0 B7R1.3 CC1=CC=CN=N1 X0232 [0,0,0,0,0,0|2,0,0]=2 1 B7R1.3 CC1=CCC=CC1 7751AF [0,0,0,0,0,0|0,0,2]=2 2 B7R1.3 CC1C=CCCC1 6090AL [0,0,0,0,0,0|0,0,4]=4 3 B7R1.3 C[N+]1=CC=CC=C1 1581AB [0,0,0,0,0,0|1,0,0]=1 4 B7R1.3 ClC1=NN=CC=C1 X0225 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.3 FC1=CN=CN=C1 W7798 [0,0,0,0,0,0|3,0,0]=3 6 B7R1.3 F[N+]1=CC=CC=C1 4861AL [0,0,0,0,0,0|2,0,0]=2 7 B7R1.3 O=C1C=CCCN1 9030AB [0,0,0,0,0,0|2,0,2]=4 8 B7R1.3 O=C1C=CCOC1 6867AC [0,0,0,0,0,0|2,0,2]=4 9 B7R1.3 SC1=NC=CN=C1 2178AE [0,0,0,0,0,0|3,0,0]=3 10 B7R1.3 [O-][N+]1=CC=NC=C1 1770AB [0,0,0,0,0,0|3,0,0]=3 11 B7R1.3 [SeH]C1=CC=CC=C1 8806AL [0,0,0,0,0,0|1,0,0]=1 12 B6R1.1 C1=CC=NC=C1 9032AJ [1,0,0,0,0,0|1,0,0]=2 13 B6R1.1 C1=CC=NC=C1 I569 [1,0,0,0,0,0|1,0,0]=2 14 B6R1.1 C1=CN=NC=C1 9247AB [1,0,0,0,0,0|2,0,0]=3 15 B8R1.2 BrCC1=CC=NC=C1 V2331 [0,1,0,0,0,0|1,0,0]=2 16 B8R1.2 BrCC1=NC=NC=C1 6571AA [0,1,0,0,0,0|2,0,0]=3 17 B8R1.2 Br[Se]C1=CC=CC=C1 8804AL [0,1,0,0,0,0|1,0,0]=2 18 B8R1.2 C=CC1=NC=CN=C1 R581 [0,1,0,0,0,0|2,0,1]=4 19 B8R1.2 CC[N+]1=CC=CC=C1 E438 [0,1,0,0,0,0|1,0,0]=2 20 B8R1.2 CNC1=CN=CN=C1 5460AB [0,1,0,0,0,0|2,0,0]=3 21 B8R1.2 COC1=CC=NN=C1 Z5489 [0,1,0,0,0,0|2,0,0]=3 22 B8R1.2 ClCC1=NN=CC=C1 2587AB [0,1,0,0,0,0|2,0,0]=3 23 B8R1.2 FCC1=CC=NC=C1 2557AL [0,1,0,0,0,0|1,0,0]=2 24 B8R1.2 ICC1=CN=CC=C1 5715AJ [0,1,0,0,0,0|1,0,0]=2 25 B8R1.2 N#CC1=CC=NC=N1 W6240 [0,1,0,0,0,0|2,0,1]=4 26 B8R1.2 N#CC1=CC=NN=C1 X2036 [0,1,0,0,0,0|2,0,1]=4 27 B8R1.2 NCC1=CC=CC=C1 7149AL [0,1,0,0,0,0|0,0,0]=1 28 B8R1.2 NCC1=CC=NC=N1 Y7101 [0,1,0,0,0,0|2,0,0]=3 29 B8R1.2 NCC1=CC=NN=C1 X9904 [0,1,0,0,0,0|2,0,0]=3 30 B8R1.2 NCC1=CN=NC=C1 0175AP [0,1,0,0,0,0|2,0,0]=3 31 B8R1.2 NNC1=CC=NC=C1 0864AQ [0,1,0,0,0,0|2,0,0]=3 32 B8R1.2 NNC1=NN=CC=C1 5599AB [0,1,0,0,0,0|3,0,0]=4 33 B8R1.2 NOC1=CC=CC=C1 X4801 [0,1,0,0,0,0|1,0,0]=2 34 B8R1.2 O=CC1=CN=NC=C1 7044AB [0,1,0,0,0,0|2,0,1]=4 35 B8R1.2 O=CC1=NC=CC=N1 Y3220 [0,1,0,0,0,0|2,0,1]=4 36 B8R1.2 O=[As]C1=CC=CC=C1 7620AF [0,1,0,0,0,0|1,0,0]=2 37 B8R1.2 ONC1=CC=CC=C1 0019AQ [0,1,0,0,0,0|1,0,0]=2 38 B8R1.2 SCC1=CC=CN=C1 Z2753 [0,1,0,0,0,0|1,0,0]=2 39 B8R1.3 CC1=CN=C(Br)C=N1 V9897 [0,1,0,0,0,0|2,0,0]=3 40 B8R1.3 CC1=CN=C(C)N=C1 1431AB [0,1,0,0,0,0|2,0,0]=3 41 B8R1.3 CC1=CN=C(I)C=C1 5573AJ [0,1,0,0,0,0|1,0,0]=2 42 B8R1.3 CC1=NC=C(F)C=N1 7849AB [0,1,0,0,0,0|2,0,0]=3 43 B8R1.3 FC1=NC=C(I)C=N1 0786AC [0,1,0,0,0,0|3,0,0]=4 44 B8R1.3 NC1=CN=C(N)C=C1 X9372 [0,1,0,0,0,0|2,0,0]=3 45 B8R1.3 NC1=CN=C(N)C=N1 1979AC [0,1,0,0,0,0|3,0,0]=4 46 B8R1.3 NC1=CN=C(O)C=C1 X9224 [0,1,0,0,0,0|2,0,0]=3 47 B8R1.3 NC1=NC=C(O)C=C1 X4178 [0,1,0,0,0,0|2,0,0]=3 48 B8R1.3 NC1=NNC(=O)C=C1 0249AA [0,1,0,0,0,0|3,0,0]=4 49 B8R1.3 O=C1C=CC(Br)=NN1 X3918 [0,1,0,0,0,0|3,0,0]=4 50 B8R1.3 S=C1N=CC(Cl)=CN1 0391AQ [0,1,0,0,0,0|3,0,0]=4 51 B8R1.4 CC1=CC(=O)NC=C1 X3603 [0,1,0,0,0,0|1,0,0]=2 52 B8R1.4 CC1=CC(=O)NN=C1 X7047 [0,1,0,0,0,0|2,0,0]=3 53 B8R1.4 CC1=CC(N)=NN=C1 7108AA [0,1,0,0,0,0|2,0,0]=3 54 B8R1.4 CC1=CC=CC(=S)N1 0770AQ [0,1,0,0,0,0|1,0,0]=2 55 B8R1.4 CC1=CN=CC(Br)=C1 3129AA [0,1,0,0,0,0|1,0,0]=2 56 B8R1.4 CC1=CN=CC(N)=C1 3277AJ [0,1,0,0,0,0|1,0,0]=2 57 B8R1.4 CC1=CN=NC(=O)C1 5887AH [0,1,0,0,0,0|2,0,1]=4 58 B8R1.4 ClC1=NC=CC(Br)=N1 V4511 [0,1,0,0,0,0|3,0,0]=4 59 B8R1.4 IC1=CC(I)=NC=N1 V4101 [0,1,0,0,0,0|3,0,0]=4 60 B8R1.4 IC1=CN=CC(I)=C1 7672AB [0,1,0,0,0,0|2,0,0]=3 61 B8R1.4 NC1=CC(Cl)=NC=C1 1677AJ [0,1,0,0,0,0|2,0,0]=3 62 B8R1.4 NC1=CC(F)=CN=C1 Y4462 [0,1,0,0,0,0|2,0,0]=3 63 B8R1.4 NC1=CC(I)=NC=N1 W6793 [0,1,0,0,0,0|3,0,0]=4 64 B8R1.4 NC1=CC(O)=CC=C1 I722 [0,1,0,0,0,0|1,0,0]=2 65 B8R1.4 NC1=CC(O)=CN=C1 X9269 [0,1,0,0,0,0|2,0,0]=3 66 B8R1.4 NC1=CC=CC(N)=N1 7294AA [0,1,0,0,0,0|2,0,0]=3 67 B8R1.4 NC1=CC=CC(O)=C1 7262AB [0,1,0,0,0,0|1,0,0]=2 68 B8R1.4 NC1=CN=CC(N)=N1 W6186 [0,1,0,0,0,0|3,0,0]=4 69 B8R1.4 NC1=CN=CC(N)=N1 Z4125 [0,1,0,0,0,0|3,0,0]=4 70 B8R1.4 NC1=NC=CC(Cl)=C1 5606AH [0,1,0,0,0,0|2,0,0]=3 71 B8R1.4 NC1=NN=CC(Cl)=C1 Y1523 [0,1,0,0,0,0|3,0,0]=4 72 B8R1.4 O=C1C=CN=C(Cl)N1 8163AB [0,1,0,0,0,0|3,0,0]=4 73 B8R1.4 OC1=CC(F)=NC=C1 W4593 [0,1,0,0,0,0|2,0,0]=3 74 B8R1.4 OC1=CN=CC(I)=C1 7258AD [0,1,0,0,0,0|2,0,0]=3 75 B8R1.4 SC1=CC=CC(S)=C1 4506AL [0,1,0,0,0,0|1,0,0]=2 76 B8R1.5 CC1=C(Br)C=CN=C1 A900 [0,1,0,0,0,0|1,0,0]=2 77 B8R1.5 CC1=C(Cl)C=CN=C1 W3664 [0,1,0,0,0,0|1,0,0]=2 78 B8R1.5 CC1=C(F)C=CN=C1 2798AB [0,1,0,0,0,0|1,0,0]=2 79 B8R1.5 CC1=C(I)C=NC=N1 W9510 [0,1,0,0,0,0|2,0,0]=3 80 B8R1.5 CC1=C(N)N=CC=C1 3663AB [0,1,0,0,0,0|1,0,0]=2 81 B8R1.5 CC1=C(O)N=CN=C1 Z4298 [0,1,0,0,0,0|2,0,0]=3 82 B8R1.5 CC1=C(S)C=CC=C1 7880AF [0,1,0,0,0,0|0,0,0]=1 83 B8R1.5 CC1=CC=CC=C1O Z3651 [0,1,0,0,0,0|0,0,0]=1 84 B8R1.5 CC1=NN=CN=C1O 5164AD [0,1,0,0,0,0|3,0,0]=4 85 B8R1.5 ClC1=C(Cl)C=NC=C1 5074AD [0,1,0,0,0,0|2,0,0]=3 86 B8R1.5 FC1=C(Cl)C=NC=C1 V8604 [0,1,0,0,0,0|2,0,0]=3 87 B8R1.5 FC1=NC=CN=C1F 4974AE [0,1,0,0,0,0|3,0,0]=4 88 B8R1.5 FC1=NC=CN=C1I 6988AD [0,1,0,0,0,0|3,0,0]=4 89 B8R1.5 IC1=C(I)N=CC=C1 0321AF [0,1,0,0,0,0|2,0,0]=3 90 B8R1.5 NC1=C(F)C=NC=N1 Y5108 [0,1,0,0,0,0|3,0,0]=4 91 B8R1.5 NC1=C(I)C=NC=N1 W9386 [0,1,0,0,0,0|3,0,0]=4 92 B8R1.5 NC1=C(O)C=NC=C1 5564AH [0,1,0,0,0,0|2,0,0]=3 93 B8R1.5 NC1=CC=CC=C1N 7683AF [0,1,0,0,0,0|1,0,0]=2 94 B8R1.5 NC1=CC=CN=C1Br 1627AJ [0,1,0,0,0,0|2,0,0]=3 95 B8R1.5 NC1=CC=CN=C1F 1722AJ [0,1,0,0,0,0|2,0,0]=3 96 B8R1.5 NC1=CC=CNC1=S W5899 [0,1,0,0,0,0|2,0,0]=3 97 B8R1.5 NC1=CC=NN=C1N 9138AB [0,1,0,0,0,0|3,0,0]=4 98 B8R1.5 NC1=CC=NNC1=O 8057AB [0,1,0,0,0,0|3,0,0]=4 99 B8R1.5 NC1=CN=CN=C1O 5791AH [0,1,0,0,0,0|3,0,0]=4 100 B8R1.5 NC1=CN=NC=C1Cl 7539AB [0,1,0,0,0,0|3,0,0]=4 101 B8R1.5 NC1=CN=NC=C1N 2824AB [0,1,0,0,0,0|3,0,0]=4 102 B8R1.5 NC1=[N+]([O-])C=CC=C1 6877AA [0,1,0,0,0,0|2,0,0]=3 103 B8R1.5 O=C1NC=NC=C1Br W9821 [0,1,0,0,0,0|3,0,0]=4 104 B8R1.5 OC1=C(Cl)C=NC=N1 W6278 [0,1,0,0,0,0|3,0,0]=4 105 B8R1.5 OC1=C(I)C=NC=N1 W6277 [0,1,0,0,0,0|3,0,0]=4 106 B8R1.5 SC1=NC=CC=C1Br V7160 [0,1,0,0,0,0|2,0,0]=3 107 B6R0.4 C=CCCC(=C)C 5696AL [0,0,1,0,0,0|0,0,2]=3 108 B6R0.6 C=CCC\C=C\C 4658AL [0,0,1,0,0,0|0,0,2]=3 109 B6R1.2 BrC1=CC=NS1 7852AB [0,0,0,0,1,0|3,0,0]=4 110 B6R1.2 CC1=CCCC1 9313AJ [0,0,0,0,1,0|0,0,3]=4 111 B6R1.2 CC1=CCCO1 0728AQ [0,0,0,0,1,0|1,0,2]=4 112 B6R1.2 CC1=CNN=N1 W5081 [0,0,0,0,1,0|3,0,0]=4 113 B6R1.2 CC1=CON=C1 9884AB [0,0,0,0,1,0|2,0,0]=3 114 B6R1.2 CC1=CSN=N1 Y8051 [0,0,0,0,1,0|3,0,0]=4 115 B6R1.2 CC1=NOC=C1 Z4582 [0,0,0,0,1,0|2,0,0]=3 116 B6R1.2 CC1=NON=C1 W4957 [0,0,0,0,1,0|3,0,0]=4 117 B6R1.2 ClC1=NC=CS1 W5278 [0,0,0,0,1,0|3,0,0]=4 118 B6R1.2 IC1=CC=NN1 Z6311 [0,0,0,0,1,0|3,0,0]=4 119 B6R1.2 IC1=NC=CS1 X7912 [0,0,0,0,1,0|3,0,0]=4 120 B6R1.2 NC1=CN=CN1 5028AA [0,0,0,0,1,0|3,0,0]=4 121 B6R1.2 NC1=CNC=N1 B191 [0,0,0,0,1,0|3,0,0]=4 122 B6R1.2 NC1=CSN=C1 W7611 [0,0,0,0,1,0|3,0,0]=4 123 B6R1.2 NN1C=CC=N1 5269AB [0,0,0,0,1,0|3,0,0]=4 124 B6R1.2 O=C1C=CCN1 V5771 [0,0,0,0,1,0|2,0,1]=4 125 B6R1.2 O=C1C=CCS1 1311AQ [0,0,0,0,1,0|2,0,1]=4 126 B6R1.2 OC1=CSC=C1 8873AA [0,0,0,0,1,0|2,0,0]=3 127 B8R1.22 O=C1C=CC=CC=C1 1296AQ [0,0,0,0,0,1|1,0,0]=2 128 B5R0.1 C=CCC(=C)C 5694AL [1,0,1,0,0,0|0,0,1]=3 129 B5R0.2 C=CC\C=C/C 0307AQ [1,0,1,0,0,0|0,0,1]=3 130 B5R0.3 C\C(C=O)=C/N 3293AB [1,0,1,0,0,0|2,0,0]=4 131 B7R0.3 C=CCOC(=O)C=C 7691AF [0,1,1,0,0,0|1,0,1]=4 132 B7R0.7 C=COC(=O)\C=C\C E081 [0,1,1,0,0,0|1,0,1]=4 133 B7R0.4 C\C=C\C=C\C(=O)Cl Y2082 [0,1,1,0,0,0|2,0,0]=4 134 B7R0.6 C=C(C)CCC(=C)C 7929AF [0,1,1,0,0,0|0,0,2]=4 135 B7R1.1 BrCC1=CN=CS1 Y7777 [0,1,0,0,1,0|2,0,0]=4 136 B7R1.1 BrCC1=COC=N1 1429AA [0,1,0,0,1,0|2,0,0]=4 137 B7R1.1 BrCC1=NC=CN1 1423AC [0,1,0,0,1,0|2,0,0]=4 138 B7R1.1 CCC1=CC=NO1 3273AB [0,1,0,0,1,0|2,0,0]=4 139 B7R1.1 CCC1=CNC=N1 6226AL [0,1,0,0,1,0|2,0,0]=4 140 B7R1.1 CCC1=CNN=C1 5501AD [0,1,0,0,1,0|2,0,0]=4 141 B7R1.1 CCC1=NNC=C1 6654AA [0,1,0,0,1,0|2,0,0]=4 142 B7R1.1 CNC1=NC=CO1 6947AC [0,1,0,0,1,0|2,0,0]=4 143 B7R1.1 COC1=CC=CO1 2109AL [0,1,0,0,1,0|1,0,0]=3 144 B7R1.1 CSC1=CNC=N1 X6327 [0,1,0,0,1,0|2,0,0]=4 145 B7R1.1 CSC1=NC=CO1 6777AD [0,1,0,0,1,0|2,0,0]=4 146 B7R1.1 ClCC1=CN=CO1 8892AA [0,1,0,0,1,0|2,0,0]=4 147 B7R1.1 ClCC1=COC=N1 0393AC [0,1,0,0,1,0|2,0,0]=4 148 B7R1.1 ClCC1=NC=CS1 1126AC [0,1,0,0,1,0|2,0,0]=4 149 B7R1.1 ClCC1=NC=CS1 W5535 [0,1,0,0,1,0|2,0,0]=4 150 B7R1.1 N#CC1=COC=C1 0818AQ [0,1,0,0,1,0|1,0,1]=4 151 B7R1.1 NCC1=CC=CN1 W7617 [0,1,0,0,1,0|1,0,0]=3 152 B7R1.1 NCC1=CC=NN1 4193AH [0,1,0,0,1,0|2,0,0]=4 153 B7R1.1 NCC1=COC=C1 Y7389 [0,1,0,0,1,0|1,0,0]=3 154 B7R1.1 NCC1=COC=C1 Y9148 [0,1,0,0,1,0|1,0,0]=3 155 B7R1.1 NCC1=COC=N1 Y1477 [0,1,0,0,1,0|2,0,0]=4 156 B7R1.1 NCC1=CON=C1 3103AA [0,1,0,0,1,0|2,0,0]=4 157 B7R1.1 NCC1=CON=C1 8976AA [0,1,0,0,1,0|2,0,0]=4 158 B7R1.1 NCC1=CSC=C1 Z3907 [0,1,0,0,1,0|1,0,0]=3 159 B7R1.1 NCC1=CSC=N1 0159AD [0,1,0,0,1,0|2,0,0]=4 160 B7R1.1 NCC1=NC=CN1 1371AB [0,1,0,0,1,0|2,0,0]=4 161 B7R1.1 NCC1=NC=CO1 0960AA [0,1,0,0,1,0|2,0,0]=4 162 B7R1.1 O=CC1=CC=C[Se]1 5634AL [0,1,0,0,1,0|1,0,1]=4 163 B7R1.1 OCC1=CC=NO1 6850AC [0,1,0,0,1,0|2,0,0]=4 164 B7R1.1 OCC1=NNC=C1 X6393 [0,1,0,0,1,0|2,0,0]=4 165 B7R1.1 OCN1C=CN=C1 9540AF [0,1,0,0,1,0|2,0,0]=4 166 B7R1.2 BrC1=CC=C(Br)[Se]1 5359AL [0,1,0,0,1,0|2,0,0]=4 167 B7R1.2 CC1=CC(N)=CS1 Z4474 [0,1,0,0,1,0|1,0,0]=3 168 B7R1.2 CC1=CC=C(Cl)S1 8881AA [0,1,0,0,1,0|1,0,0]=3 169 B7R1.2 CC1=CN=C(N)N1 0439AC [0,1,0,0,1,0|2,0,0]=4 170 B7R1.2 CC1=CN=C(N)N1 3105AA [0,1,0,0,1,0|2,0,0]=4 171 B7R1.2 CC1=CN=C(N)N1 X7979 [0,1,0,0,1,0|2,0,0]=4 172 B7R1.2 CC1=COC(C)=N1 5323AL [0,1,0,0,1,0|2,0,0]=4 173 B7R1.2 CC1=CSC(N)=C1 5740AC [0,1,0,0,1,0|1,0,0]=3 174 B7R1.2 CC1=NC(Br)=CN1 W3545 [0,1,0,0,1,0|2,0,0]=4 175 B7R1.2 CC1=NC(N)=CS1 7776AC [0,1,0,0,1,0|2,0,0]=4 176 B7R1.2 CC1=NC=C(N)S1 Z5289 [0,1,0,0,1,0|2,0,0]=4 177 B7R1.2 CC1=NNC(Br)=C1 Z4899 [0,1,0,0,1,0|2,0,0]=4 178 B7R1.2 CC1=NSC(N)=C1 1797AB [0,1,0,0,1,0|2,0,0]=4 179 B7R1.2 CN1C=CC(Cl)=N1 9664AB [0,1,0,0,1,0|2,0,0]=4 180 B7R1.2 CN1C=CC(N)=N1 0807AQ [0,1,0,0,1,0|2,0,0]=4 181 B7R1.2 CN1C=NC(I)=C1 V8393 [0,1,0,0,1,0|2,0,0]=4 182 B7R1.2 CN1C=NC(N)=C1 W8501 [0,1,0,0,1,0|2,0,0]=4 183 B7R1.2 ClC1=CC(Br)=CS1 3619AB [0,1,0,0,1,0|2,0,0]=4 184 B7R1.2 FC1=CSC(Br)=C1 5520AL [0,1,0,0,1,0|2,0,0]=4 185 B7R1.4 BrC1=CSC=C1I 1469AC [0,1,0,0,1,0|2,0,0]=4 186 B7R1.4 CC1=C(Br)C=CO1 2185AJ [0,1,0,0,1,0|1,0,0]=3 187 B7R1.4 CC1=C(C)OC=N1 X5138 [0,1,0,0,1,0|2,0,0]=4 188 B7R1.4 CC1=C(N)ON=C1 4334AB [0,1,0,0,1,0|2,0,0]=4 189 B7R1.4 CC1=CCOC1=O 7576AD [0,1,0,0,1,0|1,0,1]=4 190 B7R1.4 CC1=CNC=C1C 2295AL [0,1,0,0,1,0|1,0,0]=3 191 B7R1.4 CC1=CNN=C1N 9912AB [0,1,0,0,1,0|2,0,0]=4 192 B7R1.4 CC1=NOC=C1N 4428AB [0,1,0,0,1,0|2,0,0]=4 193 B7R1.4 CN1C=CN=C1N Z5007 [0,1,0,0,1,0|2,0,0]=4 194 B7R1.4 CN1C=NC=C1N Y1665 [0,1,0,0,1,0|2,0,0]=4 195 B7R1.4 CN1SC=CC1=O P432 [0,1,0,0,1,0|2,0,0]=4 196 B9R1.5 O=C1C=CC=CC=C1Cl 5558AL [0,1,0,0,0,1|1,0,0]=3 197 B9R1.1 BrCC1=CN=C(Br)C=C1 Y3534 [0,2,0,0,0,0|1,0,0]=3 198 B9R1.1 C#CC1=CC=C(I)C=C1 1951AC [0,2,0,0,0,0|0,0,1]=3 199 B9R1.1 C=CC1=NC=C(Br)C=C1 1393AB [0,2,0,0,0,0|1,0,1]=4 200 B9R1.1 CC1=CC=C(C#N)N=N1 4296AE [0,2,0,0,0,0|2,0,0]=4 201 B9R1.1 CC1=CN=C(C=O)N=C1 5145AC [0,2,0,0,0,0|2,0,0]=4 202 B9R1.1 CC1=CN=C(CCl)C=N1 Y4151 [0,2,0,0,0,0|2,0,0]=4 203 B9R1.1 CC1=CN=C(CCl)N=C1 5238AA [0,2,0,0,0,0|2,0,0]=4 204 B9R1.1 CC1=CN=C(CCl)N=C1 W8706 [0,2,0,0,0,0|2,0,0]=4 205 B9R1.1 CC1=CN=C(CO)N=C1 5144AC [0,2,0,0,0,0|2,0,0]=4 206 B9R1.1 CC1=CN=C(NN)C=C1 6685AB [0,2,0,0,0,0|1,0,0]=3 207 B9R1.1 CC1=NC=C(CBr)C=N1 2514AC [0,2,0,0,0,0|2,0,0]=4 208 B9R1.1 CC1=NC=C(CCl)C=C1 Y9334 [0,2,0,0,0,0|1,0,0]=3 209 B9R1.1 CC1=NC=C(CN)C=N1 6982AA [0,2,0,0,0,0|2,0,0]=4 210 B9R1.1 CC1=NN=C(NN)C=C1 W5942 [0,2,0,0,0,0|2,0,0]=4 211 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [0,2,0,0,0,0|0,0,0]=2 212 B9R1.1 CCC1=CC=C(Cl)C=N1 2584AA [0,2,0,0,0,0|1,0,0]=3 213 B9R1.1 CCC1=CC=C(N)C=N1 5249AA [0,2,0,0,0,0|1,0,0]=3 214 B9R1.1 CCC1=CC=C(S)C=C1 S243 [0,2,0,0,0,0|0,0,0]=2 215 B9R1.1 CCC1=CN=C(N)C=N1 X9917 [0,2,0,0,0,0|2,0,0]=4 216 B9R1.1 CCC1=CN=C(N)N=C1 W5969 [0,2,0,0,0,0|2,0,0]=4 217 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [0,2,0,0,0,0|1,0,0]=3 218 B9R1.1 CCC1=NC=C(Br)C=N1 W8957 [0,2,0,0,0,0|2,0,0]=4 219 B9R1.1 CNC1=CC=C(Br)C=C1 V7923 [0,2,0,0,0,0|0,0,0]=2 220 B9R1.1 CNC1=CC=C(Cl)C=C1 V5059 [0,2,0,0,0,0|0,0,0]=2 221 B9R1.1 CNC1=CC=C(N)C=C1 F921 [0,2,0,0,0,0|0,0,0]=2 222 B9R1.1 CNC1=NC=C(N)C=C1 2702AB [0,2,0,0,0,0|1,0,0]=3 223 B9R1.1 CNC1=NC=C(N)C=N1 1831AJ [0,2,0,0,0,0|2,0,0]=4 224 B9R1.1 COC1=CN=C(I)C=N1 6098AC [0,2,0,0,0,0|2,0,0]=4 225 B9R1.1 COC1=NN=C(I)C=C1 8933AA [0,2,0,0,0,0|2,0,0]=4 226 B9R1.1 CSC1=CC=C(S)C=C1 U208 [0,2,0,0,0,0|0,0,0]=2 227 B9R1.1 CSC1=CN=C(Br)C=C1 Z0124 [0,2,0,0,0,0|1,0,0]=3 228 B9R1.1 CSC1=NC=C(C)C=N1 Z2994 [0,2,0,0,0,0|2,0,0]=4 229 B9R1.1 CSC1=NC=C(Cl)C=C1 Z1031 [0,2,0,0,0,0|1,0,0]=3 230 B9R1.1 CSC1=NC=C(Cl)C=N1 2139AL [0,2,0,0,0,0|2,0,0]=4 231 B9R1.1 CSC1=NC=C(N)C=N1 6318AJ [0,2,0,0,0,0|2,0,0]=4 232 B9R1.1 CSC1=NC=C(O)C=N1 Z4789 [0,2,0,0,0,0|2,0,0]=4 233 B9R1.1 C[N+]1=CC=C(CO)C=C1 7356AE [0,2,0,0,0,0|1,0,0]=3 234 B9R1.1 ClC1=NC=C(CBr)C=C1 3738AB [0,2,0,0,0,0|1,0,0]=3 235 B9R1.1 ClCC1=CN=C(Cl)N=C1 7390AA [0,2,0,0,0,0|2,0,0]=4 236 B9R1.1 ClCC1=NC=C(Cl)C=C1 7439AC [0,2,0,0,0,0|1,0,0]=3 237 B9R1.1 N#CC1=CN=C(I)C=C1 V4938 [0,2,0,0,0,0|1,0,1]=4 238 B9R1.1 N#[N+]C1=CC=C(Br)C=C1 6428AL [0,2,0,0,0,0|1,0,0]=3 239 B9R1.1 NC1=CC=C(CO)N=C1 8824AH [0,2,0,0,0,0|1,0,0]=3 240 B9R1.1 NC1=NC=C(CO)C=N1 3624AA [0,2,0,0,0,0|2,0,0]=4 241 B9R1.1 NCC1=CN=C(Cl)C=N1 1378AA [0,2,0,0,0,0|2,0,0]=4 242 B9R1.1 NCC1=CNC(=O)C=C1 5770AA [0,2,0,0,0,0|1,0,0]=3 243 B9R1.1 NCC1=NC=C(Br)C=C1 8830AH [0,2,0,0,0,0|1,0,0]=3 244 B9R1.1 NCC1=NC=C(Br)C=C1 W3796 [0,2,0,0,0,0|1,0,0]=3 245 B9R1.1 NCC1=NC=C(Br)C=N1 Z4014 [0,2,0,0,0,0|2,0,0]=4 246 B9R1.1 NCC1=NC=C(Cl)C=N1 8838AH [0,2,0,0,0,0|2,0,0]=4 247 B9R1.1 NCC1=NC=C(Cl)C=N1 9256AH [0,2,0,0,0,0|2,0,0]=4 248 B9R1.1 NNC1=NC=C(F)C=C1 Z4149 [0,2,0,0,0,0|2,0,0]=4 249 B9R1.1 O=C1C=CC(=NCl)C=C1 8527AL [0,2,0,0,0,0|1,0,0]=3 250 B9R1.1 O=CC1=CC=[N+]([O-])C=C1 0867AQ [0,2,0,0,0,0|1,0,1]=4 251 B9R1.1 OCC1=CC=C(Cl)N=N1 0342AA [0,2,0,0,0,0|2,0,0]=4 252 B9R1.1 OCC1=NC=C(Cl)C=N1 4772AJ [0,2,0,0,0,0|2,0,0]=4 253 B9R1.1 OCC1=NC=C(F)C=C1 3321AB [0,2,0,0,0,0|1,0,0]=3 254 B9R1.2 BrCC1=CC(Br)=NC=C1 6323AA [0,2,0,0,0,0|1,0,0]=3 255 B9R1.2 BrCC1=CC(Br)=NC=C1 Z1895 [0,2,0,0,0,0|1,0,0]=3 256 B9R1.2 C#CC1=CC(Br)=NC=C1 3389AA [0,2,0,0,0,0|1,0,1]=4 257 B9R1.2 C#CC1=CN=CC(Cl)=C1 X7082 [0,2,0,0,0,0|1,0,1]=4 258 B9R1.2 C#CC1=NC=CC(Br)=C1 3384AA [0,2,0,0,0,0|1,0,1]=4 259 B9R1.2 C#CC1=NC=CC(N)=C1 0256AC [0,2,0,0,0,0|1,0,1]=4 260 B9R1.2 C=CC1=CC(Br)=CN=C1 9938AA [0,2,0,0,0,0|1,0,1]=4 261 B9R1.2 C=CC1=CC(C)=CC=C1 6123AL [0,2,0,0,0,0|0,0,0]=2 262 B9R1.2 C=CC1=CC(C)=CC=N1 6788AA [0,2,0,0,0,0|1,0,0]=3 263 B9R1.2 C=CC1=NC=CC(Br)=C1 6873AB [0,2,0,0,0,0|1,0,1]=4 264 B9R1.2 C=CC1=NC=CC(N)=C1 0535AA [0,2,0,0,0,0|1,0,1]=4 265 B9R1.2 CC1=CC(C#N)=CN=C1 5922AB [0,2,0,0,0,0|1,0,0]=3 266 B9R1.2 CC1=CC(CCl)=NC=C1 4926AB [0,2,0,0,0,0|1,0,0]=3 267 B9R1.2 CC1=CC(CN)=CC=N1 6141AC [0,2,0,0,0,0|1,0,0]=3 268 B9R1.2 CC1=CC(CN)=CN=C1 2036AC [0,2,0,0,0,0|1,0,0]=3 269 B9R1.2 CC1=CC(CN)=NC=C1 Y7378 [0,2,0,0,0,0|1,0,0]=3 270 B9R1.2 CC1=CC(CO)=NC=C1 Z4739 [0,2,0,0,0,0|1,0,0]=3 271 B9R1.2 CC1=CC=CC(CBr)=N1 Y9700 [0,2,0,0,0,0|1,0,0]=3 272 B9R1.2 CC1=CC=CC(NN)=N1 W6763 [0,2,0,0,0,0|1,0,0]=3 273 B9R1.2 CC1=CN=CC(C=O)=N1 2745AA [0,2,0,0,0,0|2,0,0]=4 274 B9R1.2 CC1=CN=CC(CCl)=N1 2673AC [0,2,0,0,0,0|2,0,0]=4 275 B9R1.2 CC1=NC(C#N)=NC=C1 2189AC [0,2,0,0,0,0|2,0,0]=4 276 B9R1.2 CC1=NC(CO)=NC=C1 Y3221 [0,2,0,0,0,0|2,0,0]=4 277 B9R1.2 CC1=NC=CC(C#N)=C1 1229AB [0,2,0,0,0,0|1,0,0]=3 278 B9R1.2 CC1=NC=CC(C=O)=C1 9828AC [0,2,0,0,0,0|1,0,0]=3 279 B9R1.2 CCC1=CC(=O)N=CN1 4704AA [0,2,0,0,0,0|2,0,0]=4 280 B9R1.2 CCC1=CC(F)=CC=C1 0760AC [0,2,0,0,0,0|0,0,0]=2 281 B9R1.2 CCC1=CC(N)=CC=N1 5543AJ [0,2,0,0,0,0|1,0,0]=3 282 B9R1.2 CCC1=CC(N)=NC=N1 3305AC [0,2,0,0,0,0|2,0,0]=4 283 B9R1.2 CCC1=CC=NC(Cl)=C1 5411AB [0,2,0,0,0,0|1,0,0]=3 284 B9R1.2 CCC1=NC(C)=CC=C1 2156AA [0,2,0,0,0,0|1,0,0]=3 285 B9R1.2 CNC1=CC(O)=NC=N1 2155AA [0,2,0,0,0,0|2,0,0]=4 286 B9R1.2 CNC1=NC(N)=NC=C1 0200AA [0,2,0,0,0,0|2,0,0]=4 287 B9R1.2 COC1=CC(=O)NN=C1 X9569 [0,2,0,0,0,0|2,0,0]=4 288 B9R1.2 COC1=CC(Br)=NC=N1 8292AE [0,2,0,0,0,0|2,0,0]=4 289 B9R1.2 COC1=CC(C)=CN=C1 2251AC [0,2,0,0,0,0|1,0,0]=3 290 B9R1.2 COC1=CN=CC(Br)=N1 Y5654 [0,2,0,0,0,0|2,0,0]=4 291 B9R1.2 COC1=CN=CC(F)=C1 Y3600 [0,2,0,0,0,0|1,0,0]=3 292 B9R1.2 COC1=CN=CC(I)=C1 1202AF [0,2,0,0,0,0|1,0,0]=3 293 B9R1.2 COC1=CN=CC(N)=C1 2136AJ [0,2,0,0,0,0|1,0,0]=3 294 B9R1.2 COC1=C[N+]([O-])=CC=C1 7428AA [0,2,0,0,0,0|1,0,0]=3 295 B9R1.2 COC1=NC(=O)C=CN1 W4926 [0,2,0,0,0,0|2,0,0]=4 296 B9R1.2 COC1=NC(C)=CN=C1 2865AB [0,2,0,0,0,0|2,0,0]=4 297 B9R1.2 CSC1=CC=CC(O)=C1 1026AE [0,2,0,0,0,0|0,0,0]=2 298 B9R1.2 CSC1=NC(C)=CN=C1 2879AB [0,2,0,0,0,0|2,0,0]=4 299 B9R1.2 CSC1=NC=CC(Br)=N1 W9785 [0,2,0,0,0,0|2,0,0]=4 300 B9R1.2 CSC1=NC=CC(Cl)=C1 W5514 [0,2,0,0,0,0|1,0,0]=3 301 B9R1.2 ClC1=CC(CBr)=CC=N1 Y1576 [0,2,0,0,0,0|1,0,0]=3 302 B9R1.2 ClCC1=CC(Cl)=CN=C1 2237AJ [0,2,0,0,0,0|1,0,0]=3 303 B9R1.2 ClCC1=CN=CC(Br)=C1 Z8207 [0,2,0,0,0,0|1,0,0]=3 304 B9R1.2 ClCC1=CN=CC(Cl)=C1 2236AJ [0,2,0,0,0,0|1,0,0]=3 305 B9R1.2 FC1=CC=CC(CBr)=N1 Z3784 [0,2,0,0,0,0|1,0,0]=3 306 B9R1.2 N#CC1=CC(F)=CN=C1 V1360 [0,2,0,0,0,0|1,0,1]=4 307 B9R1.2 N#CC1=CC(I)=NC=C1 Z7521 [0,2,0,0,0,0|1,0,1]=4 308 B9R1.2 NC1=CC(CO)=CN=C1 Z2689 [0,2,0,0,0,0|1,0,0]=3 309 B9R1.2 NC1=CC=CC(C=O)=C1 X3987 [0,2,0,0,0,0|0,0,1]=3 310 B9R1.2 NC1=CC=CC(C=O)=N1 3868AB [0,2,0,0,0,0|1,0,1]=4 311 B9R1.2 NC1=NC(CO)=CC=N1 1009AB [0,2,0,0,0,0|2,0,0]=4 312 B9R1.2 NCC1=CC(=O)NC=C1 6129AC [0,2,0,0,0,0|1,0,0]=3 313 B9R1.2 NCC1=CC(Cl)=CN=C1 5679AJ [0,2,0,0,0,0|1,0,0]=3 314 B9R1.2 NCC1=CC(N)=NC=C1 5441AJ [0,2,0,0,0,0|1,0,0]=3 315 B9R1.2 NCC1=CC(N)=NC=N1 3584AF [0,2,0,0,0,0|2,0,0]=4 316 B9R1.2 NCC1=CC=CC(Br)=N1 X7041 [0,2,0,0,0,0|1,0,0]=3 317 B9R1.2 NCC1=CC=C[N+]([O-])=C1 2361AL [0,2,0,0,0,0|1,0,0]=3 318 B9R1.2 NCC1=NC(Br)=CC=C1 5367AC [0,2,0,0,0,0|1,0,0]=3 319 B9R1.2 NCC1=NC(F)=CC=C1 4862AA [0,2,0,0,0,0|1,0,0]=3 320 B9R1.2 NCC1=NC(F)=CC=C1 Y8188 [0,2,0,0,0,0|1,0,0]=3 321 B9R1.2 NCC1=NC=CC(Br)=C1 W8887 [0,2,0,0,0,0|1,0,0]=3 322 B9R1.2 NCC1=NC=CC(Br)=C1 Z3782 [0,2,0,0,0,0|1,0,0]=3 323 B9R1.2 NNC1=CC(=O)NC=C1 1453AA [0,2,0,0,0,0|2,0,0]=4 324 B9R1.2 NNC1=CC(F)=NC=C1 V7913 [0,2,0,0,0,0|2,0,0]=4 325 B9R1.2 NNC1=NC=CC(I)=C1 Y3597 [0,2,0,0,0,0|2,0,0]=4 326 B9R1.2 O=CC1=CC(F)=NC=C1 X9807 [0,2,0,0,0,0|1,0,1]=4 327 B9R1.2 O=CC1=CC(I)=CN=C1 1479AF [0,2,0,0,0,0|1,0,1]=4 328 B9R1.2 O=CC1=CC=CC(=O)N1 4493AB [0,2,0,0,0,0|1,0,1]=4 329 B9R1.2 O=CC1=CC=CC(F)=N1 N399 [0,2,0,0,0,0|1,0,1]=4 330 B9R1.2 OC1=CC=CC(CBr)=C1 Y9989 [0,2,0,0,0,0|0,0,0]=2 331 B9R1.2 OC1=NC(CCl)=NC=C1 Y3173 [0,2,0,0,0,0|2,0,0]=4 332 B9R1.2 OCC1=CC(S)=CC=C1 0333AF [0,2,0,0,0,0|0,0,0]=2 333 B9R1.2 OCC1=CN=CC(Br)=N1 3660AA [0,2,0,0,0,0|2,0,0]=4 334 B9R1.2 [O-][N+]1=CC(CO)=CC=C1 2162AH [0,2,0,0,0,0|1,0,0]=3 335 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [0,2,0,0,0,0|0,0,0]=2 336 B9R1.6 CC(Cl)C1=NC=CN=C1 Z2354 [0,2,0,0,0,0|2,0,0]=4 337 B9R1.6 CN(C)C1=CC=NC=C1 6487AL [0,2,0,0,0,0|1,0,0]=3 338 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [0,2,0,0,0,0|1,0,0]=3 339 B9R1.6 CN(C)C1=NC=NC=C1 3385AB [0,2,0,0,0,0|2,0,0]=4 340 B9R1.6 CN(N)C1=CN=CC=N1 1013AJ [0,2,0,0,0,0|2,0,0]=4 341 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [0,2,0,0,0,0|0,0,0]=2 342 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [0,2,0,0,0,0|1,0,0]=3 343 B9R1.6 CS(=O)C1=NC=CC=N1 7770AJ [0,2,0,0,0,0|2,0,0]=4 344 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [0,2,0,0,0,0|1,0,0]=3 345 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [0,2,0,0,0,0|1,0,0]=3 346 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [0,2,0,0,0,0|1,0,0]=3 347 B9R1.6 ClB(Cl)C1=CC=CC=C1 Z8862 [0,2,0,0,0,0|1,0,0]=3 348 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 Y1609 [0,2,0,0,0,0|1,0,0]=3 349 B9R1.6 FC(F)C1=CC=NC=C1 0239AF [0,2,0,0,0,0|1,0,0]=3 350 B9R1.6 N=C(N)C1=CC=CC=C1 9278AB [0,2,0,0,0,0|0,0,1]=3 351 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [0,2,0,0,0,0|1,0,1]=4 352 B9R1.6 O=C(S)C1=CN=CC=C1 9152AL [0,2,0,0,0,0|1,0,1]=4 353 B9R1.6 O=C([O-])C1=NC=CC=C1 8839AL [0,2,0,0,0,0|1,0,1]=4 354 B9R1.6 OB(O)C1=NC=CC=C1 X0604 [0,2,0,0,0,0|2,0,0]=4 355 B9R1.8 BrCCC1=CC=CC=N1 5125AB [0,2,0,0,0,0|1,0,0]=3 356 B9R1.8 CCC[N+]1=CC=CC=C1 4961AL [0,2,0,0,0,0|1,0,0]=3 357 B9R1.8 CCC[N+]1=CC=CC=C1 K559 [0,2,0,0,0,0|1,0,0]=3 358 B9R1.8 CCNC1=NC=CN=C1 Z2415 [0,2,0,0,0,0|2,0,0]=4 359 B9R1.8 CNCC1=CC=CC=C1 3855AD [0,2,0,0,0,0|0,0,0]=2 360 B9R1.8 CNCC1=CC=CC=N1 7146AD [0,2,0,0,0,0|1,0,0]=3 361 B9R1.8 CNCC1=CC=NC=N1 6023AD [0,2,0,0,0,0|2,0,0]=4 362 B9R1.8 CNCC1=NC=CC=N1 X8879 [0,2,0,0,0,0|2,0,0]=4 363 B9R1.8 CNCC1=NC=CN=C1 X9439 [0,2,0,0,0,0|2,0,0]=4 364 B9R1.8 CNNC1=CC=CC=C1 V2456 [0,2,0,0,0,0|0,0,0]=2 365 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [0,2,0,0,0,0|0,0,0]=2 366 B9R1.8 ClCCC1=NC=CC=C1 X6257 [0,2,0,0,0,0|1,0,0]=3 367 B9R1.8 N#CCC1=CC=NC=C1 Z9553 [0,2,0,0,0,0|1,0,0]=3 368 B9R1.8 N#CCC1=NC=CC=N1 8863AB [0,2,0,0,0,0|2,0,0]=4 369 B9R1.8 N#CCC1=NC=NC=C1 2417AC [0,2,0,0,0,0|2,0,0]=4 370 B9R1.8 N#CC[N+]1=CC=CC=C1 8359AL [0,2,0,0,0,0|1,0,0]=3 371 B9R1.8 NCCC1=CC=CN=C1 5033AC [0,2,0,0,0,0|1,0,0]=3 372 B9R1.8 NCCC1=CN=CC=N1 1878AJ [0,2,0,0,0,0|2,0,0]=4 373 B9R1.8 NCCC1=NC=CN=C1 Y9352 [0,2,0,0,0,0|2,0,0]=4 374 B9R1.8 NNCC1=CC=CC=N1 4874AC [0,2,0,0,0,0|1,0,0]=3 375 B9R1.8 NNCC1=CN=CN=C1 2736AD [0,2,0,0,0,0|2,0,0]=4 376 B9R1.8 NOCC1=CC=CN=C1 7306AJ [0,2,0,0,0,0|1,0,0]=3 377 B9R1.8 O=C=NC1=CC=CN=C1 Y9342 [0,2,0,0,0,0|1,0,1]=4 378 B9R1.8 O=CNC1=NC=CC=C1 1807AL [0,2,0,0,0,0|1,0,1]=4 379 B9R1.8 OCCC1=CN=CN=C1 W8980 [0,2,0,0,0,0|2,0,0]=4 380 B9R1.8 OCCC1=NC=CN=C1 Z5014 [0,2,0,0,0,0|2,0,0]=4 381 B9R1.8 S=C=NC1=CC=CC=N1 3181AH [0,2,0,0,0,0|1,0,1]=4 382 B9R1.8 [N-]=[N+]=NC1=CC=CC=C1 0023AQ [0,2,0,0,0,0|1,0,0]=3 383 B9R1.15 C#CC1=CC=CC=C1Br 1939AC [0,2,0,0,0,0|0,0,1]=3 384 B9R1.15 C#CC1=CC=CN=C1F 5833AC [0,2,0,0,0,0|1,0,1]=4 385 B9R1.15 C#CC1=CC=CN=C1N 0364AC [0,2,0,0,0,0|1,0,1]=4 386 B9R1.15 C=CC1=C(C)C=CC=C1 8079AF [0,2,0,0,0,0|0,0,0]=2 387 B9R1.15 C=CC1=CC=CC=C1N 3518AA [0,2,0,0,0,0|0,0,1]=3 388 B9R1.15 C=CC1=CC=CC=[N+]1C 0254AQ [0,2,0,0,0,0|1,0,0]=3 389 B9R1.15 CC1=C(CBr)C=NC=C1 Y7235 [0,2,0,0,0,0|1,0,0]=3 390 B9R1.15 CC1=C(CN)C=CN=C1 4277AH [0,2,0,0,0,0|1,0,0]=3 391 B9R1.15 CC1=C(CN)C=CN=C1 Y4868 [0,2,0,0,0,0|1,0,0]=3 392 B9R1.15 CC1=C(NN)C=NC=C1 2421AC [0,2,0,0,0,0|1,0,0]=3 393 B9R1.15 CC1=C(NN)N=CC=N1 0201AB [0,2,0,0,0,0|2,0,0]=4 394 B9R1.15 CC1=CC=CC=C1[Mg]Br X5408 [0,2,0,0,0,0|0,0,0]=2 395 B9R1.15 CC1=CC=CN=C1CBr Y9115 [0,2,0,0,0,0|1,0,0]=3 396 B9R1.15 CC1=CC=CN=C1CO 0931AC [0,2,0,0,0,0|1,0,0]=3 397 B9R1.15 CC1=CN=CC=C1CO 4896AB [0,2,0,0,0,0|1,0,0]=3 398 B9R1.15 CC1=NC=CC=C1CCl 8680AB [0,2,0,0,0,0|1,0,0]=3 399 B9R1.15 CC1=NC=CN=C1CCl 2672AC [0,2,0,0,0,0|2,0,0]=4 400 B9R1.15 CC1=NC=CN=C1CO 8119AA [0,2,0,0,0,0|2,0,0]=4 401 B9R1.15 CCC1=C(Br)C=CN=C1 0440AA [0,2,0,0,0,0|1,0,0]=3 402 B9R1.15 CCC1=C(Br)C=NC=C1 W9928 [0,2,0,0,0,0|1,0,0]=3 403 B9R1.15 CCC1=CC=CC=C1C Z4941 [0,2,0,0,0,0|0,0,0]=2 404 B9R1.15 CCC1=NC=CN=C1N 5741AC [0,2,0,0,0,0|2,0,0]=4 405 B9R1.15 CCC1=[N+]([O-])C=CC=C1 7886AF [0,2,0,0,0,0|1,0,0]=3 406 B9R1.15 CNC1=CC=CC=C1Br 0544AC [0,2,0,0,0,0|0,0,0]=2 407 B9R1.15 CNC1=CC=CN=C1N 8234AB [0,2,0,0,0,0|1,0,0]=3 408 B9R1.15 CNC1=NC=CC=C1N 6884AB [0,2,0,0,0,0|1,0,0]=3 409 B9R1.15 CNC1=NC=CN=C1N Y6424 [0,2,0,0,0,0|2,0,0]=4 410 B9R1.15 COC1=C(Br)C=CN=C1 X8928 [0,2,0,0,0,0|1,0,0]=3 411 B9R1.15 COC1=C(Cl)C=NC=C1 3447AC [0,2,0,0,0,0|1,0,0]=3 412 B9R1.15 COC1=C(O)C=NC=C1 7687AA [0,2,0,0,0,0|1,0,0]=3 413 B9R1.15 COC1=C(O)N=CN=C1 Y4974 [0,2,0,0,0,0|2,0,0]=4 414 B9R1.15 COC1=CC=CN=C1I Y4758 [0,2,0,0,0,0|1,0,0]=3 415 B9R1.15 COC1=CN=CC=C1O 9525AB [0,2,0,0,0,0|1,0,0]=3 416 B9R1.15 COC1=CN=CN=C1O 1033AC [0,2,0,0,0,0|2,0,0]=4 417 B9R1.15 COC1=NC=CC=C1F Z7565 [0,2,0,0,0,0|1,0,0]=3 418 B9R1.15 CSC1=NC=CC=C1Br V6364 [0,2,0,0,0,0|1,0,0]=3 419 B9R1.15 CSC1=NC=CN=C1Cl 0040AP [0,2,0,0,0,0|2,0,0]=4 420 B9R1.15 ClCC1=C(Br)C=CC=C1 8546AB [0,2,0,0,0,0|0,0,0]=2 421 B9R1.15 ClCC1=NC=CC=C1Br Z8668 [0,2,0,0,0,0|1,0,0]=3 422 B9R1.15 ClCC1=NC=CN=C1Cl W6373 [0,2,0,0,0,0|2,0,0]=4 423 B9R1.15 FC1=CC=CN=C1CCl X7998 [0,2,0,0,0,0|1,0,0]=3 424 B9R1.15 N#CC1=C(Br)C=CN=C1 B519 [0,2,0,0,0,0|1,0,1]=4 425 B9R1.15 N#CC1=C(O)C=NC=C1 3723AC [0,2,0,0,0,0|1,0,1]=4 426 B9R1.15 NC1=C(C=O)C=CN=C1 2155AJ [0,2,0,0,0,0|1,0,1]=4 427 B9R1.15 NC1=C(CO)C=NC=C1 W3010 [0,2,0,0,0,0|1,0,0]=3 428 B9R1.15 NC1=C(CO)N=CC=C1 5776AJ [0,2,0,0,0,0|1,0,0]=3 429 B9R1.15 NC1=CN=CC=C1C=O 3083AA [0,2,0,0,0,0|1,0,1]=4 430 B9R1.15 NCC1=C(F)C=NC=C1 W8931 [0,2,0,0,0,0|1,0,0]=3 431 B9R1.15 NCC1=C(F)N=CC=C1 3392AC [0,2,0,0,0,0|1,0,0]=3 432 B9R1.15 NCC1=C(I)C=CC=C1 1744AJ [0,2,0,0,0,0|0,0,0]=2 433 B9R1.15 NCC1=CC=CC=C1N W5201 [0,2,0,0,0,0|0,0,0]=2 434 B9R1.15 NCC1=CC=CN=C1Br 0546AB [0,2,0,0,0,0|1,0,0]=3 435 B9R1.15 NCC1=CC=CN=C1Cl 8496AH [0,2,0,0,0,0|1,0,0]=3 436 B9R1.15 NCC1=CC=CN=C1Cl Y8187 [0,2,0,0,0,0|1,0,0]=3 437 B9R1.15 NCC1=CC=CN=C1F W4328 [0,2,0,0,0,0|1,0,0]=3 438 B9R1.15 NCC1=CC=CNC1=O 3266AC [0,2,0,0,0,0|1,0,0]=3 439 B9R1.15 NNC1=CC=CC=C1I W6607 [0,2,0,0,0,0|1,0,0]=3 440 B9R1.15 NNC1=NC=CC=C1I Z0677 [0,2,0,0,0,0|2,0,0]=4 441 B9R1.15 O=CC1=C(Br)C=CN=C1 Y5203 [0,2,0,0,0,0|1,0,1]=4 442 B9R1.15 O=CC1=CN=CC=C1Br W3357 [0,2,0,0,0,0|1,0,1]=4 443 B9R1.15 O=CC1=CN=CC=C1O Z1966 [0,2,0,0,0,0|1,0,1]=4 444 B9R1.15 OCC1=C(Cl)C=CN=C1 V0669 [0,2,0,0,0,0|1,0,0]=3 445 B9R1.15 OCC1=C(Cl)C=NC=C1 Y4116 [0,2,0,0,0,0|1,0,0]=3 446 B9R1.15 OCC1=C(O)C=NC=C1 X7917 [0,2,0,0,0,0|1,0,0]=3 447 B9R1.15 OCC1=NC=CC=C1Br W6721 [0,2,0,0,0,0|1,0,0]=3 448 B9R1.15 OCC1=NC=CC=C1Cl Z4931 [0,2,0,0,0,0|1,0,0]=3 449 B9R1.15 [O-][N+]1=C(CCl)C=CC=C1 Y8686 [0,2,0,0,0,0|1,0,0]=3 450 B9R1.69 BrC1=C(I)C=C(I)C=N1 4413AC [0,2,0,0,0,0|2,0,0]=4 451 B9R1.69 BrC1=CC(I)=CN=C1Br 5612AC [0,2,0,0,0,0|2,0,0]=4 452 B9R1.69 BrC1=CN=C(Br)C=C1Br V8125 [0,2,0,0,0,0|2,0,0]=4 453 B9R1.69 BrC1=NC(Br)=C(I)C=C1 0773AA [0,2,0,0,0,0|2,0,0]=4 454 B9R1.69 CC1=C(Br)C=C(O)C=N1 Y8080 [0,2,0,0,0,0|1,0,0]=3 455 B9R1.69 CC1=C(Br)C=NC(=O)N1 9639AB [0,2,0,0,0,0|2,0,0]=4 456 B9R1.69 CC1=C(C)C=[N+]([O-])C=C1 Z3721 [0,2,0,0,0,0|1,0,0]=3 457 B9R1.69 CC1=C(C)N=C(N)N=C1 0723AD [0,2,0,0,0,0|2,0,0]=4 458 B9R1.69 CC1=C(Cl)C=C(N)C=N1 4848AC [0,2,0,0,0,0|1,0,0]=3 459 B9R1.69 CC1=C(Cl)C=CC(O)=N1 Z6713 [0,2,0,0,0,0|1,0,0]=3 460 B9R1.69 CC1=C(Cl)N=CC(N)=N1 6250AB [0,2,0,0,0,0|2,0,0]=4 461 B9R1.69 CC1=C(F)C=C(F)C=C1 X4510 [0,2,0,0,0,0|0,0,0]=2 462 B9R1.69 CC1=C(I)C=CC(Br)=N1 5952AH [0,2,0,0,0,0|1,0,0]=3 463 B9R1.69 CC1=C(I)C=NC(Br)=C1 5482AJ [0,2,0,0,0,0|1,0,0]=3 464 B9R1.69 CC1=C(N)C=NC(N)=C1 4925AH [0,2,0,0,0,0|1,0,0]=3 465 B9R1.69 CC1=C(S)C=CC(F)=C1 0479AF [0,2,0,0,0,0|0,0,0]=2 466 B9R1.69 CC1=CC(C)=C(I)N=C1 6146AB [0,2,0,0,0,0|1,0,0]=3 467 B9R1.69 CC1=CC(C)=NC=C1O 8941AD [0,2,0,0,0,0|1,0,0]=3 468 B9R1.69 CC1=CC(Cl)=CN=C1N 0759AQ [0,2,0,0,0,0|1,0,0]=3 469 B9R1.69 CC1=CC(Cl)=NC=C1O Y3887 [0,2,0,0,0,0|1,0,0]=3 470 B9R1.69 CC1=CC(F)=NC=C1I Y3765 [0,2,0,0,0,0|1,0,0]=3 471 B9R1.69 CC1=CC(F)=NC=C1O Y3896 [0,2,0,0,0,0|1,0,0]=3 472 B9R1.69 CC1=CC(I)=C(Br)N=C1 0052AC [0,2,0,0,0,0|1,0,0]=3 473 B9R1.69 CC1=CC(I)=C(Cl)N=C1 8904AB [0,2,0,0,0,0|1,0,0]=3 474 B9R1.69 CC1=CC(I)=CN=C1F Z0364 [0,2,0,0,0,0|1,0,0]=3 475 B9R1.69 CC1=CC(N)=C(N)C=C1 1704AA [0,2,0,0,0,0|0,0,0]=2 476 B9R1.69 CC1=CC(N)=CC=C1N 7752AF [0,2,0,0,0,0|0,0,0]=2 477 B9R1.69 CC1=CC(O)=CN=C1F Z0308 [0,2,0,0,0,0|1,0,0]=3 478 B9R1.69 CC1=CC(S)=CC=C1F X8388 [0,2,0,0,0,0|0,0,0]=2 479 B9R1.69 CC1=CC=C(Br)N=C1Br 4933AH [0,2,0,0,0,0|1,0,0]=3 480 B9R1.69 CC1=CC=C(C)C(N)=C1 7917AF [0,2,0,0,0,0|0,0,0]=2 481 B9R1.69 CC1=CC=C(C)C(S)=C1 L103 [0,2,0,0,0,0|0,0,0]=2 482 B9R1.69 CC1=CC=C(Cl)N=C1I 3354AD [0,2,0,0,0,0|1,0,0]=3 483 B9R1.69 CC1=CC=C(I)C(N)=N1 W9073 [0,2,0,0,0,0|1,0,0]=3 484 B9R1.69 CC1=CC=C(N)C(C)=C1 5318AL [0,2,0,0,0,0|0,0,0]=2 485 B9R1.69 CC1=CC=C(N)C(O)=N1 Z8999 [0,2,0,0,0,0|1,0,0]=3 486 B9R1.69 CC1=CC=C(N)N=C1N 7196AB [0,2,0,0,0,0|1,0,0]=3 487 B9R1.69 CC1=CC=C(O)C(Cl)=N1 V5467 [0,2,0,0,0,0|1,0,0]=3 488 B9R1.69 CC1=CC=C(O)C(F)=N1 N386 [0,2,0,0,0,0|1,0,0]=3 489 B9R1.69 CC1=CC=C(O)C(N)=N1 W4287 [0,2,0,0,0,0|1,0,0]=3 490 B9R1.69 CC1=CC=C(O)C=C1I Z0737 [0,2,0,0,0,0|0,0,0]=2 491 B9R1.69 CC1=CC=C(S)C=C1F 7321AE [0,2,0,0,0,0|0,0,0]=2 492 B9R1.69 CC1=CN=C(Br)C=C1Cl 0797AA [0,2,0,0,0,0|1,0,0]=3 493 B9R1.69 CC1=CN=C(Cl)C(C)=C1 Y9908 [0,2,0,0,0,0|1,0,0]=3 494 B9R1.69 CC1=CN=C(Cl)C=C1C 1648AJ [0,2,0,0,0,0|1,0,0]=3 495 B9R1.69 CC1=CN=C(F)C(O)=C1 Y3761 [0,2,0,0,0,0|1,0,0]=3 496 B9R1.69 CC1=CN=C(N)C(N)=C1 W4808 [0,2,0,0,0,0|1,0,0]=3 497 B9R1.69 CC1=CN=C(N)C=C1Br 0796AA [0,2,0,0,0,0|1,0,0]=3 498 B9R1.69 CC1=CN=C(N)C=C1Cl 0795AA [0,2,0,0,0,0|1,0,0]=3 499 B9R1.69 CC1=CN=C(O)C(N)=C1 Z8991 [0,2,0,0,0,0|1,0,0]=3 500 B9R1.69 CC1=C[N+]([O-])=C(Cl)C=C1 V4169 [0,2,0,0,0,0|1,0,0]=3 501 B9R1.69 CC1=NC(Br)=NC=C1Br 8816AA [0,2,0,0,0,0|2,0,0]=4 502 B9R1.69 CC1=NC(Br)=NC=C1N 4739AA [0,2,0,0,0,0|2,0,0]=4 503 B9R1.69 CC1=NC(F)=CC=C1O Y3898 [0,2,0,0,0,0|1,0,0]=3 504 B9R1.69 CC1=NC(N)=C(N)C=C1 3859AB [0,2,0,0,0,0|1,0,0]=3 505 B9R1.69 CC1=NC=C(Br)C(Cl)=C1 Z6267 [0,2,0,0,0,0|1,0,0]=3 506 B9R1.69 CC1=NC=C(Br)C(Cl)=N1 3458AC [0,2,0,0,0,0|2,0,0]=4 507 B9R1.69 CC1=NC=C(Br)C(O)=N1 W3643 [0,2,0,0,0,0|2,0,0]=4 508 B9R1.69 CC1=NC=C(Cl)C=C1Br Y6602 [0,2,0,0,0,0|1,0,0]=3 509 B9R1.69 CC1=NC=C(Cl)C=C1F Z8272 [0,2,0,0,0,0|1,0,0]=3 510 B9R1.69 CC1=NC=C(Cl)N=C1Cl 5741AJ [0,2,0,0,0,0|2,0,0]=4 511 B9R1.69 CC1=NC=C(F)C(Cl)=C1 Y7793 [0,2,0,0,0,0|1,0,0]=3 512 B9R1.69 CC1=NC=C(F)C(O)=N1 W3234 [0,2,0,0,0,0|2,0,0]=4 513 B9R1.69 CC1=NC=C(I)C(N)=C1 X5596 [0,2,0,0,0,0|1,0,0]=3 514 B9R1.69 CC1=NC=C(N)C(C)=N1 P337 [0,2,0,0,0,0|2,0,0]=4 515 B9R1.69 CC1=NC=C(N)N=C1Br 1542AC [0,2,0,0,0,0|2,0,0]=4 516 B9R1.69 CC1=NNC(=O)C(N)=C1 4121AD [0,2,0,0,0,0|2,0,0]=4 517 B9R1.69 CN1C=C(N)C=CC1=O 6315AJ [0,2,0,0,0,0|1,0,0]=3 518 B9R1.69 CN1C=CC(I)=CC1=O 2839AJ [0,2,0,0,0,0|1,0,0]=3 519 B9R1.69 CN1C=CC(O)=CC1=O 6177AJ [0,2,0,0,0,0|1,0,0]=3 520 B9R1.69 ClC1=CC(Br)=NC=C1I 3977AD [0,2,0,0,0,0|2,0,0]=4 521 B9R1.69 ClC1=CC(I)=CN=C1Cl 6849AC [0,2,0,0,0,0|2,0,0]=4 522 B9R1.69 ClC1=CC=C(Br)N=C1Cl Z6659 [0,2,0,0,0,0|2,0,0]=4 523 B9R1.69 FC1=C(Br)C=C(I)C=N1 0784AC [0,2,0,0,0,0|2,0,0]=4 524 B9R1.69 FC1=CC(I)=CN=C1F Y4246 [0,2,0,0,0,0|2,0,0]=4 525 B9R1.69 FC1=CN=C(Br)C(I)=C1 3880AA [0,2,0,0,0,0|2,0,0]=4 526 B9R1.69 FC1=CN=C(Br)C=C1I Z6842 [0,2,0,0,0,0|2,0,0]=4 527 B9R1.69 FC1=CN=C(F)C(Br)=C1 Z8275 [0,2,0,0,0,0|2,0,0]=4 528 B9R1.69 FC1=CN=C(F)C=C1Cl 3167AC [0,2,0,0,0,0|2,0,0]=4 529 B9R1.69 FC1=NC=C(Cl)C=C1I Z0988 [0,2,0,0,0,0|2,0,0]=4 530 B9R1.69 NC1=C(Br)C=C(Br)N=C1 2133AJ [0,2,0,0,0,0|2,0,0]=4 531 B9R1.69 NC1=C(Br)C=C(O)C=C1 2629AJ [0,2,0,0,0,0|1,0,0]=3 532 B9R1.69 NC1=C(Cl)C=CC(Cl)=N1 3372AB [0,2,0,0,0,0|2,0,0]=4 533 B9R1.69 NC1=C(N)C=C(Cl)N=C1 X9314 [0,2,0,0,0,0|2,0,0]=4 534 B9R1.69 NC1=C(O)C=CC(O)=C1 0619AB [0,2,0,0,0,0|1,0,0]=3 535 B9R1.69 NC1=C(S)C=C(F)C=C1 1981AL [0,2,0,0,0,0|1,0,0]=3 536 B9R1.69 NC1=CC(Br)=C(N)N=C1 4847AC [0,2,0,0,0,0|2,0,0]=4 537 B9R1.69 NC1=CC(Cl)=CN=C1Cl W8461 [0,2,0,0,0,0|2,0,0]=4 538 B9R1.69 NC1=CC(Cl)=CN=C1O Z9125 [0,2,0,0,0,0|2,0,0]=4 539 B9R1.69 NC1=CC(Cl)=NC=C1Cl 5486AB [0,2,0,0,0,0|2,0,0]=4 540 B9R1.69 NC1=CC(Cl)=NC=C1F W9243 [0,2,0,0,0,0|2,0,0]=4 541 B9R1.69 NC1=CC(Cl)=NC=C1O 6651AA [0,2,0,0,0,0|2,0,0]=4 542 B9R1.69 NC1=CC(F)=NC=C1F 1403AJ [0,2,0,0,0,0|2,0,0]=4 543 B9R1.69 NC1=CC(N)=NC=C1Br X9409 [0,2,0,0,0,0|2,0,0]=4 544 B9R1.69 NC1=CC=C(F)C(N)=N1 Z5416 [0,2,0,0,0,0|2,0,0]=4 545 B9R1.69 NC1=CC=C(F)C(O)=C1 0161AA [0,2,0,0,0,0|1,0,0]=3 546 B9R1.69 NC1=CC=C(I)N=C1Cl Z6600 [0,2,0,0,0,0|2,0,0]=4 547 B9R1.69 NC1=CC=C(N)C(Cl)=C1 7668AF [0,2,0,0,0,0|1,0,0]=3 548 B9R1.69 NC1=CC=C(N)C(Cl)=C1 S621 [0,2,0,0,0,0|1,0,0]=3 549 B9R1.69 NC1=CC=C(O)C(I)=C1 4851AC [0,2,0,0,0,0|1,0,0]=3 550 B9R1.69 NC1=CN=C(Cl)C(F)=C1 4835AA [0,2,0,0,0,0|2,0,0]=4 551 B9R1.69 NC1=CN=C(Cl)C(N)=C1 5029AH [0,2,0,0,0,0|2,0,0]=4 552 B9R1.69 NC1=CN=C(N)C=C1N 1532AB [0,2,0,0,0,0|2,0,0]=4 553 B9R1.69 NC1=NC(F)=C(I)C=C1 4144AC [0,2,0,0,0,0|2,0,0]=4 554 B9R1.69 NC1=NC(I)=C(Br)C=C1 4251AA [0,2,0,0,0,0|2,0,0]=4 555 B9R1.69 NC1=NC=C(Br)C(F)=C1 3049AA [0,2,0,0,0,0|2,0,0]=4 556 B9R1.69 NC1=NC=C(Br)C(F)=C1 Z5379 [0,2,0,0,0,0|2,0,0]=4 557 B9R1.69 NC1=NC=C(I)C(Br)=C1 Z3941 [0,2,0,0,0,0|2,0,0]=4 558 B9R1.69 NC1=NC=C(I)C=C1I Z2484 [0,2,0,0,0,0|2,0,0]=4 559 B9R1.69 O=C1NC(Cl)=CC=C1Br 3079AC [0,2,0,0,0,0|2,0,0]=4 560 B9R1.69 O=C1NC=C(I)C=C1Br 9745AB [0,2,0,0,0,0|2,0,0]=4 561 B9R1.69 OC1=C(Cl)C=C(Cl)N=C1 X9390 [0,2,0,0,0,0|2,0,0]=4 562 B9R1.69 OC1=C(I)C=C(I)C=N1 6239AA [0,2,0,0,0,0|2,0,0]=4 563 B9R1.69 OC1=CC(Br)=C(F)C=N1 4133AC [0,2,0,0,0,0|2,0,0]=4 564 B9R1.69 OC1=CC(Br)=NC=C1Br Y3562 [0,2,0,0,0,0|2,0,0]=4 565 B9R1.69 OC1=CC(Cl)=CN=C1Cl 5073AE [0,2,0,0,0,0|2,0,0]=4 566 B9R1.69 OC1=CC(Cl)=CN=C1F X8506 [0,2,0,0,0,0|2,0,0]=4 567 B9R1.69 OC1=CC(F)=CC=C1I 3213AJ [0,2,0,0,0,0|1,0,0]=3 568 B9R1.69 OC1=CC=C(Br)N=C1Cl V6405 [0,2,0,0,0,0|2,0,0]=4 569 B9R1.69 OC1=CC=C(Br)N=C1F Z0880 [0,2,0,0,0,0|2,0,0]=4 570 B9R1.69 OC1=CC=C(Cl)C(I)=C1 0406AB [0,2,0,0,0,0|1,0,0]=3 571 B9R1.69 OC1=CC=C(Cl)N=C1Br Z6487 [0,2,0,0,0,0|2,0,0]=4 572 B9R1.69 OC1=CC=C(Cl)N=C1Cl Z0663 [0,2,0,0,0,0|2,0,0]=4 573 B9R1.69 OC1=CC=C(I)C(F)=N1 4145AC [0,2,0,0,0,0|2,0,0]=4 574 B9R1.69 OC1=CC=C(I)N=C1I 4532AD [0,2,0,0,0,0|2,0,0]=4 575 B9R1.69 OC1=CC=C(O)C(F)=C1 V2384 [0,2,0,0,0,0|1,0,0]=3 576 B9R1.69 OC1=NC(Br)=C(Br)C=C1 V2516 [0,2,0,0,0,0|2,0,0]=4 577 B9R1.69 OC1=NC(Cl)=C(Br)C=C1 Z8661 [0,2,0,0,0,0|2,0,0]=4 578 B9R1.69 SC1=C(Cl)C=CC(Br)=C1 Y1709 [0,2,0,0,0,0|1,0,0]=3 579 B9R1.69 [O-][N+]1=C(Br)C=CC(F)=C1 5881AC [0,2,0,0,0,0|2,0,0]=4 580 B9R1.69 [O-][N+]1=C(Cl)C=CC(F)=C1 5485AB [0,2,0,0,0,0|2,0,0]=4 581 B9R1.69 [O-][N+]1=CC(Br)=CC=C1Cl 4669AC [0,2,0,0,0,0|2,0,0]=4 582 B9R1.69 [O-][N+]1=CC=C(Cl)C(Br)=C1 7007AC [0,2,0,0,0,0|2,0,0]=4 583 B9R1.3 BrC1=CC=CC(Br)=C1Br Z3405 [0,2,0,0,0,0|1,0,0]=3 584 B9R1.3 CC1=C(Br)C(F)=NC=C1 W9077 [0,2,0,0,0,0|1,0,0]=3 585 B9R1.3 CC1=C(Br)C=CN=C1N 4350AA [0,2,0,0,0,0|1,0,0]=3 586 B9R1.3 CC1=C(Br)C=NC=C1Cl 4926AA [0,2,0,0,0,0|1,0,0]=3 587 B9R1.3 CC1=C(Br)C=NC=C1I Y3949 [0,2,0,0,0,0|1,0,0]=3 588 B9R1.3 CC1=C(C)C(O)=NC=N1 4262AB [0,2,0,0,0,0|2,0,0]=4 589 B9R1.3 CC1=C(Cl)C=CN=C1N 4354AA [0,2,0,0,0,0|1,0,0]=3 590 B9R1.3 CC1=C(F)N=CN=C1F 9568AA [0,2,0,0,0,0|2,0,0]=4 591 B9R1.3 CC1=C(I)C(N)=NC=C1 4335AA [0,2,0,0,0,0|1,0,0]=3 592 B9R1.3 CC1=C(I)C(N)=NC=N1 2862AC [0,2,0,0,0,0|2,0,0]=4 593 B9R1.3 CC1=C(N)C(I)=CC=C1 2097AL [0,2,0,0,0,0|0,0,0]=2 594 B9R1.3 CC1=C(N)N=CN=C1F 9569AA [0,2,0,0,0,0|2,0,0]=4 595 B9R1.3 CC1=C(O)N=CNC1=O 7145AE [0,2,0,0,0,0|2,0,0]=4 596 B9R1.3 CC1=CC=CC(I)=C1F X4532 [0,2,0,0,0,0|0,0,0]=2 597 B9R1.3 CC1=CC=C[N+]([O-])=C1Br Z4350 [0,2,0,0,0,0|1,0,0]=3 598 B9R1.3 CC1=CC=NC(Br)=C1I 4122AC [0,2,0,0,0,0|1,0,0]=3 599 B9R1.3 CC1=CN=CC(N)=C1N Y7493 [0,2,0,0,0,0|1,0,0]=3 600 B9R1.3 CC1=NC=CC(Cl)=C1F 3345AA [0,2,0,0,0,0|1,0,0]=3 601 B9R1.3 CC1=NC=CC(O)=C1O 2121AL [0,2,0,0,0,0|1,0,0]=3 602 B9R1.3 CC1=NC=NC(C)=C1N W9342 [0,2,0,0,0,0|2,0,0]=4 603 B9R1.3 CC1=NC=NC(C)=C1O 0901AC [0,2,0,0,0,0|2,0,0]=4 604 B9R1.3 CC1=NC=NC(Cl)=C1F Z2850 [0,2,0,0,0,0|2,0,0]=4 605 B9R1.3 CC1=NC=NC(N)=C1Br W8411 [0,2,0,0,0,0|2,0,0]=4 606 B9R1.3 CC1=NC=NC(O)=C1Br W5595 [0,2,0,0,0,0|2,0,0]=4 607 B9R1.3 CC1=NC=NC(O)=C1I Y5104 [0,2,0,0,0,0|2,0,0]=4 608 B9R1.3 CN1C(=O)C=CC=C1Cl 8859AA [0,2,0,0,0,0|1,0,0]=3 609 B9R1.3 ClC1=CN=CC(Cl)=C1Br Y8799 [0,2,0,0,0,0|2,0,0]=4 610 B9R1.3 ClC1=NC=CC(Br)=C1Cl Z6497 [0,2,0,0,0,0|2,0,0]=4 611 B9R1.3 ClC1=NC=CC(Br)=C1I Z1092 [0,2,0,0,0,0|2,0,0]=4 612 B9R1.3 FC1=C(Cl)C=CN=C1Cl Z4967 [0,2,0,0,0,0|2,0,0]=4 613 B9R1.3 FC1=CC=CC(F)=C1Cl W5913 [0,2,0,0,0,0|1,0,0]=3 614 B9R1.3 FC1=CN=CC(Br)=C1Br X9659 [0,2,0,0,0,0|2,0,0]=4 615 B9R1.3 FC1=CN=CC(F)=C1Br Y7015 [0,2,0,0,0,0|2,0,0]=4 616 B9R1.3 FC1=NC=CC(F)=C1Br 4334AA [0,2,0,0,0,0|2,0,0]=4 617 B9R1.3 FC1=NC=CC(F)=C1Cl 3162AC [0,2,0,0,0,0|2,0,0]=4 618 B9R1.3 F[N+]1=C(Cl)C=CC=C1Cl 4859AL [0,2,0,0,0,0|2,0,0]=4 619 B9R1.3 NC1=C(Br)C(O)=NC=C1 1600AA [0,2,0,0,0,0|2,0,0]=4 620 B9R1.3 NC1=C(Br)C=CC=C1O X9168 [0,2,0,0,0,0|1,0,0]=3 621 B9R1.3 NC1=C(Br)N=CC=C1Br 0593AA [0,2,0,0,0,0|2,0,0]=4 622 B9R1.3 NC1=C(Cl)C(Cl)=CN=C1 Z5291 [0,2,0,0,0,0|2,0,0]=4 623 B9R1.3 NC1=C(I)C=CC=C1O X6266 [0,2,0,0,0,0|1,0,0]=3 624 B9R1.3 NC1=C(I)C=NC=C1Br 2621AL [0,2,0,0,0,0|2,0,0]=4 625 B9R1.3 NC1=C(I)C=NC=C1I Y4881 [0,2,0,0,0,0|2,0,0]=4 626 B9R1.3 NC1=C(N)C(Cl)=CN=C1 X5162 [0,2,0,0,0,0|2,0,0]=4 627 B9R1.3 NC1=C(N)C(O)=NC=C1 3944AB [0,2,0,0,0,0|2,0,0]=4 628 B9R1.3 NC1=C(O)C(Br)=CN=C1 Z3801 [0,2,0,0,0,0|2,0,0]=4 629 B9R1.3 NC1=C(O)C=CC=C1Br 1489AJ [0,2,0,0,0,0|1,0,0]=3 630 B9R1.3 NC1=C(O)C=CN=C1O 8039AJ [0,2,0,0,0,0|2,0,0]=4 631 B9R1.3 NC1=CC=CC(N)=C1N 9096AB [0,2,0,0,0,0|1,0,0]=3 632 B9R1.3 NC1=CC=NC(Cl)=C1Cl 6191AD [0,2,0,0,0,0|2,0,0]=4 633 B9R1.3 NC1=CN=CC(N)=C1N Y9631 [0,2,0,0,0,0|2,0,0]=4 634 B9R1.3 NC1=NC=CC(Cl)=C1Br 1220AB [0,2,0,0,0,0|2,0,0]=4 635 B9R1.3 NC1=NC=CC(Cl)=C1N Y8419 [0,2,0,0,0,0|2,0,0]=4 636 B9R1.3 NC1=NC=CC(Cl)=C1O 0180AA [0,2,0,0,0,0|2,0,0]=4 637 B9R1.3 NC1=NC=CC(F)=C1Br 6904AA [0,2,0,0,0,0|2,0,0]=4 638 B9R1.3 OC1=C(Br)C(Cl)=NC=C1 Y3817 [0,2,0,0,0,0|2,0,0]=4 639 B9R1.3 OC1=C(Cl)C(Cl)=NC=C1 Y3750 [0,2,0,0,0,0|2,0,0]=4 640 B9R1.3 OC1=C(Cl)C(I)=CC=C1 0239AC [0,2,0,0,0,0|1,0,0]=3 641 B9R1.3 OC1=C(Cl)C=CC=C1I 2743AB [0,2,0,0,0,0|1,0,0]=3 642 B9R1.3 OC1=C(Cl)C=CN=C1Cl 5477AB [0,2,0,0,0,0|2,0,0]=4 643 B9R1.3 OC1=C(F)C(Cl)=NC=C1 Y3760 [0,2,0,0,0,0|2,0,0]=4 644 B9R1.3 OC1=C(F)C(F)=NC=C1 4347AA [0,2,0,0,0,0|2,0,0]=4 645 B9R1.3 OC1=C(O)C(I)=CC=C1 0017AB [0,2,0,0,0,0|1,0,0]=3 646 B9R1.3 [O-][N+]1=CC=CC(O)=C1Br 3175AA [0,2,0,0,0,0|2,0,0]=4 647 B9R1.34 CC1=CC(=O)C=C(O)O1 0884AC [0,2,0,0,0,0|1,0,0]=3 648 B9R1.34 CC1=CC(=O)OC(C)=C1 1366AQ [0,2,0,0,0,0|1,0,0]=3 649 B9R1.34 CC1=CC(Br)=CC(N)=C1 Y4844 [0,2,0,0,0,0|0,0,0]=2 650 B9R1.34 CC1=CC(Br)=CC(N)=N1 7408AB [0,2,0,0,0,0|1,0,0]=3 651 B9R1.34 CC1=CC(Br)=NC(F)=C1 V3898 [0,2,0,0,0,0|1,0,0]=3 652 B9R1.34 CC1=CC(C)=NC(I)=N1 5427AD [0,2,0,0,0,0|2,0,0]=4 653 B9R1.34 CC1=CC(I)=CC(Br)=C1 Z7791 [0,2,0,0,0,0|0,0,0]=2 654 B9R1.34 CC1=CC(N)=NC(N)=N1 Z4305 [0,2,0,0,0,0|2,0,0]=4 655 B9R1.34 CC1=CC(N)=NC(S)=N1 Z2808 [0,2,0,0,0,0|2,0,0]=4 656 B9R1.34 CC1=NC(Cl)=CC(Br)=C1 Z8243 [0,2,0,0,0,0|1,0,0]=3 657 B9R1.34 CC1=NC(N)=NC(S)=C1 Z2491 [0,2,0,0,0,0|2,0,0]=4 658 B9R1.34 ClC1=CC(Br)=NC(Br)=C1 Z8107 [0,2,0,0,0,0|2,0,0]=4 659 B9R1.34 NC1=CC(Br)=CC(Br)=C1 V4004 [0,2,0,0,0,0|1,0,0]=3 660 B9R1.34 NC1=CC(Cl)=CC(Br)=N1 3462AJ [0,2,0,0,0,0|2,0,0]=4 661 B9R1.34 NC1=CC(Cl)=CC(Cl)=N1 3158AA [0,2,0,0,0,0|2,0,0]=4 662 B9R1.34 NC1=CC(Cl)=CC(N)=N1 Z2866 [0,2,0,0,0,0|2,0,0]=4 663 B9R1.34 NC1=CC(F)=NC(F)=C1 9692AB [0,2,0,0,0,0|2,0,0]=4 664 B9R1.34 SC1=CC(S)=CC(Br)=C1 6757AL [0,2,0,0,0,0|1,0,0]=3 665 B9R1.34 SC1=CC(S)=CC(S)=C1 4486AL [0,2,0,0,0,0|1,0,0]=3 666 B9R1.34 [O-][N+]1=CC(Br)=CC(F)=C1 Z8596 [0,2,0,0,0,0|2,0,0]=4 667 B9R1.34 [O-][N+]1=CC(Cl)=CC(F)=C1 Z8601 [0,2,0,0,0,0|2,0,0]=4 668 B9R1.34 [O-][N+]1=CC(F)=CC(F)=C1 V4295 [0,2,0,0,0,0|2,0,0]=4 669 B7R1.24 C1=CC=C[CH+]C=C1 9390AL [0,0,1,1,0,0|0,0,1]=3 670 B5R1.1 C1=CSN=C1 Z4550 [1,0,0,0,1,0|2,0,0]=4