0 B9R1.2 BrCC1=CC(Br)=CC=C1 001367 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.2 BrCC1=CC(I)=CC=C1 018739 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.2 C#CC1=CC(C)=CC=C1 040032 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.2 C(=O)C1=CC(C)=CC=C1 001390 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.2 CC1=CC(NN)=CC=C1 033721 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.2 CC1=CC=CC(C#N)=C1 035881 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.2 CC1=CC=CC(C#N)=N1 077340 [0,0,0,0,0,0|2,0,1]=3 7 B9R1.2 CC1=CC=CC(C=O)=N1 021900 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.2 CC1=CC=CC(CBr)=C1 067812 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.2 CC1=CC=CC(CN)=C1 008878 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.2 CC1=CC=CC(CO)=C1 102453 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.2 CC1=CC=CC(CO)=N1 092614 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.2 CC1=CN=CC(C#N)=C1 024699 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.2 CC1=NC(NN)=CC=C1 038575 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.2 CCC1=CC(I)=CC=C1 037712 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.2 CCC1=CC=CC(Br)=C1 024168 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.2 CCC1=CC=CC(N)=C1 043276 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.2 CCC1=CC=CC(N)=N1 095025 [0,0,0,0,0,0|2,0,0]=2 18 B9R1.2 CNC1=CC(Cl)=CC=C1 009649 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.2 CNC1=CC(F)=CC=C1 019287 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.2 CNC1=CC=CC(Br)=C1 045857 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.2 CNC1=CN=CC(Cl)=N1 043527 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.2 COC1=CC(Br)=CC=C1 003058 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.2 COC1=CC(Cl)=NN=C1 093603 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.2 COC1=CC(F)=CC=C1 002695 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.2 COC1=CC(I)=CC=C1 001303 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.2 COC1=CC(O)=CC=C1 235567 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.2 COC1=CC=CC(C)=C1 342147 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.2 COC1=CC=CC(Cl)=C1 118300 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.2 COC1=CC=CC(N)=C1 043402 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.2 COC1=CC=CC(N)=N1 043829 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.2 COC1=CC=CC(S)=C1 001309 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.2 COC1=CC=NC(Cl)=N1 067422 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.2 COC1=CN=CC(I)=C1 038147 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.2 COC1=CN=CC(N)=C1 048102 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.2 COC1=NC(Br)=CC=C1 045063 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.2 COC1=NC(C)=CC=C1 040046 [0,0,0,0,0,0|2,0,0]=2 37 B9R1.2 COC1=NC(Cl)=CC=C1 045005 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.2 COC1=NC=CC(Br)=N1 078127 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.2 COC1=NC=CC(Cl)=N1 078129 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.2 CSC1=CC(Br)=CC=C1 003661 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.2 CSC1=CC(C)=CC=C1 019356 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.2 CSC1=CC(Cl)=CC=C1 003553 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.2 CSC1=CC(F)=CC=C1 019273 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.2 CSC1=CC(I)=CC=C1 094459 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.2 CSC1=CC([Mg+])=CC=C1 397737 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.2 CSC1=CC=CC(N)=C1 018141 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.2 CSC1=NC=CC(Cl)=N1 049172 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.2 CSC1=NC=CC(O)=N1 076764 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.2 ClC1=CC=CC(CBr)=C1 024563 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.2 FC1=CC=CC(CBr)=C1 002171 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.2 FC1=CC=CC(CCl)=C1 001632 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.2 FC1=CC=CC(CS)=C1 024342 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.2 N#CC1=CC(F)=CN=C1 047905 [0,0,0,0,0,0|3,0,1]=4 54 B9R1.2 N#CC1=CN=CC(Br)=C1 005886 [0,0,0,0,0,0|3,0,1]=4 55 B9R1.2 N#CC1=NC(Br)=CC=C1 045311 [0,0,0,0,0,0|3,0,1]=4 56 B9R1.2 N#CC1=NC(F)=CC=C1 045312 [0,0,0,0,0,0|3,0,1]=4 57 B9R1.2 NC1=CC=CC(CO)=C1 008828 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.2 NCC1=CC(Br)=CC=C1 075951 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.2 NCC1=CC(Cl)=CC=C1 008869 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.2 NCC1=CC(F)=CC=C1 006198 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.2 NCC1=CC=CC(Br)=C1 242605 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.2 NCC1=CC=CC(I)=C1 079620 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.2 NCC1=CC=CC(O)=C1 023455 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.2 NCC1=CN=CC(Cl)=C1 091239 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.2 NCC1=NC(Br)=CC=C1 215138 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.2 NNC1=CC=CC(Br)=N1 091912 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.2 O=CC1=CC(Br)=CN=C1 037001 [0,0,0,0,0,0|3,0,1]=4 68 B9R1.2 O=CC1=NC(Br)=CC=C1 011583 [0,0,0,0,0,0|3,0,1]=4 69 B9R1.2 OCC1=CC(Br)=CC=C1 001365 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.2 OCC1=CC(Br)=CN=C1 077270 [0,0,0,0,0,0|3,0,0]=3 71 B9R1.2 OCC1=CC(Cl)=CC=C1 001376 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.2 OCC1=CC(F)=CC=C1 002170 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.2 OCC1=NC(Cl)=CC=C1 067703 [0,0,0,0,0,0|3,0,0]=3 74 B9R1.2 SCC1=CC(Br)=CC=C1 024349 [0,0,0,0,0,0|4,0,0]=4 75 B8R1.2 BrCC1=CC=CC=C1 003666 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.2 BrCC1=CC=CN=C1 214585 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.2 BrCC1=NC=CC=C1 067831 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.2 BrCC1=NC=NC=C1 231198 [1,0,0,0,0,0|3,0,0]=4 79 B8R1.2 C#CC1=CC=CN=C1 080053 [1,0,0,0,0,0|1,0,2]=4 80 B8R1.2 C#CC1=NC=CC=C1 078381 [1,0,0,0,0,0|1,0,2]=4 81 B8R1.2 CCC1=CC=CC=C1 094632 [1,0,0,0,0,0|2,0,0]=3 82 B8R1.2 CCC1=CC=CC=N1 098941 [1,0,0,0,0,0|1,0,0]=2 83 B8R1.2 CCC1=CC=CN=C1 242838 [1,0,0,0,0,0|1,0,0]=2 84 B8R1.2 CCC1=CC=NC=C1 319885 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.2 CCC1=NC=CN=C1 002727 [1,0,0,0,0,0|0,0,0]=1 86 B8R1.2 CC[N+]1=CC=CC=C1 046807 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.2 CNC1=CC=CC=C1 094625 [1,0,0,0,0,0|3,0,0]=4 88 B8R1.2 CNC1=CC=CN=C1 079398 [1,0,0,0,0,0|2,0,0]=3 89 B8R1.2 CNC1=NC=CC=C1 233304 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.2 COC1=CC=CC=C1 M03556 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.2 COC1=CC=CN=C1 079847 [1,0,0,0,0,0|2,0,0]=3 92 B8R1.2 COC1=NC=CC=C1 045214 [1,0,0,0,0,0|2,0,0]=3 93 B8R1.2 COC1=NC=CN=C1 002749 [1,0,0,0,0,0|1,0,0]=2 94 B8R1.2 CSC1=CC=CC=C1 002945 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.2 CSC1=NC=CN=C1 009618 [1,0,0,0,0,0|1,0,0]=2 96 B8R1.2 ClCC1=CC=CC=C1 106800 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.2 ClCC1=CC=CC=N1 026180 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.2 ClCC1=CC=CN=C1 043884 [1,0,0,0,0,0|2,0,0]=3 99 B8R1.2 ClCC1=NC=CC=N1 038565 [1,0,0,0,0,0|3,0,0]=4 100 B8R1.2 ClCC1=NC=CC=N1 077592 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.2 N#CC1=CN=CC=C1 234028 [1,0,0,0,0,0|2,0,1]=4 102 B8R1.2 N#CC1=NC=CC=C1 050348 [1,0,0,0,0,0|2,0,1]=4 103 B8R1.2 N#CC1=NC=CN=C1 002755 [1,0,0,0,0,0|1,0,1]=3 104 B8R1.2 NCC1=CC=CC=C1 098408 [1,0,0,0,0,0|3,0,0]=4 105 B8R1.2 NCC1=CC=CC=C1 241882 [1,0,0,0,0,0|3,0,0]=4 106 B8R1.2 NCC1=CC=CN=C1 078185 [1,0,0,0,0,0|2,0,0]=3 107 B8R1.2 NCC1=CN=CC=N1 043597 [1,0,0,0,0,0|1,0,0]=2 108 B8R1.2 NCC1=NC=CC=C1 009750 [1,0,0,0,0,0|2,0,0]=3 109 B8R1.2 NNC1=CN=CC=C1 044299 [1,0,0,0,0,0|3,0,0]=4 110 B8R1.2 NNC1=NC=CC=C1 093675 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.2 O=CC1=CC=CN=C1 065202 [1,0,0,0,0,0|2,0,1]=4 112 B8R1.2 O=CC1=NC=CC=C1 065201 [1,0,0,0,0,0|2,0,1]=4 113 B8R1.2 OCC1=CC=CC=C1 094986 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.2 OCC1=CC=CC=C1 105725 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.2 OCC1=CC=CN=C1 208628 [1,0,0,0,0,0|2,0,0]=3 116 B8R1.2 OCC1=CC=CN=N1 045003 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.2 OCC1=NC=CC=C1 043374 [1,0,0,0,0,0|2,0,0]=3 118 B8R1.2 OCC1=NC=CC=N1 067743 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.2 SCC1=CC=CC=C1 098994 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.2 [O-]CC1=CC=CC=C1 105697 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.4 BrC1=CC=CC(Br)=N1 024557 [1,0,0,0,0,0|3,0,0]=4 122 B8R1.4 BrC1=CN=CC(Br)=C1 032698 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.4 BrC1=CN=CC(I)=C1 046191 [1,0,0,0,0,0|3,0,0]=4 124 B8R1.4 CC1=CC(Br)=CC=C1 001434 [1,0,0,0,0,0|3,0,0]=4 125 B8R1.4 CC1=CC(Br)=CN=C1 036864 [1,0,0,0,0,0|2,0,0]=3 126 B8R1.4 CC1=CC(C)=NC=C1 242811 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.4 CC1=CC(Cl)=CC=C1 243038 [1,0,0,0,0,0|3,0,0]=4 128 B8R1.4 CC1=CC(F)=CC=C1 001442 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.4 CC1=CC(I)=CC=C1 001200 [1,0,0,0,0,0|3,0,0]=4 130 B8R1.4 CC1=CC=CC(C)=C1 103820 [1,0,0,0,0,0|2,0,0]=3 131 B8R1.4 CC1=CC=CC(C)=N1 092726 [1,0,0,0,0,0|1,0,0]=2 132 B8R1.4 CC1=CC=CC(C)=N1 104293 [1,0,0,0,0,0|1,0,0]=2 133 B8R1.4 CC1=CC=CC(Cl)=N1 010405 [1,0,0,0,0,0|2,0,0]=3 134 B8R1.4 CC1=CC=CC(F)=N1 006288 [1,0,0,0,0,0|2,0,0]=3 135 B8R1.4 CC1=CC=CC(N)=C1 033242 [1,0,0,0,0,0|3,0,0]=4 136 B8R1.4 CC1=CC=CC(N)=N1 020196 [1,0,0,0,0,0|2,0,0]=3 137 B8R1.4 CC1=CC=CC(O)=C1 094674 [1,0,0,0,0,0|3,0,0]=4 138 B8R1.4 CC1=CC=NC(Cl)=N1 044515 [1,0,0,0,0,0|3,0,0]=4 139 B8R1.4 CC1=CC=NC(N)=N1 003634 [1,0,0,0,0,0|3,0,0]=4 140 B8R1.4 CC1=CN=CC(C)=C1 094626 [1,0,0,0,0,0|1,0,0]=2 141 B8R1.4 CC1=CN=CC(C)=N1 002730 [1,0,0,0,0,0|0,0,0]=1 142 B8R1.4 CC1=CN=CC(Cl)=N1 067405 [1,0,0,0,0,0|1,0,0]=2 143 B8R1.4 CC1=CN=CC(N)=C1 033255 [1,0,0,0,0,0|2,0,0]=3 144 B8R1.4 CC1=NC(Br)=CC=C1 020192 [1,0,0,0,0,0|2,0,0]=3 145 B8R1.4 CC1=NC(Cl)=CC=N1 061014 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.4 CC1=NC(S)=NC=C1 068730 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.4 ClC1=CC=CC(Br)=N1 035849 [1,0,0,0,0,0|3,0,0]=4 148 B8R1.4 ClC1=CC=CC(Cl)=N1 209011 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.4 ClC1=CN=CC(Br)=C1 033253 [1,0,0,0,0,0|3,0,0]=4 150 B8R1.4 ClC1=CN=CC(Cl)=C1 049696 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.4 ClC1=CN=CC(Cl)=N1 002758 [1,0,0,0,0,0|2,0,0]=3 152 B8R1.4 FC1=CC(Cl)=CN=C1 045059 [1,0,0,0,0,0|3,0,0]=4 153 B8R1.4 FC1=CC=CC(Br)=N1 033114 [1,0,0,0,0,0|3,0,0]=4 154 B8R1.4 FC1=CC=CC(F)=N1 001607 [1,0,0,0,0,0|3,0,0]=4 155 B8R1.4 FC1=CN=CC(Br)=C1 037143 [1,0,0,0,0,0|3,0,0]=4 156 B8R1.4 FC1=CN=CC(I)=C1 038149 [1,0,0,0,0,0|3,0,0]=4 157 B8R1.4 FC1=NC(Cl)=CC=C1 033248 [1,0,0,0,0,0|3,0,0]=4 158 B8R1.4 NC1=CC(Br)=CN=C1 033123 [1,0,0,0,0,0|3,0,0]=4 159 B8R1.4 NC1=CC=CC(Cl)=N1 012728 [1,0,0,0,0,0|3,0,0]=4 160 B8R1.4 NC1=CC=CC(N)=N1 077786 [1,0,0,0,0,0|3,0,0]=4 161 B8R1.4 NC1=CN=CC(F)=C1 045309 [1,0,0,0,0,0|3,0,0]=4 162 B8R1.4 NC1=CN=CC(N)=N1 079286 [1,0,0,0,0,0|2,0,0]=3 163 B8R1.4 NC1=NC(=O)NN=C1 372700 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.4 NC1=NC(Br)=CC=C1 033158 [1,0,0,0,0,0|3,0,0]=4 165 B8R1.4 NC1=NC(Cl)=CN=C1 002753 [1,0,0,0,0,0|2,0,0]=3 166 B8R1.4 NC1=NC(F)=CC=C1 024171 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.4 OC1=CN=CC(Br)=C1 033254 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.4 OC1=CN=CC(F)=C1 079345 [1,0,0,0,0,0|3,0,0]=4 169 B8R1.4 OC1=NC(Cl)=CC=C1 037405 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.4 OC1=NC(F)=CC=C1 038546 [1,0,0,0,0,0|3,0,0]=4 171 B10R1.2 CC1=C(C)C(CN)=CC=C1 018613 [0,1,0,0,0,0|3,0,0]=4 172 B10R1.2 CC1=C(F)C(CN)=CC=C1 069731 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.2 CC1=C(N)C(CO)=CC=C1 239747 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.2 CC1=CC=CC(CBr)=C1F 006281 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.2 CCC1=C(Br)C(C)=CC=C1 038639 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.2 COC1=CC=CC(C)=C1O 068334 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.8 CC1=CC(C)=CC(CBr)=C1 003416 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.8 CC1=CC(C)=CC(CN)=C1 008879 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.8 CCC1=CC(Br)=CC(Br)=C1 037700 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.8 COC1=CC(Br)=CC(C)=C1 038668 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.8 COC1=CC(C)=CC(C)=C1 208837 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.8 COC1=CC(C)=CC(O)=C1 008959 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.8 CSC1=CC(C)=CC(C)=C1 019340 [0,1,0,0,0,0|3,0,0]=4 184 B10R1.8 CSC1=NC(C)=CC(=O)N1 046352 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.10 CC1=CC(CC#N)=CC=C1 092558 [0,1,0,0,0,0|2,0,1]=4 186 B10R1.10 CC1=CC=CC(CCO)=C1 068240 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.10 CCCC1=CC=CC(O)=C1 431370 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.10 CCNC1=CC=CC(C)=C1 216666 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.10 CCOC1=CC(C)=CC=C1 095135 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.10 CCSC1=CC(Br)=CC=C1 094879 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.10 CNCC1=CC=CC(C)=C1 224541 [0,1,0,0,0,0|2,0,0]=3 192 B10R1.10 CNCC1=CC=CC(F)=C1 077129 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.10 COCC1=CC(Br)=CC=C1 235324 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.10 ClC1=CC=CC(CCBr)=C1 020894 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.10 NCCC1=CC=CC(Br)=C1 048827 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.10 NCCC1=CC=CC(Cl)=C1 018421 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.10 NCCC1=CC=CC(F)=C1 040107 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.10 NCCC1=CC=CC(O)=C1 009950 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.10 OCCC1=CC(O)=CC=C1 092020 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.10 OCCC1=CC=CC(Br)=C1 092240 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.10 OCCC1=CC=CC(Cl)=C1 078742 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.10 OCCC1=CC=CC(F)=C1 010684 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.30 CC1=CC(CO)=C(O)C=C1 104296 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.30 CC1=CC=C(C)C(CN)=C1 018615 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.30 CC1=CC=C(N)C(CO)=C1 338195 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.30 CCC1=C(Br)C=CC(Br)=C1 037720 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.30 CCC1=C(Br)C=CC(N)=C1 044816 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.30 CCC1=C(Cl)C=CC(Br)=C1 037719 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.30 CCC1=C(Cl)C=CC(O)=C1 049114 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.30 CCC1=C(I)C=CC(Br)=C1 024167 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.30 CCC1=C(N)C=CC(Br)=C1 037858 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.30 CCC1=C(O)C=CC(F)=C1 006110 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.30 CCC1=CC(Cl)=CC=C1Br 037714 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.30 CCC1=CC(I)=CC=C1Br 037713 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.30 COC1=C(F)C=CC(C)=C1 005783 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.30 COC1=C(N)C=CC(C)=C1 044675 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.30 COC1=CC(C)=CC=C1Br 038665 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.30 COC1=CC(C)=CC=C1O 216346 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.30 COC1=CC(Cl)=CN=C1N 209243 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.30 COC1=NC(Br)=CC=C1N 210513 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.30 COC1=NC(Br)=CN=C1Cl 230078 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.30 CSC1=C(C)C=CC(C)=C1 019337 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.30 N#CC1=NC(Cl)=CN=C1N 076824 [0,1,0,0,0,0|2,0,1]=4 224 B10R1.113 CC(=O)C1=CC(C)=CC=C1 349312 [0,1,0,0,0,0|2,0,1]=4 225 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 077437 [0,1,0,0,0,0|2,0,1]=4 226 B10R1.113 CC(=O)C1=NC(C)=CC=C1 215987 [0,1,0,0,0,0|1,0,1]=3 227 B10R1.113 CC(C)C1=CC(Br)=CC=C1 024856 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.113 CC(C)C1=CC(I)=CC=C1 037580 [0,1,0,0,0,0|3,0,0]=4 229 B10R1.113 CC(C)C1=CC(N)=CC=C1 075293 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.113 CC(C)C1=CC=CC(O)=C1 099128 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.113 CC(N)C1=CC(Cl)=CC=C1 035904 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.113 CC(O)C1=CC(Br)=CC=C1 003550 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 353644 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.113 CC(O)C1=CC(F)=CC=C1 006338 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.113 CC(O)C1=NC(Br)=CC=C1 217816 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.113 CC1=CC(N(C)C)=CC=C1 242206 [0,1,0,0,0,0|3,0,0]=4 237 B10R1.113 CC1=CC=CC(C(=O)O)=N1 011322 [0,1,0,0,0,0|2,0,1]=4 238 B10R1.113 CC1=CC=CC(C(C)O)=C1 033735 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.113 CC1=CN=CC(B(O)O)=C1 076877 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.113 CC1=CN=CC(C(=O)O)=C1 024697 [0,1,0,0,0,0|2,0,1]=4 241 B10R1.113 CC1=NC(C(F)F)=CC=C1 050581 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.113 CN(C)C1=CC(Br)=CN=C1 323893 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.113 CN(C)C1=CN=CC(Cl)=N1 043526 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 468749 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.113 FC(F)C1=CC=CC(Br)=N1 050312 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.113 FC(F)C1=CN=CC(Br)=C1 050446 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 062993 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.172 BrCC1=CC=CC(CBr)=C1 237159 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.172 CCC1=CC(C#N)=CC=C1 208791 [0,1,0,0,0,0|2,0,1]=4 250 B10R1.172 COC1=CC(CCl)=CC=C1 018781 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.172 COC1=CC(CO)=CC=C1 235697 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.172 COC1=CC=CC(C=O)=N1 065223 [0,1,0,0,0,0|2,0,1]=4 253 B10R1.172 COC1=CC=CC(CBr)=C1 067808 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.172 COC1=CC=CC(CN)=C1 008880 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.172 COC1=CC=CC(OC)=C1 216356 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.172 COC1=CC=CC(OC)=N1 045228 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.172 COC1=CC=CC(SC)=C1 019335 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.172 COC1=NC(OC)=NC=C1 077892 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.172 NCC1=CC=CC(CN)=C1 228080 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.172 OCC1=CC=CC(CO)=C1 463279 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.172 OCC1=CC=CC(CO)=N1 047749 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.176 CC1=C(F)C=CC(CBr)=C1 005800 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.176 CC1=C(F)C=CC(CN)=C1 005797 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.176 CC1=C(F)C=CC(CO)=C1 005794 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.176 CC1=CC(CN)=CC=C1N 075980 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.176 CC1=CC=C(CCl)C=C1C 018620 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.176 CC1=CC=C(CN)C=C1C 018617 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.176 CC1=CC=C(CO)C=C1C 237644 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.176 CCC1=CC(Br)=C(Br)C=C1 037708 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.176 CCC1=CC(Br)=C(Cl)C=C1 037705 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.176 CCC1=CC(Br)=C(F)C=C1 037706 [0,1,0,0,0,0|3,0,0]=4 272 B10R1.176 CCC1=CC(Br)=C(I)C=C1 037707 [0,1,0,0,0,0|3,0,0]=4 273 B10R1.176 CCC1=CC(N)=C(O)C=C1 311903 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.176 CCC1=CC=C(N)C(Br)=C1 037704 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.176 CCC1=CC=C(O)C(Br)=C1 467266 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.176 COC1=CC(C)=C(C)C=C1 049843 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.176 COC1=CC(C)=C(F)C=C1 006276 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.176 COC1=CC(C)=C(N)C=C1 013907 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.176 COC1=CC=C(Br)C(C)=C1 018291 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.176 COC1=NC(C)=C(Br)C=C1 036180 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.176 CSC1=CC(C)=C(C)C=C1 019339 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.176 OCC1=CC(Cl)=C(Cl)N=C1 067706 [0,1,0,0,0,0|3,0,0]=4 283 B10R2.31 BrC1=CC=C2CCC2=C1 079227 [0,0,0,1,0,0|3,0,0]=4 284 B8R1.1 CC1=CC(CN)=NO1 094980 [0,0,0,0,1,0|3,0,0]=4 285 B8R1.1 CC1=CC(CN)=NO1 358781 [0,0,0,0,1,0|3,0,0]=4 286 B8R1.1 CC1=CC(CO)=NO1 017477 [0,0,0,0,1,0|3,0,0]=4 287 B8R1.1 CC1=CC=C(C=O)O1 216646 [0,0,0,0,1,0|2,0,1]=4 288 B8R1.1 CC1=CC=C(C=O)S1 045074 [0,0,0,0,1,0|2,0,1]=4 289 B8R1.1 CC1=CC=C(CN)O1 225706 [0,0,0,0,1,0|2,0,0]=3 290 B8R1.1 CC1=CC=C(CO)O1 013649 [0,0,0,0,1,0|2,0,0]=3 291 B8R1.1 CC1=CC=C(CO)S1 362444 [0,0,0,0,1,0|2,0,0]=3 292 B8R1.1 CC1=CSC(C=O)=N1 065270 [0,0,0,0,1,0|2,0,1]=4 293 B8R1.1 CC1=CSC(CN)=C1 023898 [0,0,0,0,1,0|3,0,0]=4 294 B8R1.1 CC1=NC(C#N)=CS1 017216 [0,0,0,0,1,0|2,0,1]=4 295 B8R1.1 CC1=NC(CCl)=CS1 016133 [0,0,0,0,1,0|2,0,0]=3 296 B8R1.1 CC1=NNC(CN)=C1 058640 [0,0,0,0,1,0|3,0,0]=4 297 B8R1.1 CC1=NOC(CCl)=N1 219873 [0,0,0,0,1,0|2,0,0]=3 298 B8R1.1 CCC1=NC=C(C)N1 403581 [0,0,0,0,1,0|0,0,1]=2 299 B8R1.1 CCC1=NN=C(N)O1 009901 [0,0,0,0,1,0|3,0,0]=4 300 B8R1.1 CCC1=NSC(N)=N1 009733 [0,0,0,0,1,0|2,0,0]=3 301 B8R1.1 CCN1C=C[N+](C)=C1 245878 [0,0,0,0,1,0|3,0,0]=4 302 B8R1.1 CN1C=C(CN)C=N1 030587 [0,0,0,0,1,0|3,0,0]=4 303 B8R1.1 CN1C=CC(CN)=N1 030355 [0,0,0,0,1,0|2,0,0]=3 304 B8R1.1 COC1=NC(N)=NS1 009730 [0,0,0,0,1,0|3,0,0]=4 305 B8R1.1 COC1=NSC(N)=N1 009665 [0,0,0,0,1,0|3,0,0]=4 306 B8R1.1 CSC1=NC(Br)=NS1 024023 [0,0,0,0,1,0|3,0,0]=4 307 B8R1.1 CSC1=NC(Cl)=NS1 024022 [0,0,0,0,1,0|3,0,0]=4 308 B8R1.1 CSC1=NC(N)=NN1 030116 [0,0,0,0,1,0|3,0,0]=4 309 B8R1.1 CSC1=NC(N)=NS1 009668 [0,0,0,0,1,0|3,0,0]=4 310 B8R1.1 CSC1=NC(O)=NS1 005951 [0,0,0,0,1,0|3,0,0]=4 311 B8R1.1 ClCC1=CN=C(Cl)S1 016115 [0,0,0,0,1,0|3,0,0]=4 312 B8R1.1 OCC1=CN=C(Br)S1 079893 [0,0,0,0,1,0|3,0,0]=4 313 B8R1.11 C#CC1=CN=CN1C 233858 [0,0,0,0,1,0|1,0,2]=4 314 B8R1.11 CN1C=NC=C1CO 236726 [0,0,0,0,1,0|2,0,0]=3 315 B7R0.1 CC\C=C\C=C\C=O 242611 [1,0,1,0,0,0|2,0,0]=4 316 B7R1.3 BrC1=CC=CN=C1 008797 [2,0,0,0,0,0|2,0,0]=4 317 B7R1.3 BrC1=CN=CC=N1 049757 [2,0,0,0,0,0|1,0,0]=3 318 B7R1.3 BrC1=NC=CC=C1 036222 [2,0,0,0,0,0|2,0,0]=4 319 B7R1.3 CC1=CC=CC=C1 035922 [2,0,0,0,0,0|2,0,0]=4 320 B7R1.3 CC1=CC=CC=C1 046885 [2,0,0,0,0,0|2,0,0]=4 321 B7R1.3 CC1=CC=CC=C1 099899 [2,0,0,0,0,0|2,0,0]=4 322 B7R1.3 CC1=CC=CC=C1 102149 [2,0,0,0,0,0|2,0,0]=4 323 B7R1.3 CC1=CC=CN=C1 235657 [2,0,0,0,0,0|1,0,0]=3 324 B7R1.3 CC1=CC=CN=N1 236526 [2,0,0,0,0,0|2,0,0]=4 325 B7R1.3 CC1=CN=CN=C1 040003 [2,0,0,0,0,0|2,0,0]=4 326 B7R1.3 CC1=NC=CC=C1 235658 [2,0,0,0,0,0|1,0,0]=3 327 B7R1.3 CC1=NC=CN=C1 002726 [2,0,0,0,0,0|0,0,0]=2 328 B7R1.3 CC1=NC=NC=C1 045243 [2,0,0,0,0,0|2,0,0]=4 329 B7R1.3 ClC1=CC=CN=C1 045189 [2,0,0,0,0,0|2,0,0]=4 330 B7R1.3 ClC1=NC=CC=C1 044502 [2,0,0,0,0,0|2,0,0]=4 331 B7R1.3 ClC1=NC=CN=C1 002754 [2,0,0,0,0,0|1,0,0]=3 332 B7R1.3 FC1=CC=CN=C1 001298 [2,0,0,0,0,0|2,0,0]=4 333 B7R1.3 FC1=CN=CC=N1 050271 [2,0,0,0,0,0|1,0,0]=3 334 B7R1.3 FC1=NC=CC=C1 001297 [2,0,0,0,0,0|2,0,0]=4 335 B7R1.3 IC1=CC=CN=C1 008065 [2,0,0,0,0,0|2,0,0]=4 336 B7R1.3 IC1=CN=CC=N1 236553 [2,0,0,0,0,0|1,0,0]=3 337 B7R1.3 IC1=NC=CC=C1 067334 [2,0,0,0,0,0|2,0,0]=4 338 B7R1.3 NC1=CC=CN=C1 003677 [2,0,0,0,0,0|2,0,0]=4 339 B7R1.3 NC1=NC=CC=C1 050259 [2,0,0,0,0,0|2,0,0]=4 340 B7R1.3 NC1=NC=CN=C1 043480 [2,0,0,0,0,0|1,0,0]=3 341 B7R1.3 NC1=NC=CN=N1 045802 [2,0,0,0,0,0|2,0,0]=4 342 B7R1.3 OC1=CC=CN=C1 045225 [2,0,0,0,0,0|2,0,0]=4 343 B7R1.3 OC1=NC=CC=C1 003423 [2,0,0,0,0,0|2,0,0]=4 344 B7R1.3 OC1=NC=CN=C1 076215 [2,0,0,0,0,0|1,0,0]=3 345 B7R1.3 SC1=NC=CC=C1 023265 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.1 CC1=CN=C(C#N)C=N1 020122 [1,1,0,0,0,0|1,0,1]=4 347 B9R1.1 CC1=CN=C(CN)C=N1 009009 [1,1,0,0,0,0|1,0,0]=3 348 B9R1.1 CCC1=CC=C(Br)C=C1 001119 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.1 CCC1=CC=C(C)C=C1 235264 [1,1,0,0,0,0|2,0,0]=4 350 B9R1.1 CCC1=CC=C(Cl)C=C1 001266 [1,1,0,0,0,0|2,0,0]=4 351 B9R1.1 CCC1=CC=C(F)C=C1 018681 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.1 CCC1=CC=C(I)C=C1 006113 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.1 CCC1=CC=C(N)C=C1 099641 [1,1,0,0,0,0|2,0,0]=4 354 B9R1.1 CCC1=CC=C(O)C=C1 241020 [1,1,0,0,0,0|2,0,0]=4 355 B9R1.1 CCC1=CN=C(C)C=C1 222089 [1,1,0,0,0,0|1,0,0]=3 356 B9R1.1 CCC1=CN=C(Cl)N=C1 045001 [1,1,0,0,0,0|2,0,0]=4 357 B9R1.1 CCC1=NC=C(Br)C=C1 077907 [1,1,0,0,0,0|1,0,0]=3 358 B9R1.1 CCC1=NC=C(C)N=C1 225679 [1,1,0,0,0,0|0,0,0]=2 359 B9R1.1 CNC1=NC=C(Br)C=C1 078710 [1,1,0,0,0,0|2,0,0]=4 360 B9R1.1 CNC1=NC=C(Cl)C=C1 075169 [1,1,0,0,0,0|2,0,0]=4 361 B9R1.1 COC1=CN=C(Br)C=C1 076484 [1,1,0,0,0,0|2,0,0]=4 362 B9R1.1 COC1=CN=C(N)C=C1 036797 [1,1,0,0,0,0|2,0,0]=4 363 B9R1.1 COC1=NC=C(Br)C=C1 023910 [1,1,0,0,0,0|2,0,0]=4 364 B9R1.1 COC1=NC=C(Cl)C=C1 035854 [1,1,0,0,0,0|2,0,0]=4 365 B9R1.1 COC1=NC=C(F)C=C1 033260 [1,1,0,0,0,0|2,0,0]=4 366 B9R1.1 COC1=NC=C(N)C=C1 024176 [1,1,0,0,0,0|2,0,0]=4 367 B9R1.1 COC1=NC=C(O)C=C1 076684 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.1 ClCC1=CN=C(Cl)C=C1 019460 [1,1,0,0,0,0|2,0,0]=4 369 B9R1.1 N#CC1=CN=C(Br)C=N1 076065 [1,1,0,0,0,0|1,0,1]=4 370 B9R1.1 NC1=CC=C(CO)C=N1 077326 [1,1,0,0,0,0|2,0,0]=4 371 B9R1.1 NC1=CC=C(CO)C=N1 104746 [1,1,0,0,0,0|2,0,0]=4 372 B9R1.1 NCC1=CN=C(Cl)C=C1 065444 [1,1,0,0,0,0|2,0,0]=4 373 B9R1.1 OCC1=CN=C(Cl)C=C1 067692 [1,1,0,0,0,0|2,0,0]=4 374 B9R1.1 OCC1=NC=C(Br)C=C1 036351 [1,1,0,0,0,0|2,0,0]=4 375 B9R1.6 CC(=O)C1=CC=CN=C1 032763 [1,1,0,0,0,0|1,0,1]=4 376 B9R1.6 CC(=O)C1=NC=CC=C1 044389 [1,1,0,0,0,0|1,0,1]=4 377 B9R1.6 CC(=O)C1=NC=CN=C1 002741 [1,1,0,0,0,0|0,0,1]=3 378 B9R1.6 CC(Br)C1=CC=CC=C1 001003 [1,1,0,0,0,0|2,0,0]=4 379 B9R1.6 CC(C)C1=CC=CC=C1 094649 [1,1,0,0,0,0|2,0,0]=4 380 B9R1.6 CC(C)C1=NC=CC=C1 078691 [1,1,0,0,0,0|1,0,0]=3 381 B9R1.6 CC(N)C1=CC=CC=C1 208695 [1,1,0,0,0,0|2,0,0]=4 382 B9R1.6 CC(N)C1=CN=CC=C1 030750 [1,1,0,0,0,0|1,0,0]=3 383 B9R1.6 CC(N)C1=NC=CC=C1 060819 [1,1,0,0,0,0|1,0,0]=3 384 B9R1.6 CC(O)C1=CC=CC=C1 098924 [1,1,0,0,0,0|2,0,0]=4 385 B9R1.6 CC(O)C1=CC=CN=C1 094012 [1,1,0,0,0,0|1,0,0]=3 386 B9R1.6 CC(O)C1=NC=CC=C1 088389 [1,1,0,0,0,0|1,0,0]=3 387 B9R1.6 CN(C)C1=CC=CN=C1 032574 [1,1,0,0,0,0|2,0,0]=4 388 B9R1.6 CN(C)C1=NC=CC=C1 219108 [1,1,0,0,0,0|2,0,0]=4 389 B9R1.6 C[C@@H](N)C1=CC=CC=C1 037431 [1,1,0,0,0,0|2,0,0]=4 390 B9R1.6 C[C@@H](N)C1=NC=CC=C1 078110 [1,1,0,0,0,0|1,0,0]=3 391 B9R1.6 C[C@@H](O)C1=CC=CC=C1 222634 [1,1,0,0,0,0|2,0,0]=4 392 B9R1.6 C[C@H](N)C1=CC=CC=C1 037432 [1,1,0,0,0,0|2,0,0]=4 393 B9R1.6 FC(F)C1=CC=CC=N1 050442 [1,1,0,0,0,0|2,0,0]=4 394 B9R1.6 FC(F)C1=CN=CC=C1 050443 [1,1,0,0,0,0|2,0,0]=4 395 B9R1.6 NC(=O)C1=NC=CN=C1 068696 [1,1,0,0,0,0|1,0,1]=4 396 B9R1.6 NC(=S)C1=NC=CN=C1 358370 [1,1,0,0,0,0|1,0,1]=4 397 B9R1.6 O=C(O)C1=NC=CN=C1 066244 [1,1,0,0,0,0|1,0,1]=4 398 B9R1.8 BrCCC1=CC=CC=C1 019261 [1,1,0,0,0,0|2,0,0]=4 399 B9R1.8 CCCC1=CC=CC=C1 095067 [1,1,0,0,0,0|2,0,0]=4 400 B9R1.8 CCCC1=NC=CC=C1 242850 [1,1,0,0,0,0|1,0,0]=3 401 B9R1.8 CCCC1=NC=CN=C1 002735 [1,1,0,0,0,0|0,0,0]=2 402 B9R1.8 CCNC1=CC=CC=C1 216665 [1,1,0,0,0,0|2,0,0]=4 403 B9R1.8 CCOC1=CC=CC=C1 098890 [1,1,0,0,0,0|2,0,0]=4 404 B9R1.8 CCOC1=NC=CC=C1 049694 [1,1,0,0,0,0|1,0,0]=3 405 B9R1.8 CCSC1=CC=CC=C1 001759 [1,1,0,0,0,0|2,0,0]=4 406 B9R1.8 CCSC1=NC=CC=C1 095363 [1,1,0,0,0,0|1,0,0]=3 407 B9R1.8 CNCC1=CC=CC=C1 020695 [1,1,0,0,0,0|2,0,0]=4 408 B9R1.8 CSCC1=CC=CC=C1 099640 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.8 ClCCC1=CC=CC=C1 208883 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.8 ClCCC1=CC=CC=N1 070463 [1,1,0,0,0,0|1,0,0]=3 411 B9R1.8 ICCC1=CC=CC=C1 001087 [1,1,0,0,0,0|2,0,0]=4 412 B9R1.8 N#CCC1=NC=CC=C1 047908 [1,1,0,0,0,0|1,0,1]=4 413 B9R1.8 NCCC1=CC=CC=C1 046873 [1,1,0,0,0,0|2,0,0]=4 414 B9R1.8 NCCC1=CC=CN=C1 010689 [1,1,0,0,0,0|1,0,0]=3 415 B9R1.8 NCCC1=CC=CN=C1 033239 [1,1,0,0,0,0|1,0,0]=3 416 B9R1.8 NCCC1=CC=CN=C1 065473 [1,1,0,0,0,0|1,0,0]=3 417 B9R1.8 NCCC1=NC=CC=C1 013702 [1,1,0,0,0,0|1,0,0]=3 418 B9R1.8 OCCC1=CC=CC=C1 222397 [1,1,0,0,0,0|2,0,0]=4 419 B9R1.8 OCCC1=CC=CN=C1 017523 [1,1,0,0,0,0|1,0,0]=3 420 B9R1.8 OCCC1=NC=CC=C1 223718 [1,1,0,0,0,0|1,0,0]=3 421 B9R1.15 CC1=CC=CN=C1CCl 234089 [1,1,0,0,0,0|2,0,0]=4 422 B9R1.15 CC1=CC=CN=C1CN 020197 [1,1,0,0,0,0|2,0,0]=4 423 B9R1.15 CCC1=C(Br)C=CC=C1 018276 [1,1,0,0,0,0|2,0,0]=4 424 B9R1.15 CCC1=C(Cl)C=CC=C1 018372 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.15 CCC1=C(I)C=CC=C1 001197 [1,1,0,0,0,0|2,0,0]=4 426 B9R1.15 CCC1=C(N)C=CC=C1 043275 [1,1,0,0,0,0|2,0,0]=4 427 B9R1.15 CCC1=C(S)C=CC=C1 001289 [1,1,0,0,0,0|2,0,0]=4 428 B9R1.15 CCC1=CC=CC=C1O 240992 [1,1,0,0,0,0|2,0,0]=4 429 B9R1.15 CCC1=NC=NC=C1F 079955 [1,1,0,0,0,0|2,0,0]=4 430 B9R1.15 CCC1=[N+]([O-])C=CC=C1 032650 [1,1,0,0,0,0|1,0,1]=4 431 B9R1.15 COC1=CC=CN=C1Br 037013 [1,1,0,0,0,0|2,0,0]=4 432 B9R1.15 COC1=CC=CN=C1N 064878 [1,1,0,0,0,0|2,0,0]=4 433 B9R1.15 COC1=CC=CN=C1O 219308 [1,1,0,0,0,0|2,0,0]=4 434 B9R1.15 COC1=NC=CC=C1F 220022 [1,1,0,0,0,0|2,0,0]=4 435 B9R1.15 COC1=NC=CC=C1I 036267 [1,1,0,0,0,0|2,0,0]=4 436 B9R1.15 N#CC1=NC=CN=C1Cl 005877 [1,1,0,0,0,0|1,0,1]=4 437 B9R1.15 N#CC1=NC=CN=C1N 076968 [1,1,0,0,0,0|1,0,1]=4 438 B9R1.15 NNC1=NC=CN=C1Cl 061253 [1,1,0,0,0,0|2,0,0]=4 439 B9R1.15 OC1=C(CBr)N=CC=C1 431436 [1,1,0,0,0,0|2,0,0]=4 440 B9R1.15 OCC1=CC=CN=C1F 036274 [1,1,0,0,0,0|2,0,0]=4 441 B9R1.15 OCC1=NC=CC=C1O 092366 [1,1,0,0,0,0|2,0,0]=4 442 B9R1.3 CC1=CC=CC(C)=C1Br 018325 [1,1,0,0,0,0|2,0,0]=4 443 B9R1.3 CC1=CC=CC(C)=C1Cl 018459 [1,1,0,0,0,0|2,0,0]=4 444 B9R1.3 CC1=CC=CC(C)=C1F 003242 [1,1,0,0,0,0|2,0,0]=4 445 B9R1.3 CC1=CC=CC(C)=C1I 002976 [1,1,0,0,0,0|2,0,0]=4 446 B9R1.3 CC1=CC=CC(C)=C1N 033243 [1,1,0,0,0,0|2,0,0]=4 447 B9R1.3 CC1=CC=CC(C)=C1O 078941 [1,1,0,0,0,0|2,0,0]=4 448 B9R1.3 CC1=CC=CC(C)=C1S 001346 [1,1,0,0,0,0|2,0,0]=4 449 B9R1.3 CC1=CC=CC(C)=[N+]1[O-] 225470 [1,1,0,0,0,0|1,0,1]=4 450 B9R1.34 CC1=CC(=O)C=C(C)O1 069041 [1,1,0,0,0,0|2,0,0]=4 451 B9R1.34 CC1=CC(Br)=CC(C)=N1 077942 [1,1,0,0,0,0|1,0,0]=3 452 B9R1.34 CC1=CC(C)=CC(Br)=C1 008025 [1,1,0,0,0,0|2,0,0]=4 453 B9R1.34 CC1=CC(C)=CC(C)=C1 095021 [1,1,0,0,0,0|2,0,0]=4 454 B9R1.34 CC1=CC(C)=CC(Cl)=C1 018463 [1,1,0,0,0,0|2,0,0]=4 455 B9R1.34 CC1=CC(C)=CC(F)=C1 002576 [1,1,0,0,0,0|2,0,0]=4 456 B9R1.34 CC1=CC(C)=CC(I)=C1 002953 [1,1,0,0,0,0|2,0,0]=4 457 B9R1.34 CC1=CC(C)=CC(I)=C1 106112 [1,1,0,0,0,0|2,0,0]=4 458 B9R1.34 CC1=CC(C)=CC(N)=C1 095075 [1,1,0,0,0,0|2,0,0]=4 459 B9R1.34 CC1=CC(C)=CC(O)=C1 214771 [1,1,0,0,0,0|2,0,0]=4 460 B9R1.34 CC1=CC(C)=CC(S)=C1 001348 [1,1,0,0,0,0|2,0,0]=4 461 B9R1.34 CC1=CC(C)=C[N+]([O-])=C1 180054 [1,1,0,0,0,0|1,0,1]=4 462 B9R1.34 CC1=CC(C)=NC(C)=C1 005102 [1,1,0,0,0,0|1,0,0]=3 463 B9R1.34 CC1=CC(C)=NC(C)=C1 102991 [1,1,0,0,0,0|1,0,0]=3 464 B9R1.34 CC1=CC(C)=[O+]C(C)=C1 005450 [1,1,0,0,0,0|2,0,0]=4 465 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 047109 [1,1,0,0,0,0|2,0,0]=4 466 B9R1.34 CC1=CC(Cl)=CC(N)=N1 079721 [1,1,0,0,0,0|2,0,0]=4 467 B9R1.34 CC1=CC(Cl)=NC(C)=C1 037141 [1,1,0,0,0,0|2,0,0]=4 468 B9R1.34 CC1=CC(Cl)=NC(C)=N1 058303 [1,1,0,0,0,0|2,0,0]=4 469 B9R1.34 CC1=CC(N)=NC(C)=C1 046704 [1,1,0,0,0,0|2,0,0]=4 470 B9R1.34 CC1=CC(N)=NC(C)=N1 233210 [1,1,0,0,0,0|2,0,0]=4 471 B9R1.34 CC1=CC(O)=CC(C)=N1 011702 [1,1,0,0,0,0|1,0,0]=3 472 B9R1.34 CC1=CC(O)=CC(O)=N1 068449 [1,1,0,0,0,0|2,0,0]=4 473 B9R1.34 CC1=CC(O)=NC(C)=N1 222325 [1,1,0,0,0,0|2,0,0]=4 474 B9R1.69 CC1=C(Br)C=CC(Br)=N1 012710 [1,1,0,0,0,0|2,0,0]=4 475 B9R1.69 CC1=C(Br)C=CC(Cl)=N1 033110 [1,1,0,0,0,0|2,0,0]=4 476 B9R1.69 CC1=C(C)N=C(N)C=C1 024688 [1,1,0,0,0,0|2,0,0]=4 477 B9R1.69 CC1=C(F)C=CC(Cl)=N1 033259 [1,1,0,0,0,0|2,0,0]=4 478 B9R1.69 CC1=C(O)N=CC(Br)=C1 035850 [1,1,0,0,0,0|2,0,0]=4 479 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 043875 [1,1,0,0,0,0|2,0,0]=4 480 B9R1.69 CC1=CC(Br)=CN=C1Br 036398 [1,1,0,0,0,0|2,0,0]=4 481 B9R1.69 CC1=CC(Br)=CN=C1Cl 036246 [1,1,0,0,0,0|2,0,0]=4 482 B9R1.69 CC1=CC(Br)=CN=C1F 012711 [1,1,0,0,0,0|2,0,0]=4 483 B9R1.69 CC1=CC(Br)=CN=C1N 002494 [1,1,0,0,0,0|2,0,0]=4 484 B9R1.69 CC1=CC(C)=C(I)C=C1 001771 [1,1,0,0,0,0|2,0,0]=4 485 B9R1.69 CC1=CC(C)=C(S)C=C1 001344 [1,1,0,0,0,0|2,0,0]=4 486 B9R1.69 CC1=CC(Cl)=CN=C1Cl 033107 [1,1,0,0,0,0|2,0,0]=4 487 B9R1.69 CC1=CC(Cl)=CN=C1N 033113 [1,1,0,0,0,0|2,0,0]=4 488 B9R1.69 CC1=CC(F)=C(Cl)N=C1 033267 [1,1,0,0,0,0|2,0,0]=4 489 B9R1.69 CC1=CC(F)=CN=C1Cl 077349 [1,1,0,0,0,0|2,0,0]=4 490 B9R1.69 CC1=CC(I)=CN=C1N 033294 [1,1,0,0,0,0|2,0,0]=4 491 B9R1.69 CC1=CC(N)=C(Cl)N=C1 033670 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.69 CC1=CC=C(Br)C(C)=C1 018327 [1,1,0,0,0,0|2,0,0]=4 493 B9R1.69 CC1=CC=C(Br)C(Cl)=N1 036228 [1,1,0,0,0,0|2,0,0]=4 494 B9R1.69 CC1=CC=C(Br)C(F)=N1 077268 [1,1,0,0,0,0|2,0,0]=4 495 B9R1.69 CC1=CC=C(N)C(C)=C1 098336 [1,1,0,0,0,0|2,0,0]=4 496 B9R1.69 CC1=CC=C(N)C(C)=N1 079681 [1,1,0,0,0,0|1,0,0]=3 497 B9R1.69 CC1=CC=C(O)C(C)=C1 208699 [1,1,0,0,0,0|2,0,0]=4 498 B9R1.69 CC1=CC=C(O)C(C)=N1 208702 [1,1,0,0,0,0|1,0,0]=3 499 B9R1.69 CC1=CC=C(O)C(I)=N1 076967 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.69 CC1=CN=C(Br)C(Br)=C1 033109 [1,1,0,0,0,0|2,0,0]=4 501 B9R1.69 CC1=CN=C(C)C(C)=C1 219272 [1,1,0,0,0,0|1,0,0]=3 502 B9R1.69 CC1=CN=C(N)C(Br)=C1 002493 [1,1,0,0,0,0|2,0,0]=4 503 B9R1.69 CC1=CN=C(N)C(Cl)=C1 219357 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.69 CC1=NC(Br)=CC=C1F 033261 [1,1,0,0,0,0|2,0,0]=4 505 B9R1.69 CC1=NC(Br)=CC=C1N 040412 [1,1,0,0,0,0|2,0,0]=4 506 B9R1.69 CC1=NC(Cl)=CC=C1N 040121 [1,1,0,0,0,0|2,0,0]=4 507 B9R1.69 CC1=NC(F)=CC=C1Br 045232 [1,1,0,0,0,0|2,0,0]=4 508 B9R1.69 CC1=NC(N)=CC=C1Br 002495 [1,1,0,0,0,0|2,0,0]=4 509 B9R1.69 ClC1=CN=C(I)C(Cl)=N1 092141 [1,1,0,0,0,0|2,0,0]=4 510 B9R1.69 NC1=NC=C(Br)N=C1Br 036760 [1,1,0,0,0,0|2,0,0]=4 511 B9R1.69 NC1=NC=C(Cl)N=C1Cl 076341 [1,1,0,0,0,0|2,0,0]=4 512 B9R1.21 CCN1C=CC(CN)=N1 030479 [0,1,0,0,1,0|1,0,0]=3 513 B9R1.21 OCC1=CC=C(CO)O1 079832 [0,1,0,0,1,0|2,0,0]=4 514 B9R1.22 CC1=CC(C)=NN1CO 031637 [0,1,0,0,1,0|2,0,0]=4 515 B9R1.22 CCN1N=C(C)C=C1N 030192 [0,1,0,0,1,0|1,0,0]=3 516 B9R1.22 CCN1N=C(C)CC1=O 180064 [0,1,0,0,1,0|1,0,1]=4 517 B9R1.23 CCC1=NC(C)=C(C)S1 009626 [0,1,0,0,1,0|1,0,0]=3 518 B9R1.23 CCN1C=C(Br)C(C)=N1 026156 [0,1,0,0,1,0|1,0,0]=3 519 B9R1.35 CC(=O)C1=CC=C(C)S1 001262 [0,1,0,0,1,0|1,0,1]=4 520 B9R1.35 CC(C)C1=NSC(N)=N1 009664 [0,1,0,0,1,0|2,0,0]=4 521 B9R1.35 CC1=CSC(C(C)C)=N1 009624 [0,1,0,0,1,0|1,0,0]=3 522 B9R1.27 CC1=NOC(C)=C1CO 033330 [0,1,0,0,1,0|2,0,0]=4 523 B11R1.8 CCC1=CC(Br)=CC(C)=C1N 038643 [0,2,0,0,0,0|2,0,0]=4 524 B11R1.267 CCC1=CC=CC(CC)=C1I 035622 [0,2,0,0,0,0|2,0,0]=4 525 B11R1.267 CCC1=CC=CC(CC)=C1N 094982 [0,2,0,0,0,0|2,0,0]=4 526 B11R1.267 CCC1=CC=CC(CC)=C1N 095095 [0,2,0,0,0,0|2,0,0]=4 527 B11R1.9 CCC1=CC(Br)=CC(CC)=C1 024787 [0,2,0,0,0,0|2,0,0]=4 528 B11R1.74 CC1=CC(C)=CC(C(C)N)=C1 080262 [0,2,0,0,0,0|2,0,0]=4 529 B11R1.23 CCC(=O)C1=CC=CC(C)=C1 240661 [0,2,0,0,0,0|2,0,0]=4 530 B11R1.23 COC(=O)C1=CN=CC(C)=C1 078340 [0,2,0,0,0,0|1,0,1]=4 531 B11R1.23 COC(=O)C1=NC(C)=CC=C1 032619 [0,2,0,0,0,0|1,0,1]=4 532 B11R1.24 CC1=CC=CC(CCCO)=N1 032551 [0,2,0,0,0,0|1,0,0]=3 533 B11R1.24 CCCOC1=CC=CC(C)=C1 095348 [0,2,0,0,0,0|2,0,0]=4 534 B11R1.157 CC1=CC(OC(C)C)=CC=C1 095161 [0,2,0,0,0,0|2,0,0]=4 535 B11R1.182 CC1=CC(CCN)=C(C)C=C1 018632 [0,2,0,0,0,0|2,0,0]=4 536 B11R1.189 COC1=CC(CCBr)=CC=C1 485630 [0,2,0,0,0,0|2,0,0]=4 537 B11R1.189 COC1=CC=CC(CCN)=C1 008884 [0,2,0,0,0,0|2,0,0]=4 538 B11R1.192 CC1=C(C)C=C(CCN)C=C1 018634 [0,2,0,0,0,0|2,0,0]=4 539 B11R1.192 CCOC1=CC=C(Br)C(C)=C1 210905 [0,2,0,0,0,0|2,0,0]=4 540 B11R1.280 COC1=CC=C(Br)C(OC)=N1 235295 [0,2,0,0,0,0|2,0,0]=4 541 B11R1.280 COC1=CC=C(N)C(OC)=N1 064853 [0,2,0,0,0,0|2,0,0]=4 542 B11R1.155 CC(F)(F)C1=CC=CC(Br)=N1 101845 [0,2,0,0,0,0|2,0,0]=4 543 B11R1.155 CC1=CC(C(F)(F)F)=CN=C1 094124 [0,2,0,0,0,0|2,0,0]=4 544 B11R1.155 CC1=CC=CC(C(F)(F)F)=N1 043712 [0,2,0,0,0,0|2,0,0]=4 545 B11R1.155 FC(F)(F)C1=NC(Cl)=CN=C1 075802 [0,2,0,0,0,0|2,0,0]=4 546 B11R1.266 COC1=CC(C(C)N)=CC=C1 030159 [0,2,0,0,0,0|2,0,0]=4 547 B11R1.266 COC1=CC=CC(C(C)C)=C1 099960 [0,2,0,0,0,0|2,0,0]=4 548 B11R2.36 CC1=CC2=C(C=C1)NCC2 208813 [0,1,0,1,0,0|2,0,0]=4 549 B7R1.1 CCC1=CC=CN1 002567 [1,0,0,0,1,0|0,0,1]=3 550 B7R1.1 CCC1=CC=CS1 001177 [1,0,0,0,1,0|1,0,0]=3 551 B7R1.1 CCC1=CSC=C1 006141 [1,0,0,0,1,0|1,0,0]=3 552 B7R1.1 CCC1=NC=CN1 018684 [1,0,0,0,1,0|0,0,1]=3 553 B7R1.1 CCN1C=CC=C1 002566 [1,0,0,0,1,0|2,0,0]=4 554 B7R1.1 CCN1C=CC=N1 068645 [1,0,0,0,1,0|1,0,0]=3 555 B7R1.1 CCN1C=CN=C1 078976 [1,0,0,0,1,0|1,0,0]=3 556 B7R1.1 COC1=CSC=C1 013627 [1,0,0,0,1,0|2,0,0]=4 557 B7R1.1 COC1=NC=CS1 009621 [1,0,0,0,1,0|2,0,0]=4 558 B7R1.1 CSC1=NC=CS1 009622 [1,0,0,0,1,0|2,0,0]=4 559 B7R1.1 ClCC1=CNC=N1 016135 [1,0,0,0,1,0|1,0,1]=4 560 B7R1.1 ClCC1=CSC=N1 013925 [1,0,0,0,1,0|2,0,0]=4 561 B7R1.1 ClCC1=NC=CN1 023425 [1,0,0,0,1,0|1,0,1]=4 562 B7R1.1 NCC1=CC=CO1 358202 [1,0,0,0,1,0|2,0,0]=4 563 B7R1.1 NCC1=CC=CS1 092186 [1,0,0,0,1,0|2,0,0]=4 564 B7R1.1 NCC1=CN=CO1 076442 [1,0,0,0,1,0|2,0,0]=4 565 B7R1.1 NCC1=COC=N1 219245 [1,0,0,0,1,0|2,0,0]=4 566 B7R1.1 NCC1=NC=CS1 013114 [1,0,0,0,1,0|2,0,0]=4 567 B7R1.1 NCC1=NNC=C1 043021 [1,0,0,0,1,0|2,0,0]=4 568 B7R1.1 OCC1=CC=CO1 143000 [1,0,0,0,1,0|2,0,0]=4 569 B7R1.1 OCC1=CC=CS1 208652 [1,0,0,0,1,0|2,0,0]=4 570 B7R1.1 OCC1=CN=CS1 016175 [1,0,0,0,1,0|2,0,0]=4 571 B7R1.1 OCC1=CNC=N1 016121 [1,0,0,0,1,0|1,0,1]=4 572 B7R1.1 OCC1=CNC=N1 067734 [1,0,0,0,1,0|1,0,1]=4 573 B7R1.1 OCC1=COC=C1 092657 [1,0,0,0,1,0|2,0,0]=4 574 B7R1.1 OCC1=CSC=C1 067714 [1,0,0,0,1,0|2,0,0]=4 575 B7R1.1 OCC1=CSC=N1 016174 [1,0,0,0,1,0|2,0,0]=4 576 B7R1.1 OCC1=NC=CS1 067720 [1,0,0,0,1,0|2,0,0]=4 577 B7R1.1 OCN1C=CC=N1 078295 [1,0,0,0,1,0|2,0,0]=4 578 B7R1.1 SCC1=CC=CO1 002796 [1,0,0,0,1,0|2,0,0]=4 579 B7R1.1 SCC1=CC=CS1 104865 [1,0,0,0,1,0|2,0,0]=4 580 B7R1.2 CC1=CC(C)=NN1 037857 [1,0,0,0,1,0|2,0,0]=4 581 B7R1.2 CC1=CC(C)=NO1 023218 [1,0,0,0,1,0|2,0,0]=4 582 B7R1.2 CC1=CC=C(Br)S1 024230 [1,0,0,0,1,0|2,0,0]=4 583 B7R1.2 CC1=CC=C(C)N1 236653 [1,0,0,0,1,0|0,0,1]=3 584 B7R1.2 CC1=CC=C(C)S1 002791 [1,0,0,0,1,0|1,0,0]=3 585 B7R1.2 CC1=CC=C(I)S1 002582 [1,0,0,0,1,0|2,0,0]=4 586 B7R1.2 CC1=CN=C(Br)S1 067363 [1,0,0,0,1,0|2,0,0]=4 587 B7R1.2 CC1=CN=C(N)S1 011366 [1,0,0,0,1,0|2,0,0]=4 588 B7R1.2 CC1=CNC(Br)=N1 222056 [1,0,0,0,1,0|1,0,1]=4 589 B7R1.2 CC1=CNC(C)=N1 078094 [1,0,0,0,1,0|0,0,1]=3 590 B7R1.2 CC1=COC(N)=N1 016110 [1,0,0,0,1,0|2,0,0]=4 591 B7R1.2 CC1=CSC(Br)=N1 016134 [1,0,0,0,1,0|2,0,0]=4 592 B7R1.2 CC1=CSC(C)=N1 002760 [1,0,0,0,1,0|1,0,0]=3 593 B7R1.2 CC1=CSC(N)=N1 023295 [1,0,0,0,1,0|2,0,0]=4 594 B7R1.2 CC1=NC(Br)=CN1 209279 [1,0,0,0,1,0|1,0,1]=4 595 B7R1.2 CC1=NC=C(I)N1 077607 [1,0,0,0,1,0|1,0,1]=4 596 B7R1.2 CC1=NN(C)C=C1 038245 [1,0,0,0,1,0|1,0,0]=3 597 B7R1.2 CC1=NNC(C)=N1 233300 [1,0,0,0,1,0|1,0,0]=3 598 B7R1.2 CC1=NSC(N)=N1 009666 [1,0,0,0,1,0|2,0,0]=4 599 B7R1.2 CN1C=CC(Br)=N1 093190 [1,0,0,0,1,0|2,0,0]=4 600 B7R1.2 CN1C=CC(Cl)=N1 044766 [1,0,0,0,1,0|2,0,0]=4 601 B7R1.2 CN1C=CC(I)=N1 047530 [1,0,0,0,1,0|2,0,0]=4 602 B7R1.2 CN1C=CC(N)=N1 025069 [1,0,0,0,1,0|2,0,0]=4 603 B7R1.4 CC1=CSC=C1Br 024231 [1,0,0,0,1,0|2,0,0]=4