0 B6R1.2 BrC1=CN=CS1 SY005152 [0,0,0,0,0,0|3,0,0]=3 1 B6R1.2 BrC1=CNC=N1 SY007649 [0,0,0,0,0,0|3,0,0]=3 2 B6R1.2 BrC1=CNN=C1 SY002635 [0,0,0,0,0,0|1,0,0]=1 3 B6R1.2 BrC1=CNN=N1 SY124531 [0,0,0,0,0,0|2,0,0]=2 4 B6R1.2 BrC1=COC=N1 SY231290 [0,0,0,0,0,0|4,0,0]=4 5 B6R1.2 BrC1=CON=C1 SY008721 [0,0,0,0,0,0|2,0,0]=2 6 B6R1.2 BrC1=CSC=N1 SY005274 [0,0,0,0,0,0|4,0,0]=4 7 B6R1.2 BrC1=CSN=C1 SY009259 [0,0,0,0,0,0|2,0,0]=2 8 B6R1.2 BrC1=NC=NN1 SY032210 [0,0,0,0,0,0|4,0,0]=4 9 B6R1.2 BrC1=NC=NS1 SY029598 [0,0,0,0,0,0|4,0,0]=4 10 B6R1.2 BrC1=NN=CS1 SY025324 [0,0,0,0,0,0|4,0,0]=4 11 B6R1.2 BrC1=NNC=C1 SY004896 [0,0,0,0,0,0|3,0,0]=3 12 B6R1.2 BrC1=NNN=N1 SY038456 [0,0,0,0,0,0|3,0,0]=3 13 B6R1.2 BrC1=NOC=C1 SY009266 [0,0,0,0,0,0|4,0,0]=4 14 B6R1.2 BrC1=NSC=C1 SY039106 [0,0,0,0,0,0|4,0,0]=4 15 B6R1.2 C=C1CCNC1 SY038558 [0,0,0,0,0,0|1,0,3]=4 16 B6R1.2 CC1=CC=CN1 SY004787 [0,0,0,0,0,0|3,0,0]=3 17 B6R1.2 CC1=CC=NO1 SY038700 [0,0,0,0,0,0|2,0,0]=2 18 B6R1.2 CC1=CNC=C1 SY014135 [0,0,0,0,0,0|1,0,0]=1 19 B6R1.2 CC1=CNN=C1 SY006499 [0,0,0,0,0,0|0,0,0]=0 20 B6R1.2 CC1=CNN=N1 SY105113 [0,0,0,0,0,0|1,0,0]=1 21 B6R1.2 CC1=COC=N1 SY046619 [0,0,0,0,0,0|3,0,0]=3 22 B6R1.2 CC1=CSC=N1 SY004152 [0,0,0,0,0,0|3,0,0]=3 23 B6R1.2 CC1=NC=CS1 SY009541 [0,0,0,0,0,0|4,0,0]=4 24 B6R1.2 CC1=NCCC1 SY015490 [0,0,0,0,0,0|3,0,1]=4 25 B6R1.2 CC1=NN=NN1 SY031544 [0,0,0,0,0,0|2,0,1]=3 26 B6R1.2 CC1=NNC=N1 SY025686 [0,0,0,0,0,0|3,0,0]=3 27 B6R1.2 CN1C=CN=N1 SY045526 [0,0,0,0,0,0|3,0,0]=3 28 B6R1.2 CN1C=NC=N1 SY046529 [0,0,0,0,0,0|3,0,0]=3 29 B6R1.2 CN1CCNC1 SY251230 [0,0,0,0,0,0|2,0,2]=4 30 B6R1.2 C[C@@H]1CCNC1 SY097390 [0,0,0,0,0,0|1,0,3]=4 31 B6R1.2 C[C@H]1CCNC1 SY097402 [0,0,0,0,0,0|1,0,3]=4 32 B6R1.2 ClC1=CN=CN1 SY056650 [0,0,0,0,0,0|3,0,0]=3 33 B6R1.2 ClC1=CNN=C1 SY016263 [0,0,0,0,0,0|1,0,0]=1 34 B6R1.2 ClC1=NC=NS1 SY017464 [0,0,0,0,0,0|4,0,0]=4 35 B6R1.2 ClC1=NNC=C1 SY032847 [0,0,0,0,0,0|3,0,0]=3 36 B6R1.2 ClC1=NNC=N1 SY031837 [0,0,0,0,0,0|4,0,0]=4 37 B6R1.2 FC1=CNC=N1 SY058295 [0,0,0,0,0,0|3,0,0]=3 38 B6R1.2 FC1=CNN=C1 SY031964 [0,0,0,0,0,0|1,0,0]=1 39 B6R1.2 FC1=NNC=C1 SY072990 [0,0,0,0,0,0|3,0,0]=3 40 B6R1.2 IC1=CC=CS1 SY001504 [0,0,0,0,0,0|4,0,0]=4 41 B6R1.2 IC1=CNC=C1 SY288841 [0,0,0,0,0,0|2,0,0]=2 42 B6R1.2 IC1=CNC=N1 SY001996 [0,0,0,0,0,0|3,0,0]=3 43 B6R1.2 IC1=CNC=N1 SY275838 [0,0,0,0,0,0|3,0,0]=3 44 B6R1.2 IC1=CNN=C1 SY004083 [0,0,0,0,0,0|1,0,0]=1 45 B6R1.2 IC1=CON=C1 SY106909 [0,0,0,0,0,0|2,0,0]=2 46 B6R1.2 IC1=CSC=C1 SY030129 [0,0,0,0,0,0|3,0,0]=3 47 B6R1.2 IC1=NNC=C1 SY026658 [0,0,0,0,0,0|3,0,0]=3 48 B6R1.2 NC1=CN=CS1 SY069459 [0,0,0,0,0,0|3,0,0]=3 49 B6R1.2 NC1=CNN=C1 SY006645 [0,0,0,0,0,0|1,0,0]=1 50 B6R1.2 NC1=COC=C1 SY237155 [0,0,0,0,0,0|3,0,0]=3 51 B6R1.2 NC1=CON=C1 SY041839 [0,0,0,0,0,0|2,0,0]=2 52 B6R1.2 NC1=CSC=C1 SY003022 [0,0,0,0,0,0|3,0,0]=3 53 B6R1.2 NC1=CSC=C1 SY098699 [0,0,0,0,0,0|3,0,0]=3 54 B6R1.2 NC1=CSC=N1 SY017948 [0,0,0,0,0,0|4,0,0]=4 55 B6R1.2 NC1=CSN=C1 SY241022 [0,0,0,0,0,0|2,0,0]=2 56 B6R1.2 NC1=NC=NS1 SY010738 [0,0,0,0,0,0|4,0,0]=4 57 B6R1.2 NC1=NC=NS1 SY021614 [0,0,0,0,0,0|4,0,0]=4 58 B6R1.2 NC1=NN=CO1 SY022770 [0,0,0,0,0,0|4,0,0]=4 59 B6R1.2 NC1=NOC=C1 SY007959 [0,0,0,0,0,0|4,0,0]=4 60 B6R1.2 NN1C=CC=C1 SY041957 [0,0,0,0,0,0|4,0,0]=4 61 B6R1.2 NN1C=NN=C1 SY001769 [0,0,0,0,0,0|2,0,1]=3 62 B6R1.2 O=C1C=CCN1 SY032773 [0,0,0,0,0,0|4,0,0]=4 63 B6R1.2 O=C1C=CCO1 SY017893 [0,0,0,0,0,0|4,0,0]=4 64 B6R1.2 O=C1C=CNN1 SY022755 [0,0,0,0,0,0|3,0,0]=3 65 B6R1.2 O=C1C=CSN1 SY045488 [0,0,0,0,0,0|4,0,0]=4 66 B6R1.2 O=C1CC=NN1 SY211686 [0,0,0,0,0,0|3,0,1]=4 67 B6R1.2 O=C1CCNC1 SY019727 [0,0,0,0,0,0|2,0,2]=4 68 B6R1.2 O=C1CCNN1 SY073624 [0,0,0,0,0,0|3,0,1]=4 69 B6R1.2 O=C1N=CNN1 SY014481 [0,0,0,0,0,0|4,0,0]=4 70 B6R1.2 OC1=CC=CS1 SY248518 [0,0,0,0,0,0|4,0,0]=4 71 B6R1.2 OC1=CNN=C1 SY032456 [0,0,0,0,0,0|1,0,0]=1 72 B6R1.2 OC1=NOC=C1 SY197715 [0,0,0,0,0,0|4,0,0]=4 73 B6R1.2 SC1=NNC=N1 SY036776 [0,0,0,0,0,0|4,0,0]=4 74 B6R1.2 [S-]C1=CN=NN1 SY026376 [0,0,0,0,0,0|2,0,1]=3 75 B5R1.1 C1=CCC=C1 SY010219 [1,0,0,0,0,0|2,0,0]=3 76 B5R1.1 C1=CCNC1 SY012047 [1,0,0,0,0,0|1,0,1]=3 77 B5R1.1 C1=CNC=N1 SY112845 [1,0,0,0,0,0|2,0,0]=3 78 B5R1.1 C1=NC=NN1 SY001414 [1,0,0,0,0,0|1,0,0]=2 79 B5R1.1 C1=NC=N[N-]1 SY004810 [1,0,0,0,0,0|1,0,1]=3 80 B5R1.1 C1=NC=N[N-]1 SY295434 [1,0,0,0,0,0|1,0,1]=3 81 B5R1.1 C1=NNN=C1 SY005819 [1,0,0,0,0,0|1,0,0]=2 82 B7R1.1 BrCC1=CSC=C1 SY021673 [0,1,0,0,0,0|2,0,0]=3 83 B7R1.1 C#CC1=CNN=C1 SY099787 [0,1,0,0,0,0|0,0,1]=2 84 B7R1.1 CCC1=CC=CS1 SY048489 [0,1,0,0,0,0|3,0,0]=4 85 B7R1.1 CCC1=CNC=N1 SY055411 [0,1,0,0,0,0|2,0,0]=3 86 B7R1.1 CCC1=CSC=C1 SY036406 [0,1,0,0,0,0|2,0,0]=3 87 B7R1.1 COC1=CNN=C1 SY100279 [0,1,0,0,0,0|0,0,0]=1 88 B7R1.1 COC1=NNC=C1 SY147600 [0,1,0,0,0,0|2,0,0]=3 89 B7R1.1 ClCC1=CN=CO1 SY232319 [0,1,0,0,0,0|2,0,0]=3 90 B7R1.1 ClCC1=NNC=C1 SY012821 [0,1,0,0,0,0|2,0,0]=3 91 B7R1.1 N#CC1=CN=CS1 SY043007 [0,1,0,0,0,0|2,0,1]=4 92 B7R1.1 N#CC1=CNC=N1 SY007663 [0,1,0,0,0,0|2,0,1]=4 93 B7R1.1 N#CC1=CNN=C1 SY035874 [0,1,0,0,0,0|0,0,1]=2 94 B7R1.1 N#CC1=CSC=C1 SY017477 [0,1,0,0,0,0|2,0,1]=4 95 B7R1.1 N#CC1=NNC=C1 SY031847 [0,1,0,0,0,0|2,0,1]=4 96 B7R1.1 NCC1=CC=CN1 SY032090 [0,1,0,0,0,0|3,0,0]=4 97 B7R1.1 NCC1=CC=NO1 SY021529 [0,1,0,0,0,0|2,0,0]=3 98 B7R1.1 NCC1=CNC=N1 SY018114 [0,1,0,0,0,0|2,0,0]=3 99 B7R1.1 NCC1=CNN=C1 SY042195 [0,1,0,0,0,0|0,0,0]=1 100 B7R1.1 NCC1=CNN=N1 SY192945 [0,1,0,0,0,0|1,0,0]=2 101 B7R1.1 NCC1=COC=C1 SY002989 [0,1,0,0,0,0|2,0,0]=3 102 B7R1.1 NCC1=COC=N1 SY026493 [0,1,0,0,0,0|3,0,0]=4 103 B7R1.1 NCC1=COC=N1 SY043130 [0,1,0,0,0,0|3,0,0]=4 104 B7R1.1 NCC1=CON=C1 SY211967 [0,1,0,0,0,0|1,0,0]=2 105 B7R1.1 NCC1=CSC=C1 SY006774 [0,1,0,0,0,0|2,0,0]=3 106 B7R1.1 NCC1=CSC=C1 SY018599 [0,1,0,0,0,0|2,0,0]=3 107 B7R1.1 NCC1=CSC=N1 SY021530 [0,1,0,0,0,0|3,0,0]=4 108 B7R1.1 NCC1=CSC=N1 SY023202 [0,1,0,0,0,0|3,0,0]=4 109 B7R1.1 NCC1=NN=NN1 SY021958 [0,1,0,0,0,0|2,0,1]=4 110 B7R1.1 NCC1=NNC=C1 SY005508 [0,1,0,0,0,0|2,0,0]=3 111 B7R1.1 NCC1=NNC=N1 SY035453 [0,1,0,0,0,0|3,0,0]=4 112 B7R1.1 NCC1=NNN=N1 SY024525 [0,1,0,0,0,0|2,0,0]=3 113 B7R1.1 NCC1=NOC=C1 SY024118 [0,1,0,0,0,0|3,0,0]=4 114 B7R1.1 NCC1=NOC=C1 SY034799 [0,1,0,0,0,0|3,0,0]=4 115 B7R1.1 O=CC1=CN=CO1 SY025934 [0,1,0,0,0,0|2,0,1]=4 116 B7R1.1 O=CC1=CN=CS1 SY005766 [0,1,0,0,0,0|2,0,1]=4 117 B7R1.1 O=CC1=CNC=C1 SY010726 [0,1,0,0,0,0|1,0,1]=3 118 B7R1.1 O=CC1=CNC=N1 SY003074 [0,1,0,0,0,0|2,0,1]=4 119 B7R1.1 O=CC1=CNN=C1 SY013236 [0,1,0,0,0,0|0,0,1]=2 120 B7R1.1 O=CC1=COC=C1 SY013826 [0,1,0,0,0,0|2,0,1]=4 121 B7R1.1 OCC1=CC=CS1 SY036796 [0,1,0,0,0,0|3,0,0]=4 122 B7R1.1 OCC1=CC=NO1 SY179337 [0,1,0,0,0,0|2,0,0]=3 123 B7R1.1 OCC1=CN=CO1 SY025391 [0,1,0,0,0,0|2,0,0]=3 124 B7R1.1 OCC1=CN=CS1 SY002035 [0,1,0,0,0,0|2,0,0]=3 125 B7R1.1 OCC1=CNC=N1 SY003265 [0,1,0,0,0,0|2,0,0]=3 126 B7R1.1 OCC1=CNN=C1 SY042536 [0,1,0,0,0,0|0,0,0]=1 127 B7R1.1 OCC1=COC=C1 SY033055 [0,1,0,0,0,0|2,0,0]=3 128 B7R1.1 OCC1=COC=N1 SY012558 [0,1,0,0,0,0|3,0,0]=4 129 B7R1.1 OCC1=CSC=C1 SY017648 [0,1,0,0,0,0|2,0,0]=3 130 B7R1.1 OCC1=NNC=C1 SY012820 [0,1,0,0,0,0|2,0,0]=3 131 B7R1.2 BrC1=CC(Br)=NN1 SY059800 [0,1,0,0,0,0|3,0,0]=4 132 B7R1.2 BrC1=CN=C(Br)S1 SY005103 [0,1,0,0,0,0|3,0,0]=4 133 B7R1.2 BrC1=CNC(Br)=N1 SY018396 [0,1,0,0,0,0|3,0,0]=4 134 B7R1.2 BrC1=CSC(Br)=C1 SY031539 [0,1,0,0,0,0|3,0,0]=4 135 B7R1.2 BrC1=CSC(I)=C1 SY202441 [0,1,0,0,0,0|3,0,0]=4 136 B7R1.2 CC1=CC(Br)=CS1 SY009269 [0,1,0,0,0,0|3,0,0]=4 137 B7R1.2 CC1=CC(Br)=NN1 SY030862 [0,1,0,0,0,0|2,0,0]=3 138 B7R1.2 CC1=CC(Br)=NO1 SY037249 [0,1,0,0,0,0|2,0,0]=3 139 B7R1.2 CC1=CC(C)=NN1 SY001302 [0,1,0,0,0,0|2,0,0]=3 140 B7R1.2 CC1=CC(Cl)=NN1 SY035853 [0,1,0,0,0,0|2,0,0]=3 141 B7R1.2 CC1=CC(I)=NN1 SY114542 [0,1,0,0,0,0|2,0,0]=3 142 B7R1.2 CC1=CC(N)=NN1 SY003009 [0,1,0,0,0,0|2,0,0]=3 143 B7R1.2 CC1=CC(N)=NO1 SY001097 [0,1,0,0,0,0|2,0,0]=3 144 B7R1.2 CC1=CC=C(Br)S1 SY002012 [0,1,0,0,0,0|3,0,0]=4 145 B7R1.2 CC1=CC=C(C)S1 SY018010 [0,1,0,0,0,0|3,0,0]=4 146 B7R1.2 CC1=CC=C(I)S1 SY016776 [0,1,0,0,0,0|3,0,0]=4 147 B7R1.2 CC1=CN(C)N=C1 SY014459 [0,1,0,0,0,0|0,0,0]=1 148 B7R1.2 CC1=CN(C)N=N1 SY116744 [0,1,0,0,0,0|1,0,0]=2 149 B7R1.2 CC1=CN=C(Br)S1 SY017607 [0,1,0,0,0,0|2,0,0]=3 150 B7R1.2 CC1=CN=C(C)O1 SY040818 [0,1,0,0,0,0|2,0,0]=3 151 B7R1.2 CC1=CN=C(C)S1 SY030427 [0,1,0,0,0,0|2,0,0]=3 152 B7R1.2 CC1=CN=C(Cl)S1 SY102232 [0,1,0,0,0,0|2,0,0]=3 153 B7R1.2 CC1=CN=C(I)O1 SY294256 [0,1,0,0,0,0|2,0,0]=3 154 B7R1.2 CC1=CNC(Br)=N1 SY039408 [0,1,0,0,0,0|2,0,0]=3 155 B7R1.2 CC1=CSC(Br)=N1 SY004506 [0,1,0,0,0,0|3,0,0]=4 156 B7R1.2 CC1=CSC(Cl)=N1 SY128140 [0,1,0,0,0,0|3,0,0]=4 157 B7R1.2 CC1=CSC(N)=N1 SY005920 [0,1,0,0,0,0|3,0,0]=4 158 B7R1.2 CC1=NC(Br)=CN1 SY026643 [0,1,0,0,0,0|3,0,0]=4 159 B7R1.2 CC1=NC(Br)=NO1 SY041226 [0,1,0,0,0,0|3,0,0]=4 160 B7R1.2 CC1=NC(I)=CN1 SY020522 [0,1,0,0,0,0|3,0,0]=4 161 B7R1.2 CC1=NC(N)=CN1 SY265833 [0,1,0,0,0,0|3,0,0]=4 162 B7R1.2 CC1=NC(N)=NO1 SY083716 [0,1,0,0,0,0|3,0,0]=4 163 B7R1.2 CC1=NC=C(Br)S1 SY023487 [0,1,0,0,0,0|3,0,0]=4 164 B7R1.2 CC1=NC=C(N)S1 SY011962 [0,1,0,0,0,0|3,0,0]=4 165 B7R1.2 CC1=NN(C)C=C1 SY017661 [0,1,0,0,0,0|2,0,0]=3 166 B7R1.2 CC1=NN(C)N=N1 SY292702 [0,1,0,0,0,0|2,0,0]=3 167 B7R1.2 CC1=NN=C(Br)O1 SY022992 [0,1,0,0,0,0|3,0,0]=4 168 B7R1.2 CC1=NN=C(Br)S1 SY028580 [0,1,0,0,0,0|3,0,0]=4 169 B7R1.2 CC1=NN=C(N)O1 SY008409 [0,1,0,0,0,0|3,0,0]=4 170 B7R1.2 CC1=NN=C(N)S1 SY004265 [0,1,0,0,0,0|3,0,0]=4 171 B7R1.2 CC1=NNC(=O)C1 SY010796 [0,1,0,0,0,0|2,0,1]=4 172 B7R1.2 CC1=NNC(=O)O1 SY017602 [0,1,0,0,0,0|3,0,0]=4 173 B7R1.2 CC1=NOC(N)=C1 SY048418 [0,1,0,0,0,0|3,0,0]=4 174 B7R1.2 CC1=NOC(O)=C1 SY040816 [0,1,0,0,0,0|3,0,0]=4 175 B7R1.2 CC1=NSC(N)=C1 SY027628 [0,1,0,0,0,0|3,0,0]=4 176 B7R1.2 CN1C=C(Br)C=N1 SY004708 [0,1,0,0,0,0|1,0,0]=2 177 B7R1.2 CN1C=C(Br)N=N1 SY059523 [0,1,0,0,0,0|2,0,0]=3 178 B7R1.2 CN1C=C(Cl)C=N1 SY016168 [0,1,0,0,0,0|1,0,0]=2 179 B7R1.2 CN1C=C(I)C=N1 SY023308 [0,1,0,0,0,0|1,0,0]=2 180 B7R1.2 CN1C=C(N)C=N1 SY005154 [0,1,0,0,0,0|1,0,0]=2 181 B7R1.2 CN1C=C(N)C=N1 SY022073 [0,1,0,0,0,0|1,0,0]=2 182 B7R1.2 CN1C=C(N)C=N1 SY112352 [0,1,0,0,0,0|1,0,0]=2 183 B7R1.2 CN1C=C(N)N=N1 SY024805 [0,1,0,0,0,0|2,0,0]=3 184 B7R1.2 CN1C=C(O)C=N1 SY111384 [0,1,0,0,0,0|1,0,0]=2 185 B7R1.2 CN1C=CC(=O)N1 SY047877 [0,1,0,0,0,0|3,0,0]=4 186 B7R1.2 CN1C=CC(Br)=N1 SY007834 [0,1,0,0,0,0|3,0,0]=4 187 B7R1.2 CN1C=CC(I)=N1 SY041223 [0,1,0,0,0,0|3,0,0]=4 188 B7R1.2 CN1C=CC(N)=N1 SY003249 [0,1,0,0,0,0|3,0,0]=4 189 B7R1.2 CN1C=C[N+](C)=C1 SY039191 [0,1,0,0,0,0|2,0,0]=3 190 B7R1.2 CN1C=C[N+](C)=C1 SY102586 [0,1,0,0,0,0|2,0,0]=3 191 B7R1.2 CN1C=C[N+](C)=C1 SY121950 [0,1,0,0,0,0|2,0,0]=3 192 B7R1.2 CN1C=NC(Br)=C1 SY008697 [0,1,0,0,0,0|2,0,0]=3 193 B7R1.2 CN1C=NC(Br)=N1 SY043004 [0,1,0,0,0,0|3,0,0]=4 194 B7R1.2 CN1C=NC(I)=C1 SY008696 [0,1,0,0,0,0|2,0,0]=3 195 B7R1.2 CN1C=NC(N)=C1 SY018016 [0,1,0,0,0,0|2,0,0]=3 196 B7R1.2 CN1C=NC(N)=N1 SY025567 [0,1,0,0,0,0|3,0,0]=4 197 B7R1.2 CN1N=CC(Br)=N1 SY060718 [0,1,0,0,0,0|2,0,0]=3 198 B7R1.2 CN1N=CC(N)=N1 SY253135 [0,1,0,0,0,0|2,0,0]=3 199 B7R1.2 CN1N=NC(N)=N1 SY013123 [0,1,0,0,0,0|3,0,0]=4 200 B7R1.2 ClC1=CN=C(Br)S1 SY019453 [0,1,0,0,0,0|3,0,0]=4 201 B7R1.2 ClC1=NC=C(Br)S1 SY047903 [0,1,0,0,0,0|3,0,0]=4 202 B7R1.2 NC1=CC(Br)=CS1 SY270848 [0,1,0,0,0,0|3,0,0]=4 203 B7R1.2 NC1=CC(Cl)=NN1 SY042394 [0,1,0,0,0,0|3,0,0]=4 204 B7R1.2 NC1=CC(N)=NN1 SY022707 [0,1,0,0,0,0|3,0,0]=4 205 B7R1.2 NC1=CSC(Br)=C1 SY280173 [0,1,0,0,0,0|3,0,0]=4 206 B7R1.2 NC1=NC=C(Br)S1 SY005157 [0,1,0,0,0,0|3,0,0]=4 207 B7R1.2 NC1=NC=C(Br)S1 SY005892 [0,1,0,0,0,0|3,0,0]=4 208 B7R1.2 NC1=NNC(Br)=C1 SY027745 [0,1,0,0,0,0|3,0,0]=4 209 B7R1.4 BrC1=C(Br)NN=N1 SY024522 [0,1,0,0,0,0|2,0,0]=3 210 B7R1.4 BrC1=COC=C1Br SY023104 [0,1,0,0,0,0|3,0,0]=4 211 B7R1.4 BrC1=CSC=C1Br SY001342 [0,1,0,0,0,0|3,0,0]=4 212 B7R1.4 BrC1=NNC=C1I SY044788 [0,1,0,0,0,0|1,0,0]=2 213 B7R1.4 CC1=C(Br)N=CN1 SY024634 [0,1,0,0,0,0|2,0,0]=3 214 B7R1.4 CC1=C(Br)SC=N1 SY021986 [0,1,0,0,0,0|3,0,0]=4 215 B7R1.4 CC1=C(C)NC=C1 SY284153 [0,1,0,0,0,0|1,0,0]=2 216 B7R1.4 CC1=C(C)NC=N1 SY036818 [0,1,0,0,0,0|2,0,0]=3 217 B7R1.4 CC1=C(I)C=NO1 SY038698 [0,1,0,0,0,0|2,0,0]=3 218 B7R1.4 CC1=C(I)N=CN1 SY034657 [0,1,0,0,0,0|2,0,0]=3 219 B7R1.4 CC1=C(N)N=CN1 SY024335 [0,1,0,0,0,0|2,0,0]=3 220 B7R1.4 CC1=C(N)ON=C1 SY193496 [0,1,0,0,0,0|1,0,0]=2 221 B7R1.4 CC1=CC=NN1C SY032670 [0,1,0,0,0,0|2,0,0]=3 222 B7R1.4 CC1=CCNC1=O SY295114 [0,1,0,0,0,0|1,0,0]=2 223 B7R1.4 CC1=CNN=C1Br SY035870 [0,1,0,0,0,0|0,0,0]=1 224 B7R1.4 CC1=CNN=C1C SY024902 [0,1,0,0,0,0|0,0,0]=1 225 B7R1.4 CC1=CNN=C1C SY102711 [0,1,0,0,0,0|0,0,0]=1 226 B7R1.4 CC1=CNN=C1N SY026483 [0,1,0,0,0,0|0,0,0]=1 227 B7R1.4 CC1=COC=C1Br SY298744 [0,1,0,0,0,0|2,0,0]=3 228 B7R1.4 CC1=CON=C1Br SY037253 [0,1,0,0,0,0|1,0,0]=2 229 B7R1.4 CC1=CSC=C1Br SY009333 [0,1,0,0,0,0|2,0,0]=3 230 B7R1.4 CC1=CSC=C1C SY100626 [0,1,0,0,0,0|2,0,0]=3 231 B7R1.4 CC1=NN=NN1C SY253276 [0,1,0,0,0,0|2,0,1]=4 232 B7R1.4 CC1=NNC=C1Br SY010801 [0,1,0,0,0,0|1,0,0]=2 233 B7R1.4 CC1=NNC=C1I SY010800 [0,1,0,0,0,0|1,0,0]=2 234 B7R1.4 CC1=NOC=C1Br SY265513 [0,1,0,0,0,0|2,0,0]=3 235 B7R1.4 CC1=NON=C1C SY130728 [0,1,0,0,0,0|2,0,0]=3 236 B7R1.4 CN1C=CN=C1Br SY013969 [0,1,0,0,0,0|2,0,0]=3 237 B7R1.4 CN1C=CN=C1Cl SY019835 [0,1,0,0,0,0|2,0,0]=3 238 B7R1.4 CN1C=CN=C1N SY010735 [0,1,0,0,0,0|2,0,0]=3 239 B7R1.4 CN1C=NC=C1Br SY016736 [0,1,0,0,0,0|2,0,0]=3 240 B7R1.4 CN1C=NC=C1Cl SY041529 [0,1,0,0,0,0|2,0,0]=3 241 B7R1.4 CN1C=NN=C1Br SY014013 [0,1,0,0,0,0|1,0,1]=3 242 B7R1.4 CN1C=NN=C1S SY049861 [0,1,0,0,0,0|1,0,1]=3 243 B7R1.4 CN1N=CC=C1Br SY043010 [0,1,0,0,0,0|3,0,0]=4 244 B7R1.4 CN1N=CC=C1I SY037964 [0,1,0,0,0,0|3,0,0]=4 245 B7R1.4 CN1N=CC=C1N SY003710 [0,1,0,0,0,0|3,0,0]=4 246 B7R1.4 CN1N=CC=C1O SY047635 [0,1,0,0,0,0|3,0,0]=4 247 B7R1.4 CN1N=CN=C1Br SY021471 [0,1,0,0,0,0|3,0,0]=4 248 B7R1.4 CN1N=NC=C1N SY024334 [0,1,0,0,0,0|2,0,1]=4 249 B7R1.4 CN1N=NN=C1N SY051261 [0,1,0,0,0,0|2,0,1]=4 250 B7R1.4 ClC1=C(Br)C=CS1 SY022252 [0,1,0,0,0,0|3,0,0]=4 251 B7R1.4 ClC1=C(Br)SC=C1 SY106998 [0,1,0,0,0,0|3,0,0]=4 252 B7R1.4 FC1=CNC=C1F SY061063 [0,1,0,0,0,0|2,0,0]=3 253 B7R1.4 IC1=C(I)NC=N1 SY005943 [0,1,0,0,0,0|3,0,0]=4 254 B7R1.4 NC1=CNN=C1Cl SY116004 [0,1,0,0,0,0|1,0,0]=2 255 B7R1.4 NC1=CSC=C1N SY184607 [0,1,0,0,0,0|3,0,0]=4 256 B7R1.4 NC1=NNC=C1Br SY007923 [0,1,0,0,0,0|1,0,0]=2 257 B7R1.4 NC1=NON=C1N SY046572 [0,1,0,0,0,0|3,0,0]=4 258 B7R1.4 O=C1OCC=C1Br SY017900 [0,1,0,0,0,0|3,0,0]=4 259 B5R0.1 CC(=O)CCN SY263173 [0,0,1,0,0,0|2,0,1]=4 260 B5R0.1 CC(=O)\C=N/O SY112549 [0,0,1,0,0,0|2,0,0]=3 261 B5R0.1 CC(I)=CCI SY237855 [0,0,1,0,0,0|3,0,0]=4 262 B5R0.1 C\C(I)=C/CI SY237856 [0,0,1,0,0,0|3,0,0]=4 263 B5R0.1 C\C(I)=C\CI SY237854 [0,0,1,0,0,0|3,0,0]=4 264 B5R0.1 C\C(I)=C\CO SY246995 [0,0,1,0,0,0|3,0,0]=4 265 B5R0.1 C\C(I)=C\CO SY252919 [0,0,1,0,0,0|3,0,0]=4 266 B5R0.3 C=CC(C)ON SY039116 [0,0,1,0,0,0|2,0,1]=4 267 B5R0.3 CC(=CI)CI SY271392 [0,0,1,0,0,0|2,0,1]=4 268 B5R0.3 C\C(=C/I)CO SY270524 [0,0,1,0,0,0|2,0,1]=4 269 B5R0.3 C\C(=C\I)CI SY248780 [0,0,1,0,0,0|2,0,1]=4 270 B5R1.2 CC1CCN1 SY099118 [0,0,0,0,1,0|1,0,2]=4 271 B5R1.2 CC1CNC1 SY056983 [0,0,0,0,1,0|0,0,3]=4 272 B5R1.2 C[C@@H]1CCN1 SY261901 [0,0,0,0,1,0|1,0,2]=4 273 B5R1.2 C[C@H]1CCN1 SY249704 [0,0,0,0,1,0|1,0,2]=4 274 B5R1.2 O=C1CNC1 SY027144 [0,0,0,0,1,0|1,0,2]=4 275 B7R1.3 BrC1=CC=CN=N1 SY007900 [0,0,0,0,0,1|3,0,0]=4 276 B7R1.3 BrC1=CN=CN=C1 SY004103 [0,0,0,0,0,1|1,0,1]=3 277 B7R1.3 BrC1=CN=CN=N1 SY300036 [0,0,0,0,0,1|2,0,1]=4 278 B7R1.3 BrC1=NC=CN=C1 SY019862 [0,0,0,0,0,1|2,0,0]=3 279 B7R1.3 BrC1=NC=NC=C1 SY110226 [0,0,0,0,0,1|2,0,0]=3 280 B7R1.3 C1=CC=C(Br)C=C1 SY061516 [0,0,0,0,0,1|3,0,0]=4 281 B7R1.3 CC1=CC=CCC1 SY292105 [0,0,0,0,0,1|2,0,1]=4 282 B7R1.3 CC1=CC=NN=C1 SY046980 [0,0,0,0,0,1|0,0,1]=2 283 B7R1.3 CC1=CCCC=C1 SY292104 [0,0,0,0,0,1|2,0,0]=3 284 B7R1.3 CC1=NC=CC=N1 SY008219 [0,0,0,0,0,1|3,0,0]=4 285 B7R1.3 CC1=NC=NC=C1 SY009308 [0,0,0,0,0,1|1,0,0]=2 286 B7R1.3 CC1=NN=CC=C1 SY031534 [0,0,0,0,0,1|2,0,0]=3 287 B7R1.3 ClC1=NN=CC=C1 SY097653 [0,0,0,0,0,1|3,0,0]=4 288 B7R1.3 IC1=CC=CN=C1 SY007548 [0,0,0,0,0,1|2,0,0]=3 289 B7R1.3 IC1=CN=CC=N1 SY005099 [0,0,0,0,0,1|2,0,0]=3 290 B7R1.3 IC1=CN=CN=C1 SY058504 [0,0,0,0,0,1|1,0,1]=3 291 B7R1.3 IC1=NC=CC=C1 SY013861 [0,0,0,0,0,1|3,0,0]=4 292 B7R1.3 NC1=CC=NC=N1 SY006845 [0,0,0,0,0,1|2,0,0]=3 293 B7R1.3 NC1=CN=CN=C1 SY007106 [0,0,0,0,0,1|1,0,1]=3 294 B7R1.3 NC1=CN=NC=C1 SY008183 [0,0,0,0,0,1|1,0,1]=3 295 B7R1.3 NC1=NC=CN=C1 SY001512 [0,0,0,0,0,1|2,0,0]=3 296 B7R1.3 NC1=NC=CN=N1 SY011250 [0,0,0,0,0,1|3,0,0]=4 297 B7R1.3 NC1=NN=CC=C1 SY017896 [0,0,0,0,0,1|3,0,0]=4 298 B7R1.3 O=C1C=CC=NN1 SY020182 [0,0,0,0,0,1|3,0,0]=4 299 B7R1.3 O=C1C=CN=CN1 SY002707 [0,0,0,0,0,1|2,0,0]=3 300 B7R1.3 OC1=CC=NC=C1 SY003367 [0,0,0,0,0,1|2,0,0]=3 301 B7R1.3 OC1=CC=NN=C1 SY045502 [0,0,0,0,0,1|1,0,1]=3 302 B7R1.3 OC1=CN=CC=N1 SY007023 [0,0,0,0,0,1|2,0,0]=3 303 B7R1.3 OC1=NC=NC=C1 SY046617 [0,0,0,0,0,1|2,0,0]=3 304 B7R1.3 SC1=CC=CC=N1 SY009099 [0,0,0,0,0,1|3,0,0]=4 305 B7R1.3 [O-]C1=CC=CC=C1 SY099113 [0,0,0,0,0,1|3,0,0]=4 306 B4R0.1 C=C(Br)CN SY122662 [1,0,1,0,0,0|1,0,1]=4 307 B4R0.1 C=C(Br)CN SY264242 [1,0,1,0,0,0|1,0,1]=4 308 B4R0.1 C=C(C)CN SY018445 [1,0,1,0,0,0|0,0,1]=3 309 B4R0.1 C=C[C@H](C)N SY245785 [1,0,1,0,0,0|1,0,1]=4 310 B4R0.1 CC(=N)NN SY188423 [1,0,1,0,0,0|1,0,0]=3 311 B4R0.1 CC(=O)CN SY018511 [1,0,1,0,0,0|1,0,1]=4 312 B4R0.1 C\C(Cl)=N\O SY307714 [1,0,1,0,0,0|2,0,0]=4 313 B4R0.1 C\C(N)=N\O SY011082 [1,0,1,0,0,0|2,0,0]=4 314 B4R0.1 N=C(N)NN SY057364 [1,0,1,0,0,0|2,0,0]=4 315 B4R0.2 C=CCCN SY036713 [1,0,1,0,0,0|1,0,1]=4 316 B4R0.2 C=CCNN SY076022 [1,0,1,0,0,0|0,0,2]=4 317 B4R0.2 C=CCON SY029026 [1,0,1,0,0,0|1,0,1]=4 318 B4R0.2 CC=CC[Pd+2] SY070788 [1,0,1,0,0,0|2,0,0]=4 319 B6R0.9 C\C=C(\C=O)CC SY265075 [0,1,1,0,0,0|2,0,0]=4 320 B8R1.2 BrCC1=CC=CN=C1 SY002302 [0,1,0,0,0,1|1,0,0]=3 321 B8R1.2 BrCC1=NC=CN=C1 SY024662 [0,1,0,0,0,1|1,0,0]=3 322 B8R1.2 BrCC1=NC=NC=C1 SY048121 [0,1,0,0,0,1|1,0,0]=3 323 B8R1.2 BrCC1=NC=NC=C1 SY285072 [0,1,0,0,0,1|1,0,0]=3 324 B8R1.2 C#CC1=CC=NC=C1 SY009430 [0,1,0,0,0,1|1,0,1]=4 325 B8R1.2 CCC1=CCCC=C1 SY292098 [0,1,0,0,0,1|2,0,0]=4 326 B8R1.2 CNC1=CC=CN=C1 SY019910 [0,1,0,0,0,1|1,0,0]=3 327 B8R1.2 CNC1=CC=NC=C1 SY007759 [0,1,0,0,0,1|1,0,0]=3 328 B8R1.2 COC1=CC=CN=C1 SY024150 [0,1,0,0,0,1|1,0,0]=3 329 B8R1.2 COC1=CC=NC=C1 SY003216 [0,1,0,0,0,1|1,0,0]=3 330 B8R1.2 COC1=CN=CN=C1 SY034303 [0,1,0,0,0,1|0,0,1]=3 331 B8R1.2 COC1=NN=CC=C1 SY047082 [0,1,0,0,0,1|2,0,0]=4 332 B8R1.2 CSC1=NC=CC=C1 SY015557 [0,1,0,0,0,1|2,0,0]=4 333 B8R1.2 ClCC1=CN=CN=C1 SY035908 [0,1,0,0,0,1|0,0,1]=3 334 B8R1.2 ClCC1=NC=CN=C1 SY024416 [0,1,0,0,0,1|1,0,0]=3 335 B8R1.2 ICC1=CC=CN=C1 SY027729 [0,1,0,0,0,1|1,0,0]=3 336 B8R1.2 N#CC1=CN=CN=C1 SY012641 [0,1,0,0,0,1|0,0,2]=4 337 B8R1.2 N#CC1=NC=NC=C1 SY019449 [0,1,0,0,0,1|1,0,1]=4 338 B8R1.2 NCC1=CC=CC=C1 SY020429 [0,1,0,0,0,1|2,0,0]=4 339 B8R1.2 NCC1=CN=CN=C1 SY104794 [0,1,0,0,0,1|0,0,1]=3 340 B8R1.2 NCC1=NC=CN=C1 SY006799 [0,1,0,0,0,1|1,0,0]=3 341 B8R1.2 NCC1=NC=CN=C1 SY020278 [0,1,0,0,0,1|1,0,0]=3 342 B8R1.2 NCC1=NC=NC=C1 SY041990 [0,1,0,0,0,1|1,0,0]=3 343 B8R1.2 NNC1=CC=CN=C1 SY018650 [0,1,0,0,0,1|2,0,0]=4 344 B8R1.2 NNC1=CC=NC=C1 SY041995 [0,1,0,0,0,1|2,0,0]=4 345 B8R1.2 NNC1=CC=NC=C1 SY128124 [0,1,0,0,0,1|2,0,0]=4 346 B8R1.2 NNC1=NC=NC=C1 SY185630 [0,1,0,0,0,1|2,0,0]=4 347 B8R1.2 NOC1=CC=CN=C1 SY282516 [0,1,0,0,0,1|2,0,0]=4 348 B8R1.2 NOC1=CC=CN=C1 SY282517 [0,1,0,0,0,1|2,0,0]=4 349 B8R1.2 NOC1=CC=NC=C1 SY282541 [0,1,0,0,0,1|2,0,0]=4 350 B8R1.2 NOC1=CC=NC=C1 SY282542 [0,1,0,0,0,1|2,0,0]=4 351 B8R1.2 O=CC1=CC=NN=C1 SY039203 [0,1,0,0,0,1|0,0,2]=4 352 B8R1.2 O=CC1=CN=CN=C1 SY002007 [0,1,0,0,0,1|0,0,2]=4 353 B8R1.2 O=CC1=NC=CN=C1 SY023908 [0,1,0,0,0,1|1,0,1]=4 354 B8R1.2 O=CC1=NC=NC=C1 SY024569 [0,1,0,0,0,1|1,0,1]=4 355 B8R1.2 OCC1=CC=CC=N1 SY005684 [0,1,0,0,0,1|2,0,0]=4 356 B8R1.2 OCC1=CC=CN=C1 SY001086 [0,1,0,0,0,1|1,0,0]=3 357 B8R1.2 OCC1=CC=CN=N1 SY013184 [0,1,0,0,0,1|2,0,0]=4 358 B8R1.2 OCC1=CC=NC=C1 SY003306 [0,1,0,0,0,1|1,0,0]=3 359 B8R1.2 OCC1=CC=NN=C1 SY111189 [0,1,0,0,0,1|0,0,1]=3 360 B8R1.2 OCC1=CN=CN=C1 SY016520 [0,1,0,0,0,1|0,0,1]=3 361 B8R1.2 OCC1=NC=CN=C1 SY004183 [0,1,0,0,0,1|1,0,0]=3 362 B8R1.2 OCC1=NC=NC=C1 SY037570 [0,1,0,0,0,1|1,0,0]=3 363 B8R1.3 BrC1=CN=C(Br)C=C1 SY001858 [0,1,0,0,0,1|2,0,0]=4 364 B8R1.3 BrC1=CN=C(Br)C=N1 SY009123 [0,1,0,0,0,1|2,0,0]=4 365 B8R1.3 BrC1=CN=C(Br)N=C1 SY015869 [0,1,0,0,0,1|1,0,1]=4 366 B8R1.3 BrC1=CN=C(I)C=C1 SY001995 [0,1,0,0,0,1|2,0,0]=4 367 B8R1.3 BrC1=CN=C(I)C=N1 SY040771 [0,1,0,0,0,1|2,0,0]=4 368 B8R1.3 BrC1=NC=C(I)C=C1 SY008264 [0,1,0,0,0,1|2,0,0]=4 369 B8R1.3 CC1=CC=C(Cl)C=N1 SY011807 [0,1,0,0,0,1|2,0,0]=4 370 B8R1.3 CC1=CC=C(I)C=C1 SY001711 [0,1,0,0,0,1|2,0,0]=4 371 B8R1.3 CC1=CN=C(Br)C=C1 SY001056 [0,1,0,0,0,1|1,0,0]=3 372 B8R1.3 CC1=CN=C(Br)C=N1 SY013918 [0,1,0,0,0,1|1,0,0]=3 373 B8R1.3 CC1=CN=C(Br)N=C1 SY031347 [0,1,0,0,0,1|0,0,1]=3 374 B8R1.3 CC1=CN=C(Cl)C=C1 SY007972 [0,1,0,0,0,1|1,0,0]=3 375 B8R1.3 CC1=CN=C(Cl)C=N1 SY029718 [0,1,0,0,0,1|1,0,0]=3 376 B8R1.3 CC1=CN=C(Cl)N=C1 SY009120 [0,1,0,0,0,1|0,0,1]=3 377 B8R1.3 CC1=CN=C(I)C=C1 SY036106 [0,1,0,0,0,1|1,0,0]=3 378 B8R1.3 CC1=CN=C(N)C=N1 SY002449 [0,1,0,0,0,1|1,0,0]=3 379 B8R1.3 CC1=CN=C(N)N=C1 SY023315 [0,1,0,0,0,1|0,0,1]=3 380 B8R1.3 CC1=CN=C(O)C=C1 SY016466 [0,1,0,0,0,1|1,0,0]=3 381 B8R1.3 CC1=CNC(=O)C=N1 SY027652 [0,1,0,0,0,1|1,0,0]=3 382 B8R1.3 CC1=NC=C(Br)C=C1 SY002011 [0,1,0,0,0,1|2,0,0]=4 383 B8R1.3 CC1=NC=C(Br)C=N1 SY009346 [0,1,0,0,0,1|1,0,1]=4 384 B8R1.3 CC1=NC=C(F)C=C1 SY003227 [0,1,0,0,0,1|2,0,0]=4 385 B8R1.3 CC1=NC=C(I)C=C1 SY023080 [0,1,0,0,0,1|2,0,0]=4 386 B8R1.3 CC1=NC=C(N)C=C1 SY002753 [0,1,0,0,0,1|2,0,0]=4 387 B8R1.3 CC1=NC=C(N)C=N1 SY024071 [0,1,0,0,0,1|1,0,1]=4 388 B8R1.3 CC1=NC=C(O)C=C1 SY007644 [0,1,0,0,0,1|2,0,0]=4 389 B8R1.3 CC1=NC=C(O)C=N1 SY045130 [0,1,0,0,0,1|1,0,1]=4 390 B8R1.3 CC1=NN=C(Br)C=C1 SY009359 [0,1,0,0,0,1|2,0,0]=4 391 B8R1.3 CC1=NN=C(C)C=C1 SY105625 [0,1,0,0,0,1|2,0,0]=4 392 B8R1.3 CC1=NN=C(Cl)C=C1 SY003541 [0,1,0,0,0,1|2,0,0]=4 393 B8R1.3 CC1=NN=C(N)C=C1 SY003794 [0,1,0,0,0,1|2,0,0]=4 394 B8R1.3 CC1=NNC(=O)C=C1 SY013962 [0,1,0,0,0,1|2,0,0]=4 395 B8R1.3 CC1=NNC(=O)C=C1 SY014239 [0,1,0,0,0,1|2,0,0]=4 396 B8R1.3 ClC1=CC=C(Br)C=N1 SY003852 [0,1,0,0,0,1|2,0,0]=4 397 B8R1.3 ClC1=CC=C(Br)N=C1 SY004233 [0,1,0,0,0,1|2,0,0]=4 398 B8R1.3 ClC1=CC=C(I)C=N1 SY007438 [0,1,0,0,0,1|2,0,0]=4 399 B8R1.3 ClC1=CN=C(Br)C=N1 SY056878 [0,1,0,0,0,1|2,0,0]=4 400 B8R1.3 ClC1=CN=C(Br)N=C1 SY099110 [0,1,0,0,0,1|1,0,1]=4 401 B8R1.3 ClC1=CN=C(Cl)C=N1 SY008970 [0,1,0,0,0,1|2,0,0]=4 402 B8R1.3 ClC1=CN=C(Cl)N=C1 SY005016 [0,1,0,0,0,1|1,0,1]=4 403 B8R1.3 ClC1=CN=C(I)C=C1 SY009070 [0,1,0,0,0,1|2,0,0]=4 404 B8R1.3 ClC1=CN=C(I)N=C1 SY027946 [0,1,0,0,0,1|1,0,1]=4 405 B8R1.3 ClC1=NC=C(I)C=N1 SY022683 [0,1,0,0,0,1|1,0,1]=4 406 B8R1.3 FC1=CN=C(Br)C=C1 SY004387 [0,1,0,0,0,1|2,0,0]=4 407 B8R1.3 FC1=CN=C(Br)C=N1 SY114907 [0,1,0,0,0,1|2,0,0]=4 408 B8R1.3 FC1=CN=C(Br)N=C1 SY012623 [0,1,0,0,0,1|1,0,1]=4 409 B8R1.3 FC1=CN=C(Cl)N=C1 SY011543 [0,1,0,0,0,1|1,0,1]=4 410 B8R1.3 FC1=CN=C(F)C=C1 SY005276 [0,1,0,0,0,1|2,0,0]=4 411 B8R1.3 FC1=CN=C(I)C=C1 SY041123 [0,1,0,0,0,1|2,0,0]=4 412 B8R1.3 FC1=CN=C(I)N=C1 SY253282 [0,1,0,0,0,1|1,0,1]=4 413 B8R1.3 FC1=NC=C(Br)C=N1 SY021620 [0,1,0,0,0,1|1,0,1]=4 414 B8R1.3 FC1=NC=C(I)C=C1 SY019262 [0,1,0,0,0,1|2,0,0]=4 415 B8R1.3 NC1=CC=C(Br)N=C1 SY002680 [0,1,0,0,0,1|2,0,0]=4 416 B8R1.3 NC1=CC=C(Cl)N=C1 SY009586 [0,1,0,0,0,1|2,0,0]=4 417 B8R1.3 NC1=CC=C(I)C=N1 SY005394 [0,1,0,0,0,1|2,0,0]=4 418 B8R1.3 NC1=CN=C(Cl)N=C1 SY013941 [0,1,0,0,0,1|1,0,1]=4 419 B8R1.3 NC1=CN=C(F)C=C1 SY014297 [0,1,0,0,0,1|2,0,0]=4 420 B8R1.3 NC1=CN=C(N)C=N1 SY020175 [0,1,0,0,0,1|2,0,0]=4 421 B8R1.3 NC1=CN=C(O)C=C1 SY007516 [0,1,0,0,0,1|2,0,0]=4 422 B8R1.3 NC1=NC=C(Br)N=C1 SY002807 [0,1,0,0,0,1|2,0,0]=4 423 B8R1.3 NC1=NC=C(Cl)C=C1 SY001089 [0,1,0,0,0,1|2,0,0]=4 424 B8R1.3 NC1=NC=C(Cl)N=C1 SY002810 [0,1,0,0,0,1|2,0,0]=4 425 B8R1.3 NC1=NC=C(F)C=C1 SY004383 [0,1,0,0,0,1|2,0,0]=4 426 B8R1.3 NC1=NC=C(F)C=N1 SY033491 [0,1,0,0,0,1|1,0,1]=4 427 B8R1.3 NC1=NC=C(I)C=N1 SY030987 [0,1,0,0,0,1|1,0,1]=4 428 B8R1.3 NC1=NC=C(I)N=C1 SY029898 [0,1,0,0,0,1|2,0,0]=4 429 B8R1.3 NC1=NC=C(O)C=C1 SY007574 [0,1,0,0,0,1|2,0,0]=4 430 B8R1.3 NC1=NC=C(O)C=N1 SY035522 [0,1,0,0,0,1|1,0,1]=4 431 B8R1.3 O=C1C=CC(O)=CN1 SY023088 [0,1,0,0,0,1|2,0,0]=4 432 B8R1.3 O=C1C=NC(Cl)=CN1 SY030969 [0,1,0,0,0,1|2,0,0]=4 433 B8R1.3 OC1=CC=C(Br)C=N1 SY003385 [0,1,0,0,0,1|2,0,0]=4 434 B8R1.3 OC1=CC=C(Br)N=C1 SY003237 [0,1,0,0,0,1|2,0,0]=4 435 B8R1.3 OC1=CC=C(Cl)C=N1 SY012331 [0,1,0,0,0,1|2,0,0]=4 436 B8R1.3 OC1=CC=C(Cl)N=C1 SY003236 [0,1,0,0,0,1|2,0,0]=4 437 B8R1.3 OC1=CC=C(F)C=N1 SY019869 [0,1,0,0,0,1|2,0,0]=4 438 B8R1.3 OC1=CC=C(I)N=C1 SY021948 [0,1,0,0,0,1|2,0,0]=4 439 B8R1.3 OC1=CN=C(Br)N=C1 SY024555 [0,1,0,0,0,1|1,0,1]=4 440 B8R1.3 OC1=CN=C(Cl)N=C1 SY008717 [0,1,0,0,0,1|1,0,1]=4 441 B8R1.3 OC1=CN=C(F)C=C1 SY022133 [0,1,0,0,0,1|2,0,0]=4 442 B8R1.3 OC1=NC=C(Br)C=N1 SY015870 [0,1,0,0,0,1|1,0,1]=4 443 B8R1.3 OC1=NC=C(Br)N=C1 SY009737 [0,1,0,0,0,1|2,0,0]=4 444 B8R1.3 OC1=NC=C(I)C=C1 SY029299 [0,1,0,0,0,1|2,0,0]=4 445 B8R1.3 OC1=NC=C(I)C=N1 SY023415 [0,1,0,0,0,1|1,0,1]=4 446 B8R1.3 SC1=NC=C(Br)C=N1 SY257854 [0,1,0,0,0,1|1,0,1]=4 447 B8R1.4 BrC1=CC(Br)=NC=C1 SY017777 [0,1,0,0,0,1|2,0,0]=4 448 B8R1.4 BrC1=CC(Br)=NC=N1 SY031025 [0,1,0,0,0,1|2,0,0]=4 449 B8R1.4 BrC1=CC(I)=CN=C1 SY031472 [0,1,0,0,0,1|2,0,0]=4 450 B8R1.4 BrC1=CN=CC(Br)=C1 SY001365 [0,1,0,0,0,1|2,0,0]=4 451 B8R1.4 BrC1=CN=CC(Br)=N1 SY024155 [0,1,0,0,0,1|2,0,0]=4 452 B8R1.4 BrC1=NC(Br)=NC=C1 SY023700 [0,1,0,0,0,1|2,0,0]=4 453 B8R1.4 BrC1=NC=CC(I)=C1 SY014604 [0,1,0,0,0,1|2,0,0]=4 454 B8R1.4 CC1=CC(=O)NN=C1 SY031246 [0,1,0,0,0,1|0,0,0]=2 455 B8R1.4 CC1=CC(Br)=CN=C1 SY013059 [0,1,0,0,0,1|1,0,0]=3 456 B8R1.4 CC1=CC(Br)=NC=C1 SY001870 [0,1,0,0,0,1|1,0,0]=3 457 B8R1.4 CC1=CC(Br)=NC=N1 SY045511 [0,1,0,0,0,1|1,0,0]=3 458 B8R1.4 CC1=CC(Cl)=NC=C1 SY004677 [0,1,0,0,0,1|1,0,0]=3 459 B8R1.4 CC1=CC(Cl)=NC=N1 SY021506 [0,1,0,0,0,1|1,0,0]=3 460 B8R1.4 CC1=CC(Cl)=NN=C1 SY101518 [0,1,0,0,0,1|0,0,1]=3 461 B8R1.4 CC1=CC(N)=NC=N1 SY029024 [0,1,0,0,0,1|1,0,0]=3 462 B8R1.4 CC1=CC(N)=NN=C1 SY011821 [0,1,0,0,0,1|0,0,1]=3 463 B8R1.4 CC1=CC(O)=NC=C1 SY021568 [0,1,0,0,0,1|1,0,0]=3 464 B8R1.4 CC1=CC(O)=NC=N1 SY005589 [0,1,0,0,0,1|1,0,0]=3 465 B8R1.4 CC1=CC=CC(Br)=N1 SY001968 [0,1,0,0,0,1|2,0,0]=4 466 B8R1.4 CC1=CC=CC(F)=N1 SY014114 [0,1,0,0,0,1|2,0,0]=4 467 B8R1.4 CC1=CC=CC(I)=C1 SY002778 [0,1,0,0,0,1|2,0,0]=4 468 B8R1.4 CC1=CC=CC(I)=N1 SY104475 [0,1,0,0,0,1|2,0,0]=4 469 B8R1.4 CC1=CC=NC(Cl)=N1 SY005393 [0,1,0,0,0,1|1,0,0]=3 470 B8R1.4 CC1=CN=CC(Cl)=C1 SY017710 [0,1,0,0,0,1|1,0,0]=3 471 B8R1.4 CC1=CN=CC(Cl)=N1 SY018894 [0,1,0,0,0,1|1,0,0]=3 472 B8R1.4 CC1=CN=CC(N)=N1 SY021601 [0,1,0,0,0,1|1,0,0]=3 473 B8R1.4 CC1=CN=CC(O)=C1 SY013073 [0,1,0,0,0,1|1,0,0]=3 474 B8R1.4 CC1=CN=CC(O)=C1 SY284223 [0,1,0,0,0,1|1,0,0]=3 475 B8R1.4 CC1=CN=CC(O)=N1 SY004473 [0,1,0,0,0,1|1,0,0]=3 476 B8R1.4 CC1=C[N+]([O-])=CC=C1 SY020469 [0,1,0,0,0,1|1,0,1]=4 477 B8R1.4 CC1=NC(Br)=NC=C1 SY029103 [0,1,0,0,0,1|1,0,0]=3 478 B8R1.4 CC1=NC(N)=CC=N1 SY024243 [0,1,0,0,0,1|2,0,0]=4 479 B8R1.4 CC1=NC(N)=NC=C1 SY007728 [0,1,0,0,0,1|1,0,0]=3 480 B8R1.4 CC1=NC(O)=CC=C1 SY009294 [0,1,0,0,0,1|2,0,0]=4 481 B8R1.4 CC1=NC(O)=NC=C1 SY001078 [0,1,0,0,0,1|1,0,0]=3 482 B8R1.4 CC1=NC(O)=NC=C1 SY073173 [0,1,0,0,0,1|1,0,0]=3 483 B8R1.4 CC1=NC=CC(Br)=C1 SY002014 [0,1,0,0,0,1|2,0,0]=4 484 B8R1.4 CC1=NC=CC(Cl)=C1 SY010438 [0,1,0,0,0,1|2,0,0]=4 485 B8R1.4 CC1=NC=CC(Cl)=N1 SY019605 [0,1,0,0,0,1|2,0,0]=4 486 B8R1.4 CC1=NC=CC(N)=C1 SY003568 [0,1,0,0,0,1|2,0,0]=4 487 B8R1.4 CC1=NC=CC(O)=C1 SY006007 [0,1,0,0,0,1|2,0,0]=4 488 B8R1.4 CC1=NC=NC(Cl)=N1 SY272714 [0,1,0,0,0,1|2,0,0]=4 489 B8R1.4 ClC1=CC(Br)=CN=C1 SY019382 [0,1,0,0,0,1|2,0,0]=4 490 B8R1.4 ClC1=CC(Br)=NC=C1 SY017821 [0,1,0,0,0,1|2,0,0]=4 491 B8R1.4 ClC1=CC(Cl)=NN=C1 SY019550 [0,1,0,0,0,1|1,0,1]=4 492 B8R1.4 ClC1=CN=CC(Cl)=N1 SY001394 [0,1,0,0,0,1|2,0,0]=4 493 B8R1.4 ClC1=NC(Br)=NC=C1 SY039573 [0,1,0,0,0,1|2,0,0]=4 494 B8R1.4 ClC1=NC(Cl)=NC=C1 SY001677 [0,1,0,0,0,1|2,0,0]=4 495 B8R1.4 ClC1=NC=CC(Br)=C1 SY006236 [0,1,0,0,0,1|2,0,0]=4 496 B8R1.4 ClC1=NC=CC(Br)=N1 SY027897 [0,1,0,0,0,1|2,0,0]=4 497 B8R1.4 ClC1=NC=CC(I)=C1 SY005539 [0,1,0,0,0,1|2,0,0]=4 498 B8R1.4 ClC1=NC=CC(I)=N1 SY263233 [0,1,0,0,0,1|2,0,0]=4 499 B8R1.4 FC1=CC(Br)=CN=C1 SY003442 [0,1,0,0,0,1|2,0,0]=4 500 B8R1.4 FC1=CC(Br)=NC=C1 SY028281 [0,1,0,0,0,1|2,0,0]=4 501 B8R1.4 FC1=CC(F)=NC=C1 SY024692 [0,1,0,0,0,1|2,0,0]=4 502 B8R1.4 FC1=CC(F)=NC=N1 SY035520 [0,1,0,0,0,1|2,0,0]=4 503 B8R1.4 FC1=CC(I)=CN=C1 SY028230 [0,1,0,0,0,1|2,0,0]=4 504 B8R1.4 FC1=NC=CC(Br)=C1 SY005160 [0,1,0,0,0,1|2,0,0]=4 505 B8R1.4 FC1=NC=CC(Cl)=C1 SY009424 [0,1,0,0,0,1|2,0,0]=4 506 B8R1.4 FC1=NC=CC(I)=C1 SY009117 [0,1,0,0,0,1|2,0,0]=4 507 B8R1.4 IC1=CN=CC(I)=N1 SY029874 [0,1,0,0,0,1|2,0,0]=4 508 B8R1.4 IC1=NC(I)=NC=C1 SY031024 [0,1,0,0,0,1|2,0,0]=4 509 B8R1.4 NC1=CC(=O)NC=C1 SY020837 [0,1,0,0,0,1|2,0,0]=4 510 B8R1.4 NC1=CC(Br)=NC=C1 SY009241 [0,1,0,0,0,1|2,0,0]=4 511 B8R1.4 NC1=CC(Cl)=CN=C1 SY005760 [0,1,0,0,0,1|2,0,0]=4 512 B8R1.4 NC1=CC(Cl)=NN=C1 SY021738 [0,1,0,0,0,1|1,0,1]=4 513 B8R1.4 NC1=CC(F)=CN=C1 SY009063 [0,1,0,0,0,1|2,0,0]=4 514 B8R1.4 NC1=CC(F)=NC=C1 SY011171 [0,1,0,0,0,1|2,0,0]=4 515 B8R1.4 NC1=CC(N)=NC=N1 SY010538 [0,1,0,0,0,1|2,0,0]=4 516 B8R1.4 NC1=CC(O)=CN=C1 SY004566 [0,1,0,0,0,1|2,0,0]=4 517 B8R1.4 NC1=CC(O)=CN=C1 SY005190 [0,1,0,0,0,1|2,0,0]=4 518 B8R1.4 NC1=CC=NC(Cl)=C1 SY004830 [0,1,0,0,0,1|2,0,0]=4 519 B8R1.4 NC1=CC=NC(Cl)=N1 SY015479 [0,1,0,0,0,1|2,0,0]=4 520 B8R1.4 NC1=CN=CC(Br)=C1 SY006230 [0,1,0,0,0,1|2,0,0]=4 521 B8R1.4 NC1=CN=CC(Cl)=N1 SY007507 [0,1,0,0,0,1|2,0,0]=4 522 B8R1.4 NC1=CN=CC(N)=C1 SY009704 [0,1,0,0,0,1|2,0,0]=4 523 B8R1.4 NC1=CN=CC(N)=N1 SY015544 [0,1,0,0,0,1|2,0,0]=4 524 B8R1.4 NC1=NC(=O)NC=C1 SY001643 [0,1,0,0,0,1|2,0,0]=4 525 B8R1.4 NC1=NC(Br)=CN=C1 SY009702 [0,1,0,0,0,1|2,0,0]=4 526 B8R1.4 NC1=NC(Br)=NC=C1 SY112545 [0,1,0,0,0,1|2,0,0]=4 527 B8R1.4 NC1=NC(F)=NC=C1 SY100475 [0,1,0,0,0,1|2,0,0]=4 528 B8R1.4 NC1=NC(N)=NC=C1 SY014486 [0,1,0,0,0,1|2,0,0]=4 529 B8R1.4 NC1=NC=CC(=O)N1 SY013450 [0,1,0,0,0,1|2,0,0]=4 530 B8R1.4 NC1=NC=CC(Br)=C1 SY005797 [0,1,0,0,0,1|2,0,0]=4 531 B8R1.4 NC1=NC=CC(Br)=N1 SY065597 [0,1,0,0,0,1|2,0,0]=4 532 B8R1.4 NC1=NC=CC(Cl)=C1 SY002647 [0,1,0,0,0,1|2,0,0]=4 533 B8R1.4 NC1=NC=CC(Cl)=N1 SY013794 [0,1,0,0,0,1|2,0,0]=4 534 B8R1.4 NC1=NC=CC(F)=C1 SY004151 [0,1,0,0,0,1|2,0,0]=4 535 B8R1.4 NC1=NC=CC(I)=C1 SY045806 [0,1,0,0,0,1|2,0,0]=4 536 B8R1.4 NC1=NC=CC(O)=C1 SY007078 [0,1,0,0,0,1|2,0,0]=4 537 B8R1.4 NC1=NC=CC(O)=C1 SY021111 [0,1,0,0,0,1|2,0,0]=4 538 B8R1.4 NC1=NC=NC(Br)=C1 SY033215 [0,1,0,0,0,1|2,0,0]=4 539 B8R1.4 NC1=NC=NC(Cl)=C1 SY002375 [0,1,0,0,0,1|2,0,0]=4 540 B8R1.4 NC1=NC=NC(I)=C1 SY076090 [0,1,0,0,0,1|2,0,0]=4 541 B8R1.4 NC1=NC=NC(O)=C1 SY008403 [0,1,0,0,0,1|2,0,0]=4 542 B8R1.4 O=C1C=C(Cl)C=NN1 SY014044 [0,1,0,0,0,1|1,0,0]=3 543 B8R1.4 O=C1C=C(I)C=CN1 SY047222 [0,1,0,0,0,1|2,0,0]=4 544 B8R1.4 O=C1C=C(I)C=NN1 SY113272 [0,1,0,0,0,1|1,0,0]=3 545 B8R1.4 O=C1C=CNC(=O)N1 SY008943 [0,1,0,0,0,1|2,0,0]=4 546 B8R1.4 O=C1C=CNC(=S)N1 SY014748 [0,1,0,0,0,1|2,0,0]=4 547 B8R1.4 O=C1C=NNC(=O)N1 SY031517 [0,1,0,0,0,1|1,0,0]=3 548 B8R1.4 OC1=CC(Cl)=CN=C1 SY008912 [0,1,0,0,0,1|2,0,0]=4 549 B8R1.4 OC1=CC(Cl)=NC=C1 SY006501 [0,1,0,0,0,1|2,0,0]=4 550 B8R1.4 OC1=CC(O)=NC=N1 SY001718 [0,1,0,0,0,1|2,0,0]=4 551 B8R1.4 OC1=CC=NC(O)=C1 SY009441 [0,1,0,0,0,1|2,0,0]=4 552 B8R1.4 OC1=CN=CC(Br)=C1 SY003815 [0,1,0,0,0,1|2,0,0]=4 553 B8R1.4 OC1=CN=CC(Cl)=N1 SY016303 [0,1,0,0,0,1|2,0,0]=4 554 B8R1.4 OC1=CN=CC(F)=C1 SY022138 [0,1,0,0,0,1|2,0,0]=4 555 B8R1.4 OC1=CN=CC(O)=C1 SY024612 [0,1,0,0,0,1|2,0,0]=4 556 B8R1.4 OC1=NC(Cl)=NC=C1 SY019878 [0,1,0,0,0,1|2,0,0]=4 557 B8R1.4 OC1=NC=CC(Br)=C1 SY013311 [0,1,0,0,0,1|2,0,0]=4 558 B8R1.4 OC1=NC=CC(Cl)=C1 SY025321 [0,1,0,0,0,1|2,0,0]=4 559 B8R1.4 OC1=NC=CC(F)=C1 SY112598 [0,1,0,0,0,1|2,0,0]=4 560 B8R1.4 OC1=NC=NC(Cl)=C1 SY017399 [0,1,0,0,0,1|2,0,0]=4 561 B8R1.5 BrC1=C(I)C=CN=C1 SY096733 [0,1,0,0,0,1|2,0,0]=4 562 B8R1.5 BrC1=C(I)C=NC=C1 SY012191 [0,1,0,0,0,1|2,0,0]=4 563 B8R1.5 BrC1=CC=CN=C1Br SY012472 [0,1,0,0,0,1|2,0,0]=4 564 B8R1.5 BrC1=CC=CN=C1I SY022374 [0,1,0,0,0,1|2,0,0]=4 565 B8R1.5 CC1=C(Br)C=CN=C1 SY014607 [0,1,0,0,0,1|1,0,0]=3 566 B8R1.5 CC1=C(Br)C=NC=C1 SY005820 [0,1,0,0,0,1|1,0,0]=3 567 B8R1.5 CC1=C(F)C=NC=C1 SY016334 [0,1,0,0,0,1|1,0,0]=3 568 B8R1.5 CC1=C(N)C=CN=C1 SY004399 [0,1,0,0,0,1|1,0,0]=3 569 B8R1.5 CC1=C(N)C=NC=C1 SY004420 [0,1,0,0,0,1|1,0,0]=3 570 B8R1.5 CC1=C(N)C=NC=N1 SY007134 [0,1,0,0,0,1|1,0,0]=3 571 B8R1.5 CC1=C(N)N=CC=N1 SY004895 [0,1,0,0,0,1|1,0,0]=3 572 B8R1.5 CC1=C(O)C=CC=N1 SY007645 [0,1,0,0,0,1|2,0,0]=4 573 B8R1.5 CC1=C(O)C=NC=C1 SY005852 [0,1,0,0,0,1|1,0,0]=3 574 B8R1.5 CC1=CC=CN=C1Br SY008917 [0,1,0,0,0,1|1,0,0]=3 575 B8R1.5 CC1=CC=CN=C1Cl SY017766 [0,1,0,0,0,1|1,0,0]=3 576 B8R1.5 CC1=CC=CN=C1F SY016853 [0,1,0,0,0,1|1,0,0]=3 577 B8R1.5 CC1=CC=CNC1=O SY020532 [0,1,0,0,0,1|1,0,0]=3 578 B8R1.5 CC1=CC=NN=C1Cl SY096919 [0,1,0,0,0,1|0,0,1]=3 579 B8R1.5 CC1=CC=NN=C1N SY013686 [0,1,0,0,0,1|0,0,1]=3 580 B8R1.5 CC1=CC=NNC1=O SY031250 [0,1,0,0,0,1|0,0,0]=2 581 B8R1.5 CC1=CN=CN=C1Cl SY021347 [0,1,0,0,0,1|0,0,1]=3 582 B8R1.5 CC1=CN=CNC1=O SY031521 [0,1,0,0,0,1|0,0,0]=2 583 B8R1.5 CC1=NC=CC=C1Br SY004393 [0,1,0,0,0,1|2,0,0]=4 584 B8R1.5 CC1=NC=CC=C1Cl SY013090 [0,1,0,0,0,1|2,0,0]=4 585 B8R1.5 CC1=NC=CC=C1N SY003689 [0,1,0,0,0,1|2,0,0]=4 586 B8R1.5 CC1=NC=CN=C1Br SY023914 [0,1,0,0,0,1|1,0,0]=3 587 B8R1.5 CC1=NC=CN=C1Cl SY008899 [0,1,0,0,0,1|1,0,0]=3 588 B8R1.5 CC1=NC=CN=C1O SY005478 [0,1,0,0,0,1|1,0,0]=3 589 B8R1.5 CC1=NC=NC=C1Br SY031501 [0,1,0,0,0,1|1,0,0]=3 590 B8R1.5 CC1=[N+]([O-])C=CC=C1 SY019993 [0,1,0,0,0,1|2,0,0]=4 591 B8R1.5 ClC1=C(Br)C=CC=N1 SY004419 [0,1,0,0,0,1|2,0,0]=4 592 B8R1.5 ClC1=C(Br)C=CN=C1 SY017769 [0,1,0,0,0,1|2,0,0]=4 593 B8R1.5 ClC1=C(Br)C=NC=C1 SY023955 [0,1,0,0,0,1|2,0,0]=4 594 B8R1.5 ClC1=C(Cl)C=NC=C1 SY010516 [0,1,0,0,0,1|2,0,0]=4 595 B8R1.5 ClC1=C(I)C=CN=C1 SY023409 [0,1,0,0,0,1|2,0,0]=4 596 B8R1.5 ClC1=C(I)C=NC=C1 SY106601 [0,1,0,0,0,1|2,0,0]=4 597 B8R1.5 ClC1=C(I)C=NC=N1 SY021511 [0,1,0,0,0,1|1,0,1]=4 598 B8R1.5 ClC1=CC=CN=C1Br SY019780 [0,1,0,0,0,1|2,0,0]=4 599 B8R1.5 ClC1=NC=CC=C1I SY004388 [0,1,0,0,0,1|2,0,0]=4 600 B8R1.5 ClC1=NC=CN=C1Cl SY004668 [0,1,0,0,0,1|2,0,0]=4 601 B8R1.5 ClC1=NC=CN=C1I SY039432 [0,1,0,0,0,1|2,0,0]=4 602 B8R1.5 ClC1=NC=NC=C1Br SY023357 [0,1,0,0,0,1|1,0,1]=4 603 B8R1.5 FC1=C(Br)C=CN=C1 SY038188 [0,1,0,0,0,1|2,0,0]=4 604 B8R1.5 FC1=C(Br)C=CN=C1 SY112282 [0,1,0,0,0,1|2,0,0]=4 605 B8R1.5 FC1=C(Br)C=NC=C1 SY024694 [0,1,0,0,0,1|2,0,0]=4 606 B8R1.5 FC1=C(Cl)C=CN=C1 SY007770 [0,1,0,0,0,1|2,0,0]=4 607 B8R1.5 FC1=C(I)C=CC=N1 SY004135 [0,1,0,0,0,1|2,0,0]=4 608 B8R1.5 FC1=C(I)C=CN=C1 SY023403 [0,1,0,0,0,1|2,0,0]=4 609 B8R1.5 FC1=CC=CN=C1Br SY019785 [0,1,0,0,0,1|2,0,0]=4 610 B8R1.5 FC1=NC=CC=C1Br SY024684 [0,1,0,0,0,1|2,0,0]=4 611 B8R1.5 FC1=NC=CC=C1Cl SY024689 [0,1,0,0,0,1|2,0,0]=4 612 B8R1.5 NC1=C(Br)C=CN=C1 SY025389 [0,1,0,0,0,1|2,0,0]=4 613 B8R1.5 NC1=C(Br)C=NC=C1 SY013100 [0,1,0,0,0,1|2,0,0]=4 614 B8R1.5 NC1=C(Cl)C=CN=C1 SY005857 [0,1,0,0,0,1|2,0,0]=4 615 B8R1.5 NC1=C(Cl)C=NC=C1 SY005858 [0,1,0,0,0,1|2,0,0]=4 616 B8R1.5 NC1=C(Cl)N=CC=C1 SY005474 [0,1,0,0,0,1|2,0,0]=4 617 B8R1.5 NC1=C(Cl)N=CC=N1 SY003686 [0,1,0,0,0,1|2,0,0]=4 618 B8R1.5 NC1=C(F)C=NC=C1 SY008130 [0,1,0,0,0,1|2,0,0]=4 619 B8R1.5 NC1=C(I)C=CN=C1 SY027942 [0,1,0,0,0,1|2,0,0]=4 620 B8R1.5 NC1=C(N)N=CC=N1 SY020176 [0,1,0,0,0,1|2,0,0]=4 621 B8R1.5 NC1=C(O)C=CN=C1 SY031780 [0,1,0,0,0,1|2,0,0]=4 622 B8R1.5 NC1=CC=CN=C1Br SY013790 [0,1,0,0,0,1|2,0,0]=4 623 B8R1.5 NC1=CC=CN=C1F SY030938 [0,1,0,0,0,1|2,0,0]=4 624 B8R1.5 NC1=CC=CN=C1O SY008406 [0,1,0,0,0,1|2,0,0]=4 625 B8R1.5 NC1=CC=NC=C1I SY005850 [0,1,0,0,0,1|2,0,0]=4 626 B8R1.5 NC1=CN=CN=C1Cl SY009689 [0,1,0,0,0,1|1,0,1]=4 627 B8R1.5 NC1=CN=CN=C1N SY020178 [0,1,0,0,0,1|1,0,1]=4 628 B8R1.5 NC1=CN=CN=C1O SY202187 [0,1,0,0,0,1|1,0,1]=4 629 B8R1.5 NC1=NC=CC=C1Br SY006500 [0,1,0,0,0,1|2,0,0]=4 630 B8R1.5 NC1=NC=CC=C1Cl SY002650 [0,1,0,0,0,1|2,0,0]=4 631 B8R1.5 NC1=NC=CC=C1F SY002465 [0,1,0,0,0,1|2,0,0]=4 632 B8R1.5 NC1=NC=CC=C1I SY002851 [0,1,0,0,0,1|2,0,0]=4 633 B8R1.5 NC1=NC=CN=C1Br SY017457 [0,1,0,0,0,1|2,0,0]=4 634 B8R1.5 NC1=NC=CNC1=O SY021602 [0,1,0,0,0,1|2,0,0]=4 635 B8R1.5 NC1=NC=NC=C1Br SY031520 [0,1,0,0,0,1|1,0,1]=4 636 B8R1.5 O=C1NC=NC=C1Br SY031524 [0,1,0,0,0,1|1,0,0]=3 637 B8R1.5 O=C1NC=NC=C1Br SY267153 [0,1,0,0,0,1|1,0,0]=3 638 B8R1.5 O=C1NCCC=C1Br SY263614 [0,1,0,0,0,1|2,0,0]=4 639 B8R1.5 O=C1NN=CC=C1Cl SY033523 [0,1,0,0,0,1|1,0,0]=3 640 B8R1.5 OC1=C(Br)N=CC=C1 SY004806 [0,1,0,0,0,1|2,0,0]=4 641 B8R1.5 OC1=C(I)C=CN=C1 SY029140 [0,1,0,0,0,1|2,0,0]=4 642 B8R1.5 OC1=C(I)C=NC=C1 SY109175 [0,1,0,0,0,1|2,0,0]=4 643 B8R1.5 OC1=CC=CN=C1Cl SY001399 [0,1,0,0,0,1|2,0,0]=4 644 B8R1.5 OC1=CC=CN=C1F SY014301 [0,1,0,0,0,1|2,0,0]=4 645 B8R1.5 OC1=CC=CN=C1I SY015100 [0,1,0,0,0,1|2,0,0]=4 646 B8R1.5 OC1=CC=CN=C1O SY015232 [0,1,0,0,0,1|2,0,0]=4 647 B8R1.5 OC1=CN=CC=C1Br SY004894 [0,1,0,0,0,1|2,0,0]=4 648 B8R1.5 OC1=NC=CC=C1Br SY008491 [0,1,0,0,0,1|2,0,0]=4 649 B8R1.5 OC1=NC=CC=C1Cl SY007422 [0,1,0,0,0,1|2,0,0]=4 650 B8R1.5 OC1=NC=CC=C1F SY002356 [0,1,0,0,0,1|2,0,0]=4 651 B8R1.5 SC1=C(Br)C=NC=C1 SY031436 [0,1,0,0,0,1|2,0,0]=4 652 B8R1.1 C#CC1=CN(C)C=N1 SY060623 [0,2,0,0,0,0|2,0,0]=4 653 B8R1.1 C#CC1=CN(C)N=C1 SY133296 [0,2,0,0,0,0|0,0,1]=3 654 B8R1.1 CC1=CC(CN)=NO1 SY022793 [0,2,0,0,0,0|2,0,0]=4 655 B8R1.1 CC1=CN=C(C=O)S1 SY025200 [0,2,0,0,0,0|2,0,0]=4 656 B8R1.1 CC1=CN=C(CN)S1 SY024631 [0,2,0,0,0,0|2,0,0]=4 657 B8R1.1 CC1=CNC(CN)=N1 SY025135 [0,2,0,0,0,0|2,0,0]=4 658 B8R1.1 CC1=CSC(C=O)=C1 SY035937 [0,2,0,0,0,0|2,0,0]=4 659 B8R1.1 CC1=NNC(CN)=C1 SY038660 [0,2,0,0,0,0|2,0,0]=4 660 B8R1.1 CC1=NNC(CN)=C1 SY040860 [0,2,0,0,0,0|2,0,0]=4 661 B8R1.1 CC1=NOC(CBr)=C1 SY036655 [0,2,0,0,0,0|2,0,0]=4 662 B8R1.1 CCC1=CC(N)=NN1 SY008703 [0,2,0,0,0,0|2,0,0]=4 663 B8R1.1 CCC1=CC(O)=NO1 SY248522 [0,2,0,0,0,0|2,0,0]=4 664 B8R1.1 CCC1=CCC(C)=C1 SY308291 [0,2,0,0,0,0|2,0,0]=4 665 B8R1.1 CCC1=CN=C(N)S1 SY106256 [0,2,0,0,0,0|2,0,0]=4 666 B8R1.1 CCC1=NC(C)=CN1 SY036797 [0,2,0,0,0,0|2,0,0]=4 667 B8R1.1 CCN1C=C(Br)C=N1 SY012330 [0,2,0,0,0,0|1,0,0]=3 668 B8R1.1 CCN1C=C(I)C=N1 SY026014 [0,2,0,0,0,0|1,0,0]=3 669 B8R1.1 CCN1C=C(N)C=N1 SY024886 [0,2,0,0,0,0|1,0,0]=3 670 B8R1.1 CCN1C=C(N)N=N1 SY252863 [0,2,0,0,0,0|2,0,0]=4 671 B8R1.1 CCN1C=C[N+](C)=C1 SY012923 [0,2,0,0,0,0|2,0,0]=4 672 B8R1.1 CCN1C=C[N+](C)=C1 SY023273 [0,2,0,0,0,0|2,0,0]=4 673 B8R1.1 CCN1C=C[N+](C)=C1 SY036848 [0,2,0,0,0,0|2,0,0]=4 674 B8R1.1 CCN1C=C[N+](C)=C1 SY037972 [0,2,0,0,0,0|2,0,0]=4 675 B8R1.1 CCN1C=C[N+](C)=C1 SY039167 [0,2,0,0,0,0|2,0,0]=4 676 B8R1.1 CCN1C=C[N+](C)=C1 SY041796 [0,2,0,0,0,0|2,0,0]=4 677 B8R1.1 CCN1C=C[N+](C)=C1 SY041801 [0,2,0,0,0,0|2,0,0]=4 678 B8R1.1 CC[N+]1=CN(C)C=C1 SY113749 [0,2,0,0,0,0|2,0,0]=4 679 B8R1.1 CN1C=C(C#N)C=N1 SY015914 [0,2,0,0,0,0|0,0,1]=3 680 B8R1.1 CN1C=C(C=O)C=N1 SY017600 [0,2,0,0,0,0|0,0,1]=3 681 B8R1.1 CN1C=C(CBr)C=N1 SY278549 [0,2,0,0,0,0|0,0,0]=2 682 B8R1.1 CN1C=C(CCl)C=N1 SY041738 [0,2,0,0,0,0|0,0,0]=2 683 B8R1.1 CN1C=C(CN)C=N1 SY035452 [0,2,0,0,0,0|0,0,0]=2 684 B8R1.1 CN1C=C(CO)C=N1 SY017187 [0,2,0,0,0,0|0,0,0]=2 685 B8R1.1 CN1C=C(CO)N=N1 SY131092 [0,2,0,0,0,0|1,0,0]=3 686 B8R1.1 CN1C=C(NN)C=N1 SY272634 [0,2,0,0,0,0|1,0,0]=3 687 B8R1.1 CN1C=CC(CCl)=N1 SY037769 [0,2,0,0,0,0|2,0,0]=4 688 B8R1.1 CN1C=CC(CN)=N1 SY024167 [0,2,0,0,0,0|2,0,0]=4 689 B8R1.1 CN1C=CC(CO)=N1 SY064602 [0,2,0,0,0,0|2,0,0]=4 690 B8R1.1 CN1C=NC(C=O)=C1 SY041684 [0,2,0,0,0,0|2,0,0]=4 691 B8R1.1 CN1C=NC(CCl)=C1 SY115079 [0,2,0,0,0,0|2,0,0]=4 692 B8R1.1 CN1C=NC(CN)=C1 SY035068 [0,2,0,0,0,0|2,0,0]=4 693 B8R1.1 CN1C=NC(CO)=C1 SY020882 [0,2,0,0,0,0|2,0,0]=4 694 B8R1.1 CN1N=NC(CO)=N1 SY129241 [0,2,0,0,0,0|2,0,0]=4 695 B8R1.1 COC1=CC(N)=NO1 SY006835 [0,2,0,0,0,0|2,0,0]=4 696 B8R1.1 CSC1=NNC(N)=C1 SY240081 [0,2,0,0,0,0|2,0,0]=4 697 B8R1.1 ClC1=NC=C(CBr)S1 SY222476 [0,2,0,0,0,0|2,0,0]=4 698 B8R1.1 ClC1=NC=C(CI)S1 SY251089 [0,2,0,0,0,0|2,0,0]=4 699 B8R1.1 NCC1=CN=C(Cl)S1 SY031011 [0,2,0,0,0,0|2,0,0]=4 700 B8R1.1 O=CC1=CC(Br)=CN1 SY031830 [0,2,0,0,0,0|2,0,0]=4 701 B8R1.1 O=CC1=CC(I)=CN1 SY102993 [0,2,0,0,0,0|2,0,0]=4 702 B8R1.1 O=CC1=CNC(Br)=C1 SY225462 [0,2,0,0,0,0|1,0,1]=4 703 B8R1.1 O=CC1=CNC(I)=C1 SY263118 [0,2,0,0,0,0|1,0,1]=4 704 B8R1.1 OCC1=CN=C(Br)S1 SY040567 [0,2,0,0,0,0|2,0,0]=4 705 B8R1.1 OCC1=CNC(Br)=N1 SY285958 [0,2,0,0,0,0|2,0,0]=4 706 B8R1.7 CC(=O)C1=CN=CN1 SY042637 [0,2,0,0,0,0|2,0,0]=4 707 B8R1.7 CC(=O)C1=CSC=C1 SY009376 [0,2,0,0,0,0|2,0,0]=4 708 B8R1.7 CC(=O)C1=NNC=C1 SY123629 [0,2,0,0,0,0|2,0,0]=4 709 B8R1.7 CC(C)C1=CNC=N1 SY037472 [0,2,0,0,0,0|2,0,0]=4 710 B8R1.7 CC(C)C1=CNN=C1 SY278608 [0,2,0,0,0,0|0,0,0]=2 711 B8R1.7 CC(C)C1=NNC=C1 SY025107 [0,2,0,0,0,0|2,0,0]=4 712 B8R1.7 CC(C)N1C=CN=C1 SY015614 [0,2,0,0,0,0|2,0,0]=4 713 B8R1.7 C[C@@H](N)C1=CNC=N1 SY307692 [0,2,0,0,0,0|2,0,0]=4 714 B8R1.7 C[C@H](N)C1=CNC=N1 SY307691 [0,2,0,0,0,0|2,0,0]=4 715 B8R1.7 FC(F)C1=CN=CS1 SY265771 [0,2,0,0,0,0|2,0,0]=4 716 B8R1.7 FC(F)C1=CSC=C1 SY265636 [0,2,0,0,0,0|2,0,0]=4 717 B8R1.7 NC(=O)C1=CNN=C1 SY031430 [0,2,0,0,0,0|0,0,1]=3 718 B8R1.7 O=C(O)C1=CNC=C1 SY004601 [0,2,0,0,0,0|1,0,1]=4 719 B8R1.7 O=C(O)C1=CNN=C1 SY018302 [0,2,0,0,0,0|0,0,1]=3 720 B8R1.7 O=C(O)C1=CON=C1 SY029017 [0,2,0,0,0,0|1,0,1]=4 721 B8R1.7 O=C(O)C1=CSN=C1 SY022883 [0,2,0,0,0,0|1,0,1]=4 722 B8R1.7 O=[N+]([O-])C1=CNC=C1 SY004596 [0,2,0,0,0,0|2,0,0]=4 723 B8R1.7 O=[N+]([O-])C1=CNN=C1 SY005156 [0,2,0,0,0,0|1,0,0]=3 724 B8R1.7 O=[N+]([O-])C1=CNN=N1 SY020363 [0,2,0,0,0,0|2,0,0]=4 725 B8R1.7 OB(O)C1=CNN=C1 SY005161 [0,2,0,0,0,0|1,0,0]=3 726 B8R1.7 OB(O)C1=CON=C1 SY020548 [0,2,0,0,0,0|2,0,0]=4 727 B8R1.8 CCCC1=NNC=C1 SY147130 [0,2,0,0,0,0|2,0,0]=4 728 B8R1.8 CCCN1C=CN=C1 SY029323 [0,2,0,0,0,0|2,0,0]=4 729 B8R1.8 CNCC1=COC=C1 SY014265 [0,2,0,0,0,0|2,0,0]=4 730 B8R1.8 COCC1=CN=CN1 SY159476 [0,2,0,0,0,0|2,0,0]=4 731 B8R1.8 COCC1=NNC=C1 SY262778 [0,2,0,0,0,0|2,0,0]=4 732 B8R1.8 ClCCC1=CNC=N1 SY019470 [0,2,0,0,0,0|2,0,0]=4 733 B8R1.8 ClCCC1=CNN=C1 SY040390 [0,2,0,0,0,0|0,0,0]=2 734 B8R1.8 N#CCC1=CC=NO1 SY233661 [0,2,0,0,0,0|2,0,0]=4 735 B8R1.8 N#CCC1=CN=CO1 SY232342 [0,2,0,0,0,0|2,0,0]=4 736 B8R1.8 N#CCC1=CNC=N1 SY041793 [0,2,0,0,0,0|2,0,0]=4 737 B8R1.8 N#CCC1=NNC=C1 SY012822 [0,2,0,0,0,0|2,0,0]=4 738 B8R1.8 N#CCN1C=CN=C1 SY008199 [0,2,0,0,0,0|2,0,0]=4 739 B8R1.8 NCCC1=CNC=N1 SY012860 [0,2,0,0,0,0|2,0,0]=4 740 B8R1.8 NCCC1=CNC=N1 SY041787 [0,2,0,0,0,0|2,0,0]=4 741 B8R1.8 NCCC1=CNN=C1 SY039272 [0,2,0,0,0,0|0,0,0]=2 742 B8R1.8 NCCC1=CSC=C1 SY034366 [0,2,0,0,0,0|2,0,0]=4 743 B8R1.8 NCCC1=NNC=C1 SY021017 [0,2,0,0,0,0|2,0,0]=4 744 B8R1.8 NCCC1=NNC=C1 SY040011 [0,2,0,0,0,0|2,0,0]=4 745 B8R1.8 NCCN1C=CN=C1 SY014254 [0,2,0,0,0,0|2,0,0]=4 746 B8R1.8 NCCN1C=CN=C1 SY079565 [0,2,0,0,0,0|2,0,0]=4 747 B8R1.8 NCCN1C=CN=C1 SY110715 [0,2,0,0,0,0|2,0,0]=4 748 B8R1.8 NCCN1C=NN=C1 SY022380 [0,2,0,0,0,0|1,0,1]=4 749 B8R1.8 NOCC1=CSC=C1 SY281788 [0,2,0,0,0,0|2,0,0]=4 750 B8R1.8 NOCC1=CSC=C1 SY281789 [0,2,0,0,0,0|2,0,0]=4 751 B8R1.8 OCCC1=CNN=C1 SY007566 [0,2,0,0,0,0|0,0,0]=2 752 B8R1.8 OCCC1=CSC=C1 SY003714 [0,2,0,0,0,0|2,0,0]=4 753 B8R1.8 OCCN1C=CN=C1 SY007581 [0,2,0,0,0,0|2,0,0]=4 754 B8R1.8 OCCN1C=NN=C1 SY022378 [0,2,0,0,0,0|1,0,1]=4 755 B8R1.11 BrCC1=C(Br)SC=C1 SY041583 [0,2,0,0,0,0|2,0,0]=4 756 B8R1.11 CC1=C(C#N)C=NO1 SY040667 [0,2,0,0,0,0|1,0,1]=4 757 B8R1.11 CC1=C(C#N)N=CN1 SY035699 [0,2,0,0,0,0|2,0,0]=4 758 B8R1.11 CC1=C(C=O)NC=C1 SY013401 [0,2,0,0,0,0|1,0,0]=3 759 B8R1.11 CC1=C(C=O)NC=N1 SY017270 [0,2,0,0,0,0|2,0,0]=4 760 B8R1.11 CC1=C(CCl)C=NO1 SY197419 [0,2,0,0,0,0|1,0,0]=3 761 B8R1.11 CC1=C(CCl)N=CO1 SY147182 [0,2,0,0,0,0|2,0,0]=4 762 B8R1.11 CC1=C(CCl)OC=N1 SY233036 [0,2,0,0,0,0|2,0,0]=4 763 B8R1.11 CC1=C(CN)C=NO1 SY035076 [0,2,0,0,0,0|1,0,0]=3 764 B8R1.11 CC1=C(CO)C=CO1 SY026412 [0,2,0,0,0,0|2,0,0]=4 765 B8R1.11 CC1=C(CO)N=CN1 SY017269 [0,2,0,0,0,0|2,0,0]=4 766 B8R1.11 CC1=C(CO)NC=N1 SY007668 [0,2,0,0,0,0|2,0,0]=4 767 B8R1.11 CC1=C(CO)ON=C1 SY226579 [0,2,0,0,0,0|1,0,0]=3 768 B8R1.11 CC1=NNC=C1C=O SY024565 [0,2,0,0,0,0|0,0,1]=3 769 B8R1.11 CC1=NON=C1C=O SY162027 [0,2,0,0,0,0|2,0,0]=4 770 B8R1.11 CC1=NON=C1CN SY109552 [0,2,0,0,0,0|2,0,0]=4 771 B8R1.11 CCC1=CN=CN1C SY268701 [0,2,0,0,0,0|2,0,0]=4 772 B8R1.11 CCC1=CNN=C1C SY263511 [0,2,0,0,0,0|0,0,0]=2 773 B8R1.11 CCC1=NNC=C1I SY247711 [0,2,0,0,0,0|1,0,0]=3 774 B8R1.11 CN1C=CN=C1C#N SY034553 [0,2,0,0,0,0|2,0,0]=4 775 B8R1.11 CN1C=CN=C1C=O SY001200 [0,2,0,0,0,0|2,0,0]=4 776 B8R1.11 CN1C=CN=C1CCl SY110045 [0,2,0,0,0,0|2,0,0]=4 777 B8R1.11 CN1C=CN=C1CN SY020883 [0,2,0,0,0,0|2,0,0]=4 778 B8R1.11 CN1C=CN=C1CO SY003332 [0,2,0,0,0,0|2,0,0]=4 779 B8R1.11 CN1C=NC=C1C=O SY017852 [0,2,0,0,0,0|2,0,0]=4 780 B8R1.11 CN1C=NC=C1CN SY004189 [0,2,0,0,0,0|2,0,0]=4 781 B8R1.11 CN1C=NN=C1CO SY043008 [0,2,0,0,0,0|1,0,1]=4 782 B8R1.11 CN1N=CC=C1CBr SY280197 [0,2,0,0,0,0|2,0,0]=4 783 B8R1.11 CN1N=CC=C1CCl SY024067 [0,2,0,0,0,0|2,0,0]=4 784 B8R1.11 CN1N=CC=C1CN SY023427 [0,2,0,0,0,0|2,0,0]=4 785 B8R1.11 CN1N=CC=C1CN SY035234 [0,2,0,0,0,0|2,0,0]=4 786 B8R1.11 CN1N=CC=C1CO SY024066 [0,2,0,0,0,0|2,0,0]=4 787 B8R1.11 N#CC1=C(N)ON=C1 SY029358 [0,2,0,0,0,0|1,0,1]=4 788 B8R1.11 N#CC1=CNN=C1N SY001600 [0,2,0,0,0,0|0,0,1]=3 789 B8R1.11 N#CC1=NNC=C1Br SY006371 [0,2,0,0,0,0|1,0,0]=3 790 B8R1.11 O=CC1=C(Cl)C=CN1 SY048118 [0,2,0,0,0,0|2,0,0]=4 791 B8R1.11 O=CC1=C(I)C=NN1 SY278584 [0,2,0,0,0,0|1,0,0]=3 792 B8R1.18 CC1=C(Br)N=C(Br)S1 SY027970 [0,2,0,0,0,0|2,0,0]=4 793 B8R1.18 CC1=C(Br)N=C(N)S1 SY104526 [0,2,0,0,0,0|2,0,0]=4 794 B8R1.18 CC1=C(Br)NC(Br)=N1 SY028401 [0,2,0,0,0,0|2,0,0]=4 795 B8R1.18 CC1=C(Br)SC(Br)=C1 SY049637 [0,2,0,0,0,0|2,0,0]=4 796 B8R1.18 CC1=C(C)SC(Br)=N1 SY029879 [0,2,0,0,0,0|2,0,0]=4 797 B8R1.18 CC1=C(C)SC(N)=N1 SY029871 [0,2,0,0,0,0|2,0,0]=4 798 B8R1.18 CC1=C(C)SC(N)=N1 SY029876 [0,2,0,0,0,0|2,0,0]=4 799 B8R1.18 CC1=C(Cl)SC(Cl)=C1 SY036862 [0,2,0,0,0,0|2,0,0]=4 800 B8R1.18 CC1=C(N)N=C(Br)S1 SY267560 [0,2,0,0,0,0|2,0,0]=4 801 B8R1.18 CC1=C(N)SC(Br)=C1 SY268433 [0,2,0,0,0,0|2,0,0]=4 802 B8R1.18 CC1=C(O)N=C(N)S1 SY272544 [0,2,0,0,0,0|2,0,0]=4 803 B8R1.18 CC1=CC(N)=NN1C SY019430 [0,2,0,0,0,0|2,0,0]=4 804 B8R1.18 CC1=CC(N)=NN1C SY251679 [0,2,0,0,0,0|2,0,0]=4 805 B8R1.18 CC1=CC(O)OC1=O SY219275 [0,2,0,0,0,0|2,0,0]=4 806 B8R1.18 CC1=NC(I)=CN1C SY267333 [0,2,0,0,0,0|2,0,0]=4 807 B8R1.18 CC1=NN(C)C(N)=C1 SY008722 [0,2,0,0,0,0|2,0,0]=4 808 B8R1.18 CC1=NN(C)C(O)=C1 SY030644 [0,2,0,0,0,0|2,0,0]=4 809 B8R1.18 CC1=NN(C)C=C1Br SY024636 [0,2,0,0,0,0|1,0,0]=3 810 B8R1.18 CC1=NN(C)C=C1N SY013429 [0,2,0,0,0,0|1,0,0]=3 811 B8R1.18 CC1=NN(C)C=C1N SY026449 [0,2,0,0,0,0|1,0,0]=3 812 B8R1.18 CN1C=C(Br)C(F)=N1 SY047541 [0,2,0,0,0,0|1,0,0]=3 813 B8R1.18 CN1C=C(Br)C(N)=N1 SY056690 [0,2,0,0,0,0|1,0,0]=3 814 B8R1.18 CN1C=C(F)C(Br)=N1 SY047539 [0,2,0,0,0,0|1,0,0]=3 815 B8R1.18 CN1N=C(Br)C(Br)=N1 SY040186 [0,2,0,0,0,0|2,0,0]=4 816 B8R1.18 O=C1C=C(Br)C(=O)N1 SY264831 [0,2,0,0,0,0|2,0,0]=4 817 B8R1.50 BrC1=NNC(Br)=C1Br SY007965 [0,2,0,0,0,0|1,0,0]=3 818 B8R1.50 CC1=C(Br)C(Br)=NN1 SY046772 [0,2,0,0,0,0|1,0,0]=3 819 B8R1.50 CC1=C(Br)C=NN1C SY032821 [0,2,0,0,0,0|1,0,0]=3 820 B8R1.50 CC1=C(C)C(N)=NO1 SY018148 [0,2,0,0,0,0|1,0,0]=3 821 B8R1.50 CC1=C(I)C(I)=NN1 SY115252 [0,2,0,0,0,0|1,0,0]=3 822 B8R1.50 CC1=C(N)N(C)C=N1 SY023789 [0,2,0,0,0,0|2,0,0]=4 823 B8R1.50 CC1=C(N)N(C)N=C1 SY101574 [0,2,0,0,0,0|0,0,0]=2 824 B8R1.50 CC1=C(N)N=CN1C SY025918 [0,2,0,0,0,0|2,0,0]=4 825 B8R1.50 CC1=C(N)SC=C1Br SY268434 [0,2,0,0,0,0|2,0,0]=4 826 B8R1.50 CC1=CSC(C)=C1Br SY225463 [0,2,0,0,0,0|2,0,0]=4 827 B8R1.50 CC1=NC=C(Br)N1C SY020573 [0,2,0,0,0,0|2,0,0]=4 828 B8R1.50 CC1=NNC(C)=C1Br SY010799 [0,2,0,0,0,0|1,0,0]=3 829 B8R1.50 CC1=NNC(C)=C1I SY005941 [0,2,0,0,0,0|1,0,0]=3 830 B8R1.50 CC1=NNC(C)=C1N SY079005 [0,2,0,0,0,0|1,0,0]=3 831 B8R1.50 CC1=NNC(N)=C1C SY009268 [0,2,0,0,0,0|0,0,0]=2 832 B8R1.50 CC1=NNC(O)=C1C SY250666 [0,2,0,0,0,0|0,0,0]=2 833 B8R1.50 CC1=NOC(C)=C1Br SY018309 [0,2,0,0,0,0|2,0,0]=4 834 B8R1.50 CC1=NOC(C)=C1I SY004304 [0,2,0,0,0,0|2,0,0]=4 835 B8R1.50 CC1=NOC(C)=C1N SY109596 [0,2,0,0,0,0|2,0,0]=4 836 B8R1.50 CN1C(S)=NN=C1Br SY297579 [0,2,0,0,0,0|1,0,1]=4 837 B8R1.50 CN1N=CC(Br)=C1N SY030450 [0,2,0,0,0,0|1,0,0]=3 838 B8R1.50 CN1N=NC(Br)=C1Br SY040188 [0,2,0,0,0,0|2,0,0]=4 839 B6R1.1 C1=CC=NC=C1 SY002183 [0,0,1,1,0,0|1,0,1]=4 840 B6R1.1 C1=CC=NN=C1 SY008960 [0,0,1,1,0,0|0,0,2]=4 841 B6R1.1 C1=CCNCC1 SY020557 [0,0,1,1,0,0|1,0,1]=4