 1P003463 [0,2,0,0,0,0|1,0,0]=3 3013 B9R1.15 O=Cc1ccncc1N 1P00DEZT [0,2,0,0,0,0|1,0,0]=3 3014 B9R1.15 O=Cc1ccncc1O 1P00757U [0,2,0,0,0,0|1,0,0]=3 3015 B9R1.15 O=Cc1cnccc1Br 1P000G6U [0,2,0,0,0,0|1,0,0]=3 3016 B9R1.15 O=Cc1cnccc1Br 1P00AP7I [0,2,0,0,0,0|1,0,0]=3 3017 B9R1.15 O=Cc1cnccc1C 1P00D9CN [0,2,0,0,0,0|1,0,0]=3 3018 B9R1.15 O=Cc1cnccc1Cl 1P000AXW [0,2,0,0,0,0|1,0,0]=3 3019 B9R1.15 O=Cc1cnccc1N 1P0037OR [0,2,0,0,0,0|0,0,0]=2 3020 B9R1.15 O=Cc1cnccc1N 1P00619R [0,2,0,0,0,0|0,0,0]=2 3021 B9R1.15 O=Cc1cnccc1O 1P0036Q3 [0,2,0,0,0,0|1,0,0]=3 3022 B9R1.15 O=Cc1cncnc1N 1P001UPA [0,2,0,0,0,0|1,0,0]=3 3023 B9R1.15 O=Cc1ncccc1N 1P0037JT [0,2,0,0,0,0|2,0,0]=4 3024 B9R1.15 O=Cc1ncncc1C 1P01EMMI [0,2,0,0,0,0|2,0,0]=4 3025 B9R1.15 O=Cc1ncncc1N 1P00II0O [0,2,0,0,0,0|2,0,0]=4 3026 B9R1.15 O=Nc1ccccc1C 1P00EG52 [0,2,0,0,0,0|1,0,1]=4 3027 B9R1.15 O=c1c(ccn[nH]1)C#N 1P003KBC [0,2,0,0,0,0|1,0,1]=4 3028 B9R1.15 O=c1cc[nH]cc1C#N 1P00027D [0,2,0,0,0,0|1,0,1]=4 3029 B9R1.15 OCc1ccccc1Br 1P002EHD [0,2,0,0,0,0|2,0,0]=4 3030 B9R1.15 OCc1ccccc1Br 1P004WEF [0,2,0,0,0,0|2,0,0]=4 3031 B9R1.15 OCc1ccccc1C 1P003I5H [0,2,0,0,0,0|2,0,0]=4 3032 B9R1.15 OCc1ccccc1Cl 1P0026K3 [0,2,0,0,0,0|2,0,0]=4 3033 B9R1.15 OCc1ccccc1F 1P003BOX [0,2,0,0,0,0|2,0,0]=4 3034 B9R1.15 OCc1ccccc1I 1P00DF4T [0,2,0,0,0,0|2,0,0]=4 3035 B9R1.15 OCc1ccccc1N 1P0033KS [0,2,0,0,0,0|1,0,0]=3 3036 B9R1.15 OCc1ccccc1O 1P00IGEK [0,2,0,0,0,0|2,0,0]=4 3037 B9R1.15 OCc1ccccc1S 1P003HZ0 [0,2,0,0,0,0|2,0,0]=4 3038 B9R1.15 OCc1cccnc1N 1P002OD6 [0,2,0,0,0,0|2,0,0]=4 3039 B9R1.15 OCc1ccncc1Br 1P001EO2 [0,2,0,0,0,0|1,0,0]=3 3040 B9R1.15 OCc1ccncc1C 1P00C847 [0,2,0,0,0,0|1,0,0]=3 3041 B9R1.15 OCc1ccncc1Cl 1P003C8S [0,2,0,0,0,0|1,0,0]=3 3042 B9R1.15 OCc1ccncc1F 1P008EEG [0,2,0,0,0,0|1,0,0]=3 3043 B9R1.15 OCc1ccncc1N 1P007K0Z [0,2,0,0,0,0|1,0,0]=3 3044 B9R1.15 OCc1ccncc1O 1P00C7AH [0,2,0,0,0,0|1,0,0]=3 3045 B9R1.15 OCc1ccnnc1C 1P00I3WD [0,2,0,0,0,0|2,0,0]=4 3046 B9R1.15 OCc1cnccc1Br 1P00AQMY [0,2,0,0,0,0|1,0,0]=3 3047 B9R1.15 OCc1cnccc1C 1P00D9CV [0,2,0,0,0,0|1,0,0]=3 3048 B9R1.15 OCc1cnccc1Cl 1P002E5M [0,2,0,0,0,0|1,0,0]=3 3049 B9R1.15 OCc1cnccc1Cl 1P002OUG [0,2,0,0,0,0|1,0,0]=3 3050 B9R1.15 OCc1cnccc1N 1P0018HB [0,2,0,0,0,0|0,0,0]=2 3051 B9R1.15 OCc1cncnc1C 1P01A6T5 [0,2,0,0,0,0|2,0,0]=4 3052 B9R1.15 OCc1cncnc1Cl 1P00CO18 [0,2,0,0,0,0|2,0,0]=4 3053 B9R1.15 OCc1cncnc1N 1P00558M [0,2,0,0,0,0|1,0,0]=3 3054 B9R1.15 OCc1ncccc1N 1P003JAQ [0,2,0,0,0,0|2,0,0]=4 3055 B9R1.15 OCc1ncncc1Br 1P0034OU [0,2,0,0,0,0|2,0,0]=4 3056 B9R1.15 OCc1ncncc1N 1P001ODL [0,2,0,0,0,0|2,0,0]=4 3057 B9R1.15 ONc1ccccc1Cl 1P007HD5 [0,2,0,0,0,0|1,0,0]=3 3058 B9R1.15 SCc1ccccc1Br 1P001J1L [0,2,0,0,0,0|2,0,0]=4 3059 B9R1.15 SCc1ccccc1C 1P003B52 [0,2,0,0,0,0|2,0,0]=4 3060 B9R1.15 SCc1ccccc1Cl 1P003HIA [0,2,0,0,0,0|2,0,0]=4 3061 B9R1.15 SCc1ccccc1F 1P00FDHP [0,2,0,0,0,0|2,0,0]=4 3062 B9R1.15 SCc1ccccc1N 1P0284O8 [0,2,0,0,0,0|1,0,0]=3 3063 B9R1.15 [C-]#[N+]c1ccccc1Br 1P0027V3 [0,2,0,0,0,0|1,0,1]=4 3064 B9R1.15 [C-]#[N+]c1ccccc1C 1P008T4R [0,2,0,0,0,0|1,0,1]=4 3065 B9R1.15 [C-]#[N+]c1ccccc1I 1P00I1VF [0,2,0,0,0,0|1,0,1]=4 3066 B9R1.69 Brc1c[nH]c(=O)cc1C 1P01BEN4 [0,2,0,0,0,0|1,0,1]=4 3067 B9R1.69 Brc1c[nH]c(=O)cc1Cl 1P00A188 [0,2,0,0,0,0|1,0,1]=4 3068 B9R1.69 Brc1c[nH]c(=O)cc1O 1P00G65E [0,2,0,0,0,0|1,0,1]=4 3069 B9R1.69 Brc1cc(Br)n[nH]c1=O 1P0293VW [0,2,0,0,0,0|2,0,0]=4 3070 B9R1.69 Brc1cc[n+](c(c1)C)[O-] 1P000279 [0,2,0,0,0,0|1,0,1]=4 3071 B9R1.69 Brc1ccc(=O)n(c1)N 1P01DZNM [0,2,0,0,0,0|2,0,0]=4 3072 B9R1.69 Brc1ccc(c(=O)[nH]1)N 1P0092XJ [0,2,0,0,0,0|2,0,0]=4 3073 B9R1.69 Brc1ccc(c(c1)Br)Br 1P003DRU [0,2,0,0,0,0|2,0,0]=4 3074 B9R1.69 Brc1ccc(c(c1)Br)C 1P003G6O [0,2,0,0,0,0|2,0,0]=4 3075 B9R1.69 Brc1ccc(c(c1)Br)Cl 1P002ZCN [0,2,0,0,0,0|2,0,0]=4 3076 B9R1.69 Brc1ccc(c(c1)Br)F 1P003G66 [0,2,0,0,0,0|2,0,0]=4 3077 B9R1.69 Brc1ccc(c(c1)Br)I 1P00383V [0,2,0,0,0,0|2,0,0]=4 3078 B9R1.69 Brc1ccc(c(c1)Br)N 1P003G6E [0,2,0,0,0,0|1,0,0]=3 3079 B9R1.69 Brc1ccc(c(c1)Br)O 1P003BL9 [0,2,0,0,0,0|2,0,0]=4 3080 B9R1.69 Brc1ccc(c(c1)C)Br 1P003GDL [0,2,0,0,0,0|2,0,0]=4 3081 B9R1.69 Brc1ccc(c(c1)C)C 1P003828 [0,2,0,0,0,0|2,0,0]=4 3082 B9R1.69 Brc1ccc(c(c1)C)Cl 1P003831 [0,2,0,0,0,0|2,0,0]=4 3083 B9R1.69 Brc1ccc(c(c1)C)F 1P003MXT [0,2,0,0,0,0|2,0,0]=4 3084 B9R1.69 Brc1ccc(c(c1)C)I 1P000DDU [0,2,0,0,0,0|2,0,0]=4 3085 B9R1.69 Brc1ccc(c(c1)C)N 1P003LDV [0,2,0,0,0,0|1,0,0]=3 3086 B9R1.69 Brc1ccc(c(c1)C)O 1P002OE2 [0,2,0,0,0,0|2,0,0]=4 3087 B9R1.69 Brc1ccc(c(c1)C)S 1P01B9DG [0,2,0,0,0,0|2,0,0]=4 3088 B9R1.69 Brc1ccc(c(c1)Cl)Br 1P003BHB [0,2,0,0,0,0|2,0,0]=4 3089 B9R1.69 Brc1ccc(c(c1)Cl)C 1P003LD2 [0,2,0,0,0,0|2,0,0]=4 3090 B9R1.69 Brc1ccc(c(c1)Cl)Cl 1P0024MW [0,2,0,0,0,0|2,0,0]=4 3091 B9R1.69 Brc1ccc(c(c1)Cl)F 1P003LCS [0,2,0,0,0,0|2,0,0]=4 3092 B9R1.69 Brc1ccc(c(c1)Cl)I 1P003LCT [0,2,0,0,0,0|2,0,0]=4 3093 B9R1.69 Brc1ccc(c(c1)Cl)N 1P00BXS1 [0,2,0,0,0,0|1,0,0]=3 3094 B9R1.69 Brc1ccc(c(c1)Cl)O 1P0034DX [0,2,0,0,0,0|2,0,0]=4 3095 B9R1.69 Brc1ccc(c(c1)Cl)S 1P003WI1 [0,2,0,0,0,0|2,0,0]=4 3096 B9R1.69 Brc1ccc(c(c1)F)Br 1P00333C [0,2,0,0,0,0|2,0,0]=4 3097 B9R1.69 Brc1ccc(c(c1)F)C 1P003LDM [0,2,0,0,0,0|2,0,0]=4 3098 B9R1.69 Brc1ccc(c(c1)F)Cl 1P003LBH [0,2,0,0,0,0|2,0,0]=4 3099 B9R1.69 Brc1ccc(c(c1)F)F 1P003IXR [0,2,0,0,0,0|2,0,0]=4 3100 B9R1.69 Brc1ccc(c(c1)F)I 1P003EKW [0,2,0,0,0,0|2,0,0]=4 3101 B9R1.69 Brc1ccc(c(c1)F)N 1P000EPZ [0,2,0,0,0,0|1,0,0]=3 3102 B9R1.69 Brc1ccc(c(c1)F)N 1P0034E0 [0,2,0,0,0,0|1,0,0]=3 3103 B9R1.69 Brc1ccc(c(c1)F)O 1P002LB2 [0,2,0,0,0,0|2,0,0]=4 3104 B9R1.69 Brc1ccc(c(c1)F)S 1P002041 [0,2,0,0,0,0|2,0,0]=4 3105 B9R1.69 Brc1ccc(c(c1)I)Br 1P0041LJ [0,2,0,0,0,0|2,0,0]=4 3106 B9R1.69 Brc1ccc(c(c1)I)C 1P002S07 [0,2,0,0,0,0|2,0,0]=4 3107 B9R1.69 Brc1ccc(c(c1)I)Cl 1P0036D9 [0,2,0,0,0,0|2,0,0]=4 3108 B9R1.69 Brc1ccc(c(c1)I)F 1P000CK9 [0,2,0,0,0,0|2,0,0]=4 3109 B9R1.69 Brc1ccc(c(c1)I)I 1P00C4MT [0,2,0,0,0,0|2,0,0]=4 3110 B9R1.69 Brc1ccc(c(c1)I)N 1P0034E7 [0,2,0,0,0,0|1,0,0]=3 3111 B9R1.69 Brc1ccc(c(c1)I)O 1P002JAU [0,2,0,0,0,0|2,0,0]=4 3112 B9R1.69 Brc1ccc(c(c1)N)Br 1P00381C [0,2,0,0,0,0|1,0,0]=3 3113 B9R1.69 Brc1ccc(c(c1)N)C 1P003MYE [0,2,0,0,0,0|1,0,0]=3 3114 B9R1.69 Brc1ccc(c(c1)N)Cl 1P0034O6 [0,2,0,0,0,0|1,0,0]=3 3115 B9R1.69 Brc1ccc(c(c1)N)F 1P002YAJ [0,2,0,0,0,0|1,0,0]=3 3116 B9R1.69 Brc1ccc(c(c1)N)I 1P00EC4W [0,2,0,0,0,0|1,0,0]=3 3117 B9R1.69 Brc1ccc(c(c1)N)N 1P001PY2 [0,2,0,0,0,0|1,0,0]=3 3118 B9R1.69 Brc1ccc(c(c1)N)O 1P0033JV [0,2,0,0,0,0|1,0,0]=3 3119 B9R1.69 Brc1ccc(c(c1)N)S 1P008LQE [0,2,0,0,0,0|1,0,0]=3 3120 B9R1.69 Brc1ccc(c(c1)N)S 1P00H0OS [0,2,0,0,0,0|1,0,0]=3 3121 B9R1.69 Brc1ccc(c(c1)O)Br 1P00386D [0,2,0,0,0,0|2,0,0]=4 3122 B9R1.69 Brc1ccc(c(c1)O)C 1P00C182 [0,2,0,0,0,0|2,0,0]=4 3123 B9R1.69 Brc1ccc(c(c1)O)Cl 1P00I1WA [0,2,0,0,0,0|2,0,0]=4 3124 B9R1.69 Brc1ccc(c(c1)O)F 1P003MXQ [0,2,0,0,0,0|2,0,0]=4 3125 B9R1.69 Brc1ccc(c(c1)O)I 1P0039Z7 [0,2,0,0,0,0|2,0,0]=4 3126 B9R1.69 Brc1ccc(c(c1)O)N 1P003GXD [0,2,0,0,0,0|1,0,0]=3 3127 B9R1.69 Brc1ccc(c(c1)O)O 1P001ZEC [0,2,0,0,0,0|2,0,0]=4 3128 B9R1.69 Brc1ccc(c(c1)S)Br 1P01EW8E [0,2,0,0,0,0|2,0,0]=4 3129 B9R1.69 Brc1ccc(c(c1)S)C 1P01BL10 [0,2,0,0,0,0|2,0,0]=4 3130 B9R1.69 Brc1ccc(c(c1)S)Cl 1P01BL0U [0,2,0,0,0,0|2,0,0]=4 3131 B9R1.69 Brc1ccc(c(c1)S)F 1P01C12F [0,2,0,0,0,0|2,0,0]=4 3132 B9R1.69 Brc1ccc(c(c1)S)N 1P002NRC [0,2,0,0,0,0|1,0,0]=3 3133 B9R1.69 Brc1ccc(c(c1)S)N 1P01BDY0 [0,2,0,0,0,0|1,0,0]=3 3134 B9R1.69 Brc1ccc(c(n1)Br)N 1P00341B [0,2,0,0,0,0|2,0,0]=4 3135 B9R1.69 Brc1ccc(c(n1)C)N 1P000T17 [0,2,0,0,0,0|2,0,0]=4 3136 B9R1.69 Brc1ccc(c(n1)Cl)N 1P00AQHY [0,2,0,0,0,0|2,0,0]=4 3137 B9R1.69 Brc1ccc(c(n1)F)N 1P00GB0A [0,2,0,0,0,0|2,0,0]=4 3138 B9R1.69 Brc1ccc(c(n1)I)N 1P00H0ID [0,2,0,0,0,0|2,0,0]=4 3139 B9R1.69 Brc1ccc(c(n1)N)Br 1P006V5M [0,2,0,0,0,0|2,0,0]=4 3140 B9R1.69 Brc1ccc(c(n1)N)C 1P003AHY [0,2,0,0,0,0|2,0,0]=4 3141 B9R1.69 Brc1ccc(c(n1)N)Cl 1P008YD2 [0,2,0,0,0,0|2,0,0]=4 3142 B9R1.69 Brc1ccc(c(n1)N)Cl 1P028R97 [0,2,0,0,0,0|2,0,0]=4 3143 B9R1.69 Brc1ccc(c(n1)N)F 1P009YUB [0,2,0,0,0,0|2,0,0]=4 3144 B9R1.69 Brc1ccc(c(n1)N)N 1P000Z8P [0,2,0,0,0,0|2,0,0]=4 3145 B9R1.69 Brc1ccc(c(n1)N)O 1P006FXZ [0,2,0,0,0,0|2,0,0]=4 3146 B9R1.69 Brc1ccn(c(=O)c1)C 1P0038NF [0,2,0,0,0,0|1,0,1]=4 3147 B9R1.69 Brc1ccn(c(=O)c1)O 1P00JZDX [0,2,0,0,0,0|1,0,1]=4 3148 B9R1.69 Brc1cnc(c(c1)Br)N 1P003GTR [0,2,0,0,0,0|2,0,0]=4 3149 B9R1.69 Brc1cnc(c(c1)C)N 1P0033K5 [0,2,0,0,0,0|2,0,0]=4 3150 B9R1.69 Brc1cnc(c(c1)Cl)N 1P00I7ZH [0,2,0,0,0,0|2,0,0]=4 3151 B9R1.69 Brc1cnc(c(c1)F)N 1P0036YQ [0,2,0,0,0,0|2,0,0]=4 3152 B9R1.69 Brc1cnc(c(c1)I)N 1P003GX0 [0,2,0,0,0,0|2,0,0]=4 3153 B9R1.69 Brc1cnc(c(c1)N)Br 1P006H5H [0,2,0,0,0,0|2,0,0]=4 3154 B9R1.69 Brc1cnc(c(c1)N)C 1P0034OF [0,2,0,0,0,0|2,0,0]=4 3155 B9R1.69 Brc1cnc(c(c1)N)Cl 1P003JCW [0,2,0,0,0,0|2,0,0]=4 3156 B9R1.69 Brc1cnc(c(c1)N)F 1P00341Q [0,2,0,0,0,0|2,0,0]=4 3157 B9R1.69 Brc1cnc(c(c1)N)I 1P0096FM [0,2,0,0,0,0|2,0,0]=4 3158 B9R1.69 Brc1cnc(c(c1)N)N 1P0034NZ [0,2,0,0,0,0|2,0,0]=4 3159 B9R1.69 Brc1cnc(c(c1)N)N 1P008UMH [0,2,0,0,0,0|2,0,0]=4 3160 B9R1.69 Brc1cnc(c(c1)N)O 1P00341T [0,2,0,0,0,0|2,0,0]=4 3161 B9R1.69 Brc1cnc(c(c1)O)N 1P0033SX [0,2,0,0,0,0|2,0,0]=4 3162 B9R1.69 Brc1ncc(=O)n(c1)C 1P000MBR [0,2,0,0,0,0|2,0,0]=4 3163 B9R1.69 Brc1ncc(c(c1)Br)C 1P005CTF [0,2,0,0,0,0|1,0,0]=3 3164 B9R1.69 Brc1ncc(c(c1)Br)Cl 1P00IF4D [0,2,0,0,0,0|1,0,0]=3 3165 B9R1.69 Brc1ncc(c(c1)Br)F 1P000OUO [0,2,0,0,0,0|1,0,0]=3 3166 B9R1.69 Brc1ncc(c(c1)Br)N 1P00DIFE [0,2,0,0,0,0|1,0,0]=3 3167 B9R1.69 Brc1ncc(c(c1)C)Br 1P0033GO [0,2,0,0,0,0|1,0,0]=3 3168 B9R1.69 Brc1ncc(c(c1)C)C 1P006L7O [0,2,0,0,0,0|1,0,0]=3 3169 B9R1.69 Brc1ncc(c(c1)C)Cl 1P0036QZ [0,2,0,0,0,0|1,0,0]=3 3170 B9R1.69 Brc1ncc(c(c1)C)F 1P0036R0 [0,2,0,0,0,0|1,0,0]=3 3171 B9R1.69 Brc1ncc(c(c1)C)I 1P003H6L [0,2,0,0,0,0|1,0,0]=3 3172 B9R1.69 Brc1ncc(c(c1)C)N 1P001OZW [0,2,0,0,0,0|1,0,0]=3 3173 B9R1.69 Brc1ncc(c(c1)C)O 1P009YU8 [0,2,0,0,0,0|1,0,0]=3 3174 B9R1.69 Brc1ncc(c(c1)Cl)Br 1P007HFD [0,2,0,0,0,0|1,0,0]=3 3175 B9R1.69 Brc1ncc(c(c1)Cl)C 1P007HFE [0,2,0,0,0,0|1,0,0]=3 3176 B9R1.69 Brc1ncc(c(c1)Cl)Cl 1P00958D [0,2,0,0,0,0|1,0,0]=3 3177 B9R1.69 Brc1ncc(c(c1)Cl)F 1P008ZJU [0,2,0,0,0,0|1,0,0]=3 3178 B9R1.69 Brc1ncc(c(c1)Cl)I 1P0012C0 [0,2,0,0,0,0|1,0,0]=3 3179 B9R1.69 Brc1ncc(c(c1)F)Br 1P0096WZ [0,2,0,0,0,0|1,0,0]=3 3180 B9R1.69 Brc1ncc(c(c1)F)C 1P01KLHG [0,2,0,0,0,0|1,0,0]=3 3181 B9R1.69 Brc1ncc(c(c1)F)Cl 1P008Y0W [0,2,0,0,0,0|1,0,0]=3 3182 B9R1.69 Brc1ncc(c(c1)F)F 1P00K2XV [0,2,0,0,0,0|1,0,0]=3 3183 B9R1.69 Brc1ncc(c(c1)F)I 1P0022PU [0,2,0,0,0,0|1,0,0]=3 3184 B9R1.69 Brc1ncc(c(c1)I)Br 1P00954K [0,2,0,0,0,0|1,0,0]=3 3185 B9R1.69 Brc1ncc(c(c1)I)C 1P000JSP [0,2,0,0,0,0|1,0,0]=3 3186 B9R1.69 Brc1ncc(c(c1)I)Cl 1P009531 [0,2,0,0,0,0|1,0,0]=3 3187 B9R1.69 Brc1ncc(c(c1)I)F 1P007E3F [0,2,0,0,0,0|1,0,0]=3 3188 B9R1.69 Brc1ncc(c(c1)N)Br 1P00BKFR [0,2,0,0,0,0|0,0,0]=2 3189 B9R1.69 Brc1ncc(c(c1)N)C 1P005NQF [0,2,0,0,0,0|0,0,0]=2 3190 B9R1.69 Brc1ncc(c(c1)N)Cl 1P00K7VM [0,2,0,0,0,0|0,0,0]=2 3191 B9R1.69 Brc1ncc(c(c1)N)F 1P004DSY [0,2,0,0,0,0|0,0,0]=2 3192 B9R1.69 Brc1ncc(c(c1)N)I 1P000UFJ [0,2,0,0,0,0|0,0,0]=2 3193 B9R1.69 Brc1ncc(c(c1)N)N 1P003AAS [0,2,0,0,0,0|0,0,0]=2 3194 B9R1.69 Brc1ncc(c(c1)N)O 1P019GGS [0,2,0,0,0,0|0,0,0]=2 3195 B9R1.69 Brc1ncc(c(c1)O)Br 1P0094I6 [0,2,0,0,0,0|1,0,0]=3 3196 B9R1.69 Brc1ncc(c(c1)O)C 1P000JS1 [0,2,0,0,0,0|1,0,0]=3 3197 B9R1.69 Brc1ncc(c(c1)O)Cl 1P000PRM [0,2,0,0,0,0|1,0,0]=3 3198 B9R1.69 Brc1ncc(c(c1)O)F 1P000PS1 [0,2,0,0,0,0|1,0,0]=3 3199 B9R1.69 Brc1ncc(c(c1)O)N 1P0281SF [0,2,0,0,0,0|1,0,0]=3 3200 B9R1.69 Brc1ncc(c(n1)Br)C 1P00E7U7 [0,2,0,0,0,0|2,0,0]=4 3201 B9R1.69 Brc1ncc(c(n1)Br)Cl 1P01FN3I [0,2,0,0,0,0|2,0,0]=4 3202 B9R1.69 Brc1ncc(c(n1)Br)F 1P009FLU [0,2,0,0,0,0|2,0,0]=4 3203 B9R1.69 Brc1ncc(c(n1)C)Br 1P00AMGN [0,2,0,0,0,0|2,0,0]=4 3204 B9R1.69 Brc1ncc(c(n1)C)F 1P0022IO [0,2,0,0,0,0|2,0,0]=4 3205 B9R1.69 Brc1ncc(c(n1)Cl)Cl 1P0283CM [0,2,0,0,0,0|2,0,0]=4 3206 B9R1.69 Brc1nnc(c(c1)Br)Br 1P0036H4 [0,2,0,0,0,0|2,0,0]=4 3207 B9R1.69 Brc1nnc(c(c1)Br)N 1P003KZN [0,2,0,0,0,0|2,0,0]=4 3208 B9R1.69 Brc1nnc(c(c1)C)Br 1P00IG2Y [0,2,0,0,0,0|2,0,0]=4 3209 B9R1.69 Brc1nnc(c(c1)C)C 1P01DVZL [0,2,0,0,0,0|2,0,0]=4 3210 B9R1.69 Brc1nnc(c(c1)C)Cl 1P01EEIB [0,2,0,0,0,0|2,0,0]=4 3211 B9R1.69 Cc1c(Br)cnc(=O)[nH]1 1P0066GF [0,2,0,0,0,0|2,0,0]=4 3212 B9R1.69 Cc1c(N)ccc(=O)[nH]1 1P00H0IA [0,2,0,0,0,0|2,0,0]=4 3213 B9R1.69 Cc1c[nH]c(=O)cc1N 1P003A4F [0,2,0,0,0,0|0,0,1]=3 3214 B9R1.69 Cc1c[nH]c(=O)nc1N 1P003L6U [0,2,0,0,0,0|1,0,1]=4 3215 B9R1.69 Cc1c[nH]c(=O)nc1N 1P00IACF [0,2,0,0,0,0|1,0,1]=4 3216 B9R1.69 Cc1cc(Br)c(=O)[nH]n1 1P00IJKG [0,2,0,0,0,0|2,0,0]=4 3217 B9R1.69 Cc1cc(Cl)n[nH]c1=O 1P00280F [0,2,0,0,0,0|2,0,0]=4 3218 B9R1.69 Cc1cc(N)c(=O)[nH]c1 1P003HUG [0,2,0,0,0,0|2,0,0]=4 3219 B9R1.69 Cc1cc(N)c(=O)[nH]n1 1P007ZUG [0,2,0,0,0,0|1,0,0]=3 3220 B9R1.69 Cc1cc(N)c[nH]c1=O 1P01A3A4 [0,2,0,0,0,0|2,0,0]=4 3221 B9R1.69 Cc1cc[n+](c(c1)C)[O-] 1P007C9H [0,2,0,0,0,0|1,0,1]=4 3222 B9R1.69 Cc1cc[n+](c(c1)Cl)[O-] 1P006VAU [0,2,0,0,0,0|1,0,1]=4 3223 B9R1.69 Cc1ccc(=N)[nH]c1N 1P00DJKY [0,2,0,0,0,0|2,0,0]=4 3224 B9R1.69 Cc1ccc(=O)[nH]c1N 1P00DK3F [0,2,0,0,0,0|2,0,0]=4 3225 B9R1.69 Cc1ccc(=O)[nH]c1N 1P028L3G [0,2,0,0,0,0|2,0,0]=4 3226 B9R1.69 Cc1ccc(c(c1)Br)Br 1P003IWH [0,2,0,0,0,0|2,0,0]=4 3227 B9R1.69 Cc1ccc(c(c1)Br)C 1P003H9M [0,2,0,0,0,0|2,0,0]=4 3228 B9R1.69 Cc1ccc(c(c1)Br)Cl 1P00IAOD [0,2,0,0,0,0|2,0,0]=4 3229 B9R1.69 Cc1ccc(c(c1)Br)F 1P003JIH [0,2,0,0,0,0|2,0,0]=4 3230 B9R1.69 Cc1ccc(c(c1)Br)I 1P00FAJ7 [0,2,0,0,0,0|2,0,0]=4 3231 B9R1.69 Cc1ccc(c(c1)Br)N 1P0010F1 [0,2,0,0,0,0|1,0,0]=3 3232 B9R1.69 Cc1ccc(c(c1)Br)N 1P003H58 [0,2,0,0,0,0|1,0,0]=3 3233 B9R1.69 Cc1ccc(c(c1)Br)O 1P003H5B [0,2,0,0,0,0|2,0,0]=4 3234 B9R1.69 Cc1ccc(c(c1)Br)S 1P00AQIF [0,2,0,0,0,0|2,0,0]=4 3235 B9R1.69 Cc1ccc(c(c1)C)Br 1P003GB4 [0,2,0,0,0,0|2,0,0]=4 3236 B9R1.69 Cc1ccc(c(c1)C)C 1P003DRZ [0,2,0,0,0,0|2,0,0]=4 3237 B9R1.69 Cc1ccc(c(c1)C)Cl 1P00IJ5B [0,2,0,0,0,0|2,0,0]=4 3238 B9R1.69 Cc1ccc(c(c1)C)F 1P0070HN [0,2,0,0,0,0|2,0,0]=4 3239 B9R1.69 Cc1ccc(c(c1)C)I 1P00397C [0,2,0,0,0,0|2,0,0]=4 3240 B9R1.69 Cc1ccc(c(c1)C)N 1P0038ZN [0,2,0,0,0,0|1,0,0]=3 3241 B9R1.69 Cc1ccc(c(c1)C)N 1P003GAX [0,2,0,0,0,0|1,0,0]=3 3242 B9R1.69 Cc1ccc(c(c1)C)O 1P0084MS [0,2,0,0,0,0|2,0,0]=4 3243 B9R1.69 Cc1ccc(c(c1)C)S 1P0033GE [0,2,0,0,0,0|2,0,0]=4 3244 B9R1.69 Cc1ccc(c(c1)Cl)Br 1P003LEP [0,2,0,0,0,0|2,0,0]=4 3245 B9R1.69 Cc1ccc(c(c1)Cl)C 1P003HB6 [0,2,0,0,0,0|2,0,0]=4 3246 B9R1.69 Cc1ccc(c(c1)Cl)Cl 1P003IX8 [0,2,0,0,0,0|2,0,0]=4 3247 B9R1.69 Cc1ccc(c(c1)Cl)F 1P001NPP [0,2,0,0,0,0|2,0,0]=4 3248 B9R1.69 Cc1ccc(c(c1)Cl)I 1P000DDR [0,2,0,0,0,0|2,0,0]=4 3249 B9R1.69 Cc1ccc(c(c1)Cl)N 1P003HE3 [0,2,0,0,0,0|1,0,0]=3 3250 B9R1.69 Cc1ccc(c(c1)Cl)O 1P0033OP [0,2,0,0,0,0|2,0,0]=4 3251 B9R1.69 Cc1ccc(c(c1)Cl)S 1P01EWUM [0,2,0,0,0,0|2,0,0]=4 3252 B9R1.69 Cc1ccc(c(c1)F)Br 1P003LEW [0,2,0,0,0,0|2,0,0]=4 3253 B9R1.69 Cc1ccc(c(c1)F)C 1P00FEJW [0,2,0,0,0,0|2,0,0]=4 3254 B9R1.69 Cc1ccc(c(c1)F)Cl 1P00IABK [0,2,0,0,0,0|2,0,0]=4 3255 B9R1.69 Cc1ccc(c(c1)F)F 1P002YDV [0,2,0,0,0,0|2,0,0]=4 3256 B9R1.69 Cc1ccc(c(c1)F)I 1P003JWM [0,2,0,0,0,0|2,0,0]=4 3257 B9R1.69 Cc1ccc(c(c1)F)N 1P0033RS [0,2,0,0,0,0|1,0,0]=3 3258 B9R1.69 Cc1ccc(c(c1)F)O 1P003HQ9 [0,2,0,0,0,0|2,0,0]=4 3259 B9R1.69 Cc1ccc(c(c1)F)S 1P01F0N3 [0,2,0,0,0,0|2,0,0]=4 3260 B9R1.69 Cc1ccc(c(c1)I)Br 1P003EJX [0,2,0,0,0,0|2,0,0]=4 3261 B9R1.69 Cc1ccc(c(c1)I)C 1P003E5F [0,2,0,0,0,0|2,0,0]=4 3262 B9R1.69 Cc1ccc(c(c1)I)Cl 1P00BOLX [0,2,0,0,0,0|2,0,0]=4 3263 B9R1.69 Cc1ccc(c(c1)I)F 1P003ESJ [0,2,0,0,0,0|2,0,0]=4 3264 B9R1.69 Cc1ccc(c(c1)I)I 1P001VTM [0,2,0,0,0,0|2,0,0]=4 3265 B9R1.69 Cc1ccc(c(c1)I)N 1P002YFM [0,2,0,0,0,0|1,0,0]=3 3266 B9R1.69 Cc1ccc(c(c1)I)O 1P001WF2 [0,2,0,0,0,0|2,0,0]=4 3267 B9R1.69 Cc1ccc(c(c1)N)Br 1P003H6Q [0,2,0,0,0,0|1,0,0]=3 3268 B9R1.69 Cc1ccc(c(c1)N)C 1P003GGB [0,2,0,0,0,0|1,0,0]=3 3269 B9R1.69 Cc1ccc(c(c1)N)C 1P00DHID [0,2,0,0,0,0|1,0,0]=3 3270 B9R1.69 Cc1ccc(c(c1)N)Cl 1P0033P4 [0,2,0,0,0,0|1,0,0]=3 3271 B9R1.69 Cc1ccc(c(c1)N)F 1P0033S2 [0,2,0,0,0,0|1,0,0]=3 3272 B9R1.69 Cc1ccc(c(c1)N)I 1P0010F3 [0,2,0,0,0,0|1,0,0]=3 3273 B9R1.69 Cc1ccc(c(c1)N)N 1P003IW6 [0,2,0,0,0,0|1,0,0]=3 3274 B9R1.69 Cc1ccc(c(c1)N)O 1P003H0G [0,2,0,0,0,0|1,0,0]=3 3275 B9R1.69 Cc1ccc(c(c1)N)O 1P003H0H [0,2,0,0,0,0|1,0,0]=3 3276 B9R1.69 Cc1ccc(c(c1)N)S 1P00BFWQ [0,2,0,0,0,0|1,0,0]=3 3277 B9R1.69 Cc1ccc(c(c1)O)Br 1P003H6U [0,2,0,0,0,0|2,0,0]=4 3278 B9R1.69 Cc1ccc(c(c1)O)C 1P005XF1 [0,2,0,0,0,0|2,0,0]=4 3279 B9R1.69 Cc1ccc(c(c1)O)Cl 1P003HFU [0,2,0,0,0,0|2,0,0]=4 3280 B9R1.69 Cc1ccc(c(c1)O)F 1P0036BO [0,2,0,0,0,0|2,0,0]=4 3281 B9R1.69 Cc1ccc(c(c1)O)I 1P00I7L1 [0,2,0,0,0,0|2,0,0]=4 3282 B9R1.69 Cc1ccc(c(c1)O)N 1P003GY2 [0,2,0,0,0,0|1,0,0]=3 3283 B9R1.69 Cc1ccc(c(c1)O)O 1P003M8C [0,2,0,0,0,0|2,0,0]=4 3284 B9R1.69 Cc1ccc(c(c1)O)S 1P028M8S [0,2,0,0,0,0|2,0,0]=4 3285 B9R1.69 Cc1ccc(c(c1)S)C 1P003GGD [0,2,0,0,0,0|2,0,0]=4 3286 B9R1.69 Cc1ccc(c(c1)S)F 1P01BL0T [0,2,0,0,0,0|2,0,0]=4 3287 B9R1.69 Cc1ccc(c(c1)S)N 1P002NRB [0,2,0,0,0,0|1,0,0]=3 3288 B9R1.69 Cc1ccc(c(c1)S)S 1P003VAU [0,2,0,0,0,0|2,0,0]=4 3289 B9R1.69 Cc1ccc(c(n1)Br)N 1P000T13 [0,2,0,0,0,0|2,0,0]=4 3290 B9R1.69 Cc1ccc(c(n1)C)N 1P00C05N [0,2,0,0,0,0|2,0,0]=4 3291 B9R1.69 Cc1ccc(c(n1)Cl)N 1P00BXUE [0,2,0,0,0,0|2,0,0]=4 3292 B9R1.69 Cc1ccc(c(n1)Cl)N 1P01A1XK [0,2,0,0,0,0|2,0,0]=4 3293 B9R1.69 Cc1ccc(c(n1)F)N 1P00I7U6 [0,2,0,0,0,0|2,0,0]=4 3294 B9R1.69 Cc1ccc(c(n1)I)N 1P00A0SK [0,2,0,0,0,0|2,0,0]=4 3295 B9R1.69 Cc1ccc(c(n1)N)Br 1P000T18 [0,2,0,0,0,0|2,0,0]=4 3296 B9R1.69 Cc1ccc(c(n1)N)C 1P0036XS [0,2,0,0,0,0|2,0,0]=4 3297 B9R1.69 Cc1ccc(c(n1)N)F 1P00HGEG [0,2,0,0,0,0|2,0,0]=4 3298 B9R1.69 Cc1ccc(c(n1)N)F 1P027TZX [0,2,0,0,0,0|2,0,0]=4 3299 B9R1.69 Cc1ccc(c(n1)N)I 1P003GUD [0,2,0,0,0,0|2,0,0]=4 3300 B9R1.69 Cc1ccc(c(n1)N)N 1P003NRN [0,2,0,0,0,0|2,0,0]=4 3301 B9R1.69 Cc1ccc(c(n1)N)N 1P00G3UQ [0,2,0,0,0,0|2,0,0]=4 3302 B9R1.69 Cc1ccc(c(n1)N)O 1P0029DI [0,2,0,0,0,0|2,0,0]=4 3303 B9R1.69 Cc1ccc(c(n1)O)N 1P00DEEK [0,2,0,0,0,0|2,0,0]=4 3304 B9R1.69 Cc1ccn(c(=S)c1)O 1P01A7FO [0,2,0,0,0,0|1,0,1]=4 3305 B9R1.69 Cc1cnc(c(c1)Br)N 1P003NJB [0,2,0,0,0,0|2,0,0]=4 3306 B9R1.69 Cc1cnc(c(c1)C)N 1P0033JL [0,2,0,0,0,0|2,0,0]=4 3307 B9R1.69 Cc1cnc(c(c1)C)N 1P00J2ZQ [0,2,0,0,0,0|2,0,0]=4 3308 B9R1.69 Cc1cnc(c(c1)Cl)N 1P003BMQ [0,2,0,0,0,0|2,0,0]=4 3309 B9R1.69 Cc1cnc(c(c1)F)N 1P009YMR [0,2,0,0,0,0|2,0,0]=4 3310 B9R1.69 Cc1cnc(c(c1)I)N 1P002LQ7 [0,2,0,0,0,0|2,0,0]=4 3311 B9R1.69 Cc1cnc(c(c1)N)Br 1P00341C [0,2,0,0,0,0|2,0,0]=4 3312 B9R1.69 Cc1cnc(c(c1)N)C 1P00H4Y1 [0,2,0,0,0,0|2,0,0]=4 3313 B9R1.69 Cc1cnc(c(c1)N)C 1P028GXB [0,2,0,0,0,0|2,0,0]=4 3314 B9R1.69 Cc1cnc(c(c1)N)Cl 1P007FD7 [0,2,0,0,0,0|2,0,0]=4 3315 B9R1.69 Cc1cnc(c(c1)N)F 1P001ZDA [0,2,0,0,0,0|2,0,0]=4 3316 B9R1.69 Cc1cnc(c(c1)N)N 1P002PC5 [0,2,0,0,0,0|2,0,0]=4 3317 B9R1.69 Cc1cnc(c(c1)N)N 1P027XYR [0,2,0,0,0,0|2,0,0]=4 3318 B9R1.69 Cc1cnc(c(c1)O)N 1P0029DH [0,2,0,0,0,0|2,0,0]=4 3319 B9R1.69 Cc1ncc(c(=O)[nH]1)Br 1P001XXP [0,2,0,0,0,0|2,0,0]=4 3320 B9R1.69 Cc1ncc(c(=O)[nH]1)C 1P00313P [0,2,0,0,0,0|2,0,0]=4 3321 B9R1.69 Cc1ncc(c(=O)[nH]1)I 1P009540 [0,2,0,0,0,0|2,0,0]=4 3322 B9R1.69 Cc1ncc(c(c1)Br)Br 1P00IN65 [0,2,0,0,0,0|1,0,0]=3 3323 B9R1.69 Cc1ncc(c(c1)Br)C 1P0038P0 [0,2,0,0,0,0|1,0,0]=3 3324 B9R1.69 Cc1ncc(c(c1)Br)Cl 1P009MEJ [0,2,0,0,0,0|1,0,0]=3 3325 B9R1.69 Cc1ncc(c(c1)Br)Cl 1P00IM5A [0,2,0,0,0,0|1,0,0]=3 3326 B9R1.69 Cc1ncc(c(c1)Br)F 1P003AJU [0,2,0,0,0,0|1,0,0]=3 3327 B9R1.69 Cc1ncc(c(c1)Br)N 1P007ELG [0,2,0,0,0,0|1,0,0]=3 3328 B9R1.69 Cc1ncc(c(c1)Br)O 1P000OV7 [0,2,0,0,0,0|1,0,0]=3 3329 B9R1.69 Cc1ncc(c(c1)C)Br 1P00C4P0 [0,2,0,0,0,0|1,0,0]=3 3330 B9R1.69 Cc1ncc(c(c1)C)N 1P000J0K [0,2,0,0,0,0|1,0,0]=3 3331 B9R1.69 Cc1ncc(c(c1)Cl)Br 1P000294 [0,2,0,0,0,0|1,0,0]=3 3332 B9R1.69 Cc1ncc(c(c1)Cl)C 1P007PEZ [0,2,0,0,0,0|1,0,0]=3 3333 B9R1.69 Cc1ncc(c(c1)Cl)F 1P00ACKD [0,2,0,0,0,0|1,0,0]=3 3334 B9R1.69 Cc1ncc(c(c1)Cl)N 1P01DL3Y [0,2,0,0,0,0|1,0,0]=3 3335 B9R1.69 Cc1ncc(c(c1)I)F 1P02235K [0,2,0,0,0,0|1,0,0]=3 3336 B9R1.69 Cc1ncc(c(c1)N)Br 1P007HFV [0,2,0,0,0,0|0,0,0]=2 3337 B9R1.69 Cc1ncc(c(c1)N)C 1P00BGL8 [0,2,0,0,0,0|0,0,0]=2 3338 B9R1.69 Cc1ncc(c(c1)N)Cl 1P003L6P [0,2,0,0,0,0|0,0,0]=2 3339 B9R1.69 Cc1ncc(c(c1)N)F 1P003L6Q [0,2,0,0,0,0|0,0,0]=2 3340 B9R1.69 Cc1ncc(c(c1)N)I 1P004RX1 [0,2,0,0,0,0|0,0,0]=2 3341 B9R1.69 Cc1ncc(c(c1)N)N 1P004UDT [0,2,0,0,0,0|0,0,0]=2 3342 B9R1.69 Cc1ncc(c(c1)N)O 1P028L7I [0,2,0,0,0,0|0,0,0]=2 3343 B9R1.69 Cc1ncc(c(c1)O)Br 1P000P9H [0,2,0,0,0,0|1,0,0]=3 3344 B9R1.69 Cc1ncc(c(n1)Br)C 1P0287H2 [0,2,0,0,0,0|2,0,0]=4 3345 B9R1.69 Cc1ncc(c(n1)C)Br 1P00698R [0,2,0,0,0,0|2,0,0]=4 3346 B9R1.69 Cc1ncc(c(n1)C)Cl 1P005VO7 [0,2,0,0,0,0|2,0,0]=4 3347 B9R1.69 Cc1ncc(c(n1)C)N 1P003GAV [0,2,0,0,0,0|2,0,0]=4 3348 B9R1.69 Cc1ncc(c(n1)C)O 1P00C794 [0,2,0,0,0,0|2,0,0]=4 3349 B9R1.69 Cc1ncc(c(n1)Cl)Br 1P004UD4 [0,2,0,0,0,0|2,0,0]=4 3350 B9R1.69 Cc1ncc(c(n1)Cl)C 1P0038WW [0,2,0,0,0,0|2,0,0]=4 3351 B9R1.69 Cc1ncc(c(n1)Cl)Cl 1P007L7K [0,2,0,0,0,0|2,0,0]=4 3352 B9R1.69 Cc1ncc(c(n1)Cl)F 1P0087B4 [0,2,0,0,0,0|2,0,0]=4 3353 B9R1.69 Cc1ncc(c(n1)Cl)I 1P009MKU [0,2,0,0,0,0|2,0,0]=4 3354 B9R1.69 Cc1ncc(c(n1)Cl)N 1P002DJS [0,2,0,0,0,0|2,0,0]=4 3355 B9R1.69 Cc1ncc(c(n1)N)Br 1P00BO3G [0,2,0,0,0,0|1,0,0]=3 3356 B9R1.69 Cc1ncc(c(n1)N)C 1P00FCPN [0,2,0,0,0,0|1,0,0]=3 3357 B9R1.69 Cc1ncc(c(n1)N)Cl 1P0038C1 [0,2,0,0,0,0|1,0,0]=3 3358 B9R1.69 Cc1ncc(c(n1)N)F 1P001H7K [0,2,0,0,0,0|1,0,0]=3 3359 B9R1.69 Cc1ncc(c(n1)O)F 1P006UVM [0,2,0,0,0,0|2,0,0]=4 3360 B9R1.69 Cc1nnc(c(c1)Br)Br 1P024VXG [0,2,0,0,0,0|2,0,0]=4 3361 B9R1.69 Cc1nnc(c(c1)Br)C 1P027YP3 [0,2,0,0,0,0|2,0,0]=4 3362 B9R1.69 Cc1nnc(c(c1)C)Cl 1P00B69Q [0,2,0,0,0,0|2,0,0]=4 3363 B9R1.69 Cc1nnc(c(c1)Cl)C 1P028NVU [0,2,0,0,0,0|2,0,0]=4 3364 B9R1.69 Cc1nnc(c(c1)N)C 1P01ADGS [0,2,0,0,0,0|1,0,0]=3 3365 B9R1.69 Cc1nnc(c(c1)N)Cl 1P01C3S7 [0,2,0,0,0,0|1,0,0]=3 3366 B9R1.69 Cc1nnc(c(c1)O)C 1P028PNF [0,2,0,0,0,0|2,0,0]=4 3367 B9R1.69 Clc1c[nH]c(=O)cc1Cl 1P004TL9 [0,2,0,0,0,0|1,0,1]=4 3368 B9R1.69 Clc1cc(Br)c(=O)[nH]n1 1P006HBA [0,2,0,0,0,0|2,0,0]=4 3369 B9R1.69 Clc1cc(Cl)n[nH]c1=O 1P007CS0 [0,2,0,0,0,0|2,0,0]=4 3370 B9R1.69 Clc1ccc([n+](c1)C)N 1P01EV58 [0,2,0,0,0,0|2,0,0]=4 3371 B9R1.69 Clc1ccc(c(=S)[nH]1)N 1P01FLO6 [0,2,0,0,0,0|2,0,0]=4 3372 B9R1.69 Clc1ccc(c(c1)Br)Br 1P00EGG3 [0,2,0,0,0,0|2,0,0]=4 3373 B9R1.69 Clc1ccc(c(c1)Br)C 1P003H4N [0,2,0,0,0,0|2,0,0]=4 3374 B9R1.69 Clc1ccc(c(c1)Br)Cl 1P00HXEB [0,2,0,0,0,0|2,0,0]=4 3375 B9R1.69 Clc1ccc(c(c1)Br)F 1P002CON [0,2,0,0,0,0|2,0,0]=4 3376 B9R1.69 Clc1ccc(c(c1)Br)I 1P00BZ6H [0,2,0,0,0,0|2,0,0]=4 3377 B9R1.69 Clc1ccc(c(c1)Br)N 1P0036S5 [0,2,0,0,0,0|1,0,0]=3 3378 B9R1.69 Clc1ccc(c(c1)Br)O 1P0032Q4 [0,2,0,0,0,0|2,0,0]=4 3379 B9R1.69 Clc1ccc(c(c1)Br)S 1P00DJSD [0,2,0,0,0,0|2,0,0]=4 3380 B9R1.69 Clc1ccc(c(c1)C)Br 1P001KUZ [0,2,0,0,0,0|2,0,0]=4 3381 B9R1.69 Clc1ccc(c(c1)C)C 1P003LIM [0,2,0,0,0,0|2,0,0]=4 3382 B9R1.69 Clc1ccc(c(c1)C)Cl 1P003GEL [0,2,0,0,0,0|2,0,0]=4 3383 B9R1.69 Clc1ccc(c(c1)C)F 1P003N3E [0,2,0,0,0,0|2,0,0]=4 3384 B9R1.69 Clc1ccc(c(c1)C)I 1P002NJK [0,2,0,0,0,0|2,0,0]=4 3385 B9R1.69 Clc1ccc(c(c1)C)N 1P0034FY [0,2,0,0,0,0|1,0,0]=3 3386 B9R1.69 Clc1ccc(c(c1)C)O 1P00HYW3 [0,2,0,0,0,0|2,0,0]=4 3387 B9R1.69 Clc1ccc(c(c1)C)S 1P007E8J [0,2,0,0,0,0|2,0,0]=4 3388 B9R1.69 Clc1ccc(c(c1)Cl)Br 1P000J0J [0,2,0,0,0,0|2,0,0]=4 3389 B9R1.69 Clc1ccc(c(c1)Cl)Cl 1P000QI8 [0,2,0,0,0,0|2,0,0]=4 3390 B9R1.69 Clc1ccc(c(c1)Cl)F 1P003329 [0,2,0,0,0,0|2,0,0]=4 3391 B9R1.69 Clc1ccc(c(c1)Cl)I 1P003G6P [0,2,0,0,0,0|2,0,0]=4 3392 B9R1.69 Clc1ccc(c(c1)Cl)N 1P003G7O [0,2,0,0,0,0|1,0,0]=3 3393 B9R1.69 Clc1ccc(c(c1)Cl)O 1P000QI7 [0,2,0,0,0,0|2,0,0]=4 3394 B9R1.69 Clc1ccc(c(c1)Cl)S 1P003G8I [0,2,0,0,0,0|2,0,0]=4 3395 B9R1.69 Clc1ccc(c(c1)F)Br 1P002COO [0,2,0,0,0,0|2,0,0]=4 3396 B9R1.69 Clc1ccc(c(c1)F)C 1P003LJZ [0,2,0,0,0,0|2,0,0]=4 3397 B9R1.69 Clc1ccc(c(c1)F)Cl 1P003GE5 [0,2,0,0,0,0|2,0,0]=4 3398 B9R1.69 Clc1ccc(c(c1)F)F 1P003EOJ [0,2,0,0,0,0|2,0,0]=4 3399 B9R1.69 Clc1ccc(c(c1)F)I 1P003LJN [0,2,0,0,0,0|2,0,0]=4 3400 B9R1.69 Clc1ccc(c(c1)F)N 1P003LJQ [0,2,0,0,0,0|1,0,0]=3 3401 B9R1.69 Clc1ccc(c(c1)F)O 1P0034FV [0,2,0,0,0,0|2,0,0]=4 3402 B9R1.69 Clc1ccc(c(c1)F)S 1P01BL0G [0,2,0,0,0,0|2,0,0]=4 3403 B9R1.69 Clc1ccc(c(c1)I)Br 1P001LPG [0,2,0,0,0,0|2,0,0]=4 3404 B9R1.69 Clc1ccc(c(c1)I)C 1P00C7LK [0,2,0,0,0,0|2,0,0]=4 3405 B9R1.69 Clc1ccc(c(c1)I)Cl 1P002ZKY [0,2,0,0,0,0|2,0,0]=4 3406 B9R1.69 Clc1ccc(c(c1)I)F 1P000CK8 [0,2,0,0,0,0|2,0,0]=4 3407 B9R1.69 Clc1ccc(c(c1)I)N 1P003LK2 [0,2,0,0,0,0|1,0,0]=3 3408 B9R1.69 Clc1ccc(c(c1)I)O 1P0064X7 [0,2,0,0,0,0|2,0,0]=4 3409 B9R1.69 Clc1ccc(c(c1)N)Br 1P003H60 [0,2,0,0,0,0|1,0,0]=3 3410 B9R1.69 Clc1ccc(c(c1)N)C 1P003GVR [0,2,0,0,0,0|1,0,0]=3 3411 B9R1.69 Clc1ccc(c(c1)N)C 1P005XUA [0,2,0,0,0,0|1,0,0]=3 3412 B9R1.69 Clc1ccc(c(c1)N)Cl 1P006BE9 [0,2,0,0,0,0|1,0,0]=3 3413 B9R1.69 Clc1ccc(c(c1)N)F 1P002LD0 [0,2,0,0,0,0|1,0,0]=3 3414 B9R1.69 Clc1ccc(c(c1)N)I 1P006CBO [0,2,0,0,0,0|1,0,0]=3 3415 B9R1.69 Clc1ccc(c(c1)N)N 1P0037CO [0,2,0,0,0,0|1,0,0]=3 3416 B9R1.69 Clc1ccc(c(c1)N)O 1P00H7RI [0,2,0,0,0,0|1,0,0]=3 3417 B9R1.69 Clc1ccc(c(c1)N)S 1P0002D5 [0,2,0,0,0,0|1,0,0]=3 3418 B9R1.69 Clc1ccc(c(c1)O)Br 1P0012LE [0,2,0,0,0,0|2,0,0]=4 3419 B9R1.69 Clc1ccc(c(c1)O)C 1P0034PL [0,2,0,0,0,0|2,0,0]=4 3420 B9R1.69 Clc1ccc(c(c1)O)Cl 1P0033GV [0,2,0,0,0,0|2,0,0]=4 3421 B9R1.69 Clc1ccc(c(c1)O)F 1P007SQI [0,2,0,0,0,0|2,0,0]=4 3422 B9R1.69 Clc1ccc(c(c1)O)I 1P0012UR [0,2,0,0,0,0|2,0,0]=4 3423 B9R1.69 Clc1ccc(c(c1)O)N 1P0033KE [0,2,0,0,0,0|1,0,0]=3 3424 B9R1.69 Clc1ccc(c(c1)O)O 1P003LN1 [0,2,0,0,0,0|2,0,0]=4 3425 B9R1.69 Clc1ccc(c(c1)S)Br 1P01BL1B [0,2,0,0,0,0|2,0,0]=4 3426 B9R1.69 Clc1ccc(c(c1)S)C 1P002HHD [0,2,0,0,0,0|2,0,0]=4 3427 B9R1.69 Clc1ccc(c(c1)S)Cl 1P003GDX [0,2,0,0,0,0|2,0,0]=4 3428 B9R1.69 Clc1ccc(c(c1)S)F 1P01BAC6 [0,2,0,0,0,0|2,0,0]=4 3429 B9R1.69 Clc1ccc(c(c1)S)I 1P01EJ8U [0,2,0,0,0,0|2,0,0]=4 3430 B9R1.69 Clc1ccc(c(c1)S)N 1P002NTK [0,2,0,0,0,0|1,0,0]=3 3431 B9R1.69 Clc1ccc(c(n1)Br)N 1P008RRP [0,2,0,0,0,0|2,0,0]=4 3432 B9R1.69 Clc1ccc(c(n1)C)N 1P001VHT [0,2,0,0,0,0|2,0,0]=4 3433 B9R1.69 Clc1ccc(c(n1)Cl)N 1P00IBHO [0,2,0,0,0,0|2,0,0]=4 3434 B9R1.69 Clc1ccc(c(n1)F)N 1P01K28H [0,2,0,0,0,0|2,0,0]=4 3435 B9R1.69 Clc1ccc(c(n1)I)N 1P0076AG [0,2,0,0,0,0|2,0,0]=4 3436 B9R1.69 Clc1ccc(c(n1)N)Br 1P003GU1 [0,2,0,0,0,0|2,0,0]=4 3437 B9R1.69 Clc1ccc(c(n1)N)C 1P00E6FO [0,2,0,0,0,0|2,0,0]=4 3438 B9R1.69 Clc1ccc(c(n1)N)C 1P027U9E [0,2,0,0,0,0|2,0,0]=4 3439 B9R1.69 Clc1ccc(c(n1)N)Cl 1P007HQF [0,2,0,0,0,0|2,0,0]=4 3440 B9R1.69 Clc1ccc(c(n1)N)Cl 1P01FJ5Y [0,2,0,0,0,0|2,0,0]=4 3441 B9R1.69 Clc1ccc(c(n1)N)F 1P01A1E3 [0,2,0,0,0,0|2,0,0]=4 3442 B9R1.69 Clc1ccc(c(n1)N)I 1P00370E [0,2,0,0,0,0|2,0,0]=4 3443 B9R1.69 Clc1ccc(c(n1)N)N 1P0074KN [0,2,0,0,0,0|2,0,0]=4 3444 B9R1.69 Clc1ccc(c(n1)N)O 1P00B9QR [0,2,0,0,0,0|2,0,0]=4 3445 B9R1.69 Clc1cnc(c(c1)Br)N 1P002SDP [0,2,0,0,0,0|2,0,0]=4 3446 B9R1.69 Clc1cnc(c(c1)C)N 1P002JC3 [0,2,0,0,0,0|2,0,0]=4 3447 B9R1.69 Clc1cnc(c(c1)Cl)N 1P003GTS [0,2,0,0,0,0|2,0,0]=4 3448 B9R1.69 Clc1cnc(c(c1)F)N 1P003GXG [0,2,0,0,0,0|2,0,0]=4 3449 B9R1.69 Clc1cnc(c(c1)I)N 1P002LQ5 [0,2,0,0,0,0|2,0,0]=4 3450 B9R1.69 Clc1cnc(c(c1)N)Br 1P00390G [0,2,0,0,0,0|2,0,0]=4 3451 B9R1.69 Clc1cnc(c(c1)N)C 1P005OTL [0,2,0,0,0,0|2,0,0]=4 3452 B9R1.69 Clc1cnc(c(c1)N)Cl 1P005L9Z [0,2,0,0,0,0|2,0,0]=4 3453 B9R1.69 Clc1cnc(c(c1)N)F 1P008SBR [0,2,0,0,0,0|2,0,0]=4 3454 B9R1.69 Clc1cnc(c(c1)N)I 1P008YD1 [0,2,0,0,0,0|2,0,0]=4 3455 B9R1.69 Clc1cnc(c(c1)N)N 1P003N5H [0,2,0,0,0,0|2,0,0]=4 3456 B9R1.69 Clc1cnc(c(c1)O)N 1P00747H [0,2,0,0,0,0|2,0,0]=4 3457 B9R1.69 Clc1ncc(=O)n(c1)C 1P01K135 [0,2,0,0,0,0|2,0,0]=4 3458 B9R1.69 Clc1ncc(c(=O)[nH]1)C 1P009K9S [0,2,0,0,0,0|2,0,0]=4 3459 B9R1.69 Clc1ncc(c(=O)[nH]1)Cl 1P01BEWZ [0,2,0,0,0,0|2,0,0]=4 3460 B9R1.69 Clc1ncc(c(=O)[nH]1)Cl 1P01XAHO [0,2,0,0,0,0|2,0,0]=4 3461 B9R1.69 Clc1ncc(c(=O)[nH]1)F 1P001O0F [0,2,0,0,0,0|2,0,0]=4 3462 B9R1.69 Clc1ncc(c(=O)[nH]1)I 1P01JUG7 [0,2,0,0,0,0|2,0,0]=4 3463 B9R1.69 Clc1ncc(c(c1)Br)Br 1P00I0MZ [0,2,0,0,0,0|1,0,0]=3 3464 B9R1.69 Clc1ncc(c(c1)Br)C 1P0036VB [0,2,0,0,0,0|1,0,0]=3 3465 B9R1.69 Clc1ncc(c(c1)Br)Cl 1P008UX8 [0,2,0,0,0,0|1,0,0]=3 3466 B9R1.69 Clc1ncc(c(c1)Br)F 1P004HS0 [0,2,0,0,0,0|1,0,0]=3 3467 B9R1.69 Clc1ncc(c(c1)Br)N 1P020MB7 [0,2,0,0,0,0|1,0,0]=3 3468 B9R1.69 Clc1ncc(c(c1)C)Br 1P0033OO [0,2,0,0,0,0|1,0,0]=3 3469 B9R1.69 Clc1ncc(c(c1)C)C 1P00CA9N [0,2,0,0,0,0|1,0,0]=3 3470 B9R1.69 Clc1ncc(c(c1)C)Cl 1P004AIC [0,2,0,0,0,0|1,0,0]=3 3471 B9R1.69 Clc1ncc(c(c1)C)F 1P008C02 [0,2,0,0,0,0|1,0,0]=3 3472 B9R1.69 Clc1ncc(c(c1)C)I 1P00382Q [0,2,0,0,0,0|1,0,0]=3 3473 B9R1.69 Clc1ncc(c(c1)C)N 1P003JDO [0,2,0,0,0,0|1,0,0]=3 3474 B9R1.69 Clc1ncc(c(c1)C)O 1P000JQI [0,2,0,0,0,0|1,0,0]=3 3475 B9R1.69 Clc1ncc(c(c1)Cl)Br 1P003MX5 [0,2,0,0,0,0|1,0,0]=3 3476 B9R1.69 Clc1ncc(c(c1)Cl)C 1P00E9HW [0,2,0,0,0,0|1,0,0]=3 3477 B9R1.69 Clc1ncc(c(c1)Cl)Cl 1P003G2A [0,2,0,0,0,0|1,0,0]=3 3478 B9R1.69 Clc1ncc(c(c1)Cl)F 1P002IO2 [0,2,0,0,0,0|1,0,0]=3 3479 B9R1.69 Clc1ncc(c(c1)Cl)I 1P0037TO [0,2,0,0,0,0|1,0,0]=3 3480 B9R1.69 Clc1ncc(c(c1)Cl)N 1P003MTQ [0,2,0,0,0,0|1,0,0]=3 3481 B9R1.69 Clc1ncc(c(c1)Cl)O 1P000PTU [0,2,0,0,0,0|1,0,0]=3 3482 B9R1.69 Clc1ncc(c(c1)F)Br 1P009XSM [0,2,0,0,0,0|1,0,0]=3 3483 B9R1.69 Clc1ncc(c(c1)F)C 1P000JRR [0,2,0,0,0,0|1,0,0]=3 3484 B9R1.69 Clc1ncc(c(c1)F)Cl 1P0015BM [0,2,0,0,0,0|1,0,0]=3 3485 B9R1.69 Clc1ncc(c(c1)F)I 1P00137Z [0,2,0,0,0,0|1,0,0]=3 3486 B9R1.69 Clc1ncc(c(c1)F)N 1P00HIV6 [0,2,0,0,0,0|1,0,0]=3 3487 B9R1.69 Clc1ncc(c(c1)F)O 1P01C4EC [0,2,0,0,0,0|1,0,0]=3 3488 B9R1.69 Clc1ncc(c(c1)I)Br 1P00C8QN [0,2,0,0,0,0|1,0,0]=3 3489 B9R1.69 Clc1ncc(c(c1)I)C 1P000Q46 [0,2,0,0,0,0|1,0,0]=3 3490 B9R1.69 Clc1ncc(c(c1)I)Cl 1P005J3Y [0,2,0,0,0,0|1,0,0]=3 3491 B9R1.69 Clc1ncc(c(c1)I)F 1P003HF5 [0,2,0,0,0,0|1,0,0]=3 3492 B9R1.69 Clc1ncc(c(c1)I)N 1P00C174 [0,2,0,0,0,0|1,0,0]=3 3493 B9R1.69 Clc1ncc(c(c1)I)O 1P008E4Z [0,2,0,0,0,0|1,0,0]=3 3494 B9R1.69 Clc1ncc(c(c1)N)Br 1P003L6N [0,2,0,0,0,0|0,0,0]=2 3495 B9R1.69 Clc1ncc(c(c1)N)C 1P005NQE [0,2,0,0,0,0|0,0,0]=2 3496 B9R1.69 Clc1ncc(c(c1)N)C 1P028TCV [0,2,0,0,0,0|0,0,0]=2 3497 B9R1.69 Clc1ncc(c(c1)N)Cl 1P00C7FA [0,2,0,0,0,0|0,0,0]=2 3498 B9R1.69 Clc1ncc(c(c1)N)Cl 1P00I3MN [0,2,0,0,0,0|0,0,0]=2 3499 B9R1.69 Clc1ncc(c(c1)N)F 1P00419E [0,2,0,0,0,0|0,0,0]=2 3500 B9R1.69 Clc1ncc(c(c1)N)I 1P0036Y5 [0,2,0,0,0,0|0,0,0]=2 3501 B9R1.69 Clc1ncc(c(c1)N)N 1P005OUX [0,2,0,0,0,0|0,0,0]=2 3502 B9R1.69 Clc1ncc(c(c1)N)O 1P0018G6 [0,2,0,0,0,0|0,0,0]=2 3503 B9R1.69 Clc1ncc(c(c1)O)Br 1P000PRF [0,2,0,0,0,0|1,0,0]=3 3504 B9R1.69 Clc1ncc(c(c1)O)C 1P009X7Y [0,2,0,0,0,0|1,0,0]=3 3505 B9R1.69 Clc1ncc(c(c1)O)Cl 1P0033GW [0,2,0,0,0,0|1,0,0]=3 3506 B9R1.69 Clc1ncc(c(c1)O)F 1P000PT1 [0,2,0,0,0,0|1,0,0]=3 3507 B9R1.69 Clc1ncc(c(c1)O)I 1P000JGR [0,2,0,0,0,0|1,0,0]=3 3508 B9R1.69 Clc1ncc(c(c1)O)N 1P0018G5 [0,2,0,0,0,0|1,0,0]=3 3509 B9R1.69 Clc1ncc(c(c1)S)Cl 1P028CL4 [0,2,0,0,0,0|1,0,0]=3 3510 B9R1.69 Clc1ncc(c(n1)Br)F 1P01XCVN [0,2,0,0,0,0|2,0,0]=4 3511 B9R1.69 Clc1ncc(c(n1)Br)N 1P0209J5 [0,2,0,0,0,0|2,0,0]=4 3512 B9R1.69 Clc1ncc(c(n1)C)Br 1P00EGBZ [0,2,0,0,0,0|2,0,0]=4 3513 B9R1.69 Clc1ncc(c(n1)C)C 1P00C7EL [0,2,0,0,0,0|2,0,0]=4 3514 B9R1.69 Clc1ncc(c(n1)C)Cl 1P000IUD [0,2,0,0,0,0|2,0,0]=4 3515 B9R1.69 Clc1ncc(c(n1)C)F 1P007N38 [0,2,0,0,0,0|2,0,0]=4 3516 B9R1.69 Clc1ncc(c(n1)C)I 1P028N50 [0,2,0,0,0,0|2,0,0]=4 3517 B9R1.69 Clc1ncc(c(n1)C)N 1P002DJR [0,2,0,0,0,0|2,0,0]=4 3518 B9R1.69 Clc1ncc(c(n1)C)O 1P000MNK [0,2,0,0,0,0|2,0,0]=4 3519 B9R1.69 Clc1ncc(c(n1)Cl)Br 1P0034O0 [0,2,0,0,0,0|2,0,0]=4 3520 B9R1.69 Clc1ncc(c(n1)Cl)C 1P00266K [0,2,0,0,0,0|2,0,0]=4 3521 B9R1.69 Clc1ncc(c(n1)Cl)Cl 1P0033F1 [0,2,0,0,0,0|2,0,0]=4 3522 B9R1.69 Clc1ncc(c(n1)Cl)F 1P002YDU [0,2,0,0,0,0|2,0,0]=4 3523 B9R1.69 Clc1ncc(c(n1)Cl)I 1P0033FP [0,2,0,0,0,0|2,0,0]=4 3524 B9R1.69 Clc1ncc(c(n1)Cl)N 1P003G6U [0,2,0,0,0,0|2,0,0]=4 3525 B9R1.69 Clc1ncc(c(n1)Cl)O 1P001BLP [0,2,0,0,0,0|2,0,0]=4 3526 B9R1.69 Clc1ncc(c(n1)F)Br 1P021LHJ [0,2,0,0,0,0|2,0,0]=4 3527 B9R1.69 Clc1ncc(c(n1)F)Cl 1P0282N4 [0,2,0,0,0,0|2,0,0]=4 3528 B9R1.69 Clc1ncc(c(n1)I)C 1P028XVB [0,2,0,0,0,0|2,0,0]=4 3529 B9R1.69 Clc1ncc(c(n1)I)Cl 1P01UNXT [0,2,0,0,0,0|2,0,0]=4 3530 B9R1.69 Clc1ncc(c(n1)N)Br 1P002AQP [0,2,0,0,0,0|1,0,0]=3 3531 B9R1.69 Clc1ncc(c(n1)N)C 1P001J3Z [0,2,0,0,0,0|1,0,0]=3 3532 B9R1.69 Clc1ncc(c(n1)N)Cl 1P003L4U [0,2,0,0,0,0|1,0,0]=3 3533 B9R1.69 Clc1ncc(c(n1)N)F 1P001O0H [0,2,0,0,0,0|1,0,0]=3 3534 B9R1.69 Clc1ncc(c(n1)N)I 1P00E9F7 [0,2,0,0,0,0|1,0,0]=3 3535 B9R1.69 Clc1ncc(c(n1)N)N 1P001ED8 [0,2,0,0,0,0|1,0,0]=3 3536 B9R1.69 Clc1ncc(c(n1)N)O 1P01DFNQ [0,2,0,0,0,0|1,0,0]=3 3537 B9R1.69 Clc1ncc(c(n1)O)Br 1P00G9DG [0,2,0,0,0,0|2,0,0]=4 3538 B9R1.69 Clc1ncn(c(=O)c1)C 1P00044M [0,2,0,0,0,0|2,0,0]=4 3539 B9R1.69 Clc1nnc(c(c1)Br)Cl 1P0038IA [0,2,0,0,0,0|2,0,0]=4 3540 B9R1.69 Clc1nnc(c(c1)Br)N 1P00341N [0,2,0,0,0,0|2,0,0]=4 3541 B9R1.69 Clc1nnc(c(c1)C)Br 1P01EEJH [0,2,0,0,0,0|2,0,0]=4 3542 B9R1.69 Clc1nnc(c(c1)C)C 1P004LI2 [0,2,0,0,0,0|2,0,0]=4 3543 B9R1.69 Clc1nnc(c(c1)C)Cl 1P002F5L [0,2,0,0,0,0|2,0,0]=4 3544 B9R1.69 Clc1nnc(c(c1)C)N 1P003JDN [0,2,0,0,0,0|2,0,0]=4 3545 B9R1.69 Clc1nnc(c(c1)C)N 1P028RXV [0,2,0,0,0,0|2,0,0]=4 3546 B9R1.69 Clc1nnc(c(c1)Cl)C 1P00FFTI [0,2,0,0,0,0|2,0,0]=4 3547 B9R1.69 Clc1nnc(c(c1)Cl)Cl 1P0033YR [0,2,0,0,0,0|2,0,0]=4 3548 B9R1.69 Clc1nnc(c(c1)Cl)N 1P000CAS [0,2,0,0,0,0|2,0,0]=4 3549 B9R1.69 Clc1nnc(c(c1)F)Cl 1P006KPW [0,2,0,0,0,0|2,0,0]=4 3550 B9R1.69 Clc1nnc(c(c1)I)Cl 1P000VG2 [0,2,0,0,0,0|2,0,0]=4 3551 B9R1.69 Clc1nnc(c(c1)N)Cl 1P0038VQ [0,2,0,0,0,0|1,0,0]=3 3552 B9R1.69 Clc1nnc(c(c1)N)N 1P01FPCW [0,2,0,0,0,0|1,0,0]=3 3553 B9R1.69 Clc1nnc(c(c1)O)Cl 1P001L5Z [0,2,0,0,0,0|2,0,0]=4 3554 B9R1.69 Clc1nnc(c(c1)O)Cl 1P002V7G [0,2,0,0,0,0|2,0,0]=4 3555 B9R1.69 Clc1nnc(c(c1)O)N 1P01JJZU [0,2,0,0,0,0|2,0,0]=4 3556 B9R1.69 Clc1nnc(c(n1)N)Cl 1P01A0VX [0,2,0,0,0,0|2,0,0]=4 3557 B9R1.69 Cn1ccc(=O)c(c1)Br 1P00IF9T [0,2,0,0,0,0|1,0,1]=4 3558 B9R1.69 Cn1ccc(=O)c(c1)O 1P00DIFA [0,2,0,0,0,0|1,0,1]=4 3559 B9R1.69 Cn1ccc(nc1=O)N 1P0083K7 [0,2,0,0,0,0|1,0,1]=4 3560 B9R1.69 Cn1ncc(=O)c(c1)Br 1P028R26 [0,2,0,0,0,0|2,0,0]=4 3561 B9R1.69 Cn1ncc(cc1=O)N 1P007M0G [0,2,0,0,0,0|1,0,1]=4 3562 B9R1.69 Fc1c[nH]c(=O)cc1Br 1P0034EL [0,2,0,0,0,0|1,0,1]=4 3563 B9R1.69 Fc1c[nH]c(=O)cc1I 1P000JSU [0,2,0,0,0,0|1,0,1]=4 3564 B9R1.69 Fc1c[nH]c(=O)cc1O 1P00CMFY [0,2,0,0,0,0|1,0,1]=4 3565 B9R1.69 Fc1cc(Br)c(=O)[nH]n1 1P028H3U [0,2,0,0,0,0|2,0,0]=4 3566 B9R1.69 Fc1ccc(c(c1)Br)Br 1P002OMQ [0,2,0,0,0,0|2,0,0]=4 3567 B9R1.69 Fc1ccc(c(c1)Br)C 1P001IF2 [0,2,0,0,0,0|2,0,0]=4 3568 B9R1.69 Fc1ccc(c(c1)Br)Cl 1P0028CJ [0,2,0,0,0,0|2,0,0]=4 3569 B9R1.69 Fc1ccc(c(c1)Br)F 1P0076UR [0,2,0,0,0,0|2,0,0]=4 3570 B9R1.69 Fc1ccc(c(c1)Br)I 1P0028Z1 [0,2,0,0,0,0|2,0,0]=4 3571 B9R1.69 Fc1ccc(c(c1)Br)N 1P0001ZX [0,2,0,0,0,0|1,0,0]=3 3572 B9R1.69 Fc1ccc(c(c1)Br)O 1P0033M1 [0,2,0,0,0,0|2,0,0]=4 3573 B9R1.69 Fc1ccc(c(c1)Br)S 1P00G501 [0,2,0,0,0,0|2,0,0]=4 3574 B9R1.69 Fc1ccc(c(c1)C)Br 1P0033ME [0,2,0,0,0,0|2,0,0]=4 3575 B9R1.69 Fc1ccc(c(c1)C)C 1P003BGN [0,2,0,0,0,0|2,0,0]=4 3576 B9R1.69 Fc1ccc(c(c1)C)Cl 1P003HFI [0,2,0,0,0,0|2,0,0]=4 3577 B9R1.69 Fc1ccc(c(c1)C)F 1P003GF7 [0,2,0,0,0,0|2,0,0]=4 3578 B9R1.69 Fc1ccc(c(c1)C)I 1P00FAWB [0,2,0,0,0,0|2,0,0]=4 3579 B9R1.69 Fc1ccc(c(c1)C)N 1P0034HP [0,2,0,0,0,0|1,0,0]=3 3580 B9R1.69 Fc1ccc(c(c1)C)N 1P024HNR [0,2,0,0,0,0|1,0,0]=3 3581 B9R1.69 Fc1ccc(c(c1)C)O 1P003LU2 [0,2,0,0,0,0|2,0,0]=4 3582 B9R1.69 Fc1ccc(c(c1)C)S 1P00G4HY [0,2,0,0,0,0|2,0,0]=4 3583 B9R1.69 Fc1ccc(c(c1)Cl)Br 1P003360 [0,2,0,0,0,0|2,0,0]=4 3584 B9R1.69 Fc1ccc(c(c1)Cl)C 1P003HDW [0,2,0,0,0,0|2,0,0]=4 3585 B9R1.69 Fc1ccc(c(c1)Cl)Cl 1P006UZM [0,2,0,0,0,0|2,0,0]=4 3586 B9R1.69 Fc1ccc(c(c1)Cl)F 1P002OJZ [0,2,0,0,0,0|2,0,0]=4 3587 B9R1.69 Fc1ccc(c(c1)Cl)I 1P0004Q2 [0,2,0,0,0,0|2,0,0]=4 3588 B9R1.69 Fc1ccc(c(c1)Cl)N 1P002LD2 [0,2,0,0,0,0|1,0,0]=3 3589 B9R1.69 Fc1ccc(c(c1)Cl)O 1P002COM [0,2,0,0,0,0|2,0,0]=4 3590 B9R1.69 Fc1ccc(c(c1)Cl)S 1P0021AK [0,2,0,0,0,0|2,0,0]=4 3591 B9R1.69 Fc1ccc(c(c1)F)Br 1P003EJK [0,2,0,0,0,0|2,0,0]=4 3592 B9R1.69 Fc1ccc(c(c1)F)C 1P003G9J [0,2,0,0,0,0|2,0,0]=4 3593 B9R1.69 Fc1ccc(c(c1)F)Cl 1P003EO1 [0,2,0,0,0,0|2,0,0]=4 3594 B9R1.69 Fc1ccc(c(c1)F)F 1P003BGE [0,2,0,0,0,0|2,0,0]=4 3595 B9R1.69 Fc1ccc(c(c1)F)I 1P003G9D [0,2,0,0,0,0|2,0,0]=4 3596 B9R1.69 Fc1ccc(c(c1)F)N 1P003G93 [0,2,0,0,0,0|1,0,0]=3 3597 B9R1.69 Fc1ccc(c(c1)F)O 1P003G9G [0,2,0,0,0,0|2,0,0]=4 3598 B9R1.69 Fc1ccc(c(c1)F)S 1P002CPD [0,2,0,0,0,0|2,0,0]=4 3599 B9R1.69 Fc1ccc(c(c1)I)Br 1P0028Z2 [0,2,0,0,0,0|2,0,0]=4 3600 B9R1.69 Fc1ccc(c(c1)I)C 1P0010F5 [0,2,0,0,0,0|2,0,0]=4 3601 B9R1.69 Fc1ccc(c(c1)I)Cl 1P00292D [0,2,0,0,0,0|2,0,0]=4 3602 B9R1.69 Fc1ccc(c(c1)I)F 1P003BLZ [0,2,0,0,0,0|2,0,0]=4 3603 B9R1.69 Fc1ccc(c(c1)I)I 1P00BCIC [0,2,0,0,0,0|2,0,0]=4 3604 B9R1.69 Fc1ccc(c(c1)I)N 1P003LTR [0,2,0,0,0,0|1,0,0]=3 3605 B9R1.69 Fc1ccc(c(c1)I)O 1P00386P [0,2,0,0,0,0|2,0,0]=4 3606 B9R1.69 Fc1ccc(c(c1)N)Br 1P0001ZW [0,2,0,0,0,0|1,0,0]=3 3607 B9R1.69 Fc1ccc(c(c1)N)C 1P003N7P [0,2,0,0,0,0|1,0,0]=3 3608 B9R1.69 Fc1ccc(c(c1)N)Cl 1P003HF7 [0,2,0,0,0,0|1,0,0]=3 3609 B9R1.69 Fc1ccc(c(c1)N)F 1P003GEW [0,2,0,0,0,0|1,0,0]=3 3610 B9R1.69 Fc1ccc(c(c1)N)I 1P00387O [0,2,0,0,0,0|1,0,0]=3 3611 B9R1.69 Fc1ccc(c(c1)N)N 1P0038EE [0,2,0,0,0,0|1,0,0]=3 3612 B9R1.69 Fc1ccc(c(c1)N)O 1P003GVY [0,2,0,0,0,0|1,0,0]=3 3613 B9R1.69 Fc1ccc(c(c1)N)S 1P00811G [0,2,0,0,0,0|1,0,0]=3 3614 B9R1.69 Fc1ccc(c(c1)O)Br 1P0033MC [0,2,0,0,0,0|2,0,0]=4 3615 B9R1.69 Fc1ccc(c(c1)O)C 1P003LTQ [0,2,0,0,0,0|2,0,0]=4 3616 B9R1.69 Fc1ccc(c(c1)O)Cl 1P00I7ZU [0,2,0,0,0,0|2,0,0]=4 3617 B9R1.69 Fc1ccc(c(c1)O)F 1P0033GY [0,2,0,0,0,0|2,0,0]=4 3618 B9R1.69 Fc1ccc(c(c1)O)N 1P003GXQ [0,2,0,0,0,0|1,0,0]=3 3619 B9R1.69 Fc1ccc(c(c1)O)O 1P003LVL [0,2,0,0,0,0|2,0,0]=4 3620 B9R1.69 Fc1ccc(c(c1)S)C 1P00G54K [0,2,0,0,0,0|2,0,0]=4 3621 B9R1.69 Fc1ccc(c(c1)S)F 1P0054EG [0,2,0,0,0,0|2,0,0]=4 3622 B9R1.69 Fc1ccc(c(c1)S)N 1P00C1II [0,2,0,0,0,0|1,0,0]=3 3623 B9R1.69 Fc1ccc(c(n1)Br)N 1P00942R [0,2,0,0,0,0|2,0,0]=4 3624 B9R1.69 Fc1ccc(c(n1)C)N 1P002VYJ [0,2,0,0,0,0|2,0,0]=4 3625 B9R1.69 Fc1ccc(c(n1)F)N 1P0094G8 [0,2,0,0,0,0|2,0,0]=4 3626 B9R1.69 Fc1ccc(c(n1)I)N 1P01XACZ [0,2,0,0,0,0|2,0,0]=4 3627 B9R1.69 Fc1ccc(c(n1)N)Br 1P000KOJ [0,2,0,0,0,0|2,0,0]=4 3628 B9R1.69 Fc1ccc(c(n1)N)C 1P020MKO [0,2,0,0,0,0|2,0,0]=4 3629 B9R1.69 Fc1ccc(c(n1)N)Cl 1P01B1WF [0,2,0,0,0,0|2,0,0]=4 3630 B9R1.69 Fc1ccc(c(n1)N)F 1P00IIO1 [0,2,0,0,0,0|2,0,0]=4 3631 B9R1.69 Fc1ccc(c(n1)N)I 1P0290YW [0,2,0,0,0,0|2,0,0]=4 3632 B9R1.69 Fc1ccc(c(n1)N)N 1P00EGNA [0,2,0,0,0,0|2,0,0]=4 3633 B9R1.69 Fc1cnc(c(c1)Br)N 1P008EOJ [0,2,0,0,0,0|2,0,0]=4 3634 B9R1.69 Fc1cnc(c(c1)C)N 1P0036RB [0,2,0,0,0,0|2,0,0]=4 3635 B9R1.69 Fc1cnc(c(c1)Cl)N 1P001591 [0,2,0,0,0,0|2,0,0]=4 3636 B9R1.69 Fc1cnc(c(c1)F)N 1P003BMP [0,2,0,0,0,0|2,0,0]=4 3637 B9R1.69 Fc1cnc(c(c1)I)N 1P005EXM [0,2,0,0,0,0|2,0,0]=4 3638 B9R1.69 Fc1cnc(c(c1)N)Br 1P0036S4 [0,2,0,0,0,0|2,0,0]=4 3639 B9R1.69 Fc1cnc(c(c1)N)C 1P01TAO5 [0,2,0,0,0,0|2,0,0]=4 3640 B9R1.69 Fc1cnc(c(c1)N)Cl 1P004K05 [0,2,0,0,0,0|2,0,0]=4 3641 B9R1.69 Fc1cnc(c(c1)N)N 1P0034Q8 [0,2,0,0,0,0|2,0,0]=4 3642 B9R1.69 Fc1cnc(c(c1)N)O 1P00HIWB [0,2,0,0,0,0|2,0,0]=4 3643 B9R1.69 Fc1cnc(c(c1)O)N 1P00028C [0,2,0,0,0,0|2,0,0]=4 3644 B9R1.69 Fc1ncc(c(c1)Br)C 1P000JST [0,2,0,0,0,0|1,0,0]=3 3645 B9R1.69 Fc1ncc(c(c1)Br)Cl 1P01ENN0 [0,2,0,0,0,0|1,0,0]=3 3646 B9R1.69 Fc1ncc(c(c1)Br)F 1P009X7O [0,2,0,0,0,0|1,0,0]=3 3647 B9R1.69 Fc1ncc(c(c1)Br)I 1P01NLXO [0,2,0,0,0,0|1,0,0]=3 3648 B9R1.69 Fc1ncc(c(c1)Br)N 1P01KX76 [0,2,0,0,0,0|1,0,0]=3 3649 B9R1.69 Fc1ncc(c(c1)Br)O 1P000JSK [0,2,0,0,0,0|1,0,0]=3 3650 B9R1.69 Fc1ncc(c(c1)C)Br 1P003MXO [0,2,0,0,0,0|1,0,0]=3 3651 B9R1.69 Fc1ncc(c(c1)C)F 1P021TAC [0,2,0,0,0,0|1,0,0]=3 3652 B9R1.69 Fc1ncc(c(c1)C)I 1P000JBZ [0,2,0,0,0,0|1,0,0]=3 3653 B9R1.69 Fc1ncc(c(c1)C)N 1P003NOD [0,2,0,0,0,0|1,0,0]=3 3654 B9R1.69 Fc1ncc(c(c1)Cl)Br 1P008UXI [0,2,0,0,0,0|1,0,0]=3 3655 B9R1.69 Fc1ncc(c(c1)Cl)Cl 1P0223J0 [0,2,0,0,0,0|1,0,0]=3 3656 B9R1.69 Fc1ncc(c(c1)Cl)F 1P004XRS [0,2,0,0,0,0|1,0,0]=3 3657 B9R1.69 Fc1ncc(c(c1)Cl)I 1P000JBY [0,2,0,0,0,0|1,0,0]=3 3658 B9R1.69 Fc1ncc(c(c1)F)Br 1P01KZ25 [0,2,0,0,0,0|1,0,0]=3 3659 B9R1.69 Fc1ncc(c(c1)F)C 1P028ZDF [0,2,0,0,0,0|1,0,0]=3 3660 B9R1.69 Fc1ncc(c(c1)F)Cl 1P01XCYY [0,2,0,0,0,0|1,0,0]=3 3661 B9R1.69 Fc1ncc(c(c1)F)F 1P008ISN [0,2,0,0,0,0|1,0,0]=3 3662 B9R1.69 Fc1ncc(c(c1)F)I 1P00G3SH [0,2,0,0,0,0|1,0,0]=3 3663 B9R1.69 Fc1ncc(c(c1)F)N 1P001VAP [0,2,0,0,0,0|1,0,0]=3 3664 B9R1.69 Fc1ncc(c(c1)F)O 1P00A1YN [0,2,0,0,0,0|1,0,0]=3 3665 B9R1.69 Fc1ncc(c(c1)I)Br 1P01KYDT [0,2,0,0,0,0|1,0,0]=3 3666 B9R1.69 Fc1ncc(c(c1)I)C 1P003HQ2 [0,2,0,0,0,0|1,0,0]=3 3667 B9R1.69 Fc1ncc(c(c1)I)Cl 1P006M71 [0,2,0,0,0,0|1,0,0]=3 3668 B9R1.69 Fc1ncc(c(c1)I)F 1P000617 [0,2,0,0,0,0|1,0,0]=3 3669 B9R1.69 Fc1ncc(c(c1)I)O 1P00K7SK [0,2,0,0,0,0|1,0,0]=3 3670 B9R1.69 Fc1ncc(c(c1)N)Br 1P01FJ5W [0,2,0,0,0,0|0,0,0]=2 3671 B9R1.69 Fc1ncc(c(c1)N)C 1P001BAX [0,2,0,0,0,0|0,0,0]=2 3672 B9R1.69 Fc1ncc(c(c1)N)Cl 1P01BWH5 [0,2,0,0,0,0|0,0,0]=2 3673 B9R1.69 Fc1ncc(c(c1)N)F 1P002IO0 [0,2,0,0,0,0|0,0,0]=2 3674 B9R1.69 Fc1ncc(c(c1)O)C 1P00HHDX [0,2,0,0,0,0|1,0,0]=3 3675 B9R1.69 Fc1ncc(c(c1)O)Cl 1P024DTD [0,2,0,0,0,0|1,0,0]=3 3676 B9R1.69 Fc1ncc(c(c1)O)F 1P021J16 [0,2,0,0,0,0|1,0,0]=3 3677 B9R1.69 Fc1ncc(c(n1)F)Br 1P00GX1N [0,2,0,0,0,0|2,0,0]=4 3678 B9R1.69 Fc1ncc(c(n1)F)C 1P01B5BQ [0,2,0,0,0,0|2,0,0]=4 3679 B9R1.69 Fc1ncc(c(n1)F)Cl 1P002R4P [0,2,0,0,0,0|2,0,0]=4 3680 B9R1.69 Fc1ncc(c(n1)F)F 1P0021M5 [0,2,0,0,0,0|2,0,0]=4 3681 B9R1.69 Fc1ncc(c(n1)N)Br 1P028U7W [0,2,0,0,0,0|1,0,0]=3 3682 B9R1.69 Fc1nnc(c(c1)F)F 1P0285AY [0,2,0,0,0,0|2,0,0]=4 3683 B9R1.69 Ic1ccc(c(c1)Br)Br 1P00H0UK [0,2,0,0,0,0|2,0,0]=4 3684 B9R1.69 Ic1ccc(c(c1)Br)C 1P007LDU [0,2,0,0,0,0|2,0,0]=4 3685 B9R1.69 Ic1ccc(c(c1)Br)Cl 1P00C17F [0,2,0,0,0,0|2,0,0]=4 3686 B9R1.69 Ic1ccc(c(c1)Br)F 1P0055SD [0,2,0,0,0,0|2,0,0]=4 3687 B9R1.69 Ic1ccc(c(c1)Br)N 1P002ZEK [0,2,0,0,0,0|1,0,0]=3 3688 B9R1.69 Ic1ccc(c(c1)Br)O 1P009K4Z [0,2,0,0,0,0|2,0,0]=4 3689 B9R1.69 Ic1ccc(c(c1)C)Br 1P0028YR [0,2,0,0,0,0|2,0,0]=4 3690 B9R1.69 Ic1ccc(c(c1)C)C 1P00I6GA [0,2,0,0,0,0|2,0,0]=4 3691 B9R1.69 Ic1ccc(c(c1)C)Cl 1P000DDS [0,2,0,0,0,0|2,0,0]=4 3692 B9R1.69 Ic1ccc(c(c1)C)F 1P003HQY [0,2,0,0,0,0|2,0,0]=4 3693 B9R1.69 Ic1ccc(c(c1)C)I 1P008POI [0,2,0,0,0,0|2,0,0]=4 3694 B9R1.69 Ic1ccc(c(c1)C)N 1P0010F4 [0,2,0,0,0,0|1,0,0]=3 3695 B9R1.69 Ic1ccc(c(c1)C)O 1P0034JG [0,2,0,0,0,0|2,0,0]=4 3696 B9R1.69 Ic1ccc(c(c1)Cl)Br 1P00DC9F [0,2,0,0,0,0|2,0,0]=4 3697 B9R1.69 Ic1ccc(c(c1)Cl)C 1P003BNS [0,2,0,0,0,0|2,0,0]=4 3698 B9R1.69 Ic1ccc(c(c1)Cl)Cl 1P002AND [0,2,0,0,0,0|2,0,0]=4 3699 B9R1.69 Ic1ccc(c(c1)Cl)F 1P001P09 [0,2,0,0,0,0|2,0,0]=4 3700 B9R1.69 Ic1ccc(c(c1)Cl)N 1P003BNR [0,2,0,0,0,0|1,0,0]=3 3701 B9R1.69 Ic1ccc(c(c1)Cl)O 1P000C6B [0,2,0,0,0,0|2,0,0]=4 3702 B9R1.69 Ic1ccc(c(c1)Cl)S 1P01EJ6V [0,2,0,0,0,0|2,0,0]=4 3703 B9R1.69 Ic1ccc(c(c1)F)Br 1P007MYU [0,2,0,0,0,0|2,0,0]=4 3704 B9R1.69 Ic1ccc(c(c1)F)C 1P003HQ3 [0,2,0,0,0,0|2,0,0]=4 3705 B9R1.69 Ic1ccc(c(c1)F)Cl 1P00292E [0,2,0,0,0,0|2,0,0]=4 3706 B9R1.69 Ic1ccc(c(c1)F)F 1P003DV1 [0,2,0,0,0,0|2,0,0]=4 3707 B9R1.69 Ic1ccc(c(c1)F)I 1P001FOK [0,2,0,0,0,0|2,0,0]=4 3708 B9R1.69 Ic1ccc(c(c1)F)N 1P002ZEJ [0,2,0,0,0,0|1,0,0]=3 3709 B9R1.69 Ic1ccc(c(c1)F)O 1P00BFRE [0,2,0,0,0,0|2,0,0]=4 3710 B9R1.69 Ic1ccc(c(c1)I)Br 1P01V8D3 [0,2,0,0,0,0|2,0,0]=4 3711 B9R1.69 Ic1ccc(c(c1)I)Cl 1P01C2TC [0,2,0,0,0,0|2,0,0]=4 3712 B9R1.69 Ic1ccc(c(c1)I)N 1P00DA5Y [0,2,0,0,0,0|1,0,0]=3 3713 B9R1.69 Ic1ccc(c(c1)I)O 1P002DQ0 [0,2,0,0,0,0|2,0,0]=4 3714 B9R1.69 Ic1ccc(c(c1)N)Br 1P008UJ0 [0,2,0,0,0,0|1,0,0]=3 3715 B9R1.69 Ic1ccc(c(c1)N)C 1P003N9Q [0,2,0,0,0,0|1,0,0]=3 3716 B9R1.69 Ic1ccc(c(c1)N)Cl 1P001WXL [0,2,0,0,0,0|1,0,0]=3 3717 B9R1.69 Ic1ccc(c(c1)N)F 1P008B0G [0,2,0,0,0,0|1,0,0]=3 3718 B9R1.69 Ic1ccc(c(c1)N)I 1P00EUWK [0,2,0,0,0,0|1,0,0]=3 3719 B9R1.69 Ic1ccc(c(c1)N)N 1P00I4K3 [0,2,0,0,0,0|1,0,0]=3 3720 B9R1.69 Ic1ccc(c(c1)N)O 1P00IKTO [0,2,0,0,0,0|1,0,0]=3 3721 B9R1.69 Ic1ccc(c(c1)O)Br 1P0033MG [0,2,0,0,0,0|2,0,0]=4 3722 B9R1.69 Ic1ccc(c(c1)O)C 1P00AOOA [0,2,0,0,0,0|2,0,0]=4 3723 B9R1.69 Ic1ccc(c(c1)O)Cl 1P002XGW [0,2,0,0,0,0|2,0,0]=4 3724 B9R1.69 Ic1ccc(c(c1)O)F 1P007623 [0,2,0,0,0,0|2,0,0]=4 3725 B9R1.69 Ic1ccc(c(c1)O)N 1P003W1P [0,2,0,0,0,0|1,0,0]=3 3726 B9R1.69 Ic1ccc(c(c1)O)O 1P00GFO5 [0,2,0,0,0,0|2,0,0]=4 3727 B9R1.69 Ic1ccc(c(c1)S)Br 1P02844X [0,2,0,0,0,0|2,0,0]=4 3728 B9R1.69 Ic1ccc(c(n1)Cl)N 1P00941I [0,2,0,0,0,0|2,0,0]=4 3729 B9R1.69 Ic1ccc(c(n1)F)N 1P001II2 [0,2,0,0,0,0|2,0,0]=4 3730 B9R1.69 Ic1ccc(c(n1)I)N 1P028TKV [0,2,0,0,0,0|2,0,0]=4 3731 B9R1.69 Ic1ccn(c(=O)c1)C 1P00H4QV [0,2,0,0,0,0|1,0,1]=4 3732 B9R1.69 Ic1cnc(c(c1)Br)N 1P005UTC [0,2,0,0,0,0|2,0,0]=4 3733 B9R1.69 Ic1cnc(c(c1)C)N 1P00HZM4 [0,2,0,0,0,0|2,0,0]=4 3734 B9R1.69 Ic1cnc(c(c1)Cl)N 1P00664Z [0,2,0,0,0,0|2,0,0]=4 3735 B9R1.69 Ic1cnc(c(c1)F)N 1P0010S8 [0,2,0,0,0,0|2,0,0]=4 3736 B9R1.69 Ic1cnc(c(c1)I)N 1P002OA7 [0,2,0,0,0,0|2,0,0]=4 3737 B9R1.69 Ic1cnc(c(c1)N)Br 1P008VE7 [0,2,0,0,0,0|2,0,0]=4 3738 B9R1.69 Ic1cnc(c(c1)N)Cl 1P00728W [0,2,0,0,0,0|2,0,0]=4 3739 B9R1.69 Ic1cnc(c(c1)N)O 1P00G9SK [0,2,0,0,0,0|2,0,0]=4 3740 B9R1.69 Ic1ncc(c(c1)C)Br 1P005UOR [0,2,0,0,0,0|1,0,0]=3 3741 B9R1.69 Ic1ncc(c(c1)F)Br 1P009XUE [0,2,0,0,0,0|1,0,0]=3 3742 B9R1.69 Ic1ncc(c(n1)C)Br 1P000RXU [0,2,0,0,0,0|2,0,0]=4 3743 B9R1.69 Ic1ncc(c(n1)C)Cl 1P000RTJ [0,2,0,0,0,0|2,0,0]=4 3744 B9R1.69 Nc1c(F)cnc(=O)[nH]1 1P0028LP [0,2,0,0,0,0|1,0,0]=3 3745 B9R1.69 Nc1cc(Br)c(=O)[nH]c1 1P009WLI [0,2,0,0,0,0|2,0,0]=4 3746 B9R1.69 Nc1cc(Cl)c[nH]c1=O 1P003JCZ [0,2,0,0,0,0|2,0,0]=4 3747 B9R1.69 Nc1cc(Cl)n[nH]c1=O 1P01A43A [0,2,0,0,0,0|1,0,0]=3 3748 B9R1.69 Nc1cc(F)c[nH]c1=O 1P000SMC [0,2,0,0,0,0|2,0,0]=4 3749 B9R1.69 Nc1ccc(=O)n(c1)C 1P000A2Z [0,2,0,0,0,0|2,0,0]=4 3750 B9R1.69 Nc1ccc(=O)n(c1)C 1P00CJBG [0,2,0,0,0,0|2,0,0]=4 3751 B9R1.69 Nc1ccc(=O)n(c1)C 1P00CPCU [0,2,0,0,0,0|2,0,0]=4 3752 B9R1.69 Nc1ccc(c(c1)Br)Br 1P00EFJ4 [0,2,0,0,0,0|1,0,0]=3 3753 B9R1.69 Nc1ccc(c(c1)Br)C 1P00342X [0,2,0,0,0,0|1,0,0]=3 3754 B9R1.69 Nc1ccc(c(c1)Br)Cl 1P003JI2 [0,2,0,0,0,0|1,0,0]=3 3755 B9R1.69 Nc1ccc(c(c1)Br)F 1P000P2U [0,2,0,0,0,0|1,0,0]=3 3756 B9R1.69 Nc1ccc(c(c1)Br)F 1P003JIC [0,2,0,0,0,0|1,0,0]=3 3757 B9R1.69 Nc1ccc(c(c1)Br)I 1P004M85 [0,2,0,0,0,0|1,0,0]=3 3758 B9R1.69 Nc1ccc(c(c1)Br)N 1P0011WU [0,2,0,0,0,0|1,0,0]=3 3759 B9R1.69 Nc1ccc(c(c1)Br)O 1P001XWA [0,2,0,0,0,0|1,0,0]=3 3760 B9R1.69 Nc1ccc(c(c1)Br)S 1P019ZV5 [0,2,0,0,0,0|1,0,0]=3 3761 B9R1.69 Nc1ccc(c(c1)C)Br 1P00BEV8 [0,2,0,0,0,0|1,0,0]=3 3762 B9R1.69 Nc1ccc(c(c1)C)Br 1P00FAD7 [0,2,0,0,0,0|1,0,0]=3 3763 B9R1.69 Nc1ccc(c(c1)C)C 1P003766 [0,2,0,0,0,0|1,0,0]=3 3764 B9R1.69 Nc1ccc(c(c1)C)C 1P00FQ4P [0,2,0,0,0,0|1,0,0]=3 3765 B9R1.69 Nc1ccc(c(c1)C)Cl 1P002ZWA [0,2,0,0,0,0|1,0,0]=3 3766 B9R1.69 Nc1ccc(c(c1)C)Cl 1P003LLN [0,2,0,0,0,0|1,0,0]=3 3767 B9R1.69 Nc1ccc(c(c1)C)F 1P003HQN [0,2,0,0,0,0|1,0,0]=3 3768 B9R1.69 Nc1ccc(c(c1)C)I 1P00D94P [0,2,0,0,0,0|1,0,0]=3 3769 B9R1.69 Nc1ccc(c(c1)C)N 1P0036PO [0,2,0,0,0,0|1,0,0]=3 3770 B9R1.69 Nc1ccc(c(c1)C)N 1P003GDA [0,2,0,0,0,0|1,0,0]=3 3771 B9R1.69 Nc1ccc(c(c1)C)N 1P00IBCB [0,2,0,0,0,0|1,0,0]=3 3772 B9R1.69 Nc1ccc(c(c1)C)O 1P003L5D [0,2,0,0,0,0|1,0,0]=3 3773 B9R1.69 Nc1ccc(c(c1)Cl)Br 1P007R3I [0,2,0,0,0,0|1,0,0]=3 3774 B9R1.69 Nc1ccc(c(c1)Cl)C 1P003JP7 [0,2,0,0,0,0|1,0,0]=3 3775 B9R1.69 Nc1ccc(c(c1)Cl)C 1P008NB0 [0,2,0,0,0,0|1,0,0]=3 3776 B9R1.69 Nc1ccc(c(c1)Cl)Cl 1P00H81W [0,2,0,0,0,0|1,0,0]=3 3777 B9R1.69 Nc1ccc(c(c1)Cl)F 1P003449 [0,2,0,0,0,0|1,0,0]=3 3778 B9R1.69 Nc1ccc(c(c1)Cl)I 1P007M0L [0,2,0,0,0,0|1,0,0]=3 3779 B9R1.69 Nc1ccc(c(c1)Cl)N 1P003BNF [0,2,0,0,0,0|1,0,0]=3 3780 B9R1.69 Nc1ccc(c(c1)Cl)N 1P00IBCD [0,2,0,0,0,0|1,0,0]=3 3781 B9R1.69 Nc1ccc(c(c1)Cl)O 1P00398D [0,2,0,0,0,0|1,0,0]=3 3782 B9R1.69 Nc1ccc(c(c1)Cl)S 1P019NY5 [0,2,0,0,0,0|1,0,0]=3 3783 B9R1.69 Nc1ccc(c(c1)F)Br 1P003LES [0,2,0,0,0,0|1,0,0]=3 3784 B9R1.69 Nc1ccc(c(c1)F)C 1P003JWX [0,2,0,0,0,0|1,0,0]=3 3785 B9R1.69 Nc1ccc(c(c1)F)Cl 1P003LLA [0,2,0,0,0,0|1,0,0]=3 3786 B9R1.69 Nc1ccc(c(c1)F)F 1P0033Z6 [0,2,0,0,0,0|1,0,0]=3 3787 B9R1.69 Nc1ccc(c(c1)F)F 1P0202B4 [0,2,0,0,0,0|1,0,0]=3 3788 B9R1.69 Nc1ccc(c(c1)F)I 1P00IBYY [0,2,0,0,0,0|1,0,0]=3 3789 B9R1.69 Nc1ccc(c(c1)F)N 1P001FQU [0,2,0,0,0,0|1,0,0]=3 3790 B9R1.69 Nc1ccc(c(c1)F)O 1P0037Z4 [0,2,0,0,0,0|1,0,0]=3 3791 B9R1.69 Nc1ccc(c(c1)F)O 1P009K8D [0,2,0,0,0,0|1,0,0]=3 3792 B9R1.69 Nc1ccc(c(c1)F)S 1P019NY3 [0,2,0,0,0,0|1,0,0]=3 3793 B9R1.69 Nc1ccc(c(c1)I)Br 1P00ED2K [0,2,0,0,0,0|1,0,0]=3 3794 B9R1.69 Nc1ccc(c(c1)I)C 1P0037T7 [0,2,0,0,0,0|1,0,0]=3 3795 B9R1.69 Nc1ccc(c(c1)I)Cl 1P003933 [0,2,0,0,0,0|1,0,0]=3 3796 B9R1.69 Nc1ccc(c(c1)I)F 1P00H8SJ [0,2,0,0,0,0|1,0,0]=3 3797 B9R1.69 Nc1ccc(c(c1)I)N 1P005TI0 [0,2,0,0,0,0|1,0,0]=3 3798 B9R1.69 Nc1ccc(c(c1)I)O 1P003WK1 [0,2,0,0,0,0|1,0,0]=3 3799 B9R1.69 Nc1ccc(c(c1)N)Br 1P00EKEF [0,2,0,0,0,0|1,0,0]=3 3800 B9R1.69 Nc1ccc(c(c1)N)Cl 1P003LN2 [0,2,0,0,0,0|1,0,0]=3 3801 B9R1.69 Nc1ccc(c(c1)N)Cl 1P0054D4 [0,2,0,0,0,0|1,0,0]=3 3802 B9R1.69 Nc1ccc(c(c1)N)F 1P003G61 [0,2,0,0,0,0|1,0,0]=3 3803 B9R1.69 Nc1ccc(c(c1)N)N 1P00IBCC [0,2,0,0,0,0|1,0,0]=3 3804 B9R1.69 Nc1ccc(c(c1)N)O 1P001356 [0,2,0,0,0,0|1,0,0]=3 3805 B9R1.69 Nc1ccc(c(c1)N)O 1P003G62 [0,2,0,0,0,0|1,0,0]=3 3806 B9R1.69 Nc1ccc(c(c1)O)Br 1P00DBZ5 [0,2,0,0,0,0|1,0,0]=3 3807 B9R1.69 Nc1ccc(c(c1)O)C 1P003K0J [0,2,0,0,0,0|1,0,0]=3 3808 B9R1.69 Nc1ccc(c(c1)O)Cl 1P003BNW [0,2,0,0,0,0|1,0,0]=3 3809 B9R1.69 Nc1ccc(c(c1)O)F 1P00027G [0,2,0,0,0,0|1,0,0]=3 3810 B9R1.69 Nc1ccc(c(c1)O)F 1P028ER8 [0,2,0,0,0,0|1,0,0]=3 3811 B9R1.69 Nc1ccc(c(c1)O)O 1P001QUF [0,2,0,0,0,0|1,0,0]=3 3812 B9R1.69 Nc1ccc(c(c1)O)O 1P00DNFX [0,2,0,0,0,0|1,0,0]=3 3813 B9R1.69 Nc1ccc(c(c1)S)C 1P019TVV [0,2,0,0,0,0|1,0,0]=3 3814 B9R1.69 Nc1ccc(c(c1)S)Cl 1P019TVT [0,2,0,0,0,0|1,0,0]=3 3815 B9R1.69 Nc1ccc(c(n1)Br)Br 1P0041GH [0,2,0,0,0,0|2,0,0]=4 3816 B9R1.69 Nc1ccc(c(n1)Br)C 1P00H1FJ [0,2,0,0,0,0|2,0,0]=4 3817 B9R1.69 Nc1ccc(c(n1)Br)Cl 1P0002FC [0,2,0,0,0,0|2,0,0]=4 3818 B9R1.69 Nc1ccc(c(n1)Br)F 1P00A1NN [0,2,0,0,0,0|2,0,0]=4 3819 B9R1.69 Nc1ccc(c(n1)Br)I 1P00I0ME [0,2,0,0,0,0|2,0,0]=4 3820 B9R1.69 Nc1ccc(c(n1)Br)N 1P000RVY [0,2,0,0,0,0|2,0,0]=4 3821 B9R1.69 Nc1ccc(c(n1)C)Br 1P003NJ5 [0,2,0,0,0,0|2,0,0]=4 3822 B9R1.69 Nc1ccc(c(n1)C)C 1P00ED1Z [0,2,0,0,0,0|2,0,0]=4 3823 B9R1.69 Nc1ccc(c(n1)C)Cl 1P003N50 [0,2,0,0,0,0|2,0,0]=4 3824 B9R1.69 Nc1ccc(c(n1)C)F 1P003A3H [0,2,0,0,0,0|2,0,0]=4 3825 B9R1.69 Nc1ccc(c(n1)C)I 1P003NJ8 [0,2,0,0,0,0|2,0,0]=4 3826 B9R1.69 Nc1ccc(c(n1)C)N 1P005TIA [0,2,0,0,0,0|2,0,0]=4 3827 B9R1.69 Nc1ccc(c(n1)C)O 1P01UNYV [0,2,0,0,0,0|2,0,0]=4 3828 B9R1.69 Nc1ccc(c(n1)Cl)Br 1P0033K7 [0,2,0,0,0,0|2,0,0]=4 3829 B9R1.69 Nc1ccc(c(n1)Cl)C 1P00DI4N [0,2,0,0,0,0|2,0,0]=4 3830 B9R1.69 Nc1ccc(c(n1)Cl)Cl 1P000IY8 [0,2,0,0,0,0|2,0,0]=4 3831 B9R1.69 Nc1ccc(c(n1)Cl)F 1P01K9HS [0,2,0,0,0,0|2,0,0]=4 3832 B9R1.69 Nc1ccc(c(n1)Cl)I 1P0017AI [0,2,0,0,0,0|2,0,0]=4 3833 B9R1.69 Nc1ccc(c(n1)F)Br 1P00375J [0,2,0,0,0,0|2,0,0]=4 3834 B9R1.69 Nc1ccc(c(n1)F)Cl 1P009WNQ [0,2,0,0,0,0|2,0,0]=4 3835 B9R1.69 Nc1ccc(c(n1)F)I 1P004D20 [0,2,0,0,0,0|2,0,0]=4 3836 B9R1.69 Nc1ccc(c(n1)I)Br 1P007PK6 [0,2,0,0,0,0|2,0,0]=4 3837 B9R1.69 Nc1ccc(c(n1)N)Br 1P00DDFI [0,2,0,0,0,0|2,0,0]=4 3838 B9R1.69 Nc1ccc(c(n1)N)Cl 1P00DJLA [0,2,0,0,0,0|2,0,0]=4 3839 B9R1.69 Nc1ccc(c(n1)N)I 1P004Q7Y [0,2,0,0,0,0|2,0,0]=4 3840 B9R1.69 Nc1ccc(c(n1)N)N 1P00C2VC [0,2,0,0,0,0|2,0,0]=4 3841 B9R1.69 Nc1ccn(c(=O)c1)C 1P003L4E [0,2,0,0,0,0|0,0,1]=3 3842 B9R1.69 Nc1ccn(c(=O)c1)C 1P009KLB [0,2,0,0,0,0|0,0,1]=3 3843 B9R1.69 Nc1cnc(c(c1)Br)Br 1P00DGU1 [0,2,0,0,0,0|2,0,0]=4 3844 B9R1.69 Nc1cnc(c(c1)Br)C 1P00AQ03 [0,2,0,0,0,0|2,0,0]=4 3845 B9R1.69 Nc1cnc(c(c1)Br)Cl 1P000UOR [0,2,0,0,0,0|2,0,0]=4 3846 B9R1.69 Nc1cnc(c(c1)Br)F 1P002KMJ [0,2,0,0,0,0|2,0,0]=4 3847 B9R1.69 Nc1cnc(c(c1)C)Br 1P00BXUH [0,2,0,0,0,0|2,0,0]=4 3848 B9R1.69 Nc1cnc(c(c1)C)C 1P0037G9 [0,2,0,0,0,0|2,0,0]=4 3849 B9R1.69 Nc1cnc(c(c1)C)Cl 1P003HCJ [0,2,0,0,0,0|2,0,0]=4 3850 B9R1.69 Nc1cnc(c(c1)C)F 1P00AOW6 [0,2,0,0,0,0|2,0,0]=4 3851 B9R1.69 Nc1cnc(c(c1)Cl)Br 1P000UOS [0,2,0,0,0,0|2,0,0]=4 3852 B9R1.69 Nc1cnc(c(c1)Cl)C 1P00H0M7 [0,2,0,0,0,0|2,0,0]=4 3853 B9R1.69 Nc1cnc(c(c1)Cl)Cl 1P006A22 [0,2,0,0,0,0|2,0,0]=4 3854 B9R1.69 Nc1cnc(c(c1)Cl)F 1P01BJOP [0,2,0,0,0,0|2,0,0]=4 3855 B9R1.69 Nc1cnc(c(c1)F)Br 1P00HITD [0,2,0,0,0,0|2,0,0]=4 3856 B9R1.69 Nc1cnc(c(c1)F)C 1P01KLJ1 [0,2,0,0,0,0|2,0,0]=4 3857 B9R1.69 Nc1cnc(c(c1)F)Cl 1P000OUH [0,2,0,0,0,0|2,0,0]=4 3858 B9R1.69 Nc1cnc(c(c1)F)F 1P019ZKR [0,2,0,0,0,0|2,0,0]=4 3859 B9R1.69 Nc1cnc(c(c1)F)O 1P00HVD9 [0,2,0,0,0,0|2,0,0]=4 3860 B9R1.69 Nc1cnc(c(c1)I)Br 1P00FENQ [0,2,0,0,0,0|2,0,0]=4 3861 B9R1.69 Nc1cnc(c(c1)N)Cl 1P00EDCK [0,2,0,0,0,0|2,0,0]=4 3862 B9R1.69 Nc1nc(=O)[nH]cc1Br 1P0034D3 [0,2,0,0,0,0|1,0,1]=4 3863 B9R1.69 Nc1nc(=O)[nH]cc1Cl 1P00C1VB [0,2,0,0,0,0|1,0,1]=4 3864 B9R1.69 Nc1nc(=O)[nH]cc1I 1P003N9Y [0,2,0,0,0,0|1,0,1]=4 3865 B9R1.69 Nc1nc(=O)[nH]cc1N 1P00BU9D [0,2,0,0,0,0|1,0,1]=4 3866 B9R1.69 Nc1nc(=O)[nH]cc1N 1P01FJAH [0,2,0,0,0,0|1,0,1]=4 3867 B9R1.69 Nc1ncc(c(=O)[nH]1)Br 1P0015Q0 [0,2,0,0,0,0|2,0,0]=4 3868 B9R1.69 Nc1ncc(c(=O)[nH]1)Br 1P00EAYR [0,2,0,0,0,0|2,0,0]=4 3869 B9R1.69 Nc1ncc(c(=O)[nH]1)C 1P001RVP [0,2,0,0,0,0|2,0,0]=4 3870 B9R1.69 Nc1ncc(c(=O)[nH]1)Cl 1P01E83P [0,2,0,0,0,0|2,0,0]=4 3871 B9R1.69 Nc1ncc(c(=O)[nH]1)F 1P001YHK [0,2,0,0,0,0|2,0,0]=4 3872 B9R1.69 Nc1ncc(c(=O)[nH]1)I 1P00CKRQ [0,2,0,0,0,0|2,0,0]=4 3873 B9R1.69 Nc1ncc(c(=O)[nH]1)N 1P003AMC [0,2,0,0,0,0|2,0,0]=4 3874 B9R1.69 Nc1ncc(c(c1)Br)Br 1P004Q80 [0,2,0,0,0,0|1,0,0]=3 3875 B9R1.69 Nc1ncc(c(c1)Br)C 1P007HFF [0,2,0,0,0,0|1,0,0]=3 3876 B9R1.69 Nc1ncc(c(c1)Br)Cl 1P008YCT [0,2,0,0,0,0|1,0,0]=3 3877 B9R1.69 Nc1ncc(c(c1)Br)F 1P020M9U [0,2,0,0,0,0|1,0,0]=3 3878 B9R1.69 Nc1ncc(c(c1)Br)I 1P0081GV [0,2,0,0,0,0|1,0,0]=3 3879 B9R1.69 Nc1ncc(c(c1)Br)N 1P01C5O8 [0,2,0,0,0,0|1,0,0]=3 3880 B9R1.69 Nc1ncc(c(c1)C)Br 1P003GX7 [0,2,0,0,0,0|1,0,0]=3 3881 B9R1.69 Nc1ncc(c(c1)C)C 1P00EGIV [0,2,0,0,0,0|1,0,0]=3 3882 B9R1.69 Nc1ncc(c(c1)C)Cl 1P00I7RS [0,2,0,0,0,0|1,0,0]=3 3883 B9R1.69 Nc1ncc(c(c1)C)F 1P007JYO [0,2,0,0,0,0|1,0,0]=3 3884 B9R1.69 Nc1ncc(c(c1)C)I 1P003GXS [0,2,0,0,0,0|1,0,0]=3 3885 B9R1.69 Nc1ncc(c(c1)C)O 1P0098HF [0,2,0,0,0,0|1,0,0]=3 3886 B9R1.69 Nc1ncc(c(c1)Cl)Br 1P005ZOQ [0,2,0,0,0,0|1,0,0]=3 3887 B9R1.69 Nc1ncc(c(c1)Cl)C 1P008ZKE [0,2,0,0,0,0|1,0,0]=3 3888 B9R1.69 Nc1ncc(c(c1)Cl)Cl 1P002HH9 [0,2,0,0,0,0|1,0,0]=3 3889 B9R1.69 Nc1ncc(c(c1)Cl)I 1P005RV0 [0,2,0,0,0,0|1,0,0]=3 3890 B9R1.69 Nc1ncc(c(c1)F)Br 1P00IIMV [0,2,0,0,0,0|1,0,0]=3 3891 B9R1.69 Nc1ncc(c(c1)F)C 1P01KLA4 [0,2,0,0,0,0|1,0,0]=3 3892 B9R1.69 Nc1ncc(c(c1)F)Cl 1P01FPE1 [0,2,0,0,0,0|1,0,0]=3 3893 B9R1.69 Nc1ncc(c(c1)F)F 1P009WCW [0,2,0,0,0,0|1,0,0]=3 3894 B9R1.69 Nc1ncc(c(c1)F)I 1P00ATGX [0,2,0,0,0,0|1,0,0]=3 3895 B9R1.69 Nc1ncc(c(c1)F)O 1P01XC8A [0,2,0,0,0,0|1,0,0]=3 3896 B9R1.69 Nc1ncc(c(c1)I)C 1P000JTI [0,2,0,0,0,0|1,0,0]=3 3897 B9R1.69 Nc1ncc(c(c1)I)Cl 1P000RHX [0,2,0,0,0,0|1,0,0]=3 3898 B9R1.69 Nc1ncc(c(c1)I)F 1P001VN1 [0,2,0,0,0,0|1,0,0]=3 3899 B9R1.69 Nc1ncc(c(c1)N)Br 1P000QYJ [0,2,0,0,0,0|0,0,0]=2 3900 B9R1.69 Nc1ncc(c(c1)N)F 1P028CPQ [0,2,0,0,0,0|0,0,0]=2 3901 B9R1.69 Nc1ncc(c(c1)N)N 1P002N4B [0,2,0,0,0,0|0,0,0]=2 3902 B9R1.69 Nc1ncc(c(c1)O)Br 1P01BCNX [0,2,0,0,0,0|1,0,0]=3 3903 B9R1.69 Nc1ncc(c(c1)O)Cl 1P019STN [0,2,0,0,0,0|1,0,0]=3 3904 B9R1.69 Nc1ncc(c(n1)Br)Br 1P0284U8 [0,2,0,0,0,0|2,0,0]=4 3905 B9R1.69 Nc1ncc(c(n1)Br)C 1P000MPX [0,2,0,0,0,0|2,0,0]=4 3906 B9R1.69 Nc1ncc(c(n1)C)Br 1P001Z6F [0,2,0,0,0,0|2,0,0]=4 3907 B9R1.69 Nc1ncc(c(n1)C)C 1P000J0I [0,2,0,0,0,0|2,0,0]=4 3908 B9R1.69 Nc1ncc(c(n1)C)Cl 1P00CMIC [0,2,0,0,0,0|2,0,0]=4 3909 B9R1.69 Nc1ncc(c(n1)C)I 1P00BK9G [0,2,0,0,0,0|2,0,0]=4 3910 B9R1.69 Nc1ncc(c(n1)Cl)Br 1P0039GU [0,2,0,0,0,0|2,0,0]=4 3911 B9R1.69 Nc1ncc(c(n1)Cl)C 1P002DJT [0,2,0,0,0,0|2,0,0]=4 3912 B9R1.69 Nc1ncc(c(n1)Cl)Cl 1P003978 [0,2,0,0,0,0|2,0,0]=4 3913 B9R1.69 Nc1ncc(c(n1)Cl)F 1P001YHM [0,2,0,0,0,0|2,0,0]=4 3914 B9R1.69 Nc1ncc(c(n1)Cl)I 1P00I8AR [0,2,0,0,0,0|2,0,0]=4 3915 B9R1.69 Nc1ncc(c(n1)F)Cl 1P0286GN [0,2,0,0,0,0|2,0,0]=4 3916 B9R1.69 Nc1ncc(c(n1)N)Br 1P0002D4 [0,2,0,0,0,0|1,0,0]=3 3917 B9R1.69 Nc1ncc(c(n1)N)Cl 1P00AT8T [0,2,0,0,0,0|1,0,0]=3 3918 B9R1.69 Nc1ncc(c(n1)N)F 1P001O0G [0,2,0,0,0,0|1,0,0]=3 3919 B9R1.69 Nc1ncc(c(n1)N)I 1P00HYXG [0,2,0,0,0,0|1,0,0]=3 3920 B9R1.69 Nc1ncc(c(n1)N)N 1P00I7I3 [0,2,0,0,0,0|1,0,0]=3 3921 B9R1.69 Nc1ncc(c(n1)N)O 1P001GF6 [0,2,0,0,0,0|1,0,0]=3 3922 B9R1.69 Nc1ncn(c(=O)c1)C 1P00HCTS [0,2,0,0,0,0|1,0,1]=4 3923 B9R1.69 Nc1nnc(c(c1)C)C 1P01AJ0W [0,2,0,0,0,0|2,0,0]=4 3924 B9R1.69 Nc1nnc(c(c1)C)Cl 1P00390P [0,2,0,0,0,0|2,0,0]=4 3925 B9R1.69 O=C1C=CC(=O)C(=C1)Br 1P003H2P [0,2,0,0,0,0|2,0,0]=4 3926 B9R1.69 O=C1C=CC(=O)C(=C1)C 1P00IABX [0,2,0,0,0,0|2,0,0]=4 3927 B9R1.69 O=C1C=CC(=O)C(=C1)Cl 1P003HB5 [0,2,0,0,0,0|2,0,0]=4 3928 B9R1.69 O=C1C=CC(=O)C(=C1)I 1P00CZBP [0,2,0,0,0,0|2,0,0]=4 3929 B9R1.69 O=C1N=NC(=O)C(=C1)C 1P00629C [0,2,0,0,0,0|2,0,0]=4 3930 B9R1.69 O=c1cc(C)[nH]cc1O 1P005SX1 [0,2,0,0,0,0|1,0,1]=4 3931 B9R1.69 O=c1occ(c(c1)Cl)Br 1P027X7O [0,2,0,0,0,0|2,0,0]=4 3932 B9R1.69 Oc1ccc(c(c1)Br)C 1P003JIZ [0,2,0,0,0,0|2,0,0]=4 3933 B9R1.69 Oc1ccc(c(c1)Br)Cl 1P0012LD [0,2,0,0,0,0|2,0,0]=4 3934 B9R1.69 Oc1ccc(c(c1)Br)F 1P00342W [0,2,0,0,0,0|2,0,0]=4 3935 B9R1.69 Oc1ccc(c(c1)Br)I 1P003AVN [0,2,0,0,0,0|2,0,0]=4 3936 B9R1.69 Oc1ccc(c(c1)Br)N 1P0036ZQ [0,2,0,0,0,0|1,0,0]=3 3937 B9R1.69 Oc1ccc(c(c1)Br)O 1P003P18 [0,2,0,0,0,0|2,0,0]=4 3938 B9R1.69 Oc1ccc(c(c1)C)Br 1P001KJY [0,2,0,0,0,0|2,0,0]=4 3939 B9R1.69 Oc1ccc(c(c1)C)C 1P003IZJ [0,2,0,0,0,0|2,0,0]=4 3940 B9R1.69 Oc1ccc(c(c1)C)F 1P003LV0 [0,2,0,0,0,0|2,0,0]=4 3941 B9R1.69 Oc1ccc(c(c1)C)I 1P007N48 [0,2,0,0,0,0|2,0,0]=4 3942 B9R1.69 Oc1ccc(c(c1)C)N 1P003L83 [0,2,0,0,0,0|1,0,0]=3 3943 B9R1.69 Oc1ccc(c(c1)C)O 1P003I66 [0,2,0,0,0,0|2,0,0]=4 3944 B9R1.69 Oc1ccc(c(c1)Cl)Br 1P007N4R [0,2,0,0,0,0|2,0,0]=4 3945 B9R1.69 Oc1ccc(c(c1)Cl)C 1P00344J [0,2,0,0,0,0|2,0,0]=4 3946 B9R1.69 Oc1ccc(c(c1)Cl)Cl 1P003IX0 [0,2,0,0,0,0|2,0,0]=4 3947 B9R1.69 Oc1ccc(c(c1)Cl)F 1P002S9C [0,2,0,0,0,0|2,0,0]=4 3948 B9R1.69 Oc1ccc(c(c1)Cl)I 1P00344G [0,2,0,0,0,0|2,0,0]=4 3949 B9R1.69 Oc1ccc(c(c1)Cl)N 1P0021W8 [0,2,0,0,0,0|1,0,0]=3 3950 B9R1.69 Oc1ccc(c(c1)Cl)N 1P003L61 [0,2,0,0,0,0|1,0,0]=3 3951 B9R1.69 Oc1ccc(c(c1)Cl)O 1P0033PT [0,2,0,0,0,0|2,0,0]=4 3952 B9R1.69 Oc1ccc(c(c1)F)Br 1P0034EG [0,2,0,0,0,0|2,0,0]=4 3953 B9R1.69 Oc1ccc(c(c1)F)C 1P003JX1 [0,2,0,0,0,0|2,0,0]=4 3954 B9R1.69 Oc1ccc(c(c1)F)Cl 1P003LLG [0,2,0,0,0,0|2,0,0]=4 3955 B9R1.69 Oc1ccc(c(c1)F)F 1P003IXT [0,2,0,0,0,0|2,0,0]=4 3956 B9R1.69 Oc1ccc(c(c1)F)I 1P000K9C [0,2,0,0,0,0|2,0,0]=4 3957 B9R1.69 Oc1ccc(c(c1)F)N 1P0024IU [0,2,0,0,0,0|1,0,0]=3 3958 B9R1.69 Oc1ccc(c(c1)F)N 1P0034CY [0,2,0,0,0,0|1,0,0]=3 3959 B9R1.69 Oc1ccc(c(c1)F)O 1P0033SB [0,2,0,0,0,0|2,0,0]=4 3960 B9R1.69 Oc1ccc(c(c1)I)C 1P00EIPO [0,2,0,0,0,0|2,0,0]=4 3961 B9R1.69 Oc1ccc(c(c1)I)Cl 1P002929 [0,2,0,0,0,0|2,0,0]=4 3962 B9R1.69 Oc1ccc(c(c1)I)N 1P00FH5V [0,2,0,0,0,0|1,0,0]=3 3963 B9R1.69 Oc1ccc(c(c1)I)N 1P01BDT2 [0,2,0,0,0,0|1,0,0]=3 3964 B9R1.69 Oc1ccc(c(c1)N)Br 1P000269 [0,2,0,0,0,0|1,0,0]=3 3965 B9R1.69 Oc1ccc(c(c1)N)C 1P00I5SA [0,2,0,0,0,0|1,0,0]=3 3966 B9R1.69 Oc1ccc(c(c1)N)Cl 1P001SA8 [0,2,0,0,0,0|1,0,0]=3 3967 B9R1.69 Oc1ccc(c(c1)N)F 1P003JC8 [0,2,0,0,0,0|1,0,0]=3 3968 B9R1.69 Oc1ccc(c(c1)N)N 1P00EKSG [0,2,0,0,0,0|1,0,0]=3 3969 B9R1.69 Oc1ccc(c(c1)N)N 1P01DE8U [0,2,0,0,0,0|1,0,0]=3 3970 B9R1.69 Oc1ccc(c(c1)N)O 1P01E45U [0,2,0,0,0,0|1,0,0]=3 3971 B9R1.69 Oc1ccc(c(c1)O)Br 1P003LHU [0,2,0,0,0,0|2,0,0]=4 3972 B9R1.69 Oc1ccc(c(c1)O)C 1P00DCZM [0,2,0,0,0,0|2,0,0]=4 3973 B9R1.69 Oc1ccc(c(c1)O)Cl 1P0034H4 [0,2,0,0,0,0|2,0,0]=4 3974 B9R1.69 Oc1ccc(c(c1)O)F 1P0034HK [0,2,0,0,0,0|2,0,0]=4 3975 B9R1.69 Oc1ccc(c(c1)O)N 1P003L7I [0,2,0,0,0,0|1,0,0]=3 3976 B9R1.69 Oc1ccc(c(c1)O)O 1P003DRY [0,2,0,0,0,0|2,0,0]=4 3977 B9R1.69 Oc1ccc(c(c1)S)Cl 1P0284IP [0,2,0,0,0,0|2,0,0]=4 3978 B9R1.69 Oc1ccc(c(c1)S)O 1P002XFY [0,2,0,0,0,0|2,0,0]=4 3979 B9R1.69 Oc1ccc(c(n1)Cl)N 1P009YMS [0,2,0,0,0,0|2,0,0]=4 3980 B9R1.69 Oc1ccn(c(=O)c1)C 1P0034II [0,2,0,0,0,0|1,0,1]=4 3981 B9R1.69 Oc1cnc(c(c1)C)N 1P00BBO2 [0,2,0,0,0,0|2,0,0]=4 3982 B9R1.69 Oc1cnc(c(c1)Cl)N 1P002KMN [0,2,0,0,0,0|2,0,0]=4 3983 B9R1.69 Oc1cnc(c(c1)F)N 1P01BSND [0,2,0,0,0,0|2,0,0]=4 3984 B9R1.69 Oc1cnc(c(c1)N)Cl 1P01X83J [0,2,0,0,0,0|2,0,0]=4 3985 B9R1.69 Oc1ncc(c(c1)Br)C 1P00IN6W [0,2,0,0,0,0|1,0,0]=3 3986 B9R1.69 Oc1ncc(c(c1)Br)Cl 1P01FV1O [0,2,0,0,0,0|1,0,0]=3 3987 B9R1.69 Oc1ncc(c(c1)C)Br 1P007BY9 [0,2,0,0,0,0|1,0,0]=3 3988 B9R1.69 Oc1ncc(c(c1)C)Cl 1P004AIE [0,2,0,0,0,0|1,0,0]=3 3989 B9R1.69 Oc1ncc(c(c1)C)I 1P00IINR [0,2,0,0,0,0|1,0,0]=3 3990 B9R1.69 Oc1ncc(c(c1)C)N 1P00IIWT [0,2,0,0,0,0|1,0,0]=3 3991 B9R1.69 Oc1ncc(c(c1)F)Br 1P01FRHQ [0,2,0,0,0,0|1,0,0]=3 3992 B9R1.69 Oc1ncc(c(c1)F)N 1P01BS6M [0,2,0,0,0,0|1,0,0]=3 3993 B9R1.69 Oc1ncc(c(c1)I)Cl 1P0099VP [0,2,0,0,0,0|1,0,0]=3 3994 B9R1.69 Oc1ncc(c(c1)O)Cl 1P0039GM [0,2,0,0,0,0|1,0,0]=3 3995 B9R1.69 Oc1ncc(c(n1)C)C 1P00J2RO [0,2,0,0,0,0|2,0,0]=4 3996 B9R1.69 Oc1nnc(c(c1)Br)O 1P01FPB4 [0,2,0,0,0,0|2,0,0]=4 3997 B9R1.69 Oc1nnc(c(c1)C)Cl 1P0039DP [0,2,0,0,0,0|2,0,0]=4 3998 B9R1.69 Oc1nnc(c(c1)C)O 1P003J75 [0,2,0,0,0,0|2,0,0]=4 3999 B9R1.69 Sc1ccc(c(c1)Br)C 1P01B6M7 [0,2,0,0,0,0|2,0,0]=4 4000 B9R1.69 Sc1ccc(c(c1)Br)Cl 1P01B33T [0,2,0,0,0,0|2,0,0]=4 4001 B9R1.69 Sc1ccc(c(c1)Br)F 1P00H2Y8 [0,2,0,0,0,0|2,0,0]=4 4002 B9R1.69 Sc1ccc(c(c1)C)Br 1P00AXJ7 [0,2,0,0,0,0|2,0,0]=4 4003 B9R1.69 Sc1ccc(c(c1)C)C 1P002H3X [0,2,0,0,0,0|2,0,0]=4 4004 B9R1.69 Sc1ccc(c(c1)C)O 1P00I6L4 [0,2,0,0,0,0|2,0,0]=4 4005 B9R1.69 Sc1ccc(c(c1)Cl)Cl 1P003IX7 [0,2,0,0,0,0|2,0,0]=4 4006 B9R1.69 Sc1ccc(c(c1)Cl)F 1P003JOT [0,2,0,0,0,0|2,0,0]=4 4007 B9R1.69 Sc1ccc(c(c1)F)Br 1P00IIGP [0,2,0,0,0,0|2,0,0]=4 4008 B9R1.69 Sc1ccc(c(c1)F)C 1P00EDES [0,2,0,0,0,0|2,0,0]=4 4009 B9R1.69 Sc1ccc(c(c1)F)Cl 1P01C4ZM [0,2,0,0,0,0|2,0,0]=4 4010 B9R1.69 Sc1ccc(c(c1)F)F 1P0033Z8 [0,2,0,0,0,0|2,0,0]=4 4011 B9R1.69 Sc1ccc(c(c1)F)N 1P007EH8 [0,2,0,0,0,0|1,0,0]=3 4012 B9R1.69 Sc1ccc(c(c1)O)Cl 1P0291L2 [0,2,0,0,0,0|2,0,0]=4 4013 B9R1.69 Sc1ncc(c(n1)S)C 1P00F3YQ [0,2,0,0,0,0|2,0,0]=4 4014 B9R1.69 [O-][n+]1ccc(c(c1)C)Br 1P0005NW [0,2,0,0,0,0|1,0,1]=4 4015 B9R1.69 [O-][n+]1ccc(c(c1)C)Cl 1P007F4E [0,2,0,0,0,0|1,0,1]=4 4016 B9R1.69 [O-][n+]1ccc(c(c1)N)F 1P028BT4 [0,2,0,0,0,0|1,0,1]=4 4017 B9R1.69 [O-][n+]1ccc(c(c1)N)N 1P0061A3 [0,2,0,0,0,0|0,0,1]=3 4018 B9R1.3 Brc1c(Br)cn[nH]c1=O 1P003KY1 [0,2,0,0,0,0|2,0,0]=4 4019 B9R1.3 Brc1c(Br)cnnc1Br 1P01ENKD [0,2,0,0,0,0|2,0,0]=4 4020 B9R1.3 Brc1c(C)cccc1Br 1P00EH6S [0,2,0,0,0,0|2,0,0]=4 4021 B9R1.3 Brc1c(C)cccc1Cl 1P00ICDG [0,2,0,0,0,0|2,0,0]=4 4022 B9R1.3 Brc1c(C)cccc1F 1P003H3J [0,2,0,0,0,0|2,0,0]=4 4023 B9R1.3 Brc1c(C)cccc1I 1P008BA3 [0,2,0,0,0,0|2,0,0]=4 4024 B9R1.3 Brc1c(C)cccc1N 1P0033LR [0,2,0,0,0,0|1,0,0]=3 4025 B9R1.3 Brc1c(C)cccc1O 1P0033LS [0,2,0,0,0,0|2,0,0]=4 4026 B9R1.3 Brc1c(C)ccnc1Br 1P00GUFL [0,2,0,0,0,0|1,0,0]=3 4027 B9R1.3 Brc1c(C)ccnc1C 1P00386X [0,2,0,0,0,0|1,0,0]=3 4028 B9R1.3 Brc1c(C)cncc1Cl 1P024I4Z [0,2,0,0,0,0|1,0,0]=3 4029 B9R1.3 Brc1c(C)cncc1N 1P0288OY [0,2,0,0,0,0|1,0,0]=3 4030 B9R1.3 Brc1c(C)cncc1O 1P00PRV9 [0,2,0,0,0,0|1,0,0]=3 4031 B9R1.3 Brc1c(C)ncnc1Cl 1P003MZT [0,2,0,0,0,0|2,0,0]=4 4032 B9R1.3 Brc1c(C)ncnc1N 1P0059M9 [0,2,0,0,0,0|1,0,0]=3 4033 B9R1.3 Brc1c(C)ncnc1O 1P003N01 [0,2,0,0,0,0|2,0,0]=4 4034 B9R1.3 Brc1c(Cl)cccc1I 1P00132Q [0,2,0,0,0,0|2,0,0]=4 4035 B9R1.3 Brc1c(Cl)ccnc1Cl 1P001K9I [0,2,0,0,0,0|1,0,0]=3 4036 B9R1.3 Brc1c(F)cccc1Cl 1P00329C [0,2,0,0,0,0|2,0,0]=4 4037 B9R1.3 Brc1c(F)cccc1I 1P00G4XM [0,2,0,0,0,0|2,0,0]=4 4038 B9R1.3 Brc1c(F)ccnc1F 1P000JQK [0,2,0,0,0,0|1,0,0]=3 4039 B9R1.3 Brc1c(F)cncc1Br 1P000RWD [0,2,0,0,0,0|1,0,0]=3 4040 B9R1.3 Brc1c(F)cncc1Cl 1P01DN4H [0,2,0,0,0,0|1,0,0]=3 4041 B9R1.3 Brc1c(F)ncnc1Cl 1P028A1U [0,2,0,0,0,0|2,0,0]=4 4042 B9R1.3 Brc1c(N)cccc1Cl 1P00374G [0,2,0,0,0,0|1,0,0]=3 4043 B9R1.3 Brc1c(N)cccc1F 1P003H3F [0,2,0,0,0,0|1,0,0]=3 4044 B9R1.3 Brc1c(N)cccc1F 1P009MMR [0,2,0,0,0,0|1,0,0]=3 4045 B9R1.3 Brc1c(N)cccc1I 1P01FHWR [0,2,0,0,0,0|1,0,0]=3 4046 B9R1.3 Brc1c(N)cccc1O 1P00026A [0,2,0,0,0,0|1,0,0]=3 4047 B9R1.3 Brc1c(N)cncc1Br 1P01A4HQ [0,2,0,0,0,0|1,0,0]=3 4048 B9R1.3 Brc1c(N)cncc1Cl 1P01BAA2 [0,2,0,0,0,0|1,0,0]=3 4049 B9R1.3 Brc1c(N)cncc1Cl 1P02850A [0,2,0,0,0,0|1,0,0]=3 4050 B9R1.3 Brc1c(N)cncc1F 1P028SKB [0,2,0,0,0,0|1,0,0]=3 4051 B9R1.3 Brc1c(N)ncnc1Cl 1P0037AZ [0,2,0,0,0,0|1,0,0]=3 4052 B9R1.3 Brc1c(O)cccc1Cl 1P0038V8 [0,2,0,0,0,0|2,0,0]=4 4053 B9R1.3 Brc1c(O)cccc1F 1P0033LO [0,2,0,0,0,0|2,0,0]=4 4054 B9R1.3 Brc1c(O)cccc1I 1P004OSU [0,2,0,0,0,0|2,0,0]=4 4055 B9R1.3 Brc1c(O)cncc1Cl 1P009MCO [0,2,0,0,0,0|1,0,0]=3 4056 B9R1.3 Brc1c(O)cncc1F 1P028549 [0,2,0,0,0,0|1,0,0]=3 4057 B9R1.3 Brc1c[nH]cc(c1=O)Br 1P00BE77 [0,2,0,0,0,0|1,0,1]=4 4058 B9R1.3 Brc1cc[nH]c(=O)c1C 1P000JSE [0,2,0,0,0,0|1,0,1]=4 4059 B9R1.3 Brc1cccc(c1C)Br 1P00372T [0,2,0,0,0,0|2,0,0]=4 4060 B9R1.3 Brc1cccc(c1Cl)Br 1P002GAB [0,2,0,0,0,0|2,0,0]=4 4061 B9R1.3 Brc1cccc(c1F)Br 1P0038QZ [0,2,0,0,0,0|2,0,0]=4 4062 B9R1.3 Brc1cccc(c1I)Br 1P002BTO [0,2,0,0,0,0|2,0,0]=4 4063 B9R1.3 Brc1cccc(c1N)Br 1P0037VT [0,2,0,0,0,0|1,0,0]=3 4064 B9R1.3 Brc1cccc(c1O)Br 1P003GJ5 [0,2,0,0,0,0|2,0,0]=4 4065 B9R1.3 Brc1ccnc(c1C)Cl 1P000Y6W [0,2,0,0,0,0|1,0,0]=3 4066 B9R1.3 Brc1ccnc(c1C)F 1P000Y6Y [0,2,0,0,0,0|1,0,0]=3 4067 B9R1.3 Brc1ccnc(c1C)N 1P000JT5 [0,2,0,0,0,0|1,0,0]=3 4068 B9R1.3 Brc1ccnc(c1Cl)C 1P01FM2S [0,2,0,0,0,0|1,0,0]=3 4069 B9R1.3 Brc1ccnc(c1Cl)F 1P000616 [0,2,0,0,0,0|1,0,0]=3 4070 B9R1.3 Brc1ccnc(c1Cl)N 1P00H0LY [0,2,0,0,0,0|1,0,0]=3 4071 B9R1.3 Brc1ccnc(c1Cl)O 1P01EMQV [0,2,0,0,0,0|1,0,0]=3 4072 B9R1.3 Brc1ccnc(c1F)C 1P009I34 [0,2,0,0,0,0|1,0,0]=3 4073 B9R1.3 Brc1ccnc(c1F)Cl 1P009MBY [0,2,0,0,0,0|1,0,0]=3 4074 B9R1.3 Brc1ccnc(c1F)N 1P020JJ1 [0,2,0,0,0,0|1,0,0]=3 4075 B9R1.3 Brc1ccnc(c1I)Cl 1P006G2O [0,2,0,0,0,0|1,0,0]=3 4076 B9R1.3 Brc1ccnc(c1I)F 1P006B1G [0,2,0,0,0,0|1,0,0]=3 4077 B9R1.3 Brc1ccnc(c1I)N 1P016OD9 [0,2,0,0,0,0|1,0,0]=3 4078 B9R1.3 Brc1ccnc(c1N)C 1P000T16 [0,2,0,0,0,0|1,0,0]=3 4079 B9R1.3 Brc1ccnc(c1N)Cl 1P00HULP [0,2,0,0,0,0|1,0,0]=3 4080 B9R1.3 Brc1ccnc(c1N)O 1P02930C [0,2,0,0,0,0|1,0,0]=3 4081 B9R1.3 Brc1ccnc(c1O)Cl 1P00HGG2 [0,2,0,0,0,0|1,0,0]=3 4082 B9R1.3 Brc1ccnc(c1O)N 1P000BKZ [0,2,0,0,0,0|1,0,0]=3 4083 B9R1.3 Brc1ccnc(c1O)N 1P000BQF [0,2,0,0,0,0|1,0,0]=3 4084 B9R1.3 Brc1cncc(c1C)Br 1P003J1R [0,2,0,0,0,0|1,0,0]=3 4085 B9R1.3 Brc1cncc(c1Cl)Br 1P009GZO [0,2,0,0,0,0|1,0,0]=3 4086 B9R1.3 Brc1cncc(c1I)Br 1P00A160 [0,2,0,0,0,0|1,0,0]=3 4087 B9R1.3 Brc1cncc(c1N)Br 1P003L5K [0,2,0,0,0,0|0,0,0]=2 4088 B9R1.3 Brc1cncc(c1O)Br 1P003J1P [0,2,0,0,0,0|1,0,0]=3 4089 B9R1.3 Brc1cncc(c1[O-])Br 1P001GSP [0,2,0,0,0,0|1,0,0]=3 4090 B9R1.3 Brc1ncnc(c1Cl)Br 1P01FKYG [0,2,0,0,0,0|2,0,0]=4 4091 B9R1.3 Cc1c(=O)cc[nH]c1C 1P01BBX5 [0,2,0,0,0,0|1,0,1]=4 4092 B9R1.3 Cc1c(Br)cccc1I 1P0038ZO [0,2,0,0,0,0|2,0,0]=4 4093 B9R1.3 Cc1c(Br)ccnc1Br 1P000Y6U [0,2,0,0,0,0|1,0,0]=3 4094 B9R1.3 Cc1c(Br)ccnc1C 1P002RRG [0,2,0,0,0,0|1,0,0]=3 4095 B9R1.3 Cc1c(Br)ccnc1C 1P01EI7S [0,2,0,0,0,0|1,0,0]=3 4096 B9R1.3 Cc1c(Br)cncc1I 1P018BQ3 [0,2,0,0,0,0|1,0,0]=3 4097 B9R1.3 Cc1c(C)cc[nH]c1=N 1P003GTM [0,2,0,0,0,0|1,0,1]=4 4098 B9R1.3 Cc1c(C)cc[nH]c1=O 1P00CJAV [0,2,0,0,0,0|1,0,1]=4 4099 B9R1.3 Cc1c(C)cccc1Br 1P0033EW [0,2,0,0,0,0|2,0,0]=4 4100 B9R1.3 Cc1c(C)cccc1C 1P003DRG [0,2,0,0,0,0|2,0,0]=4 4101 B9R1.3 Cc1c(C)cccc1Cl 1P003JMR [0,2,0,0,0,0|2,0,0]=4 4102 B9R1.3 Cc1c(C)cccc1Cl 1P028GZ4 [0,2,0,0,0,0|2,0,0]=4 4103 B9R1.3 Cc1c(C)cccc1F 1P003JY3 [0,2,0,0,0,0|2,0,0]=4 4104 B9R1.3 Cc1c(C)cccc1I 1P003EW5 [0,2,0,0,0,0|2,0,0]=4 4105 B9R1.3 Cc1c(C)cccc1N 1P0033EU [0,2,0,0,0,0|1,0,0]=3 4106 B9R1.3 Cc1c(C)cccc1N 1P003G0V [0,2,0,0,0,0|1,0,0]=3 4107 B9R1.3 Cc1c(C)cccc1O 1P000UCK [0,2,0,0,0,0|2,0,0]=4 4108 B9R1.3 Cc1c(C)cccc1S 1P002H3Y [0,2,0,0,0,0|2,0,0]=4 4109 B9R1.3 Cc1c(C)ccnc1Br 1P00CJBW [0,2,0,0,0,0|1,0,0]=3 4110 B9R1.3 Cc1c(C)ccnc1Cl 1P00FFVC [0,2,0,0,0,0|1,0,0]=3 4111 B9R1.3 Cc1c(C)cncc1Br 1P007MH8 [0,2,0,0,0,0|1,0,0]=3 4112 B9R1.3 Cc1c(C)cncc1C 1P002AT3 [0,2,0,0,0,0|1,0,0]=3 4113 B9R1.3 Cc1c(C)cncc1N 1P01BK1Z [0,2,0,0,0,0|1,0,0]=3 4114 B9R1.3 Cc1c(C)cncc1N 1P028A7P [0,2,0,0,0,0|1,0,0]=3 4115 B9R1.3 Cc1c(C)cnnc1Cl 1P024SHX [0,2,0,0,0,0|2,0,0]=4 4116 B9R1.3 Cc1c(C)ncnc1Cl 1P003LM8 [0,2,0,0,0,0|2,0,0]=4 4117 B9R1.3 Cc1c(C)ncnc1N 1P00DDMJ [0,2,0,0,0,0|1,0,0]=3 4118 B9R1.3 Cc1c(C)ncnc1O 1P00C5RZ [0,2,0,0,0,0|2,0,0]=4 4119 B9R1.3 Cc1c(Cl)cccc1Br 1P00E9KV [0,2,0,0,0,0|2,0,0]=4 4120 B9R1.3 Cc1c(Cl)cccc1I 1P003BO3 [0,2,0,0,0,0|2,0,0]=4 4121 B9R1.3 Cc1c(Cl)ccnc1C 1P00D4T4 [0,2,0,0,0,0|1,0,0]=3 4122 B9R1.3 Cc1c(Cl)ccnc1Cl 1P0010NB [0,2,0,0,0,0|1,0,0]=3 4123 B9R1.3 Cc1c(Cl)cncc1Br 1P000R5X [0,2,0,0,0,0|1,0,0]=3 4124 B9R1.3 Cc1c(Cl)cncc1I 1P01B24N [0,2,0,0,0,0|1,0,0]=3 4125 B9R1.3 Cc1c(F)cccc1Br 1P001IF1 [0,2,0,0,0,0|2,0,0]=4 4126 B9R1.3 Cc1c(F)cccc1Cl 1P0033PG [0,2,0,0,0,0|2,0,0]=4 4127 B9R1.3 Cc1c(F)cccc1I 1P003HRN [0,2,0,0,0,0|2,0,0]=4 4128 B9R1.3 Cc1c(F)cccc1S 1P01FFLY [0,2,0,0,0,0|2,0,0]=4 4129 B9R1.3 Cc1c(F)ccnc1F 1P01K02Y [0,2,0,0,0,0|1,0,0]=3 4130 B9R1.3 Cc1c(F)cncc1Br 1P003JJI [0,2,0,0,0,0|1,0,0]=3 4131 B9R1.3 Cc1c(N)cccc1Br 1P00342M [0,2,0,0,0,0|1,0,0]=3 4132 B9R1.3 Cc1c(N)cccc1Cl 1P003451 [0,2,0,0,0,0|1,0,0]=3 4133 B9R1.3 Cc1c(N)cccc1Cl 1P003GYZ [0,2,0,0,0,0|1,0,0]=3 4134 B9R1.3 Cc1c(N)cccc1F 1P003JVW [0,2,0,0,0,0|1,0,0]=3 4135 B9R1.3 Cc1c(N)cccc1F 1P00EW8F [0,2,0,0,0,0|1,0,0]=3 4136 B9R1.3 Cc1c(N)cccc1I 1P007CZJ [0,2,0,0,0,0|1,0,0]=3 4137 B9R1.3 Cc1c(N)cccc1O 1P003JB8 [0,2,0,0,0,0|1,0,0]=3 4138 B9R1.3 Cc1c(N)ccnc1C 1P0017RO [0,2,0,0,0,0|0,0,0]=2 4139 B9R1.3 Cc1c(N)cncc1Br 1P008H4R [0,2,0,0,0,0|1,0,0]=3 4140 B9R1.3 Cc1c(N)cncc1Cl 1P01A21N [0,2,0,0,0,0|1,0,0]=3 4141 B9R1.3 Cc1c(N)ncnc1Cl 1P001J42 [0,2,0,0,0,0|1,0,0]=3 4142 B9R1.3 Cc1c(N)ncnc1F 1P0024HB [0,2,0,0,0,0|1,0,0]=3 4143 B9R1.3 Cc1c(O)cccc1Br 1P003AAL [0,2,0,0,0,0|2,0,0]=4 4144 B9R1.3 Cc1c(O)cccc1Cl 1P00BY9G [0,2,0,0,0,0|2,0,0]=4 4145 B9R1.3 Cc1c(O)cccc1F 1P003JVZ [0,2,0,0,0,0|2,0,0]=4 4146 B9R1.3 Cc1c(O)ccnc1C 1P01ENHN [0,2,0,0,0,0|1,0,0]=3 4147 B9R1.3 Cc1c(O)cncc1Br 1P00CRDD [0,2,0,0,0,0|1,0,0]=3 4148 B9R1.3 Cc1c(S)cccc1Cl 1P01BL0W [0,2,0,0,0,0|2,0,0]=4 4149 B9R1.3 Cc1c[nH]cc(c1=O)Br 1P01E82R [0,2,0,0,0,0|1,0,1]=4 4150 B9R1.3 Cc1c[nH]cc(c1=O)Br 1P028XFZ [0,2,0,0,0,0|1,0,1]=4 4151 B9R1.3 Cc1cc[nH]c(=O)c1Br 1P00342K [0,2,0,0,0,0|1,0,1]=4 4152 B9R1.3 Cc1cccc(c1Br)C 1P0033NA [0,2,0,0,0,0|2,0,0]=4 4153 B9R1.3 Cc1cccc(c1Cl)C 1P0033NW [0,2,0,0,0,0|2,0,0]=4 4154 B9R1.3 Cc1cccc(c1F)C 1P003GMC [0,2,0,0,0,0|2,0,0]=4 4155 B9R1.3 Cc1cccc(c1I)C 1P0033TQ [0,2,0,0,0,0|2,0,0]=4 4156 B9R1.3 Cc1cccc(c1N)C 1P0033II [0,2,0,0,0,0|1,0,0]=3 4157 B9R1.3 Cc1cccc(c1N)C 1P008EWO [0,2,0,0,0,0|1,0,0]=3 4158 B9R1.3 Cc1cccc(c1O)C 1P003GME [0,2,0,0,0,0|2,0,0]=4 4159 B9R1.3 Cc1cccc(c1S)C 1P003GM7 [0,2,0,0,0,0|2,0,0]=4 4160 B9R1.3 Cc1ccnc(c1Br)Cl 1P003A46 [0,2,0,0,0,0|1,0,0]=3 4161 B9R1.3 Cc1ccnc(c1Br)F 1P008D3U [0,2,0,0,0,0|1,0,0]=3 4162 B9R1.3 Cc1ccnc(c1Br)I 1P027UI5 [0,2,0,0,0,0|1,0,0]=3 4163 B9R1.3 Cc1ccnc(c1Br)N 1P003GTY [0,2,0,0,0,0|1,0,0]=3 4164 B9R1.3 Cc1ccnc(c1Cl)Br 1P00H1MC [0,2,0,0,0,0|1,0,0]=3 4165 B9R1.3 Cc1ccnc(c1Cl)N 1P00EDC0 [0,2,0,0,0,0|1,0,0]=3 4166 B9R1.3 Cc1ccnc(c1F)Br 1P00GS0H [0,2,0,0,0,0|1,0,0]=3 4167 B9R1.3 Cc1ccnc(c1F)Cl 1P003HC1 [0,2,0,0,0,0|1,0,0]=3 4168 B9R1.3 Cc1ccnc(c1F)I 1P027E61 [0,2,0,0,0,0|1,0,0]=3 4169 B9R1.3 Cc1ccnc(c1F)N 1P008UW8 [0,2,0,0,0,0|1,0,0]=3 4170 B9R1.3 Cc1ccnc(c1F)N 1P027U0P [0,2,0,0,0,0|1,0,0]=3 4171 B9R1.3 Cc1ccnc(c1I)Br 1P004K0E [0,2,0,0,0,0|1,0,0]=3 4172 B9R1.3 Cc1ccnc(c1I)Cl 1P00H1GY [0,2,0,0,0,0|1,0,0]=3 4173 B9R1.3 Cc1ccnc(c1I)N 1P000JQD [0,2,0,0,0,0|1,0,0]=3 4174 B9R1.3 Cc1ccnc(c1N)Br 1P000T15 [0,2,0,0,0,0|1,0,0]=3 4175 B9R1.3 Cc1ccnc(c1N)Cl 1P003JB3 [0,2,0,0,0,0|1,0,0]=3 4176 B9R1.3 Cc1ccnc(c1N)F 1P001ZDB [0,2,0,0,0,0|1,0,0]=3 4177 B9R1.3 Cc1ccnc(c1N)O 1P00C7KX [0,2,0,0,0,0|1,0,0]=3 4178 B9R1.3 Cc1ccnc(c1O)Br 1P000JSH [0,2,0,0,0,0|1,0,0]=3 4179 B9R1.3 Cc1ccnc(c1O)Cl 1P008D46 [0,2,0,0,0,0|1,0,0]=3 4180 B9R1.3 Cc1ccnc(c1O)N 1P0029DG [0,2,0,0,0,0|1,0,0]=3 4181 B9R1.3 Cc1cn[nH]c(=O)c1Cl 1P024H5M [0,2,0,0,0,0|2,0,0]=4 4182 B9R1.3 Cc1cncc(c1Br)C 1P002DRJ [0,2,0,0,0,0|1,0,0]=3 4183 B9R1.3 Cc1cncc(c1Br)C 1P00J0PM [0,2,0,0,0,0|1,0,0]=3 4184 B9R1.3 Cc1cncc(c1Cl)C 1P00ACLY [0,2,0,0,0,0|1,0,0]=3 4185 B9R1.3 Cc1cncc(c1Cl)C 1P00ADTB [0,2,0,0,0,0|1,0,0]=3 4186 B9R1.3 Cc1cncc(c1N)C 1P003A9B [0,2,0,0,0,0|0,0,0]=2 4187 B9R1.3 Cc1nc[nH]c(=O)c1Cl 1P008PEH [0,2,0,0,0,0|2,0,0]=4 4188 B9R1.3 Cc1nc[nH]c(=O)c1N 1P028CGR [0,2,0,0,0,0|2,0,0]=4 4189 B9R1.3 Cc1ncnc(c1Br)C 1P001PUZ [0,2,0,0,0,0|2,0,0]=4 4190 B9R1.3 Cc1ncnc(c1N)C 1P00GV3Q [0,2,0,0,0,0|2,0,0]=4 4191 B9R1.3 Cc1ncnc(c1N)C 1P028EV9 [0,2,0,0,0,0|2,0,0]=4 4192 B9R1.3 Cc1ncnc(c1O)C 1P005W5O [0,2,0,0,0,0|2,0,0]=4 4193 B9R1.3 ClC1C=NC=C(C1=O)Cl 1P003J2T [0,2,0,0,0,0|1,0,1]=4 4194 B9R1.3 Clc1c(Br)cccc1I 1P01AVD8 [0,2,0,0,0,0|2,0,0]=4 4195 B9R1.3 Clc1c(Br)ccnc1Br 1P00GV2F [0,2,0,0,0,0|1,0,0]=3 4196 B9R1.3 Clc1c(Br)ccnc1Cl 1P0006YL [0,2,0,0,0,0|1,0,0]=3 4197 B9R1.3 Clc1c(C)cccc1Br 1P00IKE7 [0,2,0,0,0,0|2,0,0]=4 4198 B9R1.3 Clc1c(C)cccc1Cl 1P003FYN [0,2,0,0,0,0|2,0,0]=4 4199 B9R1.3 Clc1c(C)cccc1F 1P000DQG [0,2,0,0,0,0|2,0,0]=4 4200 B9R1.3 Clc1c(C)cccc1I 1P000DDT [0,2,0,0,0,0|2,0,0]=4 4201 B9R1.3 Clc1c(C)cccc1N 1P002VP6 [0,2,0,0,0,0|1,0,0]=3 4202 B9R1.3 Clc1c(C)cccc1S 1P006AME [0,2,0,0,0,0|2,0,0]=4 4203 B9R1.3 Clc1c(C)ccnc1Cl 1P002FP1 [0,2,0,0,0,0|1,0,0]=3 4204 B9R1.3 Clc1c(C)cncc1Br 1P01BAAV [0,2,0,0,0,0|1,0,0]=3 4205 B9R1.3 Clc1c(C)cncc1Br 1P01BADI [0,2,0,0,0,0|1,0,0]=3 4206 B9R1.3 Clc1c(C)cncc1Cl 1P01K26B [0,2,0,0,0,0|1,0,0]=3 4207 B9R1.3 Clc1c(C)ncnc1Cl 1P0036DL [0,2,0,0,0,0|2,0,0]=4 4208 B9R1.3 Clc1c(C)ncnc1N 1P000UUK [0,2,0,0,0,0|1,0,0]=3 4209 B9R1.3 Clc1c(Cl)cccc1Br 1P003FY8 [0,2,0,0,0,0|2,0,0]=4 4210 B9R1.3 Clc1c(Cl)cccc1I 1P003DUM [0,2,0,0,0,0|2,0,0]=4 4211 B9R1.3 Clc1c(Cl)ccnc1Br 1P00I0MF [0,2,0,0,0,0|1,0,0]=3 4212 B9R1.3 Clc1c(Cl)ccnc1C 1P008UGI [0,2,0,0,0,0|1,0,0]=3 4213 B9R1.3 Clc1c(Cl)ccnc1Cl 1P002XYQ [0,2,0,0,0,0|1,0,0]=3 4214 B9R1.3 Clc1c(Cl)ccnc1F 1P004OLD [0,2,0,0,0,0|1,0,0]=3 4215 B9R1.3 Clc1c(Cl)ccnc1N 1P002HH8 [0,2,0,0,0,0|1,0,0]=3 4216 B9R1.3 Clc1c(Cl)cn[nH]c1=O 1P0034BS [0,2,0,0,0,0|2,0,0]=4 4217 B9R1.3 Clc1c(Cl)cncc1Br 1P0001F2 [0,2,0,0,0,0|1,0,0]=3 4218 B9R1.3 Clc1c(Cl)cncc1Cl 1P003IV2 [0,2,0,0,0,0|1,0,0]=3 4219 B9R1.3 Clc1c(Cl)cnnc1Cl 1P0039EF [0,2,0,0,0,0|2,0,0]=4 4220 B9R1.3 Clc1c(Cl)ncnc1Cl 1P00266N [0,2,0,0,0,0|2,0,0]=4 4221 B9R1.3 Clc1c(F)cccc1Br 1P0045VF [0,2,0,0,0,0|2,0,0]=4 4222 B9R1.3 Clc1c(F)cccc1I 1P01EW3K [0,2,0,0,0,0|2,0,0]=4 4223 B9R1.3 Clc1c(F)ccnc1F 1P004OLF [0,2,0,0,0,0|1,0,0]=3 4224 B9R1.3 Clc1c(F)cncc1Br 1P00A1O9 [0,2,0,0,0,0|1,0,0]=3 4225 B9R1.3 Clc1c(F)cncc1Cl 1P004OLE [0,2,0,0,0,0|1,0,0]=3 4226 B9R1.3 Clc1c(I)ccnc1Cl 1P0089H7 [0,2,0,0,0,0|1,0,0]=3 4227 B9R1.3 Clc1c(N)cccc1Br 1P00DIG5 [0,2,0,0,0,0|1,0,0]=3 4228 B9R1.3 Clc1c(N)cccc1Cl 1P003FY1 [0,2,0,0,0,0|1,0,0]=3 4229 B9R1.3 Clc1c(N)cccc1F 1P007R3O [0,2,0,0,0,0|1,0,0]=3 4230 B9R1.3 Clc1c(N)cccc1O 1P00341F [0,2,0,0,0,0|1,0,0]=3 4231 B9R1.3 Clc1c(N)ccnc1Cl 1P00AKZ0 [0,2,0,0,0,0|0,0,0]=2 4232 B9R1.3 Clc1c(N)ccnc1Cl 1P02814E [0,2,0,0,0,0|0,0,0]=2 4233 B9R1.3 Clc1c(N)cncc1Br 1P0041GI [0,2,0,0,0,0|1,0,0]=3 4234 B9R1.3 Clc1c(N)cncc1Br 1P028B8J [0,2,0,0,0,0|1,0,0]=3 4235 B9R1.3 Clc1c(N)cncc1Cl 1P003KYC [0,2,0,0,0,0|1,0,0]=3 4236 B9R1.3 Clc1c(N)cncc1F 1P01ELIN [0,2,0,0,0,0|1,0,0]=3 4237 B9R1.3 Clc1c(N)cnnc1Cl 1P00H0LI [0,2,0,0,0,0|1,0,0]=3 4238 B9R1.3 Clc1c(N)ncnc1Cl 1P0032FU [0,2,0,0,0,0|1,0,0]=3 4239 B9R1.3 Clc1c(O)cccc1Br 1P004OSV [0,2,0,0,0,0|2,0,0]=4 4240 B9R1.3 Clc1c(O)cccc1F 1P0036UU [0,2,0,0,0,0|2,0,0]=4 4241 B9R1.3 Clc1c(O)cccc1I 1P0037CR [0,2,0,0,0,0|2,0,0]=4 4242 B9R1.3 Clc1c(O)ccnc1Cl 1P000EPM [0,2,0,0,0,0|1,0,0]=3 4243 B9R1.3 Clc1c(O)cnnc1Cl 1P00DLV5 [0,2,0,0,0,0|2,0,0]=4 4244 B9R1.3 Clc1c(O)ncnc1Cl 1P003MQD [0,2,0,0,0,0|2,0,0]=4 4245 B9R1.3 Clc1c(S)cccc1Cl 1P003FYM [0,2,0,0,0,0|2,0,0]=4 4246 B9R1.3 Clc1c(S)ccnc1Cl 1P01DZFM [0,2,0,0,0,0|1,0,0]=3 4247 B9R1.3 Clc1c[nH]cc(c1=O)Br 1P01KLH7 [0,2,0,0,0,0|1,0,1]=4 4248 B9R1.3 Clc1cccc(c1Br)Cl 1P003EJN [0,2,0,0,0,0|2,0,0]=4 4249 B9R1.3 Clc1cccc(c1C)Cl 1P00HETG [0,2,0,0,0,0|2,0,0]=4 4250 B9R1.3 Clc1cccc(c1F)Cl 1P003DZW [0,2,0,0,0,0|2,0,0]=4 4251 B9R1.3 Clc1cccc(c1I)Cl 1P002GAA [0,2,0,0,0,0|2,0,0]=4 4252 B9R1.3 Clc1cccc(c1N)Cl 1P0037GN [0,2,0,0,0,0|1,0,0]=3 4253 B9R1.3 Clc1cccc(c1O)Cl 1P004LD0 [0,2,0,0,0,0|2,0,0]=4 4254 B9R1.3 Clc1cccc(c1S)Cl 1P002QHD [0,2,0,0,0,0|2,0,0]=4 4255 B9R1.3 Clc1ccnc(c1Br)C 1P01BJR8 [0,2,0,0,0,0|1,0,0]=3 4256 B9R1.3 Clc1ccnc(c1Br)F 1P01FSNU [0,2,0,0,0,0|1,0,0]=3 4257 B9R1.3 Clc1ccnc(c1Br)N 1P00C4Q1 [0,2,0,0,0,0|1,0,0]=3 4258 B9R1.3 Clc1ccnc(c1Br)O 1P01LV6X [0,2,0,0,0,0|1,0,0]=3 4259 B9R1.3 Clc1ccnc(c1C)Br 1P00ILFZ [0,2,0,0,0,0|1,0,0]=3 4260 B9R1.3 Clc1ccnc(c1C)N 1P000JTR [0,2,0,0,0,0|1,0,0]=3 4261 B9R1.3 Clc1ccnc(c1F)Br 1P000GNO [0,2,0,0,0,0|1,0,0]=3 4262 B9R1.3 Clc1ccnc(c1F)C 1P000JE6 [0,2,0,0,0,0|1,0,0]=3 4263 B9R1.3 Clc1ccnc(c1F)N 1P00QC4I [0,2,0,0,0,0|1,0,0]=3 4264 B9R1.3 Clc1ccnc(c1I)C 1P01ALOD [0,2,0,0,0,0|1,0,0]=3 4265 B9R1.3 Clc1ccnc(c1I)F 1P025GD4 [0,2,0,0,0,0|1,0,0]=3 4266 B9R1.3 Clc1ccnc(c1I)N 1P0075TT [0,2,0,0,0,0|1,0,0]=3 4267 B9R1.3 Clc1ccnc(c1N)Br 1P00CMH3 [0,2,0,0,0,0|1,0,0]=3 4268 B9R1.3 Clc1ccnc(c1N)C 1P0096BN [0,2,0,0,0,0|1,0,0]=3 4269 B9R1.3 Clc1ccnc(c1O)Br 1P009JP0 [0,2,0,0,0,0|1,0,0]=3 4270 B9R1.3 Clc1ccnc(c1O)I 1P00I2D4 [0,2,0,0,0,0|1,0,0]=3 4271 B9R1.3 Clc1ccnc(c1O)N 1P00028D [0,2,0,0,0,0|1,0,0]=3 4272 B9R1.3 Clc1ccnc(c1O)N 1P01B714 [0,2,0,0,0,0|1,0,0]=3 4273 B9R1.3 Clc1cn[nH]c(=O)c1Br 1P00HFKP [0,2,0,0,0,0|2,0,0]=4 4274 B9R1.3 Clc1cn[nH]c(=O)c1C 1P00HATY [0,2,0,0,0,0|2,0,0]=4 4275 B9R1.3 Clc1cn[nH]c(=O)c1N 1P00DJ26 [0,2,0,0,0,0|1,0,0]=3 4276 B9R1.3 Clc1cncc(c1Br)Cl 1P007GEI [0,2,0,0,0,0|1,0,0]=3 4277 B9R1.3 Clc1cncc(c1C)Cl 1P0003IC [0,2,0,0,0,0|1,0,0]=3 4278 B9R1.3 Clc1cncc(c1F)Cl 1P006RQD [0,2,0,0,0,0|1,0,0]=3 4279 B9R1.3 Clc1cncc(c1I)Cl 1P0033ZW [0,2,0,0,0,0|1,0,0]=3 4280 B9R1.3 Clc1cncc(c1N)Cl 1P002LTR [0,2,0,0,0,0|0,0,0]=2 4281 B9R1.3 Clc1cncc(c1O)Cl 1P00AQ55 [0,2,0,0,0,0|1,0,0]=3 4282 B9R1.3 Clc1nc[nH]c(=N)c1I 1P01DIAP [0,2,0,0,0,0|1,0,1]=4 4283 B9R1.3 Clc1nc[nH]c(=O)c1Br 1P0087PK [0,2,0,0,0,0|2,0,0]=4 4284 B9R1.3 Clc1nc[nH]c(=S)c1N 1P00DGFD [0,2,0,0,0,0|2,0,0]=4 4285 B9R1.3 Clc1ncnc(c1Br)Cl 1P0061RE [0,2,0,0,0,0|2,0,0]=4 4286 B9R1.3 Clc1ncnc(c1C)Cl 1P003L00 [0,2,0,0,0,0|2,0,0]=4 4287 B9R1.3 Clc1ncnc(c1F)Cl 1P0034C3 [0,2,0,0,0,0|2,0,0]=4 4288 B9R1.3 Clc1ncnc(c1I)Cl 1P000A1Q [0,2,0,0,0,0|2,0,0]=4 4289 B9R1.3 Clc1ncnc(c1N)Cl 1P0034NL [0,2,0,0,0,0|2,0,0]=4 4290 B9R1.3 Clc1ncnc(c1O)Cl 1P00CJBJ [0,2,0,0,0,0|2,0,0]=4 4291 B9R1.3 Cn1c(N)cccc1=O 1P028SZO [0,2,0,0,0,0|2,0,0]=4 4292 B9R1.3 Cn1c(N)ccnc1=O 1P00E0LA [0,2,0,0,0,0|1,0,0]=3 4293 B9R1.3 Cn1c(N)nccc1=O 1P00BLJR [0,2,0,0,0,0|2,0,0]=4 4294 B9R1.3 Cn1cccc(c1=O)N 1P0039L3 [0,2,0,0,0,0|2,0,0]=4 4295 B9R1.3 Cn1cccc(c1=O)N 1P00C7BC [0,2,0,0,0,0|2,0,0]=4 4296 B9R1.3 Cn1ccnc(c1=O)Br 1P01AK69 [0,2,0,0,0,0|2,0,0]=4 4297 B9R1.3 Cn1ccnc(c1=O)Cl 1P00J162 [0,2,0,0,0,0|2,0,0]=4 4298 B9R1.3 Cn1ccnc(c1=O)N 1P019SZB [0,2,0,0,0,0|2,0,0]=4 4299 B9R1.3 Cn1cncc(c1=O)Br 1P01B9UV [0,2,0,0,0,0|2,0,0]=4 4300 B9R1.3 Cn1cncc(c1=O)N 1P01B34D [0,2,0,0,0,0|2,0,0]=4 4301 B9R1.3 Fc1c(Br)cccc1I 1P003AT1 [0,2,0,0,0,0|2,0,0]=4 4302 B9R1.3 Fc1c(Br)ccnc1Br 1P021TAJ [0,2,0,0,0,0|1,0,0]=3 4303 B9R1.3 Fc1c(Br)ccnc1F 1P000JUV [0,2,0,0,0,0|1,0,0]=3 4304 B9R1.3 Fc1c(C)cccc1Br 1P003JH4 [0,2,0,0,0,0|2,0,0]=4 4305 B9R1.3 Fc1c(C)cccc1Cl 1P004P4Z [0,2,0,0,0,0|2,0,0]=4 4306 B9R1.3 Fc1c(C)cccc1F 1P003FZC [0,2,0,0,0,0|2,0,0]=4 4307 B9R1.3 Fc1c(C)cccc1I 1P0037FH [0,2,0,0,0,0|2,0,0]=4 4308 B9R1.3 Fc1c(C)cccc1N 1P002BI6 [0,2,0,0,0,0|1,0,0]=3 4309 B9R1.3 Fc1c(C)cccc1O 1P008OY9 [0,2,0,0,0,0|2,0,0]=4 4310 B9R1.3 Fc1c(C)ccnc1F 1P028XE7 [0,2,0,0,0,0|1,0,0]=3 4311 B9R1.3 Fc1c(C)cncc1Br 1P01B5EU [0,2,0,0,0,0|1,0,0]=3 4312 B9R1.3 Fc1c(C)ncnc1Br 1P00IH9A [0,2,0,0,0,0|2,0,0]=4 4313 B9R1.3 Fc1c(C)ncnc1Cl 1P003ZTY [0,2,0,0,0,0|2,0,0]=4 4314 B9R1.3 Fc1c(C)ncnc1O 1P00BH1G [0,2,0,0,0,0|2,0,0]=4 4315 B9R1.3 Fc1c(Cl)cccc1Br 1P001K9H [0,2,0,0,0,0|2,0,0]=4 4316 B9R1.3 Fc1c(Cl)cccc1I 1P003JNL [0,2,0,0,0,0|2,0,0]=4 4317 B9R1.3 Fc1c(Cl)ccnc1Cl 1P0033FM [0,2,0,0,0,0|1,0,0]=3 4318 B9R1.3 Fc1c(Cl)ccnc1F 1P004OXS [0,2,0,0,0,0|1,0,0]=3 4319 B9R1.3 Fc1c(Cl)cncc1Br 1P028WDI [0,2,0,0,0,0|1,0,0]=3 4320 B9R1.3 Fc1c(F)cccc1Br 1P003EJF [0,2,0,0,0,0|2,0,0]=4 4321 B9R1.3 Fc1c(F)cccc1Cl 1P00C1IF [0,2,0,0,0,0|2,0,0]=4 4322 B9R1.3 Fc1c(F)cccc1F 1P001LQ6 [0,2,0,0,0,0|2,0,0]=4 4323 B9R1.3 Fc1c(F)cccc1I 1P00E9V8 [0,2,0,0,0,0|2,0,0]=4 4324 B9R1.3 Fc1c(F)cccc1S 1P000VL0 [0,2,0,0,0,0|2,0,0]=4 4325 B9R1.3 Fc1c(F)ccnc1Br 1P01DWBD [0,2,0,0,0,0|1,0,0]=3 4326 B9R1.3 Fc1c(F)ccnc1F 1P0055H1 [0,2,0,0,0,0|1,0,0]=3 4327 B9R1.3 Fc1c(F)ccnc1N 1P01FSMR [0,2,0,0,0,0|1,0,0]=3 4328 B9R1.3 Fc1c(F)cncc1Cl 1P004XWY [0,2,0,0,0,0|1,0,0]=3 4329 B9R1.3 Fc1c(F)cncc1F 1P0037AC [0,2,0,0,0,0|1,0,0]=3 4330 B9R1.3 Fc1c(F)ncnc1F 1P0021M6 [0,2,0,0,0,0|2,0,0]=4 4331 B9R1.3 Fc1c(I)ccnc1F 1P0038UY [0,2,0,0,0,0|1,0,0]=3 4332 B9R1.3 Fc1c(N)cccc1Br 1P003817 [0,2,0,0,0,0|1,0,0]=3 4333 B9R1.3 Fc1c(N)cccc1Br 1P00A19K [0,2,0,0,0,0|1,0,0]=3 4334 B9R1.3 Fc1c(N)cccc1Cl 1P002LD1 [0,2,0,0,0,0|1,0,0]=3 4335 B9R1.3 Fc1c(N)cccc1F 1P0033EF [0,2,0,0,0,0|1,0,0]=3 4336 B9R1.3 Fc1c(N)cccc1I 1P01JKXD [0,2,0,0,0,0|1,0,0]=3 4337 B9R1.3 Fc1c(N)cccc1I 1P028AY3 [0,2,0,0,0,0|1,0,0]=3 4338 B9R1.3 Fc1c(N)cccc1O 1P00HF4R [0,2,0,0,0,0|1,0,0]=3 4339 B9R1.3 Fc1c(N)ccnc1F 1P01B7XG [0,2,0,0,0,0|0,0,0]=2 4340 B9R1.3 Fc1c(N)ccnc1F 1P01BV3Y [0,2,0,0,0,0|0,0,0]=2 4341 B9R1.3 Fc1c(N)ncnc1Cl 1P00G5J1 [0,2,0,0,0,0|1,0,0]=3 4342 B9R1.3 Fc1c(N)ncnc1F 1P027VHU [0,2,0,0,0,0|1,0,0]=3 4343 B9R1.3 Fc1c(O)cccc1Cl 1P002S9D [0,2,0,0,0,0|2,0,0]=4 4344 B9R1.3 Fc1c(O)cccc1F 1P0033EH [0,2,0,0,0,0|2,0,0]=4 4345 B9R1.3 Fc1c(O)ccnc1F 1P000JSD [0,2,0,0,0,0|1,0,0]=3 4346 B9R1.3 Fc1c(O)cncc1Br 1P01JPJ8 [0,2,0,0,0,0|1,0,0]=3 4347 B9R1.3 Fc1c(O)ncnc1F 1P02925Z [0,2,0,0,0,0|2,0,0]=4 4348 B9R1.3 Fc1c(S)cccc1Cl 1P008YGR [0,2,0,0,0,0|2,0,0]=4 4349 B9R1.3 Fc1cccc(c1Br)F 1P0037JN [0,2,0,0,0,0|2,0,0]=4 4350 B9R1.3 Fc1cccc(c1C)F 1P003GLB [0,2,0,0,0,0|2,0,0]=4 4351 B9R1.3 Fc1cccc(c1Cl)F 1P003EO4 [0,2,0,0,0,0|2,0,0]=4 4352 B9R1.3 Fc1cccc(c1I)F 1P00133D [0,2,0,0,0,0|2,0,0]=4 4353 B9R1.3 Fc1cccc(c1N)F 1P0033I5 [0,2,0,0,0,0|1,0,0]=3 4354 B9R1.3 Fc1cccc(c1O)F 1P0036G9 [0,2,0,0,0,0|2,0,0]=4 4355 B9R1.3 Fc1cccc(c1S)F 1P0039DS [0,2,0,0,0,0|2,0,0]=4 4356 B9R1.3 Fc1ccnc(c1Br)C 1P01BEDI [0,2,0,0,0,0|1,0,0]=3 4357 B9R1.3 Fc1ccnc(c1Br)Cl 1P01EH52 [0,2,0,0,0,0|1,0,0]=3 4358 B9R1.3 Fc1ccnc(c1Br)N 1P001HFQ [0,2,0,0,0,0|1,0,0]=3 4359 B9R1.3 Fc1ccnc(c1C)Br 1P021VQV [0,2,0,0,0,0|1,0,0]=3 4360 B9R1.3 Fc1ccnc(c1C)Cl 1P01E6LF [0,2,0,0,0,0|1,0,0]=3 4361 B9R1.3 Fc1ccnc(c1C)N 1P000JT0 [0,2,0,0,0,0|1,0,0]=3 4362 B9R1.3 Fc1ccnc(c1C)N 1P0286LJ [0,2,0,0,0,0|1,0,0]=3 4363 B9R1.3 Fc1ccnc(c1C)O 1P0283BG [0,2,0,0,0,0|1,0,0]=3 4364 B9R1.3 Fc1ccnc(c1Cl)C 1P0291V6 [0,2,0,0,0,0|1,0,0]=3 4365 B9R1.3 Fc1ccnc(c1Cl)N 1P01FJVX [0,2,0,0,0,0|1,0,0]=3 4366 B9R1.3 Fc1ccnc(c1I)Cl 1P00HS3Y [0,2,0,0,0,0|1,0,0]=3 4367 B9R1.3 Fc1ccnc(c1I)N 1P01B76Q [0,2,0,0,0,0|1,0,0]=3 4368 B9R1.3 Fc1ccnc(c1N)Cl 1P01BRM8 [0,2,0,0,0,0|1,0,0]=3 4369 B9R1.3 Fc1ccnc(c1O)Cl 1P000JSM [0,2,0,0,0,0|1,0,0]=3 4370 B9R1.3 Fc1cncc(c1Br)F 1P007TV3 [0,2,0,0,0,0|1,0,0]=3 4371 B9R1.3 Fc1cncc(c1Cl)F 1P004RQE [0,2,0,0,0,0|1,0,0]=3 4372 B9R1.3 Fc1cncc(c1Cl)F 1P00ILF0 [0,2,0,0,0,0|1,0,0]=3 4373 B9R1.3 Fc1cncc(c1I)F 1P008XT3 [0,2,0,0,0,0|1,0,0]=3 4374 B9R1.3 Fc1cncc(c1N)F 1P001RUP [0,2,0,0,0,0|0,0,0]=2 4375 B9R1.3 Fc1cncc(c1N)F 1P0290RA [0,2,0,0,0,0|0,0,0]=2 4376 B9R1.3 Fc1ncnc(c1Br)F 1P003MZL [0,2,0,0,0,0|2,0,0]=4 4377 B9R1.3 Fc1ncnc(c1C)F 1P0024HD [0,2,0,0,0,0|2,0,0]=4 4378 B9R1.3 Ic1c(C)cccc1Br 1P0039WM [0,2,0,0,0,0|2,0,0]=4 4379 B9R1.3 Ic1c(C)cccc1Cl 1P00DC7M [0,2,0,0,0,0|2,0,0]=4 4380 B9R1.3 Ic1c(C)cccc1F 1P0045V3 [0,2,0,0,0,0|2,0,0]=4 4381 B9R1.3 Ic1c(C)cccc1N 1P00H0UJ [0,2,0,0,0,0|1,0,0]=3 4382 B9R1.3 Ic1c(C)cccc1O 1P009D6N [0,2,0,0,0,0|2,0,0]=4 4383 B9R1.3 Ic1c(C)ccnc1C 1P028SAB [0,2,0,0,0,0|1,0,0]=3 4384 B9R1.3 Ic1c(C)ncnc1Cl 1P00551O [0,2,0,0,0,0|2,0,0]=4 4385 B9R1.3 Ic1c(C)ncnc1N 1P004SA6 [0,2,0,0,0,0|1,0,0]=3 4386 B9R1.3 Ic1c(Cl)cccc1Br 1P0070RI [0,2,0,0,0,0|2,0,0]=4 4387 B9R1.3 Ic1c(Cl)ccnc1Cl 1P003BLB [0,2,0,0,0,0|1,0,0]=3 4388 B9R1.3 Ic1c(F)cccc1Br 1P00D8OE [0,2,0,0,0,0|2,0,0]=4 4389 B9R1.3 Ic1c(F)cccc1Cl 1P000XQI [0,2,0,0,0,0|2,0,0]=4 4390 B9R1.3 Ic1c(F)ccnc1F 1P00G2NH [0,2,0,0,0,0|1,0,0]=3 4391 B9R1.3 Ic1c(F)cncc1Br 1P00K7SS [0,2,0,0,0,0|1,0,0]=3 4392 B9R1.3 Ic1c(I)ccnc1Cl 1P003HBO [0,2,0,0,0,0|1,0,0]=3 4393 B9R1.3 Ic1c(I)ccnc1F 1P007YRF [0,2,0,0,0,0|1,0,0]=3 4394 B9R1.3 Ic1c(N)cccc1Br 1P00ANNC [0,2,0,0,0,0|1,0,0]=3 4395 B9R1.3 Ic1c(N)cccc1Br 1P01B2SZ [0,2,0,0,0,0|1,0,0]=3 4396 B9R1.3 Ic1c(N)cccc1Cl 1P006BN5 [0,2,0,0,0,0|1,0,0]=3 4397 B9R1.3 Ic1c(N)cccc1F 1P0017Q6 [0,2,0,0,0,0|1,0,0]=3 4398 B9R1.3 Ic1c(N)cccc1F 1P0065V9 [0,2,0,0,0,0|1,0,0]=3 4399 B9R1.3 Ic1c(N)cncc1Br 1P0022IM [0,2,0,0,0,0|1,0,0]=3 4400 B9R1.3 Ic1c(N)cncc1F 1P00HUBA [0,2,0,0,0,0|1,0,0]=3 4401 B9R1.3 Ic1c(O)cccc1Br 1P004QYS [0,2,0,0,0,0|2,0,0]=4 4402 B9R1.3 Ic1c(O)cccc1Cl 1P004NYO [0,2,0,0,0,0|2,0,0]=4 4403 B9R1.3 Ic1c(O)cccc1F 1P004OSW [0,2,0,0,0,0|2,0,0]=4 4404 B9R1.3 Ic1c(O)ncnc1Cl 1P01E8XF [0,2,0,0,0,0|2,0,0]=4 4405 B9R1.3 Ic1c[nH]cc(c1=O)I 1P00DEMO [0,2,0,0,0,0|1,0,1]=4 4406 B9R1.3 Ic1cc[nH]c(=N)c1Cl 1P0096JK [0,2,0,0,0,0|1,0,1]=4 4407 B9R1.3 Ic1cccc(c1O)I 1P01BW9G [0,2,0,0,0,0|2,0,0]=4 4408 B9R1.3 Ic1ccnc(c1Br)F 1P00IFK4 [0,2,0,0,0,0|1,0,0]=3 4409 B9R1.3 Ic1ccnc(c1Br)N 1P028S0Z [0,2,0,0,0,0|1,0,0]=3 4410 B9R1.3 Ic1ccnc(c1C)Cl 1P00AP1E [0,2,0,0,0,0|1,0,0]=3 4411 B9R1.3 Ic1ccnc(c1C)F 1P0036IU [0,2,0,0,0,0|1,0,0]=3 4412 B9R1.3 Ic1ccnc(c1C)N 1P00HHE2 [0,2,0,0,0,0|1,0,0]=3 4413 B9R1.3 Ic1ccnc(c1Cl)C 1P01A5ZY [0,2,0,0,0,0|1,0,0]=3 4414 B9R1.3 Ic1ccnc(c1Cl)F 1P00GJC6 [0,2,0,0,0,0|1,0,0]=3 4415 B9R1.3 Ic1ccnc(c1F)Br 1P021PUC [0,2,0,0,0,0|1,0,0]=3 4416 B9R1.3 Ic1ccnc(c1F)Cl 1P001LJW [0,2,0,0,0,0|1,0,0]=3 4417 B9R1.3 Ic1ccnc(c1F)N 1P01NIW3 [0,2,0,0,0,0|1,0,0]=3 4418 B9R1.3 Ic1ccnc(c1F)O 1P01UNOW [0,2,0,0,0,0|1,0,0]=3 4419 B9R1.3 Ic1ccnc(c1O)Cl 1P01DU8D [0,2,0,0,0,0|1,0,0]=3 4420 B9R1.3 Ic1ccnc(c1O)F 1P01K7FV [0,2,0,0,0,0|1,0,0]=3 4421 B9R1.3 Ic1cncc(c1N)I 1P003L5Q [0,2,0,0,0,0|0,0,0]=2 4422 B9R1.3 Ic1cncc(c1O)I 1P00FEUP [0,2,0,0,0,0|1,0,0]=3 4423 B9R1.3 Ic1ncnc(c1C)I 1P028IJT [0,2,0,0,0,0|2,0,0]=4 4424 B9R1.3 Ic1ncnc(c1N)I 1P00D8JD [0,2,0,0,0,0|2,0,0]=4 4425 B9R1.3 Nc1c(Br)cccc1I 1P004SJ3 [0,2,0,0,0,0|1,0,0]=3 4426 B9R1.3 Nc1c(Br)ccnc1Br 1P0007HB [0,2,0,0,0,0|1,0,0]=3 4427 B9R1.3 Nc1c(Br)ccnc1N 1P000KOH [0,2,0,0,0,0|1,0,0]=3 4428 B9R1.3 Nc1c(Br)cncc1I 1P003L5U [0,2,0,0,0,0|0,0,0]=2 4429 B9R1.3 Nc1c(C)cccc1Br 1P003H7P [0,2,0,0,0,0|1,0,0]=3 4430 B9R1.3 Nc1c(C)cccc1Cl 1P0033PK [0,2,0,0,0,0|1,0,0]=3 4431 B9R1.3 Nc1c(C)cccc1F 1P003HRT [0,2,0,0,0,0|1,0,0]=3 4432 B9R1.3 Nc1c(C)cccc1I 1P0058EZ [0,2,0,0,0,0|1,0,0]=3 4433 B9R1.3 Nc1c(C)cccc1N 1P003BKF [0,2,0,0,0,0|1,0,0]=3 4434 B9R1.3 Nc1c(C)cccc1O 1P00I5S9 [0,2,0,0,0,0|1,0,0]=3 4435 B9R1.3 Nc1c(C)cccc1S 1P005YCV [0,2,0,0,0,0|1,0,0]=3 4436 B9R1.3 Nc1c(C)ccnc1C 1P0085CQ [0,2,0,0,0,0|1,0,0]=3 4437 B9R1.3 Nc1c(C)ccnc1N 1P003863 [0,2,0,0,0,0|1,0,0]=3 4438 B9R1.3 Nc1c(C)cncc1Br 1P00378N [0,2,0,0,0,0|0,0,0]=2 4439 B9R1.3 Nc1c(C)cncc1Cl 1P00IKGK [0,2,0,0,0,0|0,0,0]=2 4440 B9R1.3 Nc1c(C)cncc1F 1P001BRQ [0,2,0,0,0,0|0,0,0]=2 4441 B9R1.3 Nc1c(C)cncc1I 1P003L6R [0,2,0,0,0,0|0,0,0]=2 4442 B9R1.3 Nc1c(C)cncc1N 1P001BRP [0,2,0,0,0,0|0,0,0]=2 4443 B9R1.3 Nc1c(C)ncnc1Cl 1P01DHYN [0,2,0,0,0,0|2,0,0]=4 4444 B9R1.3 Nc1c(Cl)cccc1Br 1P0037GK [0,2,0,0,0,0|1,0,0]=3 4445 B9R1.3 Nc1c(Cl)cccc1Br 1P01FJ5S [0,2,0,0,0,0|1,0,0]=3 4446 B9R1.3 Nc1c(Cl)cccc1I 1P004W9T [0,2,0,0,0,0|1,0,0]=3 4447 B9R1.3 Nc1c(Cl)ccnc1Cl 1P001ZMV [0,2,0,0,0,0|1,0,0]=3 4448 B9R1.3 Nc1c(Cl)ccnc1N 1P002OR7 [0,2,0,0,0,0|1,0,0]=3 4449 B9R1.3 Nc1c(Cl)cncc1Br 1P001RUM [0,2,0,0,0,0|0,0,0]=2 4450 B9R1.3 Nc1c(Cl)cncc1I 1P000UFI [0,2,0,0,0,0|0,0,0]=2 4451 B9R1.3 Nc1c(Cl)cnnc1Cl 1P00DGT6 [0,2,0,0,0,0|1,0,0]=3 4452 B9R1.3 Nc1c(Cl)cnnc1N 1P003ZLX [0,2,0,0,0,0|1,0,0]=3 4453 B9R1.3 Nc1c(F)cccc1Br 1P003H7E [0,2,0,0,0,0|1,0,0]=3 4454 B9R1.3 Nc1c(F)cccc1Cl 1P003HGZ [0,2,0,0,0,0|1,0,0]=3 4455 B9R1.3 Nc1c(F)cccc1I 1P0048T2 [0,2,0,0,0,0|1,0,0]=3 4456 B9R1.3 Nc1c(F)cccc1S 1P005MXQ [0,2,0,0,0,0|1,0,0]=3 4457 B9R1.3 Nc1c(F)ccnc1F 1P0091JC [0,2,0,0,0,0|1,0,0]=3 4458 B9R1.3 Nc1c(F)cncc1Br 1P00158F [0,2,0,0,0,0|0,0,0]=2 4459 B9R1.3 Nc1c(F)cncc1Br 1P028Z8U [0,2,0,0,0,0|0,0,0]=2 4460 B9R1.3 Nc1c(F)cncc1Cl 1P000JTM [0,2,0,0,0,0|0,0,0]=2 4461 B9R1.3 Nc1c(F)cncc1I 1P001RTU [0,2,0,0,0,0|0,0,0]=2 4462 B9R1.3 Nc1c(N)cccc1Br 1P001PY3 [0,2,0,0,0,0|1,0,0]=3 4463 B9R1.3 Nc1c(N)cccc1Br 1P007Q7D [0,2,0,0,0,0|1,0,0]=3 4464 B9R1.3 Nc1c(N)cccc1Cl 1P0038MS [0,2,0,0,0,0|1,0,0]=3 4465 B9R1.3 Nc1c(N)cccc1F 1P003JVN [0,2,0,0,0,0|1,0,0]=3 4466 B9R1.3 Nc1c(N)cccc1I 1P00CZBM [0,2,0,0,0,0|1,0,0]=3 4467 B9R1.3 Nc1c(N)ccnc1Br 1P002IKE [0,2,0,0,0,0|0,0,0]=2 4468 B9R1.3 Nc1c(N)ccnc1C 1P001R2S [0,2,0,0,0,0|0,0,0]=2 4469 B9R1.3 Nc1c(N)ccnc1Cl 1P0076G6 [0,2,0,0,0,0|0,0,0]=2 4470 B9R1.3 Nc1c(N)ccnc1N 1P00DETR [0,2,0,0,0,0|0,0,0]=2 4471 B9R1.3 Nc1c(N)ccnc1O 1P00C7H7 [0,2,0,0,0,0|0,0,0]=2 4472 B9R1.3 Nc1c(N)cn[nH]c1=O 1P002WJ4 [0,2,0,0,0,0|1,0,0]=3 4473 B9R1.3 Nc1c(N)cncc1Br 1P0034OL [0,2,0,0,0,0|0,0,0]=2 4474 B9R1.3 Nc1c(N)cncc1Cl 1P00GVGQ [0,2,0,0,0,0|0,0,0]=2 4475 B9R1.3 Nc1c(N)cncc1I 1P01AMBM [0,2,0,0,0,0|0,0,0]=2 4476 B9R1.3 Nc1c(N)cncc1N 1P00EG2X [0,2,0,0,0,0|0,0,0]=2 4477 B9R1.3 Nc1c(N)nc[nH]c1=O 1P001XO9 [0,2,0,0,0,0|1,0,1]=4 4478 B9R1.3 Nc1c(N)nc[nH]c1=O 1P008VBO [0,2,0,0,0,0|1,0,1]=4 4479 B9R1.3 Nc1c(N)ncnc1Cl 1P003NMJ [0,2,0,0,0,0|1,0,0]=3 4480 B9R1.3 Nc1c(N)ncnc1F 1P005KL3 [0,2,0,0,0,0|1,0,0]=3 4481 B9R1.3 Nc1c(N)ncnc1N 1P003KXR [0,2,0,0,0,0|1,0,0]=3 4482 B9R1.3 Nc1c(N)ncnc1N 1P00D8S9 [0,2,0,0,0,0|1,0,0]=3 4483 B9R1.3 Nc1c(N)ncnc1O 1P00DBS6 [0,2,0,0,0,0|1,0,0]=3 4484 B9R1.3 Nc1c(O)cccc1Br 1P000CYK [0,2,0,0,0,0|1,0,0]=3 4485 B9R1.3 Nc1c(O)cccc1Cl 1P00382N [0,2,0,0,0,0|1,0,0]=3 4486 B9R1.3 Nc1c(O)cccc1Cl 1P01AMQQ [0,2,0,0,0,0|1,0,0]=3 4487 B9R1.3 Nc1c(O)cccc1F 1P0037S7 [0,2,0,0,0,0|1,0,0]=3 4488 B9R1.3 Nc1c(O)cccc1F 1P00I3OX [0,2,0,0,0,0|1,0,0]=3 4489 B9R1.3 Nc1c(O)cccc1I 1P0072EJ [0,2,0,0,0,0|1,0,0]=3 4490 B9R1.3 Nc1c(O)ccnc1O 1P008YVB [0,2,0,0,0,0|1,0,0]=3 4491 B9R1.3 Nc1c(O)cncc1F 1P027UP1 [0,2,0,0,0,0|0,0,0]=2 4492 B9R1.3 Nc1c(S)cccc1Br 1P005YJD [0,2,0,0,0,0|1,0,0]=3 4493 B9R1.3 Nc1c(S)cccc1Cl 1P00C79F [0,2,0,0,0,0|1,0,0]=3 4494 B9R1.3 Nc1c[nH]cc(c1=O)Br 1P00ICPF [0,2,0,0,0,0|1,0,1]=4 4495 B9R1.3 Nc1cc[nH]c(=O)c1Cl 1P00DGR1 [0,2,0,0,0,0|0,0,1]=3 4496 B9R1.3 Nc1cccc(c1C)N 1P008L17 [0,2,0,0,0,0|1,0,0]=3 4497 B9R1.3 Nc1cccc(c1O)N 1P0022TV [0,2,0,0,0,0|1,0,0]=3 4498 B9R1.3 Nc1ccnc([n+]1[O-])N 1P00FAHG [0,2,0,0,0,0|1,0,0]=3 4499 B9R1.3 Nc1ccnc(c1Br)C 1P00IKGJ [0,2,0,0,0,0|0,0,0]=2 4500 B9R1.3 Nc1ccnc(c1Br)Cl 1P003L5T [0,2,0,0,0,0|0,0,0]=2 4501 B9R1.3 Nc1ccnc(c1Br)F 1P0012DC [0,2,0,0,0,0|0,0,0]=2 4502 B9R1.3 Nc1ccnc(c1C)Br 1P005CTD [0,2,0,0,0,0|0,0,0]=2 4503 B9R1.3 Nc1ccnc(c1C)Cl 1P005CTC [0,2,0,0,0,0|0,0,0]=2 4504 B9R1.3 Nc1ccnc(c1C)F 1P001BAI [0,2,0,0,0,0|0,0,0]=2 4505 B9R1.3 Nc1ccnc(c1Cl)Br 1P00EGNW [0,2,0,0,0,0|0,0,0]=2 4506 B9R1.3 Nc1ccnc(c1Cl)C 1P006B0Z [0,2,0,0,0,0|0,0,0]=2 4507 B9R1.3 Nc1ccnc(c1Cl)F 1P000JSR [0,2,0,0,0,0|0,0,0]=2 4508 B9R1.3 Nc1ccnc(c1Cl)F 1P01BW8S [0,2,0,0,0,0|0,0,0]=2 4509 B9R1.3 Nc1ccnc(c1F)Br 1P01DZ7E [0,2,0,0,0,0|0,0,0]=2 4510 B9R1.3 Nc1ccnc(c1F)C 1P001R2R [0,2,0,0,0,0|0,0,0]=2 4511 B9R1.3 Nc1ccnc(c1F)Cl 1P000JSS [0,2,0,0,0,0|0,0,0]=2 4512 B9R1.3 Nc1ccnc(c1F)Cl 1P01C2XU [0,2,0,0,0,0|0,0,0]=2 4513 B9R1.3 Nc1ccnc(c1I)Br 1P000UFK [0,2,0,0,0,0|0,0,0]=2 4514 B9R1.3 Nc1ccnc(c1I)C 1P00G65M [0,2,0,0,0,0|0,0,0]=2 4515 B9R1.3 Nc1ccnc(c1I)Cl 1P00390F [0,2,0,0,0,0|0,0,0]=2 4516 B9R1.3 Nc1ccnc(c1O)Cl 1P000JQE [0,2,0,0,0,0|0,0,0]=2 4517 B9R1.3 Nc1ccnn(c1=O)C 1P01KL6Z [0,2,0,0,0,0|1,0,0]=3 4518 B9R1.3 Nc1cn[nH]c(=O)c1Br 1P01EAO0 [0,2,0,0,0,0|1,0,1]=4 4519 B9R1.3 Nc1cn[nH]c(=O)c1Cl 1P0037L8 [0,2,0,0,0,0|1,0,1]=4 4520 B9R1.3 Nc1cnnc(c1Br)Cl 1P028SFI [0,2,0,0,0,0|1,0,0]=3 4521 B9R1.3 Nc1cnnc(c1I)Cl 1P028I7B [0,2,0,0,0,0|1,0,0]=3 4522 B9R1.3 Nc1nc[nH]c(=O)c1Br 1P00EKON [0,2,0,0,0,0|1,0,1]=4 4523 B9R1.3 Nc1nc[nH]c(=O)c1Cl 1P00BU9L [0,2,0,0,0,0|1,0,1]=4 4524 B9R1.3 Nc1ncnc(c1C)N 1P00BA21 [0,2,0,0,0,0|1,0,0]=3 4525 B9R1.3 Nc1ncnc(c1Cl)N 1P01DTYE [0,2,0,0,0,0|1,0,0]=3 4526 B9R1.3 Nc1ncnc(c1I)N 1P0071MB [0,2,0,0,0,0|1,0,0]=3 4527 B9R1.3 O=c1cc[nH]c(c1O)C 1P00AQEP [0,2,0,0,0,0|1,0,1]=4 4528 B9R1.3 O=c1cc[nH]c(c1O)C 1P01C462 [0,2,0,0,0,0|1,0,1]=4 4529 B9R1.3 O=c1ccoc(c1O)C 1P0038N7 [0,2,0,0,0,0|2,0,0]=4 4530 B9R1.3 O=c1ccoc(c1[O-])C 1P007JDR [0,2,0,0,0,0|2,0,0]=4 4531 B9R1.3 O=c1nc[nH]c(c1C)Cl 1P0024H7 [0,2,0,0,0,0|2,0,0]=4 4532 B9R1.3 O=c1nc[nH]c(c1C)N 1P00DYD1 [0,2,0,0,0,0|1,0,0]=3 4533 B9R1.3 O=c1nc[nH]c(c1I)C 1P00G67Y [0,2,0,0,0,0|2,0,0]=4 4534 B9R1.3 O=c1nc[nH]c(c1N)Cl 1P00CYCN [0,2,0,0,0,0|2,0,0]=4 4535 B9R1.3 Oc1c(Br)cccc1I 1P0029PT [0,2,0,0,0,0|2,0,0]=4 4536 B9R1.3 Oc1c(Br)ccnc1Br 1P0080YP [0,2,0,0,0,0|1,0,0]=3 4537 B9R1.3 Oc1c(Br)cncc1I 1P01FMO1 [0,2,0,0,0,0|1,0,0]=3 4538 B9R1.3 Oc1c(C)cccc1Br 1P0014UW [0,2,0,0,0,0|2,0,0]=4 4539 B9R1.3 Oc1c(C)cccc1Cl 1P0033PL [0,2,0,0,0,0|2,0,0]=4 4540 B9R1.3 Oc1c(C)cccc1F 1P00DDIF [0,2,0,0,0,0|2,0,0]=4 4541 B9R1.3 Oc1c(C)cccc1N 1P0025BU [0,2,0,0,0,0|1,0,0]=3 4542 B9R1.3 Oc1c(C)cccc1N 1P00J295 [0,2,0,0,0,0|1,0,0]=3 4543 B9R1.3 Oc1c(C)cncc1Br 1P01K0QG [0,2,0,0,0,0|1,0,0]=3 4544 B9R1.3 Oc1c(Cl)cccc1Br 1P0029PS [0,2,0,0,0,0|2,0,0]=4 4545 B9R1.3 Oc1c(Cl)cccc1I 1P00BIR0 [0,2,0,0,0,0|2,0,0]=4 4546 B9R1.3 Oc1c(Cl)ccnc1Cl 1P00C6TK [0,2,0,0,0,0|1,0,0]=3 4547 B9R1.3 Oc1c(Cl)cncc1Br 1P01FSLA [0,2,0,0,0,0|1,0,0]=3 4548 B9R1.3 Oc1c(Cl)cncc1I 1P02861H [0,2,0,0,0,0|1,0,0]=3 4549 B9R1.3 Oc1c(F)cccc1Br 1P0029PR [0,2,0,0,0,0|2,0,0]=4 4550 B9R1.3 Oc1c(F)cccc1Cl 1P0029PQ [0,2,0,0,0,0|2,0,0]=4 4551 B9R1.3 Oc1c(F)cccc1I 1P00BG0L [0,2,0,0,0,0|2,0,0]=4 4552 B9R1.3 Oc1c(F)cncc1Br 1P0015BD [0,2,0,0,0,0|1,0,0]=3 4553 B9R1.3 Oc1c(I)ccnc1I 1P005799 [0,2,0,0,0,0|1,0,0]=3 4554 B9R1.3 Oc1c(N)cccc1Br 1P00BDV4 [0,2,0,0,0,0|1,0,0]=3 4555 B9R1.3 Oc1c(N)cccc1Cl 1P007BLI [0,2,0,0,0,0|1,0,0]=3 4556 B9R1.3 Oc1c(N)cccc1Cl 1P01AHOX [0,2,0,0,0,0|1,0,0]=3 4557 B9R1.3 Oc1c(N)cccc1F 1P003GZ5 [0,2,0,0,0,0|1,0,0]=3 4558 B9R1.3 Oc1c(N)cccc1I 1P00IKTM [0,2,0,0,0,0|1,0,0]=3 4559 B9R1.3 Oc1c(N)cncc1Br 1P000464 [0,2,0,0,0,0|1,0,0]=3 4560 B9R1.3 Oc1c(N)cncc1I 1P0014X5 [0,2,0,0,0,0|1,0,0]=3 4561 B9R1.3 Oc1c(N)cncc1I 1P0014ZC [0,2,0,0,0,0|1,0,0]=3 4562 B9R1.3 Oc1c(N)ncnc1Cl 1P00CBFX [0,2,0,0,0,0|1,0,0]=3 4563 B9R1.3 Oc1c(O)cccc1Br 1P001IVQ [0,2,0,0,0,0|2,0,0]=4 4564 B9R1.3 Oc1c(O)cccc1F 1P007AKV [0,2,0,0,0,0|2,0,0]=4 4565 B9R1.3 Oc1c(O)cccc1I 1P00ARL6 [0,2,0,0,0,0|2,0,0]=4 4566 B9R1.3 Oc1c(O)cccc1O 1P003A2P [0,2,0,0,0,0|2,0,0]=4 4567 B9R1.3 Oc1c(O)ccnc1Br 1P02938P [0,2,0,0,0,0|1,0,0]=3 4568 B9R1.3 Oc1c(O)ccnc1C 1P00CKMV [0,2,0,0,0,0|1,0,0]=3 4569 B9R1.3 Oc1c(S)cccc1Br 1P028ZBH [0,2,0,0,0,0|2,0,0]=4 4570 B9R1.3 Oc1c[nH]cc(c1=O)F 1P00HEZT [0,2,0,0,0,0|1,0,1]=4 4571 B9R1.3 Oc1cc[nH]c(=O)c1Br 1P005VSE [0,2,0,0,0,0|1,0,1]=4 4572 B9R1.3 Oc1cc[nH]c(=O)c1C 1P0072L8 [0,2,0,0,0,0|1,0,1]=4 4573 B9R1.3 Oc1cc[nH]c(=O)c1Cl 1P0085VH [0,2,0,0,0,0|1,0,1]=4 4574 B9R1.3 Oc1cccc(c1Br)O 1P003H87 [0,2,0,0,0,0|2,0,0]=4 4575 B9R1.3 Oc1cccc(c1C)O 1P003I78 [0,2,0,0,0,0|2,0,0]=4 4576 B9R1.3 Oc1cccc(c1Cl)O 1P00IBF7 [0,2,0,0,0,0|2,0,0]=4 4577 B9R1.3 Oc1cccc(c1F)O 1P007IK2 [0,2,0,0,0,0|2,0,0]=4 4578 B9R1.3 Oc1cccc(c1I)O 1P00C7EQ [0,2,0,0,0,0|2,0,0]=4 4579 B9R1.3 Oc1cccc(c1N)O 1P003H0T [0,2,0,0,0,0|1,0,0]=3 4580 B9R1.3 Oc1cccc(c1N)O 1P00E943 [0,2,0,0,0,0|1,0,0]=3 4581 B9R1.3 Oc1ccnc(c1Br)Cl 1P00HGED [0,2,0,0,0,0|1,0,0]=3 4582 B9R1.3 Oc1ccnc(c1C)Br 1P01BBWO [0,2,0,0,0,0|1,0,0]=3 4583 B9R1.3 Oc1ccnc(c1C)N 1P028IKC [0,2,0,0,0,0|1,0,0]=3 4584 B9R1.3 Oc1ccnc(c1Cl)Br 1P00HGEQ [0,2,0,0,0,0|1,0,0]=3 4585 B9R1.3 Oc1ccnc(c1Cl)C 1P01C8JM [0,2,0,0,0,0|1,0,0]=3 4586 B9R1.3 Oc1ccnc(c1F)Br 1P008V8W [0,2,0,0,0,0|1,0,0]=3 4587 B9R1.3 Oc1ccnc(c1F)Cl 1P0081M8 [0,2,0,0,0,0|1,0,0]=3 4588 B9R1.3 Oc1ccnc(c1N)C 1P028QPS [0,2,0,0,0,0|1,0,0]=3 4589 B9R1.3 Oc1ccnc(c1N)Cl 1P000M5D [0,2,0,0,0,0|1,0,0]=3 4590 B9R1.3 Oc1cn[nH]c(=O)c1Cl 1P00EGMN [0,2,0,0,0,0|2,0,0]=4 4591 B9R1.3 Oc1nc[nH]c(=O)c1Br 1P001PT9 [0,2,0,0,0,0|2,0,0]=4 4592 B9R1.3 Oc1nc[nH]c(=O)c1C 1P0027ZH [0,2,0,0,0,0|2,0,0]=4 4593 B9R1.3 Oc1nc[nH]c(=O)c1Cl 1P000J0T [0,2,0,0,0,0|2,0,0]=4 4594 B9R1.3 Oc1nc[nH]c(=O)c1I 1P00A0SN [0,2,0,0,0,0|2,0,0]=4 4595 B9R1.3 Oc1ncnc(c1C)O 1P00IM60 [0,2,0,0,0,0|2,0,0]=4 4596 B9R1.3 Oc1ncnc(c1F)O 1P003N85 [0,2,0,0,0,0|2,0,0]=4 4597 B9R1.3 Oc1ncnc(c1N)O 1P003MUL [0,2,0,0,0,0|2,0,0]=4 4598 B9R1.3 Sc1c(C)cccc1Cl 1P002HHE [0,2,0,0,0,0|2,0,0]=4 4599 B9R1.3 Sc1c(C)cccc1F 1P01FFLZ [0,2,0,0,0,0|2,0,0]=4 4600 B9R1.3 Sc1c(C)cccc1N 1P01B6VH [0,2,0,0,0,0|1,0,0]=3 4601 B9R1.3 Sc1c(Cl)cccc1Br 1P01B9K2 [0,2,0,0,0,0|2,0,0]=4 4602 B9R1.3 Sc1c(F)cccc1Br 1P01B9MZ [0,2,0,0,0,0|2,0,0]=4 4603 B9R1.3 Sc1c(F)cccc1Cl 1P01BL0L [0,2,0,0,0,0|2,0,0]=4 4604 B9R1.3 Sc1c(N)cccc1Cl 1P019W1V [0,2,0,0,0,0|1,0,0]=3 4605 B9R1.3 Sc1c(N)cccc1F 1P01A3FJ [0,2,0,0,0,0|1,0,0]=3 4606 B9R1.3 Sc1c(N)cccc1F 1P02837Y [0,2,0,0,0,0|1,0,0]=3 4607 B9R1.3 Sc1c(O)cccc1Br 1P004F6E [0,2,0,0,0,0|2,0,0]=4 4608 B9R1.3 Sc1c(O)cccc1F 1P0285BP [0,2,0,0,0,0|2,0,0]=4 4609 B9R1.3 Sc1ccnc(c1Cl)C 1P028YNR [0,2,0,0,0,0|1,0,0]=3 4610 B9R1.3 Sc1ccnc(c1Cl)N 1P01JV12 [0,2,0,0,0,0|1,0,0]=3 4611 B9R1.3 Sc1ccnc(c1Cl)N 1P01K8EH [0,2,0,0,0,0|1,0,0]=3 4612 B9R1.34 Brc1cc(Br)cc(c1)Br 1P00331R [0,2,0,0,0,0|2,0,0]=4 4613 B9R1.34 Brc1cc(Br)cc(c1)I 1P002BBY [0,2,0,0,0,0|2,0,0]=4 4614 B9R1.34 Brc1cc(Br)nc(c1)Br 1P006XUG [0,2,0,0,0,0|1,0,0]=3 4615 B9R1.34 Brc1cc(Br)nc(n1)Br 1P003G3B [0,2,0,0,0,0|2,0,0]=4 4616 B9R1.34 Brc1cc(Br)nc(n1)C 1P01A5NS [0,2,0,0,0,0|2,0,0]=4 4617 B9R1.34 Brc1cc(Br)nc(n1)N 1P004TL7 [0,2,0,0,0,0|2,0,0]=4 4618 B9R1.34 Brc1cc(C)[nH]c(=O)c1 1P00KA9J [0,2,0,0,0,0|1,0,1]=4 4619 B9R1.34 Brc1cc(C)nc(c1)Br 1P00GAMS [0,2,0,0,0,0|1,0,0]=3 4620 B9R1.34 Brc1cc(C)nc(c1)C 1P0037LN [0,2,0,0,0,0|1,0,0]=3 4621 B9R1.34 Brc1cc(C)nc(c1)Cl 1P0092J5 [0,2,0,0,0,0|1,0,0]=3 4622 B9R1.34 Brc1cc(C)nc(c1)F 1P000JS2 [0,2,0,0,0,0|1,0,0]=3 4623 B9R1.34 Brc1cc(C)nc(c1)N 1P003957 [0,2,0,0,0,0|1,0,0]=3 4624 B9R1.34 Brc1cc(C)nc(c1)O 1P004MH2 [0,2,0,0,0,0|1,0,0]=3 4625 B9R1.34 Brc1cc(C)oc(=O)c1 1P0011AP [0,2,0,0,0,0|2,0,0]=4 4626 B9R1.34 Brc1cc(Cl)nc(c1)Cl 1P0034DT [0,2,0,0,0,0|1,0,0]=3 4627 B9R1.34 Brc1cc(F)[nH]c(=O)c1 1P009DG1 [0,2,0,0,0,0|1,0,1]=4 4628 B9R1.34 Brc1cc(F)nc(c1)Br 1P01KKW5 [0,2,0,0,0,0|1,0,0]=3 4629 B9R1.34 Brc1cc(F)nc(c1)F 1P0037FK [0,2,0,0,0,0|1,0,0]=3 4630 B9R1.34 Brc1cc(I)cc(c1)I 1P001M5C [0,2,0,0,0,0|2,0,0]=4 4631 B9R1.34 Brc1cc(I)nc(n1)Cl 1P027TSP [0,2,0,0,0,0|2,0,0]=4 4632 B9R1.34 Brc1cc(N)nc(c1)Br 1P00CB7Z [0,2,0,0,0,0|1,0,0]=3 4633 B9R1.34 Brc1cc(N)nc(c1)Cl 1P00HG0B [0,2,0,0,0,0|1,0,0]=3 4634 B9R1.34 Brc1cc(N)nc(c1)F 1P01JZA4 [0,2,0,0,0,0|1,0,0]=3 4635 B9R1.34 Brc1cc(N)nc(c1)N 1P0034FD [0,2,0,0,0,0|1,0,0]=3 4636 B9R1.34 Cc1[nH]c(C)cc(=O)c1 1P005EJC [0,2,0,0,0,0|1,0,1]=4 4637 B9R1.34 Cc1cc(Br)cc(c1)Br 1P001SMB [0,2,0,0,0,0|2,0,0]=4 4638 B9R1.34 Cc1cc(Br)nc(c1)Br 1P003GIY [0,2,0,0,0,0|1,0,0]=3 4639 B9R1.34 Cc1cc(Br)nc(n1)C 1P0036H5 [0,2,0,0,0,0|2,0,0]=4 4640 B9R1.34 Cc1cc(Br)nc(n1)Cl 1P021Z92 [0,2,0,0,0,0|2,0,0]=4 4641 B9R1.34 Cc1cc(Br)nc(n1)N 1P00EISY [0,2,0,0,0,0|2,0,0]=4 4642 B9R1.34 Cc1cc(C)[nH]c(=O)c1 1P001SOH [0,2,0,0,0,0|1,0,1]=4 4643 B9R1.34 Cc1cc(C)[nH]c(=O)n1 1P003HV1 [0,2,0,0,0,0|2,0,0]=4 4644 B9R1.34 Cc1cc(C)[nH]c(=O)n1 1P028LUT [0,2,0,0,0,0|2,0,0]=4 4645 B9R1.34 Cc1cc(C)[nH]c(=S)n1 1P003HYO [0,2,0,0,0,0|2,0,0]=4 4646 B9R1.34 Cc1cc(C)[o+]c(c1)C 1P0033FC [0,2,0,0,0,0|2,0,0]=4 4647 B9R1.34 Cc1cc(C)[o+]c(c1)C 1P006SK0 [0,2,0,0,0,0|2,0,0]=4 4648 B9R1.34 Cc1cc(C)cc(c1)Br 1P00336A [0,2,0,0,0,0|2,0,0]=4 4649 B9R1.34 Cc1cc(C)cc(c1)C 1P003PTO [0,2,0,0,0,0|2,0,0]=4 4650 B9R1.34 Cc1cc(C)cc(c1)C 1P003RXS [0,2,0,0,0,0|2,0,0]=4 4651 B9R1.34 Cc1cc(C)cc(c1)C 1P003RXU [0,2,0,0,0,0|2,0,0]=4 4652 B9R1.34 Cc1cc(C)cc(c1)Cl 1P003N5C [0,2,0,0,0,0|2,0,0]=4 4653 B9R1.34 Cc1cc(C)cc(c1)F 1P006XRI [0,2,0,0,0,0|2,0,0]=4 4654 B9R1.34 Cc1cc(C)cc(c1)I 1P003394 [0,2,0,0,0,0|2,0,0]=4 4655 B9R1.34 Cc1cc(C)cc(c1)N 1P003J5D [0,2,0,0,0,0|1,0,0]=3 4656 B9R1.34 Cc1cc(C)cc(c1)O 1P0038OZ [0,2,0,0,0,0|2,0,0]=4 4657 B9R1.34 Cc1cc(C)cc(c1)S 1P003J5F [0,2,0,0,0,0|2,0,0]=4 4658 B9R1.34 Cc1cc(C)nc(c1)Br 1P0036L0 [0,2,0,0,0,0|1,0,0]=3 4659 B9R1.34 Cc1cc(C)nc(c1)C 1P0033F3 [0,2,0,0,0,0|1,0,0]=3 4660 B9R1.34 Cc1cc(C)nc(c1)Cl 1P0031XD [0,2,0,0,0,0|1,0,0]=3 4661 B9R1.34 Cc1cc(C)nc(c1)N 1P003GVD [0,2,0,0,0,0|1,0,0]=3 4662 B9R1.34 Cc1cc(C)nc(c1)S 1P01B1VQ [0,2,0,0,0,0|1,0,0]=3 4663 B9R1.34 Cc1cc(C)nc(n1)Br 1P001YRP [0,2,0,0,0,0|2,0,0]=4 4664 B9R1.34 Cc1cc(C)nc(n1)C 1P028XLK [0,2,0,0,0,0|2,0,0]=4 4665 B9R1.34 Cc1cc(C)nc(n1)Cl 1P00I8XA [0,2,0,0,0,0|2,0,0]=4 4666 B9R1.34 Cc1cc(C)nc(n1)I 1P001YRO [0,2,0,0,0,0|2,0,0]=4 4667 B9R1.34 Cc1cc(C)nc(n1)N 1P003O4G [0,2,0,0,0,0|2,0,0]=4 4668 B9R1.34 Cc1cc(C)nc(n1)O 1P003L0H [0,2,0,0,0,0|2,0,0]=4 4669 B9R1.34 Cc1cc(C)nc(n1)[S-] 1P003HYP [0,2,0,0,0,0|2,0,0]=4 4670 B9R1.34 Cc1cc(C)oc(=O)c1 1P003L0E [0,2,0,0,0,0|2,0,0]=4 4671 B9R1.34 Cc1cc(Cl)cc(c1)Br 1P003JJA [0,2,0,0,0,0|2,0,0]=4 4672 B9R1.34 Cc1cc(Cl)cc(c1)Cl 1P002R9V [0,2,0,0,0,0|2,0,0]=4 4673 B9R1.34 Cc1cc(Cl)cc(c1)I 1P00943U [0,2,0,0,0,0|2,0,0]=4 4674 B9R1.34 Cc1cc(Cl)nc(c1)Br 1P001PU1 [0,2,0,0,0,0|1,0,0]=3 4675 B9R1.34 Cc1cc(Cl)nc(c1)Cl 1P003GJN [0,2,0,0,0,0|1,0,0]=3 4676 B9R1.34 Cc1cc(Cl)nc(n1)C 1P0034FS [0,2,0,0,0,0|2,0,0]=4 4677 B9R1.34 Cc1cc(Cl)nc(n1)Cl 1P0033FS [0,2,0,0,0,0|2,0,0]=4 4678 B9R1.34 Cc1cc(Cl)nc(n1)N 1P003GVM [0,2,0,0,0,0|2,0,0]=4 4679 B9R1.34 Cc1cc(Cl)nc(n1)[O-] 1P0281SQ [0,2,0,0,0,0|2,0,0]=4 4680 B9R1.34 Cc1cc(F)cc(c1)Br 1P0028YS [0,2,0,0,0,0|2,0,0]=4 4681 B9R1.34 Cc1cc(F)cc(c1)Cl 1P00GV61 [0,2,0,0,0,0|2,0,0]=4 4682 B9R1.34 Cc1cc(F)cc(c1)F 1P000EN9 [0,2,0,0,0,0|2,0,0]=4 4683 B9R1.34 Cc1cc(F)cc(c1)I 1P003ESM [0,2,0,0,0,0|2,0,0]=4 4684 B9R1.34 Cc1cc(F)nc(c1)Br 1P0022N8 [0,2,0,0,0,0|1,0,0]=3 4685 B9R1.34 Cc1cc(F)nc(n1)C 1P00DC8A [0,2,0,0,0,0|2,0,0]=4 4686 B9R1.34 Cc1cc(F)nc(n1)Cl 1P027UEP [0,2,0,0,0,0|2,0,0]=4 4687 B9R1.34 Cc1cc(F)nc(n1)F 1P00FGJS [0,2,0,0,0,0|2,0,0]=4 4688 B9R1.34 Cc1cc(F)nc(n1)N 1P00ANEM [0,2,0,0,0,0|2,0,0]=4 4689 B9R1.34 Cc1cc(I)cc(c1)I 1P006ZYJ [0,2,0,0,0,0|2,0,0]=4 4690 B9R1.34 Cc1cc(N)cc(c1)Br 1P005JTO [0,2,0,0,0,0|1,0,0]=3 4691 B9R1.34 Cc1cc(N)cc(c1)Br 1P00IJTR [0,2,0,0,0,0|1,0,0]=3 4692 B9R1.34 Cc1cc(N)cc(c1)Cl 1P002VP5 [0,2,0,0,0,0|1,0,0]=3 4693 B9R1.34 Cc1cc(N)cc(c1)F 1P003JXK [0,2,0,0,0,0|1,0,0]=3 4694 B9R1.34 Cc1cc(N)cc(c1)I 1P01BB12 [0,2,0,0,0,0|1,0,0]=3 4695 B9R1.34 Cc1cc(N)cc(c1)N 1P01C0PE [0,2,0,0,0,0|1,0,0]=3 4696 B9R1.34 Cc1cc(N)cc(c1)O 1P005JQZ [0,2,0,0,0,0|1,0,0]=3 4697 B9R1.34 Cc1cc(N)nc(c1)Br 1P0038WY [0,2,0,0,0,0|1,0,0]=3 4698 B9R1.34 Cc1cc(N)nc(c1)Cl 1P006VPW [0,2,0,0,0,0|1,0,0]=3 4699 B9R1.34 Cc1cc(N)nc(c1)F 1P01DH70 [0,2,0,0,0,0|1,0,0]=3 4700 B9R1.34 Cc1cc(N)nc(c1)N 1P00C5PT [0,2,0,0,0,0|1,0,0]=3 4701 B9R1.34 Cc1cc(N)nc(n1)C 1P003GMI [0,2,0,0,0,0|1,0,0]=3 4702 B9R1.34 Cc1cc(N)nc(n1)Cl 1P001J41 [0,2,0,0,0,0|1,0,0]=3 4703 B9R1.34 Cc1cc(N)nc(n1)N 1P002793 [0,2,0,0,0,0|1,0,0]=3 4704 B9R1.34 Cc1cc(N)nc(n1)N 1P01EKIZ [0,2,0,0,0,0|1,0,0]=3 4705 B9R1.34 Cc1cc(N)nc(n1)S 1P01DNV3 [0,2,0,0,0,0|1,0,0]=3 4706 B9R1.34 Cc1cc(O)[nH]c(=O)c1 1P00I91O [0,2,0,0,0,0|1,0,1]=4 4707 B9R1.34 Cc1cc(O)cc(c1)Br 1P008RG4 [0,2,0,0,0,0|2,0,0]=4 4708 B9R1.34 Cc1cc(O)cc(c1)Cl 1P00EI3O [0,2,0,0,0,0|2,0,0]=4 4709 B9R1.34 Cc1cc(O)cc(c1)F 1P003JXG [0,2,0,0,0,0|2,0,0]=4 4710 B9R1.34 Cc1cc(O)cc(c1)O 1P00I9IN [0,2,0,0,0,0|2,0,0]=4 4711 B9R1.34 Cc1cc(O)cc(c1)O 1P00IBCI [0,2,0,0,0,0|2,0,0]=4 4712 B9R1.34 Cc1cc(O)nc(c1)Cl 1P01KL71 [0,2,0,0,0,0|1,0,0]=3 4713 B9R1.34 Cc1cc(O)nc(n1)C 1P00FACV [0,2,0,0,0,0|2,0,0]=4 4714 B9R1.34 Cc1cc(O)nc(n1)Cl 1P00EYET [0,2,0,0,0,0|2,0,0]=4 4715 B9R1.34 Cc1cc(O)nc(n1)N 1P0033K0 [0,2,0,0,0,0|2,0,0]=4 4716 B9R1.34 Cc1cc(O)nc(n1)O 1P0033G5 [0,2,0,0,0,0|2,0,0]=4 4717 B9R1.34 Cc1cc(O)nc(n1)S 1P0034U3 [0,2,0,0,0,0|2,0,0]=4 4718 B9R1.34 Cc1cc(S)nc(n1)C 1P00EYEB [0,2,0,0,0,0|2,0,0]=4 4719 B9R1.34 Cc1cc(S)nc(n1)N 1P00EEE4 [0,2,0,0,0,0|2,0,0]=4 4720 B9R1.34 Cc1nc(C)nc(n1)N 1P01DZLQ [0,2,0,0,0,0|2,0,0]=4 4721 B9R1.34 Cc1nc(N)[nH]c(=O)n1 1P001UN4 [0,2,0,0,0,0|2,0,0]=4 4722 B9R1.34 Cc1nc(N)nc(n1)Cl 1P00JED5 [0,2,0,0,0,0|2,0,0]=4 4723 B9R1.34 Cc1nc(N)nc(n1)N 1P003G5U [0,2,0,0,0,0|2,0,0]=4 4724 B9R1.34 Cc1nc(N)nc(n1)S 1P00BX2J [0,2,0,0,0,0|2,0,0]=4 4725 B9R1.34 Cc1oc(C)cc(=O)c1 1P0002DO [0,2,0,0,0,0|2,0,0]=4 4726 B9R1.34 Cc1oc(C)cc(=S)c1 1P0002DN [0,2,0,0,0,0|2,0,0]=4 4727 B9R1.34 Cc1oc(O)cc(=O)c1 1P005X5O [0,2,0,0,0,0|2,0,0]=4 4728 B9R1.34 Clc1cc(Br)cc(c1)Br 1P001LKC [0,2,0,0,0,0|2,0,0]=4 4729 B9R1.34 Clc1cc(Br)cc(c1)I 1P000VSK [0,2,0,0,0,0|2,0,0]=4 4730 B9R1.34 Clc1cc(Br)nc(c1)Br 1P000PTE [0,2,0,0,0,0|1,0,0]=3 4731 B9R1.34 Clc1cc(Br)nc(n1)Cl 1P01DXEG [0,2,0,0,0,0|2,0,0]=4 4732 B9R1.34 Clc1cc(C)[nH]c(=N)c1 1P0037S4 [0,2,0,0,0,0|1,0,1]=4 4733 B9R1.34 Clc1cc(C)[nH]c(=O)c1 1P000JSV [0,2,0,0,0,0|1,0,1]=4 4734 B9R1.34 Clc1cc(C)nc(c1)C 1P003LJJ [0,2,0,0,0,0|1,0,0]=3 4735 B9R1.34 Clc1cc(C)nc(c1)Cl 1P003G7L [0,2,0,0,0,0|1,0,0]=3 4736 B9R1.34 Clc1cc(C)nc(c1)F 1P000JQC [0,2,0,0,0,0|1,0,0]=3 4737 B9R1.34 Clc1cc(Cl)[nH]c(=O)c1 1P00FF8G [0,2,0,0,0,0|1,0,1]=4 4738 B9R1.34 Clc1cc(Cl)[nH]c(=O)n1 1P00EIVZ [0,2,0,0,0,0|2,0,0]=4 4739 B9R1.34 Clc1cc(Cl)cc(c1)Br 1P002BBZ [0,2,0,0,0,0|2,0,0]=4 4740 B9R1.34 Clc1cc(Cl)cc(c1)Cl 1P0083QZ [0,2,0,0,0,0|2,0,0]=4 4741 B9R1.34 Clc1cc(Cl)cc(c1)I 1P00308R [0,2,0,0,0,0|2,0,0]=4 4742 B9R1.34 Clc1cc(Cl)nc(c1)Br 1P01ONUZ [0,2,0,0,0,0|1,0,0]=3 4743 B9R1.34 Clc1cc(Cl)nc(c1)Cl 1P001SJH [0,2,0,0,0,0|1,0,0]=3 4744 B9R1.34 Clc1cc(Cl)nc(n1)Br 1P001CAE [0,2,0,0,0,0|2,0,0]=4 4745 B9R1.34 Clc1cc(Cl)nc(n1)C 1P00266O [0,2,0,0,0,0|2,0,0]=4 4746 B9R1.34 Clc1cc(Cl)nc(n1)Cl 1P003G3L [0,2,0,0,0,0|2,0,0]=4 4747 B9R1.34 Clc1cc(Cl)nc(n1)F 1P00CMVX [0,2,0,0,0,0|2,0,0]=4 4748 B9R1.34 Clc1cc(Cl)nc(n1)I 1P00HRZK [0,2,0,0,0,0|2,0,0]=4 4749 B9R1.34 Clc1cc(Cl)nc(n1)N 1P003GVB [0,2,0,0,0,0|2,0,0]=4 4750 B9R1.34 Clc1cc(Cl)oc(=O)c1 1P028YKY [0,2,0,0,0,0|2,0,0]=4 4751 B9R1.34 Clc1cc(F)nc(c1)Cl 1P01X9QG [0,2,0,0,0,0|1,0,0]=3 4752 B9R1.34 Clc1cc(F)nc(c1)F 1P01KLB8 [0,2,0,0,0,0|1,0,0]=3 4753 B9R1.34 Clc1cc(I)nc(n1)Cl 1P01ELKW [0,2,0,0,0,0|2,0,0]=4 4754 B9R1.34 Clc1cc(N)nc(c1)Br 1P00931D [0,2,0,0,0,0|1,0,0]=3 4755 B9R1.34 Clc1cc(N)nc(c1)Cl 1P000DDY [0,2,0,0,0,0|1,0,0]=3 4756 B9R1.34 Clc1cc(N)nc(c1)Cl 1P0095OK [0,2,0,0,0,0|1,0,0]=3 4757 B9R1.34 Clc1cc(N)nc(c1)F 1P01BDRK [0,2,0,0,0,0|1,0,0]=3 4758 B9R1.34 Clc1cc(N)nc(c1)N 1P00EAYK [0,2,0,0,0,0|1,0,0]=3 4759 B9R1.34 Clc1nc(Cl)[nH]c(=O)c1 1P008ZHO [0,2,0,0,0,0|2,0,0]=4 4760 B9R1.34 Fc1cc(Br)cc(c1)Br 1P003327 [0,2,0,0,0,0|2,0,0]=4 4761 B9R1.34 Fc1cc(Br)cc(c1)I 1P0036LE [0,2,0,0,0,0|2,0,0]=4 4762 B9R1.34 Fc1cc(Br)nc(c1)Br 1P0015B7 [0,2,0,0,0,0|1,0,0]=3 4763 B9R1.34 Fc1cc(C)nc(c1)Br 1P01UQI9 [0,2,0,0,0,0|1,0,0]=3 4764 B9R1.34 Fc1cc(C)nc(c1)C 1P00CFFD [0,2,0,0,0,0|1,0,0]=3 4765 B9R1.34 Fc1cc(C)nc(c1)F 1P008J9J [0,2,0,0,0,0|1,0,0]=3 4766 B9R1.34 Fc1cc(Cl)cc(c1)Br 1P003EKP [0,2,0,0,0,0|2,0,0]=4 4767 B9R1.34 Fc1cc(Cl)cc(c1)Cl 1P003J2J [0,2,0,0,0,0|2,0,0]=4 4768 B9R1.34 Fc1cc(Cl)cc(c1)I 1P00HS3I [0,2,0,0,0,0|2,0,0]=4 4769 B9R1.34 Fc1cc(Cl)nc(n1)C 1P0283V1 [0,2,0,0,0,0|2,0,0]=4 4770 B9R1.34 Fc1cc(Cl)nc(n1)Cl 1P00CJHA [0,2,0,0,0,0|2,0,0]=4 4771 B9R1.34 Fc1cc(F)cc(c1)Br 1P003369 [0,2,0,0,0,0|2,0,0]=4 4772 B9R1.34 Fc1cc(F)cc(c1)Cl 1P003J3K [0,2,0,0,0,0|2,0,0]=4 4773 B9R1.34 Fc1cc(F)cc(c1)F 1P003DX5 [0,2,0,0,0,0|2,0,0]=4 4774 B9R1.34 Fc1cc(F)cc(c1)I 1P003E0D [0,2,0,0,0,0|2,0,0]=4 4775 B9R1.34 Fc1cc(F)cc(c1)S 1P003745 [0,2,0,0,0,0|2,0,0]=4 4776 B9R1.34 Fc1cc(F)nc(c1)Br 1P00BYKR [0,2,0,0,0,0|1,0,0]=3 4777 B9R1.34 Fc1cc(F)nc(c1)F 1P0032PR [0,2,0,0,0,0|1,0,0]=3 4778 B9R1.34 Fc1cc(F)nc(n1)C 1P00B6X0 [0,2,0,0,0,0|2,0,0]=4 4779 B9R1.34 Fc1cc(F)nc(n1)F 1P003G3T [0,2,0,0,0,0|2,0,0]=4 4780 B9R1.34 Fc1cc(F)nc(n1)N 1P00IC6I [0,2,0,0,0,0|2,0,0]=4 4781 B9R1.34 Fc1cc(N)nc(c1)F 1P00GXMD [0,2,0,0,0,0|1,0,0]=3 4782 B9R1.34 Fc1cc(S)cc(c1)Br 1P01BL16 [0,2,0,0,0,0|2,0,0]=4 4783 B9R1.34 Ic1cc(Br)nc(c1)Br 1P000BU8 [0,2,0,0,0,0|1,0,0]=3 4784 B9R1.34 Ic1cc(C)nc(c1)Cl 1P00HHDV [0,2,0,0,0,0|1,0,0]=3 4785 B9R1.34 Ic1cc(C)nc(c1)F 1P0033RP [0,2,0,0,0,0|1,0,0]=3 4786 B9R1.34 Ic1cc(Cl)nc(c1)Cl 1P0033HS [0,2,0,0,0,0|1,0,0]=3 4787 B9R1.34 Ic1cc(F)nc(c1)F 1P00FGGN [0,2,0,0,0,0|1,0,0]=3 4788 B9R1.34 Ic1cc(I)cc(c1)I 1P00E9FI [0,2,0,0,0,0|2,0,0]=4 4789 B9R1.34 Ic1cc(I)nc(n1)C 1P006O0S [0,2,0,0,0,0|2,0,0]=4 4790 B9R1.34 Ic1cc(N)nc(c1)Cl 1P01DNKH [0,2,0,0,0,0|1,0,0]=3 4791 B9R1.34 N[13c]1n[13c](N)n[13c](n1)Cl 1P009EXC [0,2,0,0,0,0|2,0,0]=4 4792 B9R1.34 Nc1cc(=O)[nH]c(=N)[nH]1 1P00IAGC [0,2,0,0,0,0|1,0,1]=4 4793 B9R1.34 Nc1cc(=O)[nH]c(=O)[nH]1 1P003L53 [0,2,0,0,0,0|1,0,1]=4 4794 B9R1.34 Nc1cc(=O)[nH]c(=S)[nH]1 1P0038QD [0,2,0,0,0,0|1,0,1]=4 4795 B9R1.34 Nc1cc(=O)[nH]c(=S)[nH]1 1P003L71 [0,2,0,0,0,0|1,0,1]=4 4796 B9R1.34 Nc1cc(=O)[nH]c(n1)Cl 1P003NIY [0,2,0,0,0,0|1,0,1]=4 4797 B9R1.34 Nc1cc(Br)cc(c1)Br 1P002HAV [0,2,0,0,0,0|1,0,0]=3 4798 B9R1.34 Nc1cc(Br)cc(c1)Br 1P0037NU [0,2,0,0,0,0|1,0,0]=3 4799 B9R1.34 Nc1cc(Br)cc(c1)I 1P007IKY [0,2,0,0,0,0|1,0,0]=3 4800 B9R1.34 Nc1cc(Br)nc(c1)Br 1P003L50 [0,2,0,0,0,0|0,0,0]=2 4801 B9R1.34 Nc1cc(Br)nc(n1)C 1P000CA3 [0,2,0,0,0,0|1,0,0]=3 4802 B9R1.34 Nc1cc(Br)nc(n1)N 1P0282JM [0,2,0,0,0,0|1,0,0]=3 4803 B9R1.34 Nc1cc(C)[nH]c(=O)n1 1P01A4RX [0,2,0,0,0,0|1,0,1]=4 4804 B9R1.34 Nc1cc(C)nc(c1)Br 1P005CTE [0,2,0,0,0,0|0,0,0]=2 4805 B9R1.34 Nc1cc(C)nc(c1)C 1P003GMG [0,2,0,0,0,0|0,0,0]=2 4806 B9R1.34 Nc1cc(C)nc(c1)Cl 1P0054E3 [0,2,0,0,0,0|0,0,0]=2 4807 B9R1.34 Nc1cc(C)nc(c1)F 1P001TEU [0,2,0,0,0,0|0,0,0]=2 4808 B9R1.34 Nc1cc(C)nc(c1)O 1P01KL0X [0,2,0,0,0,0|0,0,0]=2 4809 B9R1.34 Nc1cc(C)oc(=O)c1 1P00AI4Y [0,2,0,0,0,0|1,0,0]=3 4810 B9R1.34 Nc1cc(Cl)[nH]c(=O)c1 1P000JUK [0,2,0,0,0,0|0,0,1]=3 4811 B9R1.34 Nc1cc(Cl)[nH]c(=O)n1 1P01DWVP [0,2,0,0,0,0|1,0,1]=4 4812 B9R1.34 Nc1cc(Cl)cc(c1)Br 1P0037BR [0,2,0,0,0,0|1,0,0]=3 4813 B9R1.34 Nc1cc(Cl)cc(c1)Cl 1P003J2A [0,2,0,0,0,0|1,0,0]=3 4814 B9R1.34 Nc1cc(Cl)nc(c1)Br 1P028EDV [0,2,0,0,0,0|0,0,0]=2 4815 B9R1.34 Nc1cc(Cl)nc(c1)Cl 1P0034CP [0,2,0,0,0,0|0,0,0]=2 4816 B9R1.34 Nc1cc(Cl)nc(n1)C 1P0020I7 [0,2,0,0,0,0|1,0,0]=3 4817 B9R1.34 Nc1cc(Cl)nc(n1)Cl 1P0004OU [0,2,0,0,0,0|1,0,0]=3 4818 B9R1.34 Nc1cc(Cl)nc(n1)N 1P001OVL [0,2,0,0,0,0|1,0,0]=3 4819 B9R1.34 Nc1cc(F)[nH]c(=O)c1 1P009QHV [0,2,0,0,0,0|0,0,1]=3 4820 B9R1.34 Nc1cc(F)cc(c1)Br 1P003JXE [0,2,0,0,0,0|1,0,0]=3 4821 B9R1.34 Nc1cc(F)cc(c1)Br 1P009XJT [0,2,0,0,0,0|1,0,0]=3 4822 B9R1.34 Nc1cc(F)cc(c1)Cl 1P003JPW [0,2,0,0,0,0|1,0,0]=3 4823 B9R1.34 Nc1cc(F)cc(c1)F 1P003J3E [0,2,0,0,0,0|1,0,0]=3 4824 B9R1.34 Nc1cc(F)cc(c1)I 1P0036Z5 [0,2,0,0,0,0|1,0,0]=3 4825 B9R1.34 Nc1cc(F)cc(c1)S 1P01AJVF [0,2,0,0,0,0|1,0,0]=3 4826 B9R1.34 Nc1cc(F)nc(c1)F 1P00EAAA [0,2,0,0,0,0|0,0,0]=2 4827 B9R1.34 Nc1cc(F)nc(n1)C 1P00B6TT [0,2,0,0,0,0|1,0,0]=3 4828 B9R1.34 Nc1cc(F)nc(n1)F 1P006FXD [0,2,0,0,0,0|1,0,0]=3 4829 B9R1.34 Nc1cc(F)nc(n1)N 1P005JMX [0,2,0,0,0,0|1,0,0]=3 4830 B9R1.34 Nc1cc(I)cc(c1)I 1P00CO1B [0,2,0,0,0,0|1,0,0]=3 4831 B9R1.34 Nc1cc(I)cc(c1)I 1P01BBMO [0,2,0,0,0,0|1,0,0]=3 4832 B9R1.34 Nc1cc(I)nc(n1)C 1P005ZOM [0,2,0,0,0,0|1,0,0]=3 4833 B9R1.34 Nc1cc(I)nc(n1)N 1P00FGIN [0,2,0,0,0,0|1,0,0]=3 4834 B9R1.34 Nc1cc(N)[nH]c(=O)n1 1P01KLD3 [0,2,0,0,0,0|1,0,0]=3 4835 B9R1.34 Nc1cc(N)[nH]c(=S)n1 1P0002DL [0,2,0,0,0,0|1,0,0]=3 4836 B9R1.34 Nc1cc(N)cc(c1)Br 1P0037UO [0,2,0,0,0,0|1,0,0]=3 4837 B9R1.34 Nc1cc(N)cc(c1)Cl 1P003N5B [0,2,0,0,0,0|1,0,0]=3 4838 B9R1.34 Nc1cc(N)cc(c1)F 1P01ALLA [0,2,0,0,0,0|1,0,0]=3 4839 B9R1.34 Nc1cc(N)cc(c1)I 1P007VQ2 [0,2,0,0,0,0|1,0,0]=3 4840 B9R1.34 Nc1cc(N)cc(c1)N 1P0039R0 [0,2,0,0,0,0|1,0,0]=3 4841 B9R1.34 Nc1cc(N)cc(c1)N 1P004OED [0,2,0,0,0,0|1,0,0]=3 4842 B9R1.34 Nc1cc(N)cc(c1)N 1P007UL8 [0,2,0,0,0,0|1,0,0]=3 4843 B9R1.34 Nc1cc(N)nc(c1)Cl 1P01FJ5V [0,2,0,0,0,0|0,0,0]=2 4844 B9R1.34 Nc1cc(N)nc(n1)C 1P002B3J [0,2,0,0,0,0|1,0,0]=3 4845 B9R1.34 Nc1cc(N)nc(n1)C 1P028Q8D [0,2,0,0,0,0|1,0,0]=3 4846 B9R1.34 Nc1cc(N)nc(n1)Cl 1P00DKVT [0,2,0,0,0,0|1,0,0]=3 4847 B9R1.34 Nc1cc(N)nc(n1)N 1P0002DM [0,2,0,0,0,0|1,0,0]=3 4848 B9R1.34 Nc1cc(O)cc(c1)Br 1P00027J [0,2,0,0,0,0|1,0,0]=3 4849 B9R1.34 Nc1cc(O)cc(c1)Cl 1P00IFIB [0,2,0,0,0,0|1,0,0]=3 4850 B9R1.34 Nc1cc(O)cc(c1)F 1P000DI7 [0,2,0,0,0,0|1,0,0]=3 4851 B9R1.34 Nc1cc(O)cc(c1)F 1P027YU7 [0,2,0,0,0,0|1,0,0]=3 4852 B9R1.34 Nc1cc(O)cc(c1)O 1P00BLIJ [0,2,0,0,0,0|1,0,0]=3 4853 B9R1.34 Nc1cc(O)cc(c1)O 1P00ED5R [0,2,0,0,0,0|1,0,0]=3 4854 B9R1.34 Nc1cc(O)nc(n1)C 1P003L72 [0,2,0,0,0,0|1,0,0]=3 4855 B9R1.34 Nc1cc(O)nc(n1)C 1P008PX1 [0,2,0,0,0,0|1,0,0]=3 4856 B9R1.34 Nc1cc(O)nc(n1)C 1P00IMT3 [0,2,0,0,0,0|1,0,0]=3 4857 B9R1.34 Nc1cc(O)nc(n1)N 1P00030Z [0,2,0,0,0,0|1,0,0]=3 4858 B9R1.34 Nc1nc(Cl)nc(n1)Cl 1P0034C1 [0,2,0,0,0,0|2,0,0]=4 4859 B9R1.34 Nc1nc(N)[nH]c(=O)c1 1P00AI9E [0,2,0,0,0,0|1,0,1]=4 4860 B9R1.34 Nc1nc(N)[nH]c(=S)c1 1P0031LJ [0,2,0,0,0,0|1,0,1]=4 4861 B9R1.34 Nc1nc(N)nc(n1)Cl 1P003HDF [0,2,0,0,0,0|2,0,0]=4 4862 B9R1.34 Nc1nc(N)nc(n1)N 1P00HBIV [0,2,0,0,0,0|2,0,0]=4 4863 B9R1.34 Nc1nc(N)nc(n1)O 1P003OAT [0,2,0,0,0,0|2,0,0]=4 4864 B9R1.34 Nc1nc(N)nc(n1)S 1P005AZU [0,2,0,0,0,0|2,0,0]=4 4865 B9R1.34 Nc1nc(O)nc(n1)O 1P003OAS [0,2,0,0,0,0|2,0,0]=4 4866 B9R1.34 O=C1CC(=CC(=O)N1)N 1P00B2G5 [0,2,0,0,0,0|0,0,2]=4 4867 B9R1.34 O=c1cc(Cl)[nH]c(n1)C 1P0021H6 [0,2,0,0,0,0|2,0,0]=4 4868 B9R1.34 O=c1cc(Cl)[nH]c(n1)N 1P000J5I [0,2,0,0,0,0|2,0,0]=4 4869 B9R1.34 O=c1cc(O)[nH]c(n1)C 1P000J5H [0,2,0,0,0,0|2,0,0]=4 4870 B9R1.34 OC1=CC(=NC(=O)C1)C 1P001QHF [0,2,0,0,0,0|1,0,1]=4 4871 B9R1.34 Oc1cc(=O)[nH]c(n1)N 1P003GVC [0,2,0,0,0,0|2,0,0]=4 4872 B9R1.34 Oc1cc(Br)cc(c1)Br 1P00E9LN [0,2,0,0,0,0|2,0,0]=4 4873 B9R1.34 Oc1cc(Br)cc(c1)I 1P0037OB [0,2,0,0,0,0|2,0,0]=4 4874 B9R1.34 Oc1cc(Br)nc(c1)Br 1P00BIWA [0,2,0,0,0,0|1,0,0]=3 4875 B9R1.34 Oc1cc(C)[nH]c(=O)c1 1P0033G4 [0,2,0,0,0,0|1,0,1]=4 4876 B9R1.34 Oc1cc(C)nc(c1)C 1P0038BK [0,2,0,0,0,0|1,0,0]=3 4877 B9R1.34 Oc1cc(C)nc(c1)O 1P00FGTY [0,2,0,0,0,0|1,0,0]=3 4878 B9R1.34 Oc1cc(C)oc(=O)c1 1P0034IO [0,2,0,0,0,0|2,0,0]=4 4879 B9R1.34 Oc1cc(Cl)cc(c1)Br 1P003432 [0,2,0,0,0,0|2,0,0]=4 4880 B9R1.34 Oc1cc(Cl)cc(c1)Cl 1P003J2K [0,2,0,0,0,0|2,0,0]=4 4881 B9R1.34 Oc1cc(Cl)cc(c1)I 1P008FUH [0,2,0,0,0,0|2,0,0]=4 4882 B9R1.34 Oc1cc(Cl)nc(c1)Cl 1P007WKE [0,2,0,0,0,0|1,0,0]=3 4883 B9R1.34 Oc1cc(Cl)nc(n1)C 1P027ZZ0 [0,2,0,0,0,0|2,0,0]=4 4884 B9R1.34 Oc1cc(Cl)nc(n1)O 1P009TSM [0,2,0,0,0,0|2,0,0]=4 4885 B9R1.34 Oc1cc(F)cc(c1)Br 1P003JXF [0,2,0,0,0,0|2,0,0]=4 4886 B9R1.34 Oc1cc(F)cc(c1)Cl 1P00292B [0,2,0,0,0,0|2,0,0]=4 4887 B9R1.34 Oc1cc(F)cc(c1)F 1P003J3P [0,2,0,0,0,0|2,0,0]=4 4888 B9R1.34 Oc1cc(F)cc(c1)I 1P00H3IX [0,2,0,0,0,0|2,0,0]=4 4889 B9R1.34 Oc1cc(F)nc(c1)F 1P00AOYF [0,2,0,0,0,0|1,0,0]=3 4890 B9R1.34 Oc1cc(I)cc(c1)I 1P002KWN [0,2,0,0,0,0|2,0,0]=4 4891 B9R1.34 Oc1cc(N)nc(c1)Br 1P01ENA5 [0,2,0,0,0,0|1,0,0]=3 4892 B9R1.34 Oc1cc(N)nc(c1)O 1P0097XM [0,2,0,0,0,0|1,0,0]=3 4893 B9R1.34 Oc1cc(O)cc(c1)Br 1P003N1P [0,2,0,0,0,0|2,0,0]=4 4894 B9R1.34 Oc1cc(O)cc(c1)F 1P00GAPP [0,2,0,0,0,0|2,0,0]=4 4895 B9R1.34 Oc1cc(O)cc(c1)I 1P00EF5H [0,2,0,0,0,0|2,0,0]=4 4896 B9R1.34 Oc1cc(O)cc(c1)O 1P0035Y1 [0,2,0,0,0,0|2,0,0]=4 4897 B9R1.34 Oc1cc(O)cc(c1)O 1P003U7F [0,2,0,0,0,0|2,0,0]=4 4898 B9R1.34 Oc1cc(O)nc(n1)C 1P003I71 [0,2,0,0,0,0|2,0,0]=4 4899 B9R1.34 Oc1cc(O)nc(n1)N 1P01FT0R [0,2,0,0,0,0|2,0,0]=4 4900 B9R1.34 Oc1cc(O)nc(n1)S 1P006CT6 [0,2,0,0,0,0|2,0,0]=4 4901 B9R1.34 Oc1cc(S)cc(c1)Br 1P02810T [0,2,0,0,0,0|2,0,0]=4 4902 B9R1.34 Sc1cc(Cl)cc(c1)Br 1P009K58 [0,2,0,0,0,0|2,0,0]=4 4903 B9R1.34 Sc1cc(Cl)cc(c1)Cl 1P003J2E [0,2,0,0,0,0|2,0,0]=4 4904 B9R1.34 Sc1cc(S)cc(c1)Br 1P0016WZ [0,2,0,0,0,0|2,0,0]=4 4905 B9R1.34 Sc1cc(S)cc(c1)S 1P003DWU [0,2,0,0,0,0|2,0,0]=4 4906 B9R1.34 [O-]c1cc(C)nc(n1)Cl 1P01FJ60 [0,2,0,0,0,0|2,0,0]=4 4907 B7R1.24 C1=C[CH+]C=CC=C1 1P003VQ0 [0,0,1,1,0,0|2,0,0]=4 4908 B9R2.50 c1ccc2c(c1)CC2 1P003OIP [0,1,0,1,0,0|2,0,0]=4 4909 B5R1.1 C1C=CC=C1 1P003OR4 [1,0,0,0,1,0|0,0,1]=3 4910 B5R1.1 [C-]1=CC=CC1 1P003D61 [1,0,0,0,1,0|0,0,2]=4 4911 B5R1.1 [C-]1=CC=CC1 1P003OR0 [1,0,0,0,1,0|0,0,2]=4 4912 B5R1.1 [C-]1=CC=CC1 1P003PMV [1,0,0,0,1,0|0,0,2]=4 4913 B5R1.1 [CH-]1C=CC=C1 1P0006P5 [1,0,0,0,1,0|0,0,1]=3 4914 B5R1.1 [CH-]1C=CC=C1 1P000X50 [1,0,0,0,1,0|0,0,1]=3 4915 B5R1.1 [CH-]1C=CC=C1 1P000X52 [1,0,0,0,1,0|0,0,1]=3 4916 B5R1.1 [CH-]1C=CC=C1 1P000XDC [1,0,0,0,1,0|0,0,1]=3 4917 B5R1.1 [CH-]1C=CC=C1 1P000XSL [1,0,0,0,1,0|0,0,1]=3 4918 B5R1.1 [CH-]1C=CC=C1 1P000XSM [1,0,0,0,1,0|0,0,1]=3 4919 B5R1.1 [CH-]1C=CC=C1 1P000YBD [1,0,0,0,1,0|0,0,1]=3 4920 B5R1.1 [CH-]1C=CC=C1 1P000YSN [1,0,0,0,1,0|0,0,1]=3 4921 B5R1.1 [CH]1C=CC=C1 1P000X4R [1,0,0,0,1,0|0,0,1]=3 4922 B5R1.1 [CH]1C=CC=C1 1P003OQZ [1,0,0,0,1,0|0,0,1]=3 4923 B5R1.1 [CH]1C=CC=C1 1P003PMU [1,0,0,0,1,0|0,0,1]=3 4924 B5R1.1 [CH]1C=CC=C1 1P003PMW [1,0,0,0,1,0|0,0,1]=3 4925 B5R1.1 [nH]1ccnc1 1P00BFOE [1,0,0,0,1,0|1,0,0]=3 4926 B5R1.1 c1ccc[nH]1 1P00360L [1,0,0,0,1,0|0,0,1]=3 4927 B5R1.1 c1cccs1 1P0038GZ [1,0,0,0,1,0|1,0,0]=3 4928 B5R1.1 c1ccn[nH]1 1P002X05 [1,0,0,0,1,0|1,0,0]=3 4929 B5R1.1 c1ccno1 1P002X04 [1,0,0,0,1,0|1,0,0]=3 4930 B5R1.1 c1ccns1 1P002X03 [1,0,0,0,1,0|1,0,0]=3 4931 B5R1.1 c1cn[nH]n1 1P002X0X [1,0,0,0,1,0|2,0,0]=4 4932 B5R1.1 c1cnn[nH]1 1P002X0W [1,0,0,0,1,0|2,0,0]=4 4933 B5R1.1 c1nc[n-]n1 1P00330T [1,0,0,0,1,0|2,0,0]=4 4934 B5R1.1 c1ncc[nH]1 1P001EPB [1,0,0,0,1,0|1,0,0]=3 4935 B5R1.1 c1ncc[nH]1 1P002X0Y [1,0,0,0,1,0|1,0,0]=3 4936 B5R1.1 c1ncc[nH]1 1P008YHM [1,0,0,0,1,0|1,0,0]=3 4937 B5R1.1 c1ncc[nH]1 1P00FF02 [1,0,0,0,1,0|1,0,0]=3 4938 B5R1.1 c1ncco1 1P002X0R [1,0,0,0,1,0|1,0,0]=3 4939 B5R1.1 c1nccs1 1P002X0Q [1,0,0,0,1,0|1,0,0]=3 4940 B5R1.1 c1ncn[nH]1 1P002X0F [1,0,0,0,1,0|2,0,0]=4 4941 B5R1.1 o1cnnc1 1P002X1N [1,0,0,0,1,0|2,0,0]=4 4942 B5R1.1 s1cnnc1 1P002XGM [1,0,0,0,1,0|2,0,0]=4