0 B7R1.3 BrC1=CC=NC=C1 RT15209 [0,0,0,0,0,0|1,0,0]=1 1 B7R1.3 BrC1=CC=NN=C1 LT0310 [0,0,0,0,0,0|2,0,0]=2 2 B7R1.3 BrC1=CC=NN=C1 RT8678 [0,0,0,0,0,0|2,0,0]=2 3 B7R1.3 BrC1=CN=CC=C1 LT6741 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.3 BrC1=NC=CC=C1 LT3801 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.3 BrC1=NC=CC=N1 LT6078 [0,0,0,0,0,0|4,0,0]=4 6 B7R1.3 BrC1=[15N]C=CC=C1 RT8856 [0,0,0,0,0,0|3,0,0]=3 7 B7R1.3 CC1=CC=NC=C1 RT15144 [0,0,0,0,0,0|1,0,0]=1 8 B7R1.3 CC1=CCC=CC1 LQ2664 [0,0,0,0,0,0|2,0,2]=4 9 B7R1.3 CC1=CN=CC=C1 JZ1098 [0,0,0,0,0,0|3,0,0]=3 10 B7R1.3 CC1=CN=CN=C1 XJ2026 [0,0,0,0,0,0|4,0,0]=4 11 B7R1.3 CC1=NC=CC=C1 JZ2441 [0,0,0,0,0,0|3,0,0]=3 12 B7R1.3 CC1=NC=CC=C1 JZ4543 [0,0,0,0,0,0|3,0,0]=3 13 B7R1.3 ClC1=CC=CN=C1 LT6769 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.3 ClC1=CC=CN=N1 XJ1615 [0,0,0,0,0,0|4,0,0]=4 15 B7R1.3 ClC1=CC=NC=C1 LT2787 [0,0,0,0,0,0|1,0,0]=1 16 B7R1.3 ClC1=CC=NC=C1 YH10789 [0,0,0,0,0,0|1,0,0]=1 17 B7R1.3 ClC1=CC=NC=N1 XJ4352 [0,0,0,0,0,0|2,0,0]=2 18 B7R1.3 ClC1=CC=NC=N1 YH41122 [0,0,0,0,0,0|2,0,0]=2 19 B7R1.3 ClC1=CC=NN=C1 YH39647 [0,0,0,0,0,0|2,0,0]=2 20 B7R1.3 ClC1=CN=CC=N1 LT6518 [0,0,0,0,0,0|4,0,0]=4 21 B7R1.3 ClC1=NC=CC=C1 JZ1022 [0,0,0,0,0,0|3,0,0]=3 22 B7R1.3 ClC1=NC=CC=N1 LT6519 [0,0,0,0,0,0|4,0,0]=4 23 B7R1.3 Cl[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 RT11347 [0,0,0,0,0,0|2,0,0]=2 24 B7R1.3 FC1=CC=CC=N1 LT6551 [0,0,0,0,0,0|3,0,0]=3 25 B7R1.3 FC1=CC=NC=C1 LQ1346 [0,0,0,0,0,0|1,0,0]=1 26 B7R1.3 FC1=CC=NC=C1 LX2788 [0,0,0,0,0,0|1,0,0]=1 27 B7R1.3 FC1=CN=CC=C1 LT2946 [0,0,0,0,0,0|3,0,0]=3 28 B7R1.3 FC1=CN=CN=C1 HL0332 [0,0,0,0,0,0|4,0,0]=4 29 B7R1.3 IC1=CC=CC=C1 HL0102 [0,0,0,0,0,0|2,0,0]=2 30 B7R1.3 IC1=CC=CC=N1 HL2853 [0,0,0,0,0,0|3,0,0]=3 31 B7R1.3 IC1=CC=CN=C1 XJ1614 [0,0,0,0,0,0|3,0,0]=3 32 B7R1.3 IC1=CC=NC=C1 YH37425 [0,0,0,0,0,0|1,0,0]=1 33 B7R1.3 NC1=CC=CC=C1 XJ0949 [0,0,0,0,0,0|1,0,0]=1 34 B7R1.3 NC1=CC=CN=C1 LT6719 [0,0,0,0,0,0|2,0,0]=2 35 B7R1.3 NC1=CC=NC=C1 CJ2909 [0,0,0,0,0,0|0,0,0]=0 36 B7R1.3 NC1=CC=NN=C1 XJ4576 [0,0,0,0,0,0|1,0,0]=1 37 B7R1.3 NC1=NC=CC=C1 LT1809 [0,0,0,0,0,0|2,0,0]=2 38 B7R1.3 NC1=NC=CC=N1 LT0280 [0,0,0,0,0,0|3,0,0]=3 39 B7R1.3 NC1=NC=NC=C1 LX2446 [0,0,0,0,0,0|1,0,0]=1 40 B7R1.3 NC1=NN=CC=C1 YH93684 [0,0,0,0,0,0|3,0,0]=3 41 B7R1.3 O=C1C=CC=NN1 XJ0875 [0,0,0,0,0,0|4,0,0]=4 42 B7R1.3 O=C1C=CCCN1 RT4551 [0,0,0,0,0,0|3,0,1]=4 43 B7R1.3 O=C1C=CN=CN1 HL2797 [0,0,0,0,0,0|2,0,0]=2 44 B7R1.3 O=C1N=CC=CN1 LT6561 [0,0,0,0,0,0|4,0,0]=4 45 B7R1.3 OC1=CC=CC=C1 HL1861 [0,0,0,0,0,0|2,0,0]=2 46 B7R1.3 OC1=CC=CN=C1 LT6810 [0,0,0,0,0,0|3,0,0]=3 47 B7R1.3 OC1=CC=NC=C1 JZ0797 [0,0,0,0,0,0|1,0,0]=1 48 B7R1.3 OC1=CC=NN=C1 YH45348 [0,0,0,0,0,0|2,0,0]=2 49 B7R1.3 OC1=CN=CN=C1 M0300483 [0,0,0,0,0,0|4,0,0]=4 50 B7R1.3 OC1=NC=CC=C1 LT1595 [0,0,0,0,0,0|3,0,0]=3 51 B7R1.3 OC1=NC=CC=N1 LQ1019 [0,0,0,0,0,0|4,0,0]=4 52 B7R1.3 OC1=NC=NC=C1 YH04928 [0,0,0,0,0,0|2,0,0]=2 53 B7R1.3 S=C1C=CC=CN1 JZ2104 [0,0,0,0,0,0|3,0,0]=3 54 B7R1.3 S=C1C=CNC=N1 XJ1784 [0,0,0,0,0,0|2,0,1]=3 55 B7R1.3 SC1=CC=CN=C1 YH37913 [0,0,0,0,0,0|3,0,0]=3 56 B7R1.3 SC1=CC=NC=C1 HL2794 [0,0,0,0,0,0|1,0,0]=1 57 B7R1.3 SC1=NC=CC=C1 LT1808 [0,0,0,0,0,0|3,0,0]=3 58 B7R1.3 SC1=NC=CC=N1 YH35007 [0,0,0,0,0,0|4,0,0]=4 59 B7R1.3 SC1=NC=CN=C1 LQ4963 [0,0,0,0,0,0|4,0,0]=4 60 B7R1.3 [15NH2]C1=NC=CC=C1 RT2238 [0,0,0,0,0,0|2,0,0]=2 61 B7R1.3 [Hg+]C1=CC=CC=C1 HL1275 [0,0,0,0,0,0|2,0,0]=2 62 B7R1.3 [Hg+]C1=CC=CC=C1 LQ0034 [0,0,0,0,0,0|2,0,0]=2 63 B7R1.3 [Li]C1=CC=CC=C1 HL0103 [0,0,0,0,0,0|2,0,0]=2 64 B7R1.3 [O-]C1=CC=CC=C1 LQ3910 [0,0,0,0,0,0|2,0,0]=2 65 B7R1.3 [O-][N+]1=CC=CC=C1 YH14354 [0,0,0,0,0,0|3,0,0]=3 66 B7R1.3 [O-][N+]1=NC=CC=C1 HL0827 [0,0,0,0,0,0|4,0,0]=4 67 B7R1.3 [SH2+]C1=CC=CC=C1 RT12088 [0,0,0,0,0,0|2,0,0]=2 68 B6R1.1 C1=CC=CC=C1 HL3217 [1,0,0,0,0,0|1,0,0]=2 69 B6R1.1 C1=CC=CC=C1 LQ3491 [1,0,0,0,0,0|1,0,0]=2 70 B6R1.1 C1=CC=CC=C1 XJ1693 [1,0,0,0,0,0|1,0,0]=2 71 B6R1.1 C1=CC=CC=C1 XJ5683 [1,0,0,0,0,0|1,0,0]=2 72 B6R1.1 C1=CC=NC=C1 JZ1746 [1,0,0,0,0,0|0,0,0]=1 73 B6R1.1 C1=CC=NC=C1 JZ1747 [1,0,0,0,0,0|0,0,0]=1 74 B6R1.1 C1=CC=NC=C1 XJ5983 [1,0,0,0,0,0|0,0,0]=1 75 B6R1.1 C1=CCCC=C1 HL0121 [1,0,0,0,0,0|1,0,1]=3 76 B6R1.1 C1=CCCC=C1 LQ3529 [1,0,0,0,0,0|1,0,1]=3 77 B6R1.1 C1=NC=NC=N1 LL0629 [1,0,0,0,0,0|2,0,0]=3 78 B6R1.1 [13CH]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 RT11277 [1,0,0,0,0,0|1,0,0]=2 79 B8R1.2 BrCC1=CC=CC=C1 JZ1264 [0,1,0,0,0,0|2,0,0]=3 80 B8R1.2 BrCC1=CC=CN=C1 YH03265 [0,1,0,0,0,0|3,0,0]=4 81 B8R1.2 BrCC1=CC=CN=C1 YH65568 [0,1,0,0,0,0|3,0,0]=4 82 B8R1.2 BrCC1=NC=CC=C1 LQ4674 [0,1,0,0,0,0|3,0,0]=4 83 B8R1.2 Br[Mg]C1=CC=CC=C1 HL1276 [0,1,0,0,0,0|2,0,0]=3 84 B8R1.2 C#CC1=CC=NC=C1 YH65004 [0,1,0,0,0,0|1,0,0]=2 85 B8R1.2 C#CC1=NC=CC=C1 JZ1801 [0,1,0,0,0,0|3,0,0]=4 86 B8R1.2 C=CC1=CC=CC=C1 XJ3473 [0,1,0,0,0,0|2,0,0]=3 87 B8R1.2 C=CC1=CC=CN=C1 RT7678 [0,1,0,0,0,0|3,0,0]=4 88 B8R1.2 CCC1=CC=CN=C1 JZ1084 [0,1,0,0,0,0|3,0,0]=4 89 B8R1.2 CCC1=CC=NC=C1 LL0974 [0,1,0,0,0,0|1,0,0]=2 90 B8R1.2 CNC1=CC=CN=C1 LT2493 [0,1,0,0,0,0|2,0,0]=3 91 B8R1.2 CNC1=CC=NC=C1 LT6892 [0,1,0,0,0,0|0,0,0]=1 92 B8R1.2 COC1=CC=CN=C1 LT6817 [0,1,0,0,0,0|3,0,0]=4 93 B8R1.2 COC1=NC=CC=C1 LT2109 [0,1,0,0,0,0|3,0,0]=4 94 B8R1.2 CSC1=NC=CC=C1 LT2167 [0,1,0,0,0,0|3,0,0]=4 95 B8R1.2 ClCC1=CC=CC=C1 HL1268 [0,1,0,0,0,0|2,0,0]=3 96 B8R1.2 ClCC1=CC=CC=N1 JZ2503 [0,1,0,0,0,0|3,0,0]=4 97 B8R1.2 ClCC1=CC=CN=C1 JZ0781 [0,1,0,0,0,0|3,0,0]=4 98 B8R1.2 ClCC1=CC=CN=C1 YH53620 [0,1,0,0,0,0|3,0,0]=4 99 B8R1.2 ClCC1=NC=CC=C1 JZ0742 [0,1,0,0,0,0|3,0,0]=4 100 B8R1.2 ClCC1=NC=CC=C1 LT2316 [0,1,0,0,0,0|3,0,0]=4 101 B8R1.2 N#CC1=CC=CC=C1 JZ4954 [0,1,0,0,0,0|1,0,1]=3 102 B8R1.2 N#CC1=CC=CC=C1 XJ4015 [0,1,0,0,0,0|1,0,1]=3 103 B8R1.2 N#CC1=CC=CN=C1 LT3052 [0,1,0,0,0,0|2,0,1]=4 104 B8R1.2 N#CC1=CC=NC=C1 JZ0789 [0,1,0,0,0,0|0,0,1]=2 105 B8R1.2 N#CC1=NC=CC=C1 JZ0735 [0,1,0,0,0,0|2,0,1]=4 106 B8R1.2 NCC1=CC=CC=C1 LQ1371 [0,1,0,0,0,0|1,0,0]=2 107 B8R1.2 NCC1=CC=CN=C1 RT2311 [0,1,0,0,0,0|2,0,0]=3 108 B8R1.2 NCC1=CC=NC=C1 LL1070 [0,1,0,0,0,0|0,0,0]=1 109 B8R1.2 NCC1=CC=NC=C1 RT10176 [0,1,0,0,0,0|0,0,0]=1 110 B8R1.2 NCC1=NC=CC=C1 HL2591 [0,1,0,0,0,0|2,0,0]=3 111 B8R1.2 NCC1=NC=CC=N1 YH17523 [0,1,0,0,0,0|3,0,0]=4 112 B8R1.2 NCC1=NC=CN=C1 YH58835 [0,1,0,0,0,0|3,0,0]=4 113 B8R1.2 NNC1=CC=CC=C1 HL1279 [0,1,0,0,0,0|1,0,0]=2 114 B8R1.2 NNC1=CC=CC=C1 JZ5772 [0,1,0,0,0,0|1,0,0]=2 115 B8R1.2 NNC1=CC=CN=C1 YH00904 [0,1,0,0,0,0|2,0,0]=3 116 B8R1.2 NNC1=CC=CN=C1 YH12082 [0,1,0,0,0,0|2,0,0]=3 117 B8R1.2 NNC1=CC=CN=C1 YH57193 [0,1,0,0,0,0|2,0,0]=3 118 B8R1.2 NNC1=NC=CN=C1 YH06483 [0,1,0,0,0,0|3,0,0]=4 119 B8R1.2 O=CC1=CC=CC=N1 JZ0732 [0,1,0,0,0,0|3,0,0]=4 120 B8R1.2 O=CC1=CC=CN=C1 RT10183 [0,1,0,0,0,0|3,0,0]=4 121 B8R1.2 O=CC1=NC=NC=C1 YH48930 [0,1,0,0,0,0|2,0,0]=3 122 B8R1.2 O=NC1=CC=CC=C1 YH08587 [0,1,0,0,0,0|1,0,1]=3 123 B8R1.2 O=[As]C1=CC=CC=C1 JZ4036 [0,1,0,0,0,0|1,1,0]=3 124 B8R1.2 OCC1=CC=CC=C1 HL1271 [0,1,0,0,0,0|2,0,0]=3 125 B8R1.2 OCC1=CC=CC=N1 LT2170 [0,1,0,0,0,0|3,0,0]=4 126 B8R1.2 OCC1=CN=CC=C1 HL1274 [0,1,0,0,0,0|3,0,0]=4 127 B8R1.2 OCC1=NC=NC=C1 YH55246 [0,1,0,0,0,0|2,0,0]=3 128 B8R1.2 O[Hg]C1=CC=CC=C1 LQ3360 [0,1,0,0,0,0|2,0,0]=3 129 B8R1.2 SCC1=CC=CC=C1 HL1273 [0,1,0,0,0,0|2,0,0]=3 130 B8R1.2 [C-]#CC1=CC=CC=C1 JZ3648 [0,1,0,0,0,0|2,0,0]=3 131 B8R1.2 [C-]#[N+]C1=CC=CC=C1 YH65599 [0,1,0,0,0,0|1,0,1]=3 132 B8R1.3 BrC1=CC=C(Br)C=C1 LT0052 [0,1,0,0,0,0|2,0,0]=3 133 B8R1.3 BrC1=CC=C(Br)N=C1 XJ1164 [0,1,0,0,0,0|3,0,0]=4 134 B8R1.3 BrC1=CC=C(I)C=C1 HL0068 [0,1,0,0,0,0|2,0,0]=3 135 B8R1.3 BrC1=CC=C(I)C=N1 HL4485 [0,1,0,0,0,0|3,0,0]=4 136 B8R1.3 BrC1=CN=C(Br)C=C1 LT3879 [0,1,0,0,0,0|3,0,0]=4 137 B8R1.3 CC1=CC=C(C)N=C1 JZ0986 [0,1,0,0,0,0|3,0,0]=4 138 B8R1.3 CC1=CC=C(Cl)C=C1 HL1310 [0,1,0,0,0,0|2,0,0]=3 139 B8R1.3 CC1=CC=C(F)C=C1 LL0677 [0,1,0,0,0,0|2,0,0]=3 140 B8R1.3 CC1=CC=C(F)C=N1 LQ4679 [0,1,0,0,0,0|3,0,0]=4 141 B8R1.3 CC1=CC=C(I)C=C1 XJ1165 [0,1,0,0,0,0|2,0,0]=3 142 B8R1.3 CC1=CC=C(N)C=C1 RT11917 [0,1,0,0,0,0|1,0,0]=2 143 B8R1.3 CC1=CC=C(N)C=C1 XJ0919 [0,1,0,0,0,0|1,0,0]=2 144 B8R1.3 CC1=CC=C(N)C=C1 XJ0920 [0,1,0,0,0,0|1,0,0]=2 145 B8R1.3 CC1=CC=C(O)C=N1 HL0641 [0,1,0,0,0,0|3,0,0]=4 146 B8R1.3 CC1=CC=C([Hg+])C=C1 RT11940 [0,1,0,0,0,0|2,0,0]=3 147 B8R1.3 CC1=CC=[N+]([O-])C=C1 HL0579 [0,1,0,0,0,0|1,0,1]=3 148 B8R1.3 CC1=CN=C(Cl)C=C1 YH41921 [0,1,0,0,0,0|3,0,0]=4 149 B8R1.3 CC1=CN=C(F)C=C1 LQ2150 [0,1,0,0,0,0|3,0,0]=4 150 B8R1.3 CC1=CN=C(N)C=C1 RT2045 [0,1,0,0,0,0|2,0,0]=3 151 B8R1.3 CC1=CN=C(N)C=N1 YH06780 [0,1,0,0,0,0|3,0,0]=4 152 B8R1.3 CC1=CN=C(O)C=C1 LT3568 [0,1,0,0,0,0|3,0,0]=4 153 B8R1.3 CC1=NC=C(Br)C=C1 JZ0784 [0,1,0,0,0,0|3,0,0]=4 154 B8R1.3 CC1=NC=C(I)C=C1 YH65880 [0,1,0,0,0,0|3,0,0]=4 155 B8R1.3 CC1=NC=C(N)C=C1 JZ1162 [0,1,0,0,0,0|2,0,0]=3 156 B8R1.3 CC1=NC=C(N)C=N1 YH59197 [0,1,0,0,0,0|3,0,0]=4 157 B8R1.3 CC1=NC=C(O)C=C1 YH65665 [0,1,0,0,0,0|3,0,0]=4 158 B8R1.3 CN1C=CC(=O)C=C1 RT6737 [0,1,0,0,0,0|1,0,1]=3 159 B8R1.3 ClC1=CC=C(Br)C=C1 XJ0365 [0,1,0,0,0,0|2,0,0]=3 160 B8R1.3 ClC1=CC=C(Cl)N=C1 XJ4241 [0,1,0,0,0,0|3,0,0]=4 161 B8R1.3 ClC1=CC=C(I)C=C1 JZ4051 [0,1,0,0,0,0|2,0,0]=3 162 B8R1.3 ClC1=CC=C(I)N=C1 HL3909 [0,1,0,0,0,0|3,0,0]=4 163 B8R1.3 ClC1=CN=C(Br)C=C1 LQ5037 [0,1,0,0,0,0|3,0,0]=4 164 B8R1.3 ClC1=NC=C(I)C=C1 LT3338 [0,1,0,0,0,0|3,0,0]=4 165 B8R1.3 FC1=CC=C(Br)C=C1 LT0069 [0,1,0,0,0,0|2,0,0]=3 166 B8R1.3 FC1=CC=C(Br)N=C1 LT1672 [0,1,0,0,0,0|3,0,0]=4 167 B8R1.3 FC1=CC=C(Cl)C=C1 LL0678 [0,1,0,0,0,0|2,0,0]=3 168 B8R1.3 FC1=CC=C(Cl)N=C1 LQ4702 [0,1,0,0,0,0|3,0,0]=4 169 B8R1.3 FC1=CC=C(I)C=C1 SY0222 [0,1,0,0,0,0|2,0,0]=3 170 B8R1.3 FC1=CN=C(I)C=C1 YH37653 [0,1,0,0,0,0|3,0,0]=4 171 B8R1.3 FC1=NC=C(Br)C=C1 XJ1359 [0,1,0,0,0,0|3,0,0]=4 172 B8R1.3 FC1=NC=C(Cl)C=C1 HL0871 [0,1,0,0,0,0|3,0,0]=4 173 B8R1.3 IC1=CC=C(I)C=C1 SY0265 [0,1,0,0,0,0|2,0,0]=3 174 B8R1.3 NC1=CC=C(Br)C=C1 HL1307 [0,1,0,0,0,0|1,0,0]=2 175 B8R1.3 NC1=CC=C(Br)C=N1 JZ1004 [0,1,0,0,0,0|2,0,0]=3 176 B8R1.3 NC1=CC=C(Cl)N=N1 LQ2924 [0,1,0,0,0,0|3,0,0]=4 177 B8R1.3 NC1=CC=C(F)C=C1 RT2771 [0,1,0,0,0,0|1,0,0]=2 178 B8R1.3 NC1=CC=C(I)C=C1 XJ0921 [0,1,0,0,0,0|1,0,0]=2 179 B8R1.3 NC1=CC=C(N)C=C1 LQ5353 [0,1,0,0,0,0|1,0,0]=2 180 B8R1.3 NC1=CC=C(N)C=C1 LT7264 [0,1,0,0,0,0|1,0,0]=2 181 B8R1.3 NC1=CC=C(N)C=C1 RT13509 [0,1,0,0,0,0|1,0,0]=2 182 B8R1.3 NC1=CC=C(O)C=C1 RT3071 [0,1,0,0,0,0|1,0,0]=2 183 B8R1.3 NC1=CC=C(O)C=N1 YH07059 [0,1,0,0,0,0|2,0,0]=3 184 B8R1.3 NC1=CC=C(S)C=C1 JZ4463 [0,1,0,0,0,0|1,0,0]=2 185 B8R1.3 NC1=CC=[N+]([O-])C=C1 RT1583 [0,1,0,0,0,0|0,0,1]=2 186 B8R1.3 NC1=CN=C(Br)C=C1 LQ3664 [0,1,0,0,0,0|2,0,0]=3 187 B8R1.3 NC1=CN=C(Cl)C=C1 LT3591 [0,1,0,0,0,0|2,0,0]=3 188 B8R1.3 NC1=CN=C(F)C=C1 HL2006 [0,1,0,0,0,0|2,0,0]=3 189 B8R1.3 NC1=CN=C(I)C=C1 XJ5029 [0,1,0,0,0,0|2,0,0]=3 190 B8R1.3 NC1=CN=C(N)C=C1 LT0141 [0,1,0,0,0,0|2,0,0]=3 191 B8R1.3 NC1=CN=C(N)C=C1 LT3284 [0,1,0,0,0,0|2,0,0]=3 192 B8R1.3 NC1=CN=C(O)C=C1 LT3510 [0,1,0,0,0,0|2,0,0]=3 193 B8R1.3 NC1=CN=C(O)C=C1 YH26818 [0,1,0,0,0,0|2,0,0]=3 194 B8R1.3 NC1=CN=C(O)C=C1 YH55281 [0,1,0,0,0,0|2,0,0]=3 195 B8R1.3 NC1=NC=C(Br)N=C1 RT2372 [0,1,0,0,0,0|3,0,0]=4 196 B8R1.3 NC1=NC=C(Cl)C=C1 LT3542 [0,1,0,0,0,0|2,0,0]=3 197 B8R1.3 NC1=NC=C(Cl)C=N1 HL2979 [0,1,0,0,0,0|3,0,0]=4 198 B8R1.3 NC1=NC=C(Cl)N=C1 YH55052 [0,1,0,0,0,0|3,0,0]=4 199 B8R1.3 NC1=NC=C(F)C=C1 LT3563 [0,1,0,0,0,0|2,0,0]=3 200 B8R1.3 NC1=NC=C(I)C=C1 LT1940 [0,1,0,0,0,0|2,0,0]=3 201 B8R1.3 NC1=NC=C(O)C=N1 LT5858 [0,1,0,0,0,0|3,0,0]=4 202 B8R1.3 O=C1C=CC(=O)C=C1 HL1314 [0,1,0,0,0,0|2,0,0]=3 203 B8R1.3 OC1=CC=C(Br)C=C1 HL1308 [0,1,0,0,0,0|2,0,0]=3 204 B8R1.3 OC1=CC=C(Br)C=N1 YH32505 [0,1,0,0,0,0|3,0,0]=4 205 B8R1.3 OC1=CC=C(I)C=C1 LT6103 [0,1,0,0,0,0|2,0,0]=3 206 B8R1.3 OC1=CC=C(I)C=C1 XJ0922 [0,1,0,0,0,0|2,0,0]=3 207 B8R1.3 OC1=CC=C(I)N=C1 RT14095 [0,1,0,0,0,0|3,0,0]=4 208 B8R1.3 OC1=CC=C(O)C=C1 JZ0106 [0,1,0,0,0,0|2,0,0]=3 209 B8R1.3 OC1=CN=C(Br)C=C1 RT15425 [0,1,0,0,0,0|3,0,0]=4 210 B8R1.3 OC1=CN=C(Cl)C=C1 LX2869 [0,1,0,0,0,0|3,0,0]=4 211 B8R1.3 OC1=CN=C(F)C=C1 LQ5323 [0,1,0,0,0,0|3,0,0]=4 212 B8R1.3 OC1=NC=C(Cl)C=C1 HL2729 [0,1,0,0,0,0|3,0,0]=4 213 B8R1.3 OC1=NC=C(F)C=C1 YH04459 [0,1,0,0,0,0|3,0,0]=4 214 B8R1.3 OC1=NC=C(I)C=C1 LT3565 [0,1,0,0,0,0|3,0,0]=4 215 B8R1.3 SC1=CC=C(Br)C=C1 HL1316 [0,1,0,0,0,0|2,0,0]=3 216 B8R1.3 [15NH2]C1=CC=C([15NH2])C=C1 RT3027 [0,1,0,0,0,0|1,0,0]=2 217 B8R1.3 [O-][N+]1=CC=C(Br)C=C1 RT9412 [0,1,0,0,0,0|1,0,1]=3 218 B8R1.3 [O-][N+]1=CC=[N+]([O-])C=C1 RT9236 [0,1,0,0,0,0|2,0,1]=4 219 B8R1.4 BrC1=CC(Br)=NC=C1 LQ5413 [0,1,0,0,0,0|1,0,0]=2 220 B8R1.4 BrC1=CC(Br)=NC=N1 YH57413 [0,1,0,0,0,0|2,0,0]=3 221 B8R1.4 BrC1=CC(I)=CC=C1 HL0095 [0,1,0,0,0,0|2,0,0]=3 222 B8R1.4 BrC1=CC=CC(Br)=C1 LQ0394 [0,1,0,0,0,0|2,0,0]=3 223 B8R1.4 BrC1=CC=CC(Br)=N1 LT0169 [0,1,0,0,0,0|3,0,0]=4 224 B8R1.4 BrC1=CC=NC(Br)=N1 LQ2525 [0,1,0,0,0,0|2,0,0]=3 225 B8R1.4 BrC1=CN=CC(Br)=C1 HL0210 [0,1,0,0,0,0|3,0,0]=4 226 B8R1.4 CC1=CC(Br)=NC=C1 JZ0770 [0,1,0,0,0,0|1,0,0]=2 227 B8R1.4 CC1=CC(C)=NC=C1 LT0137 [0,1,0,0,0,0|1,0,0]=2 228 B8R1.4 CC1=CC(Cl)=NC=N1 LQ2446 [0,1,0,0,0,0|2,0,0]=3 229 B8R1.4 CC1=CC(F)=CC=C1 YH56452 [0,1,0,0,0,0|2,0,0]=3 230 B8R1.4 CC1=CC(F)=NC=C1 HL1857 [0,1,0,0,0,0|1,0,0]=2 231 B8R1.4 CC1=CC(I)=CC=C1 SY0266 [0,1,0,0,0,0|2,0,0]=3 232 B8R1.4 CC1=CC(I)=NC=C1 XJ4661 [0,1,0,0,0,0|1,0,0]=2 233 B8R1.4 CC1=CC(N)=CN=C1 HL2566 [0,1,0,0,0,0|2,0,0]=3 234 B8R1.4 CC1=CC(N)=NC=C1 LT2288 [0,1,0,0,0,0|1,0,0]=2 235 B8R1.4 CC1=CC(N)=NC=C1 LT3916 [0,1,0,0,0,0|1,0,0]=2 236 B8R1.4 CC1=CC(O)=CC=C1 JZ0053 [0,1,0,0,0,0|2,0,0]=3 237 B8R1.4 CC1=CC(O)=CN=C1 LQ5076 [0,1,0,0,0,0|3,0,0]=4 238 B8R1.4 CC1=CC(S)=CC=C1 LQ0397 [0,1,0,0,0,0|2,0,0]=3 239 B8R1.4 CC1=CC(S)=NC=C1 YH41922 [0,1,0,0,0,0|1,0,0]=2 240 B8R1.4 CC1=CC=CC(Br)=N1 LT3715 [0,1,0,0,0,0|3,0,0]=4 241 B8R1.4 CC1=CC=CC(C)=N1 LT0202 [0,1,0,0,0,0|3,0,0]=4 242 B8R1.4 CC1=CC=CC(Cl)=N1 LT3934 [0,1,0,0,0,0|3,0,0]=4 243 B8R1.4 CC1=CC=CC(F)=N1 LQ0822 [0,1,0,0,0,0|3,0,0]=4 244 B8R1.4 CC1=CC=CC(O)=N1 XJ2432 [0,1,0,0,0,0|3,0,0]=4 245 B8R1.4 CC1=CC=NC(Br)=N1 YH31425 [0,1,0,0,0,0|2,0,0]=3 246 B8R1.4 CC1=CN=CC(Br)=C1 HL2565 [0,1,0,0,0,0|3,0,0]=4 247 B8R1.4 CC1=CN=CC(F)=C1 LQ0821 [0,1,0,0,0,0|3,0,0]=4 248 B8R1.4 CC1=CN=CC(N)=N1 JZ2741 [0,1,0,0,0,0|3,0,0]=4 249 B8R1.4 CC1=NC(Cl)=CC=C1 LT3343 [0,1,0,0,0,0|3,0,0]=4 250 B8R1.4 CC1=NC(Cl)=NC=C1 LT5821 [0,1,0,0,0,0|2,0,0]=3 251 B8R1.4 CC1=NC(N)=CC=C1 JZ0765 [0,1,0,0,0,0|2,0,0]=3 252 B8R1.4 CC1=NC(O)=NC=C1 XJ2871 [0,1,0,0,0,0|2,0,0]=3 253 B8R1.4 CC1=NC=CC(Br)=C1 XJ4664 [0,1,0,0,0,0|1,0,0]=2 254 B8R1.4 CC1=NC=CC(Br)=N1 YH24893 [0,1,0,0,0,0|2,0,0]=3 255 B8R1.4 CC1=NC=CC(Cl)=C1 XJ2546 [0,1,0,0,0,0|1,0,0]=2 256 B8R1.4 CC1=NC=CC(Cl)=C1 XJ5470 [0,1,0,0,0,0|1,0,0]=2 257 B8R1.4 CC1=NC=CC(N)=C1 LT3948 [0,1,0,0,0,0|0,0,0]=1 258 B8R1.4 CC1=NC=CC(N)=C1 LT5935 [0,1,0,0,0,0|0,0,0]=1 259 B8R1.4 CC1=NC=CC(O)=C1 LX2783 [0,1,0,0,0,0|1,0,0]=2 260 B8R1.4 CC1=NC=NC(Cl)=C1 LX3146 [0,1,0,0,0,0|2,0,0]=3 261 B8R1.4 C[N+]1=CC=CC(O)=C1 RT8366 [0,1,0,0,0,0|3,0,0]=4 262 B8R1.4 ClC1=CC(Br)=CC=C1 LT0066 [0,1,0,0,0,0|2,0,0]=3 263 B8R1.4 ClC1=CC(Br)=CC=N1 HL4510 [0,1,0,0,0,0|1,0,0]=2 264 B8R1.4 ClC1=CC(Br)=CN=C1 HL4511 [0,1,0,0,0,0|3,0,0]=4 265 B8R1.4 ClC1=CC(Cl)=NC=C1 LT3281 [0,1,0,0,0,0|1,0,0]=2 266 B8R1.4 ClC1=CC(Cl)=NC=N1 LT3099 [0,1,0,0,0,0|2,0,0]=3 267 B8R1.4 ClC1=CC(I)=CC=C1 HL0212 [0,1,0,0,0,0|2,0,0]=3 268 B8R1.4 ClC1=CC(I)=CN=C1 LT3806 [0,1,0,0,0,0|3,0,0]=4 269 B8R1.4 ClC1=CC=CC(Br)=N1 LQ2808 [0,1,0,0,0,0|3,0,0]=4 270 B8R1.4 ClC1=CC=CC(Cl)=C1 XJ0944 [0,1,0,0,0,0|2,0,0]=3 271 B8R1.4 ClC1=CC=CC(Cl)=N1 LT0182 [0,1,0,0,0,0|3,0,0]=4 272 B8R1.4 ClC1=CC=CC(I)=N1 LT3340 [0,1,0,0,0,0|3,0,0]=4 273 B8R1.4 ClC1=CC=NC(Br)=C1 LT3311 [0,1,0,0,0,0|1,0,0]=2 274 B8R1.4 ClC1=CN=CC(Cl)=C1 JZ0261 [0,1,0,0,0,0|3,0,0]=4 275 B8R1.4 ClC1=CN=NC(Cl)=C1 HL2014 [0,1,0,0,0,0|2,0,0]=3 276 B8R1.4 ClC1=NC(Cl)=NC=C1 RT7782 [0,1,0,0,0,0|2,0,0]=3 277 B8R1.4 ClC1=NC=NC(Cl)=N1 CJ3135 [0,1,0,0,0,0|3,0,0]=4 278 B8R1.4 FC1=CC(Br)=CC=N1 LQ5549 [0,1,0,0,0,0|1,0,0]=2 279 B8R1.4 FC1=CC=CC(Br)=C1 LT0067 [0,1,0,0,0,0|2,0,0]=3 280 B8R1.4 FC1=CC=CC(Cl)=N1 LT6505 [0,1,0,0,0,0|3,0,0]=4 281 B8R1.4 FC1=CC=CC(F)=C1 LT0047 [0,1,0,0,0,0|2,0,0]=3 282 B8R1.4 FC1=CC=CC(F)=N1 LT0188 [0,1,0,0,0,0|3,0,0]=4 283 B8R1.4 FC1=CC=NC(Br)=C1 LX2761 [0,1,0,0,0,0|1,0,0]=2 284 B8R1.4 FC1=CC=NC(Cl)=C1 XJ5215 [0,1,0,0,0,0|1,0,0]=2 285 B8R1.4 FC1=CC=NC(F)=C1 XJ5214 [0,1,0,0,0,0|1,0,0]=2 286 B8R1.4 FC1=CN=CC(Br)=C1 LQ0820 [0,1,0,0,0,0|3,0,0]=4 287 B8R1.4 FC1=CN=CC(Cl)=C1 LL2930 [0,1,0,0,0,0|3,0,0]=4 288 B8R1.4 FC1=CN=CC(F)=C1 YH15508 [0,1,0,0,0,0|3,0,0]=4 289 B8R1.4 FC1=NC(Br)=CC=C1 CJ2240 [0,1,0,0,0,0|3,0,0]=4 290 B8R1.4 FC1=NC=CC(I)=C1 XJ4662 [0,1,0,0,0,0|1,0,0]=2 291 B8R1.4 IC1=CC=CC(I)=C1 HL0213 [0,1,0,0,0,0|2,0,0]=3 292 B8R1.4 NC1=CC(=O)CCC1 LQ2849 [0,1,0,0,0,0|1,0,2]=4 293 B8R1.4 NC1=CC(Cl)=CC=C1 LT2571 [0,1,0,0,0,0|1,0,0]=2 294 B8R1.4 NC1=CC(Cl)=NC=C1 RT2041 [0,1,0,0,0,0|0,0,0]=1 295 B8R1.4 NC1=CC(Cl)=NC=N1 JZ2693 [0,1,0,0,0,0|1,0,0]=2 296 B8R1.4 NC1=CC(F)=CC=C1 LT6789 [0,1,0,0,0,0|1,0,0]=2 297 B8R1.4 NC1=CC(F)=NC=C1 LX2902 [0,1,0,0,0,0|0,0,0]=1 298 B8R1.4 NC1=CC(N)=NC=C1 HL1858 [0,1,0,0,0,0|0,0,0]=1 299 B8R1.4 NC1=CC(N)=NC=N1 SY0200 [0,1,0,0,0,0|1,0,0]=2 300 B8R1.4 NC1=CC(O)=CC=N1 LQ4780 [0,1,0,0,0,0|1,0,0]=2 301 B8R1.4 NC1=CC(O)=NC=C1 RT8637 [0,1,0,0,0,0|0,0,0]=1 302 B8R1.4 NC1=CC=CC(F)=C1 YH66691 [0,1,0,0,0,0|1,0,0]=2 303 B8R1.4 NC1=CC=CC(I)=C1 HL0214 [0,1,0,0,0,0|1,0,0]=2 304 B8R1.4 NC1=CC=CC(N)=C1 LT7493 [0,1,0,0,0,0|1,0,0]=2 305 B8R1.4 NC1=CC=CC(N)=N1 XJ0588 [0,1,0,0,0,0|2,0,0]=3 306 B8R1.4 NC1=CC=CC(S)=C1 LT6720 [0,1,0,0,0,0|1,0,0]=2 307 B8R1.4 NC1=CC=NC(Br)=C1 LT2715 [0,1,0,0,0,0|0,0,0]=1 308 B8R1.4 NC1=CC=NC(Cl)=N1 XJ3320 [0,1,0,0,0,0|1,0,0]=2 309 B8R1.4 NC1=CN=CC(Cl)=C1 YH47450 [0,1,0,0,0,0|2,0,0]=3 310 B8R1.4 NC1=CN=CC(F)=C1 HL3888 [0,1,0,0,0,0|2,0,0]=3 311 B8R1.4 NC1=CN=CC(N)=C1 LT5132 [0,1,0,0,0,0|2,0,0]=3 312 B8R1.4 NC1=NC(=O)NC=C1 LT7700 [0,1,0,0,0,0|1,0,1]=3 313 B8R1.4 NC1=NC(=O)NC=N1 RT16177 [0,1,0,0,0,0|2,0,1]=4 314 B8R1.4 NC1=NC(Br)=CC=C1 LT3588 [0,1,0,0,0,0|2,0,0]=3 315 B8R1.4 NC1=NC(Cl)=CC=C1 LQ5147 [0,1,0,0,0,0|2,0,0]=3 316 B8R1.4 NC1=NC(Cl)=CC=N1 LT6009 [0,1,0,0,0,0|2,0,0]=3 317 B8R1.4 NC1=NC(Cl)=CN=C1 RT2592 [0,1,0,0,0,0|3,0,0]=4 318 B8R1.4 NC1=NC(Cl)=NC=N1 RT4791 [0,1,0,0,0,0|2,0,0]=3 319 B8R1.4 NC1=NC(F)=CC=C1 XJ1826 [0,1,0,0,0,0|2,0,0]=3 320 B8R1.4 NC1=NC(N)=NC=C1 LQ0649 [0,1,0,0,0,0|1,0,0]=2 321 B8R1.4 NC1=NC(O)=CC=C1 LT0266 [0,1,0,0,0,0|2,0,0]=3 322 B8R1.4 NC1=NC(O)=CC=N1 JZ1002 [0,1,0,0,0,0|2,0,0]=3 323 B8R1.4 NC1=NC=CC(Br)=C1 LT4052 [0,1,0,0,0,0|1,0,0]=2 324 B8R1.4 NC1=NC=CC(Cl)=C1 LT3446 [0,1,0,0,0,0|1,0,0]=2 325 B8R1.4 NC1=NC=CC(F)=C1 YH65600 [0,1,0,0,0,0|1,0,0]=2 326 B8R1.4 NC1=NC=CC(I)=C1 YH06793 [0,1,0,0,0,0|1,0,0]=2 327 B8R1.4 NC1=NC=CC(O)=N1 LT0242 [0,1,0,0,0,0|2,0,0]=3 328 B8R1.4 NC1=NC=NC(O)=C1 JZ4469 [0,1,0,0,0,0|1,0,0]=2 329 B8R1.4 O=C1C=C(Cl)N=CC1 M0300599 [0,1,0,0,0,0|1,0,1]=3 330 B8R1.4 O=C1C=C(I)C=NN1 CJ2987 [0,1,0,0,0,0|2,0,1]=4 331 B8R1.4 O=C1C=C(S)NC=N1 JZ1204 [0,1,0,0,0,0|2,0,0]=3 332 B8R1.4 O=C1C=CC=C(O)N1 LT3245 [0,1,0,0,0,0|3,0,0]=4 333 B8R1.4 O=C1N=CNC(=O)N1 RT14465 [0,1,0,0,0,0|3,0,0]=4 334 B8R1.4 OC1=CC(Br)=NC=C1 XJ5246 [0,1,0,0,0,0|1,0,0]=2 335 B8R1.4 OC1=CC(Cl)=CN=C1 LL1342 [0,1,0,0,0,0|3,0,0]=4 336 B8R1.4 OC1=CC(F)=CC=C1 LT6796 [0,1,0,0,0,0|2,0,0]=3 337 B8R1.4 OC1=CC(F)=CN=C1 HL3875 [0,1,0,0,0,0|3,0,0]=4 338 B8R1.4 OC1=CC(F)=NC=C1 YH47375 [0,1,0,0,0,0|1,0,0]=2 339 B8R1.4 OC1=CC(I)=CC=C1 HL0215 [0,1,0,0,0,0|2,0,0]=3 340 B8R1.4 OC1=CC=CC(O)=C1 LQ4582 [0,1,0,0,0,0|2,0,0]=3 341 B8R1.4 OC1=CC=CC(O)=C1 RT12284 [0,1,0,0,0,0|2,0,0]=3 342 B8R1.4 OC1=CC=NC(O)=C1 HL0216 [0,1,0,0,0,0|1,0,0]=2 343 B8R1.4 OC1=CN=CC(Br)=C1 LL1343 [0,1,0,0,0,0|3,0,0]=4 344 B8R1.4 OC1=NC=CC(Br)=C1 XJ5245 [0,1,0,0,0,0|1,0,0]=2 345 B8R1.4 OC1=NC=CC(Br)=C1 YH57481 [0,1,0,0,0,0|1,0,0]=2 346 B8R1.4 OC1=NC=CC(Cl)=C1 LQ5067 [0,1,0,0,0,0|1,0,0]=2 347 B8R1.4 OC1=NC=CC(F)=C1 YH98386 [0,1,0,0,0,0|1,0,0]=2 348 B8R1.4 OC1=NC=NC(Cl)=C1 JZ1201 [0,1,0,0,0,0|2,0,0]=3 349 B8R1.4 SC1=CC=CC(Br)=C1 LQ3065 [0,1,0,0,0,0|2,0,0]=3 350 B8R1.4 SC1=CC=CC(Cl)=C1 LT6772 [0,1,0,0,0,0|2,0,0]=3 351 B8R1.4 SC1=CC=CC(S)=C1 HL0217 [0,1,0,0,0,0|2,0,0]=3 352 B8R1.4 [O-][N+]1=CC(Cl)=CC=C1 HL2029 [0,1,0,0,0,0|3,0,0]=4 353 B8R1.5 BrC1=CC=CC=C1I SY0258 [0,1,0,0,0,0|2,0,0]=3 354 B8R1.5 BrC1=CC=CN=C1Br LQ3662 [0,1,0,0,0,0|3,0,0]=4 355 B8R1.5 CC1=C(Br)C=CN=C1 XJ3543 [0,1,0,0,0,0|1,0,0]=2 356 B8R1.5 CC1=C(Br)C=NC=C1 JZ0795 [0,1,0,0,0,0|1,0,0]=2 357 B8R1.5 CC1=C(C)C=CC=C1 LQ0273 [0,1,0,0,0,0|2,0,0]=3 358 B8R1.5 CC1=C(C)C=NC=C1 XJ1007 [0,1,0,0,0,0|1,0,0]=2 359 B8R1.5 CC1=C(Cl)C=CN=C1 LQ1897 [0,1,0,0,0,0|1,0,0]=2 360 B8R1.5 CC1=C(Cl)C=CN=C1 XJ4531 [0,1,0,0,0,0|1,0,0]=2 361 B8R1.5 CC1=C(F)C=CC=C1 YH97940 [0,1,0,0,0,0|2,0,0]=3 362 B8R1.5 CC1=C(F)C=CC=N1 JZ5076 [0,1,0,0,0,0|3,0,0]=4 363 B8R1.5 CC1=C(F)C=NC=C1 YH59267 [0,1,0,0,0,0|1,0,0]=2 364 B8R1.5 CC1=C(N)C=NC=C1 RT2358 [0,1,0,0,0,0|1,0,0]=2 365 B8R1.5 CC1=C(N)N=CC=C1 CJ2791 [0,1,0,0,0,0|2,0,0]=3 366 B8R1.5 CC1=C(O)C=CN=C1 XJ4659 [0,1,0,0,0,0|1,0,0]=2 367 B8R1.5 CC1=C(O)C=NC=C1 YH25048 [0,1,0,0,0,0|1,0,0]=2 368 B8R1.5 CC1=CC=CC=C1N JZ4019 [0,1,0,0,0,0|1,0,0]=2 369 B8R1.5 CC1=CC=CC=C1N LQ0277 [0,1,0,0,0,0|1,0,0]=2 370 B8R1.5 CC1=CC=CN=C1Br JZ0769 [0,1,0,0,0,0|3,0,0]=4 371 B8R1.5 CC1=CC=CN=C1O HL0576 [0,1,0,0,0,0|3,0,0]=4 372 B8R1.5 CC1=CN=CC=C1Br YH00293 [0,1,0,0,0,0|1,0,0]=2 373 B8R1.5 CC1=CN=CC=C1N JZ1864 [0,1,0,0,0,0|0,0,0]=1 374 B8R1.5 CC1=NC=CC=C1Br LQ4989 [0,1,0,0,0,0|3,0,0]=4 375 B8R1.5 CC1=NC=CC=C1Cl YH65571 [0,1,0,0,0,0|3,0,0]=4 376 B8R1.5 CC1=NC=CC=C1N HL2564 [0,1,0,0,0,0|2,0,0]=3 377 B8R1.5 CC1=NC=CC=C1O LT5849 [0,1,0,0,0,0|3,0,0]=4 378 B8R1.5 CC1=NC=CN=C1N YH43939 [0,1,0,0,0,0|3,0,0]=4 379 B8R1.5 CC1=NC=NC=C1N LQ2453 [0,1,0,0,0,0|2,0,0]=3 380 B8R1.5 CC1=[N+]([O-])C=CC=C1 JZ0744 [0,1,0,0,0,0|3,0,0]=4 381 B8R1.5 CC1C=CN=NC1=O YH55165 [0,1,0,0,0,0|2,0,1]=4 382 B8R1.5 CN1C=CC=CC1=O LQ1352 [0,1,0,0,0,0|3,0,0]=4 383 B8R1.5 ClC1=C(Br)C=CC=C1 LT0061 [0,1,0,0,0,0|2,0,0]=3 384 B8R1.5 ClC1=C(Br)C=CN=C1 HL4512 [0,1,0,0,0,0|1,0,0]=2 385 B8R1.5 ClC1=C(Br)C=NC=C1 XJ5248 [0,1,0,0,0,0|1,0,0]=2 386 B8R1.5 ClC1=C(Cl)C=NC=C1 LQ5346 [0,1,0,0,0,0|1,0,0]=2 387 B8R1.5 ClC1=C(Cl)N=CC=C1 JZ1997 [0,1,0,0,0,0|3,0,0]=4 388 B8R1.5 ClC1=C(I)C=CC=C1 HL0203 [0,1,0,0,0,0|2,0,0]=3 389 B8R1.5 ClC1=C(I)C=NC=N1 YH11357 [0,1,0,0,0,0|2,0,0]=3 390 B8R1.5 ClC1=CN=CN=C1Cl LX2461 [0,1,0,0,0,0|2,0,0]=3 391 B8R1.5 ClC1=NC=CC=C1Br LT2446 [0,1,0,0,0,0|3,0,0]=4 392 B8R1.5 ClC1=NC=CC=C1I LT3926 [0,1,0,0,0,0|3,0,0]=4 393 B8R1.5 ClC1=NC=CC=C1I RT17630 [0,1,0,0,0,0|3,0,0]=4 394 B8R1.5 FC1=C(Br)C=CC=C1 LT1562 [0,1,0,0,0,0|2,0,0]=3 395 B8R1.5 FC1=C(Br)C=CC=N1 LQ4912 [0,1,0,0,0,0|3,0,0]=4 396 B8R1.5 FC1=C(Br)C=NC=C1 LL1934 [0,1,0,0,0,0|1,0,0]=2 397 B8R1.5 FC1=C(Cl)C=CC=C1 LQ0714 [0,1,0,0,0,0|2,0,0]=3 398 B8R1.5 FC1=C(Cl)C=CN=C1 LQ2223 [0,1,0,0,0,0|1,0,0]=2 399 B8R1.5 FC1=C(Cl)C=CN=C1 XJ6907 [0,1,0,0,0,0|1,0,0]=2 400 B8R1.5 FC1=C(F)C=CC=C1 LT0041 [0,1,0,0,0,0|2,0,0]=3 401 B8R1.5 FC1=C(F)C=NC=C1 LX3232 [0,1,0,0,0,0|1,0,0]=2 402 B8R1.5 FC1=C(F)N=CC=C1 LQ1799 [0,1,0,0,0,0|3,0,0]=4 403 B8R1.5 FC1=C(I)C=CC=C1 LQ0715 [0,1,0,0,0,0|2,0,0]=3 404 B8R1.5 FC1=C(I)C=CN=C1 XJ4663 [0,1,0,0,0,0|1,0,0]=2 405 B8R1.5 FC1=C(S)C=CC=C1 LQ2244 [0,1,0,0,0,0|2,0,0]=3 406 B8R1.5 FC1=CC=CN=C1Br LQ5002 [0,1,0,0,0,0|3,0,0]=4 407 B8R1.5 FC1=CC=CN=C1Cl LT3265 [0,1,0,0,0,0|3,0,0]=4 408 B8R1.5 FC1=CC=NC=C1Cl YH92131 [0,1,0,0,0,0|1,0,0]=2 409 B8R1.5 FC1=CN=CC=C1Br LQ2222 [0,1,0,0,0,0|1,0,0]=2 410 B8R1.5 FC1=NC=CC=C1Cl HL0870 [0,1,0,0,0,0|3,0,0]=4 411 B8R1.5 FC1=NC=CC=C1I LT3358 [0,1,0,0,0,0|3,0,0]=4 412 B8R1.5 IC1=C(I)C=CC=C1 HL0204 [0,1,0,0,0,0|2,0,0]=3 413 B8R1.5 IC1=CC=CN=C1I LT3876 [0,1,0,0,0,0|3,0,0]=4 414 B8R1.5 NC1=C(Br)C=CC=N1 LQ3666 [0,1,0,0,0,0|2,0,0]=3 415 B8R1.5 NC1=C(Br)C=CN=C1 YH48633 [0,1,0,0,0,0|1,0,0]=2 416 B8R1.5 NC1=C(Br)C=NC=C1 LQ3665 [0,1,0,0,0,0|0,0,0]=1 417 B8R1.5 NC1=C(Cl)C=CN=C1 JZ5401 [0,1,0,0,0,0|1,0,0]=2 418 B8R1.5 NC1=C(F)C=CC=C1 LT6543 [0,1,0,0,0,0|1,0,0]=2 419 B8R1.5 NC1=C(F)C=NC=C1 XJ2124 [0,1,0,0,0,0|0,0,0]=1 420 B8R1.5 NC1=C(I)C=CC=C1 HL0205 [0,1,0,0,0,0|1,0,0]=2 421 B8R1.5 NC1=C(I)C=NC=C1 XJ6581 [0,1,0,0,0,0|0,0,0]=1 422 B8R1.5 NC1=C(N)C=CC=C1 LT7286 [0,1,0,0,0,0|1,0,0]=2 423 B8R1.5 NC1=C(N)C=NC=C1 LQ0029 [0,1,0,0,0,0|0,0,0]=1 424 B8R1.5 NC1=C(N)N=CN=C1 XJ3980 [0,1,0,0,0,0|1,0,0]=2 425 B8R1.5 NC1=C(O)C=CC=N1 LT0236 [0,1,0,0,0,0|2,0,0]=3 426 B8R1.5 NC1=C(O)C=CN=C1 LQ3070 [0,1,0,0,0,0|1,0,0]=2 427 B8R1.5 NC1=C(O)C=NC=C1 RT2267 [0,1,0,0,0,0|0,0,0]=1 428 B8R1.5 NC1=C(O)N=CC=C1 LX2871 [0,1,0,0,0,0|2,0,0]=3 429 B8R1.5 NC1=CC=CC=C1Br HL0202 [0,1,0,0,0,0|1,0,0]=2 430 B8R1.5 NC1=CC=CC=C1O LT0278 [0,1,0,0,0,0|1,0,0]=2 431 B8R1.5 NC1=CC=CC=C1S LL0580 [0,1,0,0,0,0|1,0,0]=2 432 B8R1.5 NC1=CC=CN=C1Br YH59182 [0,1,0,0,0,0|2,0,0]=3 433 B8R1.5 NC1=CC=CN=C1Cl LT6701 [0,1,0,0,0,0|2,0,0]=3 434 B8R1.5 NC1=CC=CN=C1F LX2048 [0,1,0,0,0,0|2,0,0]=3 435 B8R1.5 NC1=CC=CN=C1I YH45611 [0,1,0,0,0,0|2,0,0]=3 436 B8R1.5 NC1=CC=CN=C1N YH15322 [0,1,0,0,0,0|2,0,0]=3 437 B8R1.5 NC1=CC=NC=C1Cl RT2201 [0,1,0,0,0,0|0,0,0]=1 438 B8R1.5 NC1=NC=CC=C1Cl XJ5382 [0,1,0,0,0,0|2,0,0]=3 439 B8R1.5 NC1=NC=CC=C1F LQ4289 [0,1,0,0,0,0|2,0,0]=3 440 B8R1.5 NC1=NC=CC=C1I LT3192 [0,1,0,0,0,0|2,0,0]=3 441 B8R1.5 NC1=NC=CN=C1Cl JZ3005 [0,1,0,0,0,0|3,0,0]=4 442 B8R1.5 O=C1N=CNC=C1Br YH65490 [0,1,0,0,0,0|2,0,1]=4 443 B8R1.5 O=C1N=CNC=C1O LX2213 [0,1,0,0,0,0|2,0,1]=4 444 B8R1.5 O=C1OC=CC=C1O YH03412 [0,1,0,0,0,0|3,0,0]=4 445 B8R1.5 OC1=C(Br)C=CC=C1 LQ0278 [0,1,0,0,0,0|2,0,0]=3 446 B8R1.5 OC1=C(Br)C=CN=C1 RT1983 [0,1,0,0,0,0|1,0,0]=2 447 B8R1.5 OC1=C(Br)C=NC=C1 XJ5247 [0,1,0,0,0,0|1,0,0]=2 448 B8R1.5 OC1=C(Cl)C=CN=C1 HL4980 [0,1,0,0,0,0|1,0,0]=2 449 B8R1.5 OC1=C(F)C=CC=C1 LT6549 [0,1,0,0,0,0|2,0,0]=3 450 B8R1.5 OC1=C(I)C=CC=C1 LL0943 [0,1,0,0,0,0|2,0,0]=3 451 B8R1.5 OC1=C(I)C=CN=C1 CJ2110 [0,1,0,0,0,0|1,0,0]=2 452 B8R1.5 OC1=C(O)C=NC=C1 LX3240 [0,1,0,0,0,0|1,0,0]=2 453 B8R1.5 OC1=C(O)C=NN=C1 YH06821 [0,1,0,0,0,0|2,0,0]=3 454 B8R1.5 OC1=C(O)N=CC=C1 LT0084 [0,1,0,0,0,0|3,0,0]=4 455 B8R1.5 OC1=CC=CC=C1O LL0488 [0,1,0,0,0,0|2,0,0]=3 456 B8R1.5 OC1=CC=CN=C1Br CJ2954 [0,1,0,0,0,0|3,0,0]=4 457 B8R1.5 OC1=CC=CN=C1F HL3683 [0,1,0,0,0,0|3,0,0]=4 458 B8R1.5 OC1=CC=CN=C1I LT3366 [0,1,0,0,0,0|3,0,0]=4 459 B8R1.5 OC1=NC=CC=C1Br LT5508 [0,1,0,0,0,0|3,0,0]=4 460 B8R1.5 OC1=NC=CC=C1F JZ4618 [0,1,0,0,0,0|3,0,0]=4 461 B8R1.5 ON1C(=S)C=CC=C1 JZ4972 [0,1,0,0,0,0|3,0,0]=4 462 B8R1.5 [15NH2]C1=CC=CC=C1[15NH2] RT2962 [0,1,0,0,0,0|1,0,0]=2 463 B8R1.5 [O-][N+]1=C(Br)C=CC=C1 YH45276 [0,1,0,0,0,0|3,0,0]=4 464 B8R1.5 [O-][N+]1=C(Cl)C=CC=C1 JZ2000 [0,1,0,0,0,0|3,0,0]=4 465 B8R1.5 [O-][N+]1=C([S-])C=CC=C1 JZ1761 [0,1,0,0,0,0|3,0,0]=4 466 B8R1.5 [O-][N+]1=C([S-])C=CC=C1 LT3811 [0,1,0,0,0,0|3,0,0]=4 467 B6R0.1 C\C=C\C(C)=C\C LQ4645 [0,0,1,0,0,0|2,0,1]=4 468 B6R0.4 C=C\C=C\C(=O)O RT1128 [0,0,1,0,0,0|3,0,0]=4 469 B8R2.34 C1=CC2C=CC1C2 LL0504 [0,0,0,1,0,0|2,0,1]=4 470 B8R2.34 C1=CC2C=CC1C2 LQ3528 [0,0,0,1,0,0|2,0,1]=4 471 B8R2.34 C1=CC2C=CC1C2 YH57281 [0,0,0,1,0,0|2,0,1]=4 472 B6R1.2 BrC1=CC=CO1 XJ1019 [0,0,0,0,1,0|2,0,0]=3 473 B6R1.2 BrC1=CC=CS1 LT0578 [0,0,0,0,1,0|2,0,0]=3 474 B6R1.2 BrC1=CC=NS1 YH06358 [0,0,0,0,1,0|2,0,0]=3 475 B6R1.2 BrC1=CN=CS1 HL2419 [0,0,0,0,1,0|2,0,0]=3 476 B6R1.2 BrC1=CNC=N1 HL2203 [0,0,0,0,1,0|2,0,1]=4 477 B6R1.2 BrC1=CNN=C1 HL2126 [0,0,0,0,1,0|2,0,0]=3 478 B6R1.2 BrC1=CNN=C1 RT1991 [0,0,0,0,1,0|2,0,0]=3 479 B6R1.2 BrC1=CNN=N1 YH00326 [0,0,0,0,1,0|3,0,0]=4 480 B6R1.2 BrC1=COC=C1 JZ5489 [0,0,0,0,1,0|2,0,0]=3 481 B6R1.2 BrC1=CSC=C1 LT6206 [0,0,0,0,1,0|2,0,0]=3 482 B6R1.2 BrC1=NC=CO1 RT14562 [0,0,0,0,1,0|3,0,0]=4 483 B6R1.2 BrC1=NC=CS1 HL2418 [0,0,0,0,1,0|3,0,0]=4 484 B6R1.2 BrC1=NC=NS1 YH01463 [0,0,0,0,1,0|3,0,0]=4 485 B6R1.2 BrC1=NNC=C1 YH35048 [0,0,0,0,1,0|2,0,1]=4 486 B6R1.2 BrC1=NSC=C1 YH06973 [0,0,0,0,1,0|3,0,0]=4 487 B6R1.2 CC1=CC=CC1 LQ4531 [0,0,0,0,1,0|1,0,1]=3 488 B6R1.2 CC1=CC=CO1 RT14148 [0,0,0,0,1,0|2,0,0]=3 489 B6R1.2 CC1=CC=CS1 HL0035 [0,0,0,0,1,0|2,0,0]=3 490 B6R1.2 CC1=CC=NO1 XJ2996 [0,0,0,0,1,0|2,0,0]=3 491 B6R1.2 CC1=CN=CS1 JZ2359 [0,0,0,0,1,0|2,0,0]=3 492 B6R1.2 CC1=CNC=C1 YH10214 [0,0,0,0,1,0|1,0,1]=3 493 B6R1.2 CC1=CNC=N1 RT8712 [0,0,0,0,1,0|2,0,1]=4 494 B6R1.2 CC1=CNN=C1 LX2319 [0,0,0,0,1,0|2,0,0]=3 495 B6R1.2 CC1=CNN=N1 YH65775 [0,0,0,0,1,0|3,0,0]=4 496 B6R1.2 CC1=COC=C1 LQ1543 [0,0,0,0,1,0|2,0,0]=3 497 B6R1.2 CC1=CSC=C1 LT0736 [0,0,0,0,1,0|2,0,0]=3 498 B6R1.2 CC1=CSC=C1 LT6829 [0,0,0,0,1,0|2,0,0]=3 499 B6R1.2 CC1=CSC=N1 JZ1146 [0,0,0,0,1,0|3,0,0]=4 500 B6R1.2 CC1=NC=CN1 RT6736 [0,0,0,0,1,0|3,0,0]=4 501 B6R1.2 CC1=NC=CS1 LT1779 [0,0,0,0,1,0|3,0,0]=4 502 B6R1.2 CN1C=CC=N1 LQ1547 [0,0,0,0,1,0|3,0,0]=4 503 B6R1.2 CN1C=CN=C1 RT14814 [0,0,0,0,1,0|2,0,0]=3 504 B6R1.2 CN1C=NC=N1 JZ2858 [0,0,0,0,1,0|3,0,0]=4 505 B6R1.2 ClC1=CC=CS1 LL0241 [0,0,0,0,1,0|2,0,0]=3 506 B6R1.2 ClC1=CN=CN1 JZ5089 [0,0,0,0,1,0|2,0,0]=3 507 B6R1.2 ClC1=CN=NS1 XJ2632 [0,0,0,0,1,0|3,0,0]=4 508 B6R1.2 ClC1=CNN=C1 JZ5061 [0,0,0,0,1,0|2,0,0]=3 509 B6R1.2 ClC1=CSC=C1 LT6771 [0,0,0,0,1,0|2,0,0]=3 510 B6R1.2 ClC1=NC=CS1 YH39640 [0,0,0,0,1,0|3,0,0]=4 511 B6R1.2 FC1=CC=CS1 YH59293 [0,0,0,0,1,0|2,0,0]=3 512 B6R1.2 IC1=CC=CS1 LQ2449 [0,0,0,0,1,0|2,0,0]=3 513 B6R1.2 IC1=CSC=C1 LQ3435 [0,0,0,0,1,0|2,0,0]=3 514 B6R1.2 IC1=NC=CN1 LT6074 [0,0,0,0,1,0|3,0,0]=4 515 B6R1.2 NC1=CC=CS1 LQ1192 [0,0,0,0,1,0|1,0,0]=2 516 B6R1.2 NC1=CN=CS1 JZ5184 [0,0,0,0,1,0|1,0,0]=2 517 B6R1.2 NC1=CN=NS1 XJ2617 [0,0,0,0,1,0|2,0,0]=3 518 B6R1.2 NC1=CNC=N1 XJ2788 [0,0,0,0,1,0|1,0,1]=3 519 B6R1.2 NC1=CSC=C1 JZ5185 [0,0,0,0,1,0|1,0,0]=2 520 B6R1.2 NC1=CSC=C1 LX2986 [0,0,0,0,1,0|1,0,0]=2 521 B6R1.2 NC1=CSC=N1 YH65483 [0,0,0,0,1,0|2,0,0]=3 522 B6R1.2 NC1=NC=CN1 JZ3169 [0,0,0,0,1,0|2,0,0]=3 523 B6R1.2 NC1=NC=CN1 M0300317 [0,0,0,0,1,0|2,0,0]=3 524 B6R1.2 NC1=NC=CS1 XJ5842 [0,0,0,0,1,0|2,0,0]=3 525 B6R1.2 NC1=NN=NN1 LT1321 [0,0,0,0,1,0|3,0,0]=4 526 B6R1.2 NC1=NNC=C1 LT6717 [0,0,0,0,1,0|1,0,1]=3 527 B6R1.2 NC1=NNC=N1 LT6697 [0,0,0,0,1,0|2,0,1]=4 528 B6R1.2 NC1=NOC=C1 JZ4770 [0,0,0,0,1,0|2,0,0]=3 529 B6R1.2 NC1=NOC=C1 YH02226 [0,0,0,0,1,0|2,0,0]=3 530 B6R1.2 NC1CC=CC1 YH95418 [0,0,0,0,1,0|0,0,3]=4 531 B6R1.2 NN1C=NN=C1 XJ1020 [0,0,0,0,1,0|2,0,0]=3 532 B6R1.2 O=C1C=CCC1 LQ1544 [0,0,0,0,1,0|1,0,2]=4 533 B6R1.2 O=C1C=CCN1 RT14585 [0,0,0,0,1,0|2,0,1]=4 534 B6R1.2 O=C1C=CCO1 XJ0818 [0,0,0,0,1,0|2,0,1]=4 535 B6R1.2 O=C1OC=CO1 XJ1417 [0,0,0,0,1,0|3,0,0]=4 536 B6R1.2 OC1=NOC=C1 RT14361 [0,0,0,0,1,0|3,0,0]=4 537 B6R1.2 S=C1C=CSS1 RT14520 [0,0,0,0,1,0|3,0,0]=4 538 B6R1.2 S=C1SC=CS1 LQ1546 [0,0,0,0,1,0|3,0,0]=4 539 B6R1.2 SC1=CC=CS1 JZ3241 [0,0,0,0,1,0|2,0,0]=3 540 B6R1.2 SC1=NC=CN1 XJ1416 [0,0,0,0,1,0|3,0,0]=4 541 B6R1.2 SC1=NN=CS1 LT6572 [0,0,0,0,1,0|3,0,0]=4 542 B6R1.2 [Co]C1C=CC=C1 LQ3485 [0,0,0,0,1,0|1,0,1]=3 543 B6R1.2 [Mn]C1C=CC=C1 LT4683 [0,0,0,0,1,0|1,0,1]=3 544 B6R1.2 [Mo+4]C1=CC=CC1 XJ5999 [0,0,0,0,1,0|1,0,1]=3 545 B6R1.2 [Ti+3]C1=CC=CC1 XJ1684 [0,0,0,0,1,0|1,0,1]=3 546 B6R1.2 [TlH2]C1=CC=CC1 XJ5195 [0,0,0,0,1,0|1,0,1]=3 547 B6R1.2 [Zr+3]C1=CC=CC1 XJ5181 [0,0,0,0,1,0|1,0,1]=3 548 B8R1.22 O=C1C=CC=CC=C1 XJ0912 [0,0,0,0,0,1|2,0,0]=3 549 B5R0.1 C=CCC(N)=O RT17513 [1,0,1,0,0,0|1,0,1]=4 550 B5R0.1 C=COC(N)=O RT4835 [1,0,1,0,0,0|2,0,0]=4 551 B5R0.1 C\C=C\C(N)=O RT17596 [1,0,1,0,0,0|1,0,1]=4 552 B5R0.2 C=CCCC=C HL0118 [1,0,1,0,0,0|1,0,1]=4 553 B5R0.2 C=CC\C=C\C HL0119 [1,0,1,0,0,0|1,0,1]=4 554 B5R0.2 C=C\C=C\C=O XJ1340 [1,0,1,0,0,0|1,0,0]=3 555 B5R0.3 C=CC(O)C=C HL0553 [1,0,1,0,0,0|1,0,1]=4 556 B7R1.1 C#CC1=CSC=C1 HL4323 [0,1,0,0,1,0|2,0,0]=4 557 B7R1.1 CCC1=CC=CS1 XJ1420 [0,1,0,0,1,0|2,0,0]=4 558 B7R1.1 COC1=CC=CO1 XJ4809 [0,1,0,0,1,0|2,0,0]=4 559 B7R1.1 ClCC1=CC=CS1 LT1710 [0,1,0,0,1,0|2,0,0]=4 560 B7R1.1 N#CC1=CC=CS1 HL0573 [0,1,0,0,1,0|1,0,1]=4 561 B7R1.1 N#CC1=COC=C1 XJ5045 [0,1,0,0,1,0|1,0,1]=4 562 B7R1.1 N#CN1C=CN=C1 RT15030 [0,1,0,0,1,0|1,0,1]=4 563 B7R1.1 NCC1=CC=CO1 RT4371 [0,1,0,0,1,0|1,0,0]=3 564 B7R1.1 NCC1=CC=CS1 LT5820 [0,1,0,0,1,0|1,0,0]=3 565 B7R1.1 NCC1=CSC=C1 YH51468 [0,1,0,0,1,0|1,0,0]=3 566 B7R1.1 NCC1=NC=CO1 YH92552 [0,1,0,0,1,0|2,0,0]=4 567 B7R1.1 NCC1=NC=NN1 YH08493 [0,1,0,0,1,0|2,0,0]=4 568 B7R1.1 O=CC1=CC=CN1 HL3957 [0,1,0,0,1,0|2,0,0]=4 569 B7R1.1 O=CC1=CC=CN1 RT5965 [0,1,0,0,1,0|2,0,0]=4 570 B7R1.1 O=CC1=CC=CS1 LT6658 [0,1,0,0,1,0|2,0,0]=4 571 B7R1.1 O=CC1=CC=NN1 YH58836 [0,1,0,0,1,0|2,0,0]=4 572 B7R1.1 O=CC1=CC=NS1 YH05211 [0,1,0,0,1,0|2,0,0]=4 573 B7R1.1 O=CC1=CSC=C1 LT0654 [0,1,0,0,1,0|2,0,0]=4 574 B7R1.1 O=CN1C=CN=C1 JZ2254 [0,1,0,0,1,0|2,0,0]=4 575 B7R1.1 OCC1=CC=CN1 RT14126 [0,1,0,0,1,0|2,0,0]=4 576 B7R1.1 OCC1=CC=CO1 XJ0217 [0,1,0,0,1,0|2,0,0]=4 577 B7R1.1 OCC1=CN=CS1 LT6037 [0,1,0,0,1,0|2,0,0]=4 578 B7R1.1 OCC1=CNC=C1 RT14164 [0,1,0,0,1,0|1,0,1]=4 579 B7R1.1 OCC1=CSC=C1 LT2643 [0,1,0,0,1,0|2,0,0]=4 580 B7R1.1 SCC1=CC=CO1 LL2412 [0,1,0,0,1,0|2,0,0]=4 581 B7R1.2 BrC1=CC=C(Br)S1 LT0144 [0,1,0,0,1,0|2,0,0]=4 582 B7R1.2 BrC1=CSC(Br)=C1 LQ2406 [0,1,0,0,1,0|2,0,0]=4 583 B7R1.2 CC1=CC(C)=NN1 YH13269 [0,1,0,0,1,0|2,0,0]=4 584 B7R1.2 CC1=CC(C)=NO1 LL0658 [0,1,0,0,1,0|2,0,0]=4 585 B7R1.2 CC1=CC(N)=NN1 LT6115 [0,1,0,0,1,0|1,0,1]=4 586 B7R1.2 CC1=CC(N)=NO1 JZ4347 [0,1,0,0,1,0|2,0,0]=4 587 B7R1.2 CC1=CC=C(C)N1 XJ1201 [0,1,0,0,1,0|2,0,0]=4 588 B7R1.2 CC1=CC=C(C)O1 JZ0985 [0,1,0,0,1,0|2,0,0]=4 589 B7R1.2 CC1=CC=C(C)S1 LT0161 [0,1,0,0,1,0|2,0,0]=4 590 B7R1.2 CC1=CN=C(Br)S1 XJ5466 [0,1,0,0,1,0|2,0,0]=4 591 B7R1.2 CC1=CN=C(Cl)S1 YH55067 [0,1,0,0,1,0|2,0,0]=4 592 B7R1.2 CC1=CN=C(N)O1 YH54873 [0,1,0,0,1,0|2,0,0]=4 593 B7R1.2 CC1=CN=C(N)S1 LT5981 [0,1,0,0,1,0|2,0,0]=4 594 B7R1.2 CC1=CNC(C)=C1 XJ1200 [0,1,0,0,1,0|1,0,1]=4 595 B7R1.2 CC1=COC(N)=N1 LQ4845 [0,1,0,0,1,0|2,0,0]=4 596 B7R1.2 CC1=CSC(N)=N1 YH56147 [0,1,0,0,1,0|2,0,0]=4 597 B7R1.2 CN1C=C(Br)C=N1 JZ5026 [0,1,0,0,1,0|2,0,0]=4 598 B7R1.2 CN1C=CC(N)=N1 YH42950 [0,1,0,0,1,0|1,0,1]=4 599 B7R1.2 CN1C=NC(I)=C1 XJ6263 [0,1,0,0,1,0|2,0,0]=4 600 B7R1.2 ClC1=CC=C(Br)S1 LQ2313 [0,1,0,0,1,0|2,0,0]=4 601 B7R1.2 NC1=CC(=O)CC1 YH51937 [0,1,0,0,1,0|0,0,2]=4 602 B7R1.2 NC1=NC=C(Br)S1 LT1932 [0,1,0,0,1,0|2,0,0]=4 603 B7R1.2 NC1=NC=C(Br)S1 YH32232 [0,1,0,0,1,0|2,0,0]=4 604 B7R1.2 NC1=NC=C(Cl)S1 YH65536 [0,1,0,0,1,0|2,0,0]=4 605 B7R1.2 NC1=NN=C(Br)S1 YH65528 [0,1,0,0,1,0|2,0,0]=4 606 B7R1.2 NC1=NNC(N)=N1 HL0826 [0,1,0,0,1,0|2,0,0]=4 607 B7R1.2 NC1=NNC(O)=C1 LQ5283 [0,1,0,0,1,0|1,0,1]=4 608 B7R1.2 O=C1C=CC(=O)N1 LT7482 [0,1,0,0,1,0|2,0,0]=4 609 B7R1.2 O=C1C=CC(=O)O1 LQ0391 [0,1,0,0,1,0|2,0,0]=4 610 B7R1.2 O=C1C=CC(=O)O1 LT3790 [0,1,0,0,1,0|2,0,0]=4 611 B7R1.4 BrC1=C(Br)SC=C1 LQ2407 [0,1,0,0,1,0|2,0,0]=4 612 B7R1.4 BrC1=CSC=C1Br CJ2871 [0,1,0,0,1,0|2,0,0]=4 613 B7R1.4 BrC1=CSC=C1Br LT0598 [0,1,0,0,1,0|2,0,0]=4 614 B7R1.4 CC1=C(Br)C=CS1 LT2486 [0,1,0,0,1,0|2,0,0]=4 615 B7R1.4 CC1=C(Br)N=CN1 YH37368 [0,1,0,0,1,0|2,0,0]=4 616 B7R1.4 CC1=C(Br)SC=C1 LT1661 [0,1,0,0,1,0|2,0,0]=4 617 B7R1.4 CC1=C(C)SC=C1 LQ1299 [0,1,0,0,1,0|2,0,0]=4 618 B7R1.4 CC1=C(C)SC=N1 JZ1110 [0,1,0,0,1,0|2,0,0]=4 619 B7R1.4 CC1=C(Cl)SC=C1 XJ4095 [0,1,0,0,1,0|2,0,0]=4 620 B7R1.4 CC1=C(N)C=NO1 SY0005 [0,1,0,0,1,0|1,0,0]=3 621 B7R1.4 CC1=C(S)C=CO1 LQ4612 [0,1,0,0,1,0|2,0,0]=4 622 B7R1.4 CC1=C([Mn])CC=C1 LQ3504 [0,1,0,0,1,0|1,0,1]=4 623 B7R1.4 CC1=COC=C1C RT14117 [0,1,0,0,1,0|2,0,0]=4 624 B7R1.4 CC1=CSC=C1C YH11171 [0,1,0,0,1,0|2,0,0]=4 625 B7R1.4 CN1C=CN=C1N RT2180 [0,1,0,0,1,0|2,0,0]=4 626 B7R1.4 CN1C=CN=C1S LL0062 [0,1,0,0,1,0|2,0,0]=4 627 B7R1.4 CN1N=CC=C1N JZ4455 [0,1,0,0,1,0|1,0,0]=3 628 B7R1.4 ClC1=C(Br)C=CS1 LT0622 [0,1,0,0,1,0|2,0,0]=4 629 B7R1.4 ClC1=C(Cl)NC=N1 JZ5088 [0,1,0,0,1,0|2,0,0]=4 630 B7R1.4 ClC1=C(Cl)SC=C1 LT0531 [0,1,0,0,1,0|2,0,0]=4 631 B7R1.4 IC1=C(I)NC=N1 LT2699 [0,1,0,0,1,0|2,0,0]=4 632 B7R1.4 NC1=C(Br)C=CS1 YH65584 [0,1,0,0,1,0|1,0,0]=3 633 B7R1.4 NC1=CSC=C1N LT0596 [0,1,0,0,1,0|1,0,0]=3 634 B7R1.4 NC1=NON=C1N XJ4367 [0,1,0,0,1,0|2,0,0]=4 635 B9R1.5 O=C1C=CC=CC=C1O LL0946 [0,1,0,0,0,1|2,0,0]=4 636 B9R1.89 COC1=CC=CC=CC1 RT17722 [0,1,0,0,0,1|2,0,0]=4 637 B9R1.1 BrCC1=CC=C(Br)C=C1 YH08714 [0,2,0,0,0,0|2,0,0]=4 638 B9R1.1 BrCC1=CC=C(I)C=C1 XJ4204 [0,2,0,0,0,0|2,0,0]=4 639 B9R1.1 C#CC1=CC=C(Br)C=C1 HL0382 [0,2,0,0,0,0|2,0,0]=4 640 B9R1.1 C#CC1=CC=C(C)C=C1 HL0383 [0,2,0,0,0,0|2,0,0]=4 641 B9R1.1 C#CC1=CC=C(Cl)C=C1 SY0319 [0,2,0,0,0,0|2,0,0]=4 642 B9R1.1 C#CC1=CC=C(F)C=C1 HL0384 [0,2,0,0,0,0|2,0,0]=4 643 B9R1.1 C#CC1=CC=C(N)C=C1 XJ4023 [0,2,0,0,0,0|1,0,0]=3 644 B9R1.1 C#CC1=CC=C(O)C=C1 YH65749 [0,2,0,0,0,0|2,0,0]=4 645 B9R1.1 C(=O)C1=CC=C(Br)C=C1 HL0659 [0,2,0,0,0,0|2,0,0]=4 646 B9R1.1 C(=O)C1=CC=C(Cl)C=C1 XJ0297 [0,2,0,0,0,0|2,0,0]=4 647 B9R1.1 C(=O)C1=CC=C(F)C=C1 RT10834 [0,2,0,0,0,0|2,0,0]=4 648 B9R1.1 C(=O)C1=CC=C(N)N=C1 RT2853 [0,2,0,0,0,0|2,0,0]=4 649 B9R1.1 C=CC1=CC=C(Br)C=C1 XJ2035 [0,2,0,0,0,0|2,0,0]=4 650 B9R1.1 C=CC1=CC=C(C)C=C1 XJ1131 [0,2,0,0,0,0|2,0,0]=4 651 B9R1.1 C=CC1=CC=C(Cl)C=C1 JZ4358 [0,2,0,0,0,0|2,0,0]=4 652 B9R1.1 C=CC1=CC=C(F)C=C1 LQ0811 [0,2,0,0,0,0|2,0,0]=4 653 B9R1.1 C=CC1=CC=C(N)C=C1 LQ1825 [0,2,0,0,0,0|1,0,0]=3 654 B9R1.1 CC1=CC=C(C#N)C=C1 XJ0295 [0,2,0,0,0,0|1,0,1]=4 655 B9R1.1 CC1=CC=C(C=O)C=C1 XJ0296 [0,2,0,0,0,0|2,0,0]=4 656 B9R1.1 CC1=CC=C(CBr)C=C1 XJ0291 [0,2,0,0,0,0|2,0,0]=4 657 B9R1.1 CC1=CC=C(CN)C=C1 XJ0294 [0,2,0,0,0,0|1,0,0]=3 658 B9R1.1 CC1=CC=C(CN)C=N1 RT4381 [0,2,0,0,0,0|2,0,0]=4 659 B9R1.1 CC1=CC=C(CO)C=C1 HL0057 [0,2,0,0,0,0|2,0,0]=4 660 B9R1.1 CC1=CC=C(NN)C=C1 JZ4047 [0,2,0,0,0,0|1,0,0]=3 661 B9R1.1 CC1=CC=C(NN)C=C1 XJ0909 [0,2,0,0,0,0|1,0,0]=3 662 B9R1.1 CC1=NC=C(NN)C=C1 YH93974 [0,2,0,0,0,0|2,0,0]=4 663 B9R1.1 CCC1=CC=C(Br)C=C1 LT0068 [0,2,0,0,0,0|2,0,0]=4 664 B9R1.1 CCC1=CC=C(Cl)C=C1 XJ1132 [0,2,0,0,0,0|2,0,0]=4 665 B9R1.1 CCC1=CC=C(I)C=C1 JZ5676 [0,2,0,0,0,0|2,0,0]=4 666 B9R1.1 CCC1=CC=C(O)C=C1 LQ4557 [0,2,0,0,0,0|2,0,0]=4 667 B9R1.1 CCC1=CC=[N+]([O-])C=C1 RT11871 [0,2,0,0,0,0|1,0,1]=4 668 B9R1.1 CNC1=CC=C(N)C=C1 LT5160 [0,2,0,0,0,0|1,0,0]=3 669 B9R1.1 CNC1=CC=C(O)C=C1 LT7433 [0,2,0,0,0,0|1,0,0]=3 670 B9R1.1 CNC1=NC=C(Cl)C=C1 RT2598 [0,2,0,0,0,0|2,0,0]=4 671 B9R1.1 COC1=CC=C(Br)C=C1 YH22845 [0,2,0,0,0,0|2,0,0]=4 672 B9R1.1 COC1=CC=C(F)C=C1 RT11598 [0,2,0,0,0,0|2,0,0]=4 673 B9R1.1 COC1=CC=C(N)C=C1 YH22851 [0,2,0,0,0,0|1,0,0]=3 674 B9R1.1 COC1=CC=C(N)C=N1 LT3597 [0,2,0,0,0,0|2,0,0]=4 675 B9R1.1 COC1=CC=C(N)N=C1 XJ3542 [0,2,0,0,0,0|2,0,0]=4 676 B9R1.1 COC1=CC=C(O)C=C1 LQ0608 [0,2,0,0,0,0|2,0,0]=4 677 B9R1.1 COC1=CC=[N+]([O-])C=C1 RT6739 [0,2,0,0,0,0|1,0,1]=4 678 B9R1.1 CSC1=CC=C(C)C=C1 XJ1135 [0,2,0,0,0,0|2,0,0]=4 679 B9R1.1 CSC1=CC=C(F)C=C1 XJ0702 [0,2,0,0,0,0|2,0,0]=4 680 B9R1.1 CSC1=CN=C(N)C=C1 RT4644 [0,2,0,0,0,0|2,0,0]=4 681 B9R1.1 ClC1=CC=C(CBr)C=C1 XJ1130 [0,2,0,0,0,0|2,0,0]=4 682 B9R1.1 ClC1=CC=C([Mg]Br)C=C1 XJ1431 [0,2,0,0,0,0|2,0,0]=4 683 B9R1.1 ClCC1=CC=C(Br)C=C1 HL0056 [0,2,0,0,0,0|2,0,0]=4 684 B9R1.1 ClCC1=CC=C(Cl)C=C1 XJ0293 [0,2,0,0,0,0|2,0,0]=4 685 B9R1.1 FC1=CC=C(CBr)C=C1 RT11193 [0,2,0,0,0,0|2,0,0]=4 686 B9R1.1 FC1=CC=C(CCl)C=C1 LL0673 [0,2,0,0,0,0|2,0,0]=4 687 B9R1.1 FC1=CC=C(CS)C=C1 JZ5068 [0,2,0,0,0,0|2,0,0]=4 688 B9R1.1 FC1=CC=C([Mg]Br)C=C1 LL0674 [0,2,0,0,0,0|2,0,0]=4 689 B9R1.1 N#CC1=CC=C(Br)C=C1 LT6101 [0,2,0,0,0,0|1,0,1]=4 690 B9R1.1 N#CC1=CC=C(Br)C=C1 XJ1133 [0,2,0,0,0,0|1,0,1]=4 691 B9R1.1 N#CC1=CC=C(F)C=C1 LT3074 [0,2,0,0,0,0|1,0,1]=4 692 B9R1.1 N#CC1=CC=C(I)C=C1 HL2444 [0,2,0,0,0,0|1,0,1]=4 693 B9R1.1 N#CC1=CC=C(N)C=C1 RT3702 [0,2,0,0,0,0|1,0,0]=3 694 B9R1.1 N#CC1=CC=C(O)C=C1 LT2823 [0,2,0,0,0,0|1,0,1]=4 695 B9R1.1 N#CC1=NC=C(N)C=C1 CJ3122 [0,2,0,0,0,0|2,0,0]=4 696 B9R1.1 N#[N+]C1=CC=C(F)C=C1 RT6271 [0,2,0,0,0,0|1,0,1]=4 697 B9R1.1 NC1=CC=C(C=O)C=C1 LQ1002 [0,2,0,0,0,0|1,0,0]=3 698 B9R1.1 NC1=CC=C(CO)C=N1 YH25373 [0,2,0,0,0,0|2,0,0]=4 699 B9R1.1 NC1=CC=C(CO)N=C1 YH91412 [0,2,0,0,0,0|2,0,0]=4 700 B9R1.1 NCC1=CC=C(Br)C=C1 YH59044 [0,2,0,0,0,0|1,0,0]=3 701 B9R1.1 NCC1=CC=C(Cl)C=C1 LT2948 [0,2,0,0,0,0|1,0,0]=3 702 B9R1.1 NCC1=CC=C(F)C=C1 RT1536 [0,2,0,0,0,0|1,0,0]=3 703 B9R1.1 NCC1=CC=C(I)C=C1 LT1523 [0,2,0,0,0,0|1,0,0]=3 704 B9R1.1 NCC1=CC=C(N)C=C1 JZ2534 [0,2,0,0,0,0|1,0,0]=3 705 B9R1.1 NCC1=CC=C(O)C=C1 LQ1367 [0,2,0,0,0,0|1,0,0]=3 706 B9R1.1 NCC1=CN=C(Cl)C=C1 HL4996 [0,2,0,0,0,0|2,0,0]=4 707 B9R1.1 NNC1=CC=C(Br)C=C1 HL0058 [0,2,0,0,0,0|1,0,0]=3 708 B9R1.1 NNC1=CC=C(Br)C=C1 XJ1129 [0,2,0,0,0,0|1,0,0]=3 709 B9R1.1 NNC1=CC=C(Cl)C=C1 JZ4359 [0,2,0,0,0,0|1,0,0]=3 710 B9R1.1 NNC1=CC=C(Cl)C=C1 JZ4360 [0,2,0,0,0,0|1,0,0]=3 711 B9R1.1 NNC1=CC=C(F)C=C1 LQ1485 [0,2,0,0,0,0|1,0,0]=3 712 B9R1.1 O=CC1=CC=C(I)C=C1 XJ4171 [0,2,0,0,0,0|2,0,0]=4 713 B9R1.1 O=CC1=CC=C(O)C=C1 RT12842 [0,2,0,0,0,0|2,0,0]=4 714 B9R1.1 O=CC1=CC=C(S)C=C1 RT11108 [0,2,0,0,0,0|2,0,0]=4 715 B9R1.1 O=NC1=CC=C(O)C=C1 RT11953 [0,2,0,0,0,0|1,0,1]=4 716 B9R1.1 OC1=CC=C(CBr)C=C1 CJ3032 [0,2,0,0,0,0|2,0,0]=4 717 B9R1.1 OCC1=CC=C(Br)C=C1 XJ1430 [0,2,0,0,0,0|2,0,0]=4 718 B9R1.1 OCC1=CC=C(Cl)C=C1 JZ0815 [0,2,0,0,0,0|2,0,0]=4 719 B9R1.1 OCC1=CC=C(I)C=C1 XJ4412 [0,2,0,0,0,0|2,0,0]=4 720 B9R1.1 OCC1=CC=C(O)C=C1 JZ0347 [0,2,0,0,0,0|2,0,0]=4 721 B9R1.1 ONC1=CC=C(Cl)C=C1 YH88188 [0,2,0,0,0,0|1,0,0]=3 722 B9R1.1 [C-]#[N+]C1=CC=C(Br)C=C1 LQ4762 [0,2,0,0,0,0|1,0,1]=4 723 B9R1.2 BrCC1=CC(Br)=CC=C1 LT6733 [0,2,0,0,0,0|2,0,0]=4 724 B9R1.2 C#CC1=CC(Br)=CC=C1 SY0298 [0,2,0,0,0,0|2,0,0]=4 725 B9R1.2 C#CC1=CC(C)=CC=C1 XJ1365 [0,2,0,0,0,0|2,0,0]=4 726 B9R1.2 C#CC1=CC(F)=CC=C1 LQ2245 [0,2,0,0,0,0|2,0,0]=4 727 B9R1.2 C#CC1=CC=CC(Cl)=C1 XJ1366 [0,2,0,0,0,0|2,0,0]=4 728 B9R1.2 C#CC1=CC=CC(N)=C1 SY0248 [0,2,0,0,0,0|1,0,0]=3 729 B9R1.2 C=CC1=CC(Br)=CC=C1 LT6743 [0,2,0,0,0,0|2,0,0]=4 730 B9R1.2 C=CC1=CC(Cl)=CC=C1 XJ2036 [0,2,0,0,0,0|2,0,0]=4 731 B9R1.2 C=CC1=CC(F)=CC=C1 LT6798 [0,2,0,0,0,0|2,0,0]=4 732 B9R1.2 C=CC1=CC(O)=CC=C1 RT11655 [0,2,0,0,0,0|2,0,0]=4 733 B9R1.2 C=CC1=CC=CC(C)=C1 LQ4468 [0,2,0,0,0,0|2,0,0]=4 734 B9R1.2 CC1=CC(C#N)=CC=C1 LT7492 [0,2,0,0,0,0|1,0,1]=4 735 B9R1.2 CC1=CC(C=O)=CC=C1 JZ3952 [0,2,0,0,0,0|2,0,0]=4 736 B9R1.2 CC1=CC(CCl)=NC=C1 YH58257 [0,2,0,0,0,0|1,0,0]=3 737 B9R1.2 CC1=CC(CN)=CC=C1 LQ0295 [0,2,0,0,0,0|1,0,0]=3 738 B9R1.2 CC1=CC(CO)=NC=C1 YH01119 [0,2,0,0,0,0|1,0,0]=3 739 B9R1.2 CC1=CC(NN)=CC=C1 LL0975 [0,2,0,0,0,0|1,0,0]=3 740 B9R1.2 CC1=NC(C=O)=CC=N1 HL0584 [0,2,0,0,0,0|2,0,0]=4 741 B9R1.2 CC1=NC(CO)=CC=N1 YH65643 [0,2,0,0,0,0|2,0,0]=4 742 B9R1.2 CC1=NC=CC(CCl)=C1 RT9279 [0,2,0,0,0,0|1,0,0]=3 743 B9R1.2 CC1=NC=CC(CN)=C1 RT9263 [0,2,0,0,0,0|0,0,0]=2 744 B9R1.2 CCC1=CC(C)=CC=C1 JZ3949 [0,2,0,0,0,0|2,0,0]=4 745 B9R1.2 CCC1=CC(Cl)=NC=C1 LT3331 [0,2,0,0,0,0|1,0,0]=3 746 B9R1.2 CCC1=CC=CC(Br)=C1 XJ2282 [0,2,0,0,0,0|2,0,0]=4 747 B9R1.2 CCC1=CC=CC(N)=C1 XJ1048 [0,2,0,0,0,0|1,0,0]=3 748 B9R1.2 CCC1=CC=CC(O)=C1 YH10409 [0,2,0,0,0,0|2,0,0]=4 749 B9R1.2 CCC1=CC=NC(Br)=C1 LT3312 [0,2,0,0,0,0|1,0,0]=3 750 B9R1.2 CCC1=CC=NC(N)=C1 LT3293 [0,2,0,0,0,0|1,0,0]=3 751 B9R1.2 CNC1=CC=CC(C)=C1 LQ1364 [0,2,0,0,0,0|1,0,0]=3 752 B9R1.2 COC1=CC(Br)=CC=C1 JZ1081 [0,2,0,0,0,0|2,0,0]=4 753 B9R1.2 COC1=CC(Cl)=NC=N1 SY0204 [0,2,0,0,0,0|2,0,0]=4 754 B9R1.2 COC1=CC(N)=CC=C1 RT2821 [0,2,0,0,0,0|1,0,0]=3 755 B9R1.2 COC1=CC(N)=NC=C1 XJ3562 [0,2,0,0,0,0|1,0,0]=3 756 B9R1.2 COC1=CC=CC(N)=N1 YH41174 [0,2,0,0,0,0|2,0,0]=4 757 B9R1.2 COC1=CC=CC(O)=C1 LQ0600 [0,2,0,0,0,0|2,0,0]=4 758 B9R1.2 COC1=CC=NC(Cl)=C1 XJ4369 [0,2,0,0,0,0|1,0,0]=3 759 B9R1.2 COC1=CN=CC(N)=C1 LL1064 [0,2,0,0,0,0|2,0,0]=4 760 B9R1.2 COC1=NC(N)=NC=C1 LQ0640 [0,2,0,0,0,0|2,0,0]=4 761 B9R1.2 COC1=NC=CC(Br)=C1 XJ6753 [0,2,0,0,0,0|1,0,0]=3 762 B9R1.2 COC1=NC=CC(F)=C1 HL4973 [0,2,0,0,0,0|1,0,0]=3 763 B9R1.2 COC1=NC=CC(I)=C1 YH98675 [0,2,0,0,0,0|1,0,0]=3 764 B9R1.2 COC1=NC=CC(N)=C1 LQ4219 [0,2,0,0,0,0|0,0,0]=2 765 B9R1.2 COC1=NC=NC(N)=C1 LT2712 [0,2,0,0,0,0|1,0,0]=3 766 B9R1.2 COC1=NC=NC(N)=N1 HL0654 [0,2,0,0,0,0|2,0,0]=4 767 B9R1.2 CSC1=CC(Cl)=CC=C1 XJ2763 [0,2,0,0,0,0|2,0,0]=4 768 B9R1.2 CSC1=CC(Cl)=CC=C1 XJ4867 [0,2,0,0,0,0|2,0,0]=4 769 B9R1.2 CSC1=CC(I)=CC=C1 YH31373 [0,2,0,0,0,0|2,0,0]=4 770 B9R1.2 CSC1=CC=CC(F)=C1 XJ1274 [0,2,0,0,0,0|2,0,0]=4 771 B9R1.2 CSC1=CC=CC(N)=C1 LT2494 [0,2,0,0,0,0|1,0,0]=3 772 B9R1.2 CSC1=CC=NC(Cl)=N1 YH03519 [0,2,0,0,0,0|2,0,0]=4 773 B9R1.2 CSC1=NC(Cl)=CC=N1 YH03518 [0,2,0,0,0,0|2,0,0]=4 774 B9R1.2 CSC1=NC=CC(=O)N1 XJ2986 [0,2,0,0,0,0|2,0,0]=4 775 B9R1.2 FC1=CC=CC(CCl)=C1 HL1820 [0,2,0,0,0,0|2,0,0]=4 776 B9R1.2 N#CC1=CC(Br)=CC=C1 LT3005 [0,2,0,0,0,0|1,0,1]=4 777 B9R1.2 N#CC1=CC(Cl)=CC=C1 LT2928 [0,2,0,0,0,0|1,0,1]=4 778 B9R1.2 N#CC1=CC(Cl)=NC=C1 LT3345 [0,2,0,0,0,0|0,0,1]=3 779 B9R1.2 N#CC1=CC(F)=NC=C1 LQ2598 [0,2,0,0,0,0|0,0,1]=3 780 B9R1.2 N#CC1=CC(I)=CC=C1 HL4359 [0,2,0,0,0,0|1,0,1]=4 781 B9R1.2 N#CC1=CC(N)=NC=C1 RT4098 [0,2,0,0,0,0|0,0,1]=3 782 B9R1.2 N#CC1=CC(O)=CC=C1 XJ1426 [0,2,0,0,0,0|1,0,1]=4 783 B9R1.2 N#CC1=CC(O)=CC=N1 YH02743 [0,2,0,0,0,0|1,0,0]=3 784 B9R1.2 N#CC1=CC=CC(N)=C1 LT6708 [0,2,0,0,0,0|1,0,0]=3 785 B9R1.2 N#CC1=CN=CC(N)=C1 YH32932 [0,2,0,0,0,0|2,0,0]=4 786 B9R1.2 N#CC1=NC=CC(N)=C1 YH98662 [0,2,0,0,0,0|0,0,0]=2 787 B9R1.2 NC1=CC(CO)=CC=N1 LT3191 [0,2,0,0,0,0|1,0,0]=3 788 B9R1.2 NC1=CN=CC(CO)=C1 YH01842 [0,2,0,0,0,0|2,0,0]=4 789 B9R1.2 NCC1=CC(Br)=CC=C1 XJ3599 [0,2,0,0,0,0|1,0,0]=3 790 B9R1.2 NCC1=CC(I)=CC=C1 LQ1363 [0,2,0,0,0,0|1,0,0]=3 791 B9R1.2 NCC1=CC(N)=CC=C1 LT2553 [0,2,0,0,0,0|1,0,0]=3 792 B9R1.2 NCC1=CC=CC(Cl)=C1 LT6763 [0,2,0,0,0,0|1,0,0]=3 793 B9R1.2 NNC1=CC(Cl)=NC=C1 YH14679 [0,2,0,0,0,0|0,0,0]=2 794 B9R1.2 NNC1=CC(Cl)=NC=N1 YH08071 [0,2,0,0,0,0|1,0,0]=3 795 B9R1.2 NNC1=CC=CC(Cl)=C1 HL2219 [0,2,0,0,0,0|1,0,0]=3 796 B9R1.2 NNC1=CC=CC(F)=C1 JZ2155 [0,2,0,0,0,0|1,0,0]=3 797 B9R1.2 NNC1=NC(Br)=CC=C1 JZ5733 [0,2,0,0,0,0|2,0,0]=4 798 B9R1.2 NNC1=NC(O)=NC=C1 XJ2459 [0,2,0,0,0,0|1,0,0]=3 799 B9R1.2 O=CC1=CC(Br)=NC=C1 LL1981 [0,2,0,0,0,0|1,0,0]=3 800 B9R1.2 O=CC1=CC(Cl)=CC=C1 XJ1050 [0,2,0,0,0,0|2,0,0]=4 801 B9R1.2 O=CC1=CC(F)=CC=C1 LT6791 [0,2,0,0,0,0|2,0,0]=4 802 B9R1.2 O=CC1=CC(O)=NC=C1 YH65488 [0,2,0,0,0,0|1,0,0]=3 803 B9R1.2 O=CC1=CC=CC(Br)=C1 LQ2404 [0,2,0,0,0,0|2,0,0]=4 804 B9R1.2 O=CC1=CC=CC(O)=C1 JZ0346 [0,2,0,0,0,0|2,0,0]=4 805 B9R1.2 O=CC1=CC=NC(Cl)=C1 LX3013 [0,2,0,0,0,0|1,0,0]=3 806 B9R1.2 O=CC1=CC=NC(F)=C1 HL3440 [0,2,0,0,0,0|1,0,0]=3 807 B9R1.2 OC1=CC=CC(CCl)=C1 LT2488 [0,2,0,0,0,0|2,0,0]=4 808 B9R1.2 OCC1=CC(Br)=NC=C1 LT3320 [0,2,0,0,0,0|1,0,0]=3 809 B9R1.2 OCC1=CC(Cl)=CC=C1 XJ1427 [0,2,0,0,0,0|2,0,0]=4 810 B9R1.2 OCC1=CC(Cl)=NC=C1 YH20577 [0,2,0,0,0,0|1,0,0]=3 811 B9R1.2 OCC1=CC(F)=CC=C1 HL1821 [0,2,0,0,0,0|2,0,0]=4 812 B9R1.2 OCC1=CC(I)=CC=C1 XJ5829 [0,2,0,0,0,0|2,0,0]=4 813 B9R1.2 OCC1=CC=CC(Br)=C1 LT6732 [0,2,0,0,0,0|2,0,0]=4 814 B9R1.2 OCC1=NC=CC(Br)=C1 YH31728 [0,2,0,0,0,0|1,0,0]=3 815 B9R1.2 OCC1=NC=NC(Cl)=C1 YH66296 [0,2,0,0,0,0|2,0,0]=4 816 B9R1.6 C=C(C)C1=CC=CC=C1 XJ0257 [0,2,0,0,0,0|2,0,0]=4 817 B9R1.6 CC(=O)C1=CC=CC=C1 RT11112 [0,2,0,0,0,0|2,0,0]=4 818 B9R1.6 CC(=O)C1=CC=NC=C1 HL0648 [0,2,0,0,0,0|1,0,0]=3 819 B9R1.6 CC(Br)C1=CC=CC=C1 XJ1034 [0,2,0,0,0,0|2,0,0]=4 820 B9R1.6 CC(N)C1=CC=CC=C1 JZ0721 [0,2,0,0,0,0|1,0,0]=3 821 B9R1.6 CN(C)C1=CC=NC=C1 LT3039 [0,2,0,0,0,0|0,0,0]=2 822 B9R1.6 CN(C)C1=NC=CC=C1 XJ2942 [0,2,0,0,0,0|2,0,0]=4 823 B9R1.6 CN(N)C1=CC=CC=C1 LQ1214 [0,2,0,0,0,0|1,0,0]=3 824 B9R1.6 CN(N)C1=CC=CC=C1 LX2044 [0,2,0,0,0,0|1,0,0]=3 825 B9R1.6 C[C@@H](N)C1=CC=CC=C1 RT1721 [0,2,0,0,0,0|1,0,0]=3 826 B9R1.6 C[C@@H](N)C1=NC=CC=C1 YH51514 [0,2,0,0,0,0|2,0,0]=4 827 B9R1.6 C[C@H](N)C1=CC=CC=C1 RT1720 [0,2,0,0,0,0|1,0,0]=3 828 B9R1.6 C[Si](=O)C1=CC=CC=C1 XJ3509 [0,2,0,0,0,0|2,0,0]=4 829 B9R1.6 ClC(Cl)C1=CC=CC=C1 LT3671 [0,2,0,0,0,0|2,0,0]=4 830 B9R1.6 ClP(Cl)C1=CC=CC=C1 JZ4097 [0,2,0,0,0,0|1,1,0]=4 831 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 YH96399 [0,2,0,0,0,0|2,0,0]=4 832 B9R1.6 N=C(N)C1=CC=CC=C1 LQ1861 [0,2,0,0,0,0|1,0,0]=3 833 B9R1.6 N=C(N)C1=CC=NC=C1 JZ2903 [0,2,0,0,0,0|0,0,0]=2 834 B9R1.6 N=C(N)C1=CC=NC=C1 YH55019 [0,2,0,0,0,0|0,0,0]=2 835 B9R1.6 NC(=O)C1=CC=CC=C1 CJ3392 [0,2,0,0,0,0|1,0,0]=3 836 B9R1.6 NC(=O)C1=CC=CC=C1 LT4036 [0,2,0,0,0,0|1,0,0]=3 837 B9R1.6 NC(=O)C1=CC=CN=C1 XJ0261 [0,2,0,0,0,0|2,0,0]=4 838 B9R1.6 NC(=O)C1=CC=NC=C1 XJ1788 [0,2,0,0,0,0|0,0,0]=2 839 B9R1.6 NC(=S)C1=CC=CC=C1 XJ2085 [0,2,0,0,0,0|1,0,0]=3 840 B9R1.6 O=C(F)C1=CC=CC=C1 HL1804 [0,2,0,0,0,0|2,0,0]=4 841 B9R1.6 O=C(O)C1=CC=NC=C1 JZ0786 [0,2,0,0,0,0|1,0,0]=3 842 B9R1.6 O=C(O)C1=CN=NC=C1 XJ5546 [0,2,0,0,0,0|2,0,0]=4 843 B9R1.6 O=C(O)C1=NC=NC=C1 LQ4720 [0,2,0,0,0,0|2,0,0]=4 844 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0026 [0,2,0,0,0,0|2,0,0]=4 845 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0027 [0,2,0,0,0,0|2,0,0]=4 846 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ0044 [0,2,0,0,0,0|2,0,0]=4 847 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ4278 [0,2,0,0,0,0|2,0,0]=4 848 B9R1.6 O=C([O-])C1=CC=CC=C1 LT4848 [0,2,0,0,0,0|2,0,0]=4 849 B9R1.6 O=C([O-])C1=CC=CC=C1 XJ0991 [0,2,0,0,0,0|2,0,0]=4 850 B9R1.6 O=S(O)C1=CC=CC=C1 LQ1215 [0,2,0,0,0,0|2,0,0]=4 851 B9R1.6 O=S([O-])C1=CC=CC=C1 LL1085 [0,2,0,0,0,0|2,0,0]=4 852 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 XJ0263 [0,2,0,0,0,0|1,0,1]=4 853 B9R1.6 O=[P+]([O-])C1=CC=CC=C1 LQ2659 [0,2,0,0,0,0|1,1,0]=4 854 B9R1.6 OB(O)C1=CC=CC=C1 JZ0681 [0,2,0,0,0,0|2,0,0]=4 855 B9R1.6 OB(O)C1=CC=NC=C1 CJ2813 [0,2,0,0,0,0|1,0,0]=3 856 B9R1.6 [18O]=C([18OH])C1=CC=CC=C1 RT11444 [0,2,0,0,0,0|2,0,0]=4 857 B9R1.6 [SiH](Cl)(Cl)C1=CC=CC=C1 HL0912 [0,2,0,0,0,0|2,0,0]=4 858 B9R1.8 BrCCC1=CC=CC=C1 LL0334 [0,2,0,0,0,0|2,0,0]=4 859 B9R1.8 BrCCC1=CC=NC=C1 CJ2885 [0,2,0,0,0,0|1,0,0]=3 860 B9R1.8 C=CSC1=CC=CC=C1 HL0999 [0,2,0,0,0,0|2,0,0]=4 861 B9R1.8 CCCC1=CC=NC=C1 LT3807 [0,2,0,0,0,0|1,0,0]=3 862 B9R1.8 CCSC1=CC=CC=C1 JZ4001 [0,2,0,0,0,0|2,0,0]=4 863 B9R1.8 CNCC1=CC=CC=C1 RT3204 [0,2,0,0,0,0|1,0,0]=3 864 B9R1.8 CNCC1=CC=CN=C1 LQ4200 [0,2,0,0,0,0|2,0,0]=4 865 B9R1.8 CSSC1=CC=CC=C1 JZ4887 [0,2,0,0,0,0|2,0,0]=4 866 B9R1.8 C\C=C\C1=CC=CC=C1 RT6350 [0,2,0,0,0,0|2,0,0]=4 867 B9R1.8 C\C=C\C1=CC=CC=C1 RT6415 [0,2,0,0,0,0|2,0,0]=4 868 B9R1.8 ClCCC1=CC=CC=C1 JZ3996 [0,2,0,0,0,0|2,0,0]=4 869 B9R1.8 ClCCC1=CC=CC=C1 JZ4528 [0,2,0,0,0,0|2,0,0]=4 870 B9R1.8 ClCCC1=CC=NC=C1 CJ2857 [0,2,0,0,0,0|1,0,0]=3 871 B9R1.8 N#COC1=CC=CC=C1 RT6011 [0,2,0,0,0,0|1,0,1]=4 872 B9R1.8 NCCC1=CC=CN=C1 LQ4201 [0,2,0,0,0,0|2,0,0]=4 873 B9R1.8 NCCC1=CC=NC=C1 YH11719 [0,2,0,0,0,0|0,0,0]=2 874 B9R1.8 NNCC1=CC=CC=C1 LQ1000 [0,2,0,0,0,0|1,0,0]=3 875 B9R1.8 NNCC1=CC=CC=C1 LX3048 [0,2,0,0,0,0|1,0,0]=3 876 B9R1.8 NOCC1=CC=CC=C1 LT5864 [0,2,0,0,0,0|1,0,0]=3 877 B9R1.8 O=C=NC1=CC=CC=C1 LL0339 [0,2,0,0,0,0|1,0,1]=4 878 B9R1.8 O=CCC1=CC=CC=C1 XJ0479 [0,2,0,0,0,0|2,0,0]=4 879 B9R1.8 O=COC1=CC=CC=C1 HL2038 [0,2,0,0,0,0|2,0,0]=4 880 B9R1.8 OCCC1=CC=CC=C1 YH43593 [0,2,0,0,0,0|2,0,0]=4 881 B9R1.8 OCCC1=CC=NC=C1 XJ2857 [0,2,0,0,0,0|1,0,0]=3 882 B9R1.8 O\N=C\C1=CC=CC=C1 RT6343 [0,2,0,0,0,0|1,0,1]=4 883 B9R1.8 SCCC1=CC=NC=C1 RT10479 [0,2,0,0,0,0|1,0,0]=3 884 B9R1.8 [2H]\C=C\C1=CC=CC=C1 RT11345 [0,2,0,0,0,0|2,0,0]=4 885 B9R1.15 BrCC1=C(Br)C=CC=C1 LT0304 [0,2,0,0,0,0|2,0,0]=4 886 B9R1.15 BrCC1=C(I)C=CC=C1 LQ5027 [0,2,0,0,0,0|2,0,0]=4 887 B9R1.15 C#CC1=C(Br)C=CC=C1 SY0117 [0,2,0,0,0,0|2,0,0]=4 888 B9R1.15 C#CC1=C(Cl)C=CC=C1 XJ1422 [0,2,0,0,0,0|2,0,0]=4 889 B9R1.15 C#CC1=C(F)C=CC=C1 SY0296 [0,2,0,0,0,0|2,0,0]=4 890 B9R1.15 C#CC1=CC=CC=C1C SY0118 [0,2,0,0,0,0|2,0,0]=4 891 B9R1.15 C#CC1=CC=CC=C1N XJ5657 [0,2,0,0,0,0|1,0,0]=3 892 B9R1.15 C(=O)C1=C(Cl)C=CC=C1 XJ0153 [0,2,0,0,0,0|2,0,0]=4 893 B9R1.15 C(=O)C1=C(F)C=CC=C1 LT6545 [0,2,0,0,0,0|2,0,0]=4 894 B9R1.15 C(=O)C1=CN=CC=C1Br YH36722 [0,2,0,0,0,0|1,0,0]=3 895 B9R1.15 C(=O)C1=CN=CC=C1Cl YH25552 [0,2,0,0,0,0|1,0,0]=3 896 B9R1.15 C=CC1=C(Br)C=CC=C1 XJ2039 [0,2,0,0,0,0|2,0,0]=4 897 B9R1.15 C=CC1=C(F)C=CC=C1 HL1763 [0,2,0,0,0,0|2,0,0]=4 898 B9R1.15 C=CC1=CC=CC=C1C XJ1115 [0,2,0,0,0,0|2,0,0]=4 899 B9R1.15 C=CC1=CC=CC=C1O RT11656 [0,2,0,0,0,0|2,0,0]=4 900 B9R1.15 CC1=C(C#N)C=CC=C1 LQ0969 [0,2,0,0,0,0|1,0,1]=4 901 B9R1.15 CC1=C(C#N)C=CN=C1 RT15452 [0,2,0,0,0,0|0,0,1]=3 902 B9R1.15 CC1=C(C#N)C=NC=C1 LQ2868 [0,2,0,0,0,0|1,0,0]=3 903 B9R1.15 CC1=CC=CC=C1C=O LQ0970 [0,2,0,0,0,0|2,0,0]=4 904 B9R1.15 CC1=CC=CC=C1CN XJ0151 [0,2,0,0,0,0|1,0,0]=3 905 B9R1.15 CC1=CC=CN=C1CN LT3920 [0,2,0,0,0,0|2,0,0]=4 906 B9R1.15 CC1=CN=CN=C1CN RT2792 [0,2,0,0,0,0|1,0,0]=3 907 B9R1.15 CCC1=C(Br)C=CC=C1 JZ1837 [0,2,0,0,0,0|2,0,0]=4 908 B9R1.15 CCC1=C(Br)C=NC=C1 LQ4988 [0,2,0,0,0,0|1,0,0]=3 909 B9R1.15 CCC1=C(C)C=CN=C1 LQ0971 [0,2,0,0,0,0|1,0,0]=3 910 B9R1.15 CCC1=C(F)C=NC=N1 YH33319 [0,2,0,0,0,0|2,0,0]=4 911 B9R1.15 CCC1=CC=CC=C1F RT10529 [0,2,0,0,0,0|2,0,0]=4 912 B9R1.15 CCC1=CC=CC=C1I XJ4411 [0,2,0,0,0,0|2,0,0]=4 913 B9R1.15 CCC1=CC=CC=C1S LT1736 [0,2,0,0,0,0|2,0,0]=4 914 B9R1.15 CCC1=CC=CN=C1N RT2490 [0,2,0,0,0,0|2,0,0]=4 915 B9R1.15 CNC1=C(F)C=CC=C1 RT3629 [0,2,0,0,0,0|1,0,0]=3 916 B9R1.15 CNC1=CC=CC=C1C XJ1117 [0,2,0,0,0,0|1,0,0]=3 917 B9R1.15 COC1=C(Br)C=CC=C1 LT0298 [0,2,0,0,0,0|2,0,0]=4 918 B9R1.15 COC1=C(F)C=CC=C1 LT6544 [0,2,0,0,0,0|2,0,0]=4 919 B9R1.15 COC1=C(N)C=NC=C1 YH55284 [0,2,0,0,0,0|1,0,0]=3 920 B9R1.15 COC1=CC=CC=C1O LT7681 [0,2,0,0,0,0|2,0,0]=4 921 B9R1.15 COC1=CC=CN=C1N XJ3561 [0,2,0,0,0,0|2,0,0]=4 922 B9R1.15 COC1=CN=CN=C1N LQ1357 [0,2,0,0,0,0|1,0,0]=3 923 B9R1.15 COC1=NC=CC=C1N LQ4218 [0,2,0,0,0,0|2,0,0]=4 924 B9R1.15 CSC1=C(Cl)C=CC=C1 JZ5186 [0,2,0,0,0,0|2,0,0]=4 925 B9R1.15 CSC1=C(F)C=CC=C1 XJ1257 [0,2,0,0,0,0|2,0,0]=4 926 B9R1.15 CSC1=CC=CC=C1C JZ4854 [0,2,0,0,0,0|2,0,0]=4 927 B9R1.15 CSC1=CC=CC=C1I LQ4804 [0,2,0,0,0,0|2,0,0]=4 928 B9R1.15 CSC1=CC=CC=C1O JZ4356 [0,2,0,0,0,0|2,0,0]=4 929 B9R1.15 ClC1=CC=CC=C1CBr XJ1116 [0,2,0,0,0,0|2,0,0]=4 930 B9R1.15 ClCC1=CC=CC=C1Br JZ3842 [0,2,0,0,0,0|2,0,0]=4 931 B9R1.15 FC1=C(CBr)C=CC=C1 XJ0768 [0,2,0,0,0,0|2,0,0]=4 932 B9R1.15 FC1=CC=CC=C1CBr RT11192 [0,2,0,0,0,0|2,0,0]=4 933 B9R1.15 N#CC1=C(Br)C=CC=C1 LT0301 [0,2,0,0,0,0|1,0,1]=4 934 B9R1.15 N#CC1=C(Br)C=NC=C1 LQ3706 [0,2,0,0,0,0|0,0,1]=3 935 B9R1.15 N#CC1=C(Cl)C=CC=C1 CJ2994 [0,2,0,0,0,0|1,0,1]=4 936 B9R1.15 N#CC1=C(Cl)C=NC=C1 XJ6157 [0,2,0,0,0,0|0,0,1]=3 937 B9R1.15 N#CC1=C(F)C=CC=C1 LT6546 [0,2,0,0,0,0|1,0,1]=4 938 B9R1.15 N#CC1=C(F)C=CN=C1 YH23267 [0,2,0,0,0,0|1,0,0]=3 939 B9R1.15 N#CC1=C(I)C=CC=C1 JZ2517 [0,2,0,0,0,0|1,0,1]=4 940 B9R1.15 N#CC1=C(N)C=CC=C1 RT1553 [0,2,0,0,0,0|1,0,0]=3 941 B9R1.15 N#CC1=C(N)C=NC=C1 LL1429 [0,2,0,0,0,0|0,0,1]=3 942 B9R1.15 N#CC1=C(O)C=CC=C1 YH09892 [0,2,0,0,0,0|1,0,1]=4 943 B9R1.15 N#CC1=CC=CN=C1N LT3414 [0,2,0,0,0,0|2,0,0]=4 944 B9R1.15 N#CC1=CN=CC=C1Cl RT9283 [0,2,0,0,0,0|1,0,0]=3 945 B9R1.15 N#CC1=CN=CC=C1O YH93754 [0,2,0,0,0,0|1,0,0]=3 946 B9R1.15 N#CC1=CN=CN=C1O JZ2594 [0,2,0,0,0,0|2,0,0]=4 947 B9R1.15 N#CC1=NC=CC=C1N YH00943 [0,2,0,0,0,0|2,0,0]=4 948 B9R1.15 NC1=C(C=O)C=CN=C1 RT2203 [0,2,0,0,0,0|1,0,0]=3 949 B9R1.15 NC1=C(C=O)C=NC=C1 YH01035 [0,2,0,0,0,0|0,0,0]=2 950 B9R1.15 NC1=C(C=O)N=CC=C1 RT2315 [0,2,0,0,0,0|2,0,0]=4 951 B9R1.15 NC1=C(CO)C=NC=C1 HL3458 [0,2,0,0,0,0|0,0,0]=2 952 B9R1.15 NC1=CC=CC=C1CO LT2291 [0,2,0,0,0,0|1,0,0]=3 953 B9R1.15 NC1=NC=CC=C1C=O LX3234 [0,2,0,0,0,0|2,0,0]=4 954 B9R1.15 NC1=NC=CC=C1CO JZ5602 [0,2,0,0,0,0|2,0,0]=4 955 B9R1.15 NCC1=C(I)C=CC=C1 YH59249 [0,2,0,0,0,0|1,0,0]=3 956 B9R1.15 NCC1=C(N)C=CC=C1 YH52512 [0,2,0,0,0,0|1,0,0]=3 957 B9R1.15 NCC1=C(O)C=CC=C1 LQ1562 [0,2,0,0,0,0|1,0,0]=3 958 B9R1.15 NCC1=CC=CC=C1Br LT0305 [0,2,0,0,0,0|1,0,0]=3 959 B9R1.15 NCC1=CC=CC=C1Cl LT6512 [0,2,0,0,0,0|1,0,0]=3 960 B9R1.15 NCC1=CC=CN=C1Cl YH66504 [0,2,0,0,0,0|2,0,0]=4 961 B9R1.15 NCC1=CC=CNC1=O RT2213 [0,2,0,0,0,0|2,0,0]=4 962 B9R1.15 NNC1=C(F)C=CC=C1 JZ2154 [0,2,0,0,0,0|1,0,0]=3 963 B9R1.15 NNC1=CC=CC=C1Br XJ5550 [0,2,0,0,0,0|1,0,0]=3 964 B9R1.15 NNC1=CC=CC=C1F LT1512 [0,2,0,0,0,0|1,0,0]=3 965 B9R1.15 O=CC1=C(Br)C=CC=C1 LT0299 [0,2,0,0,0,0|2,0,0]=4 966 B9R1.15 O=CC1=C(Br)C=NC=C1 YH14731 [0,2,0,0,0,0|1,0,0]=3 967 B9R1.15 O=CC1=C(F)C=NC=C1 LT3415 [0,2,0,0,0,0|1,0,0]=3 968 B9R1.15 O=CC1=C(O)C=NC=C1 YH42136 [0,2,0,0,0,0|1,0,0]=3 969 B9R1.15 OCC1=C(Cl)C=CC=C1 LT1480 [0,2,0,0,0,0|2,0,0]=4 970 B9R1.15 OCC1=C(Cl)C=CN=C1 HL3791 [0,2,0,0,0,0|1,0,0]=3 971 B9R1.15 OCC1=C(F)C=CC=C1 XJ0769 [0,2,0,0,0,0|2,0,0]=4 972 B9R1.15 OCC1=C(F)C=NC=C1 YH90998 [0,2,0,0,0,0|1,0,0]=3 973 B9R1.15 OCC1=C(I)C=CC=C1 LQ2821 [0,2,0,0,0,0|2,0,0]=4 974 B9R1.15 OCC1=CC=CC=C1Br LQ4155 [0,2,0,0,0,0|2,0,0]=4 975 B9R1.15 OCC1=CC=NC=C1Cl YH65905 [0,2,0,0,0,0|1,0,0]=3 976 B9R1.15 SCC1=C(Cl)C=CC=C1 XJ5403 [0,2,0,0,0,0|2,0,0]=4 977 B9R1.69 BrC1=CC=C(Br)C(Br)=C1 HL0208 [0,2,0,0,0,0|2,0,0]=4 978 B9R1.69 CC1=C(Br)C=C(Br)C=C1 LQ4730 [0,2,0,0,0,0|2,0,0]=4 979 B9R1.69 CC1=C(Br)C=C(Cl)C=C1 JZ5771 [0,2,0,0,0,0|2,0,0]=4 980 B9R1.69 CC1=C(Br)C=CC(F)=C1 XJ0793 [0,2,0,0,0,0|2,0,0]=4 981 B9R1.69 CC1=C(Br)C=CC(O)=C1 YH34913 [0,2,0,0,0,0|2,0,0]=4 982 B9R1.69 CC1=C(Br)C=NC(N)=N1 YH39917 [0,2,0,0,0,0|2,0,0]=4 983 B9R1.69 CC1=C(C)C=C(O)C=C1 LQ0281 [0,2,0,0,0,0|2,0,0]=4 984 B9R1.69 CC1=C(Cl)C=C(F)C=C1 LT6493 [0,2,0,0,0,0|2,0,0]=4 985 B9R1.69 CC1=C(Cl)C=C(N)C=C1 LT2581 [0,2,0,0,0,0|1,0,0]=3 986 B9R1.69 CC1=C(Cl)N=NC(Cl)=C1 JZ5284 [0,2,0,0,0,0|2,0,0]=4 987 B9R1.69 CC1=C(F)C=C(Br)C=C1 LQ5173 [0,2,0,0,0,0|2,0,0]=4 988 B9R1.69 CC1=C(F)C=C(N)C=C1 XJ0801 [0,2,0,0,0,0|1,0,0]=3 989 B9R1.69 CC1=C(F)C=CC(N)=C1 XJ0797 [0,2,0,0,0,0|1,0,0]=3 990 B9R1.69 CC1=C(I)C=C(F)N=C1 LT6534 [0,2,0,0,0,0|1,0,0]=3 991 B9R1.69 CC1=C(I)C=CC(N)=N1 XJ6323 [0,2,0,0,0,0|2,0,0]=4 992 B9R1.69 CC1=C(N)C=C(F)C=C1 XJ0672 [0,2,0,0,0,0|1,0,0]=3 993 B9R1.69 CC1=C(N)C=CC(Br)=N1 LQ5483 [0,2,0,0,0,0|2,0,0]=4 994 B9R1.69 CC1=C(N)C=CC(O)=C1 LT2719 [0,2,0,0,0,0|1,0,0]=3 995 B9R1.69 CC1=C(N)N=CC(Br)=C1 HL2567 [0,2,0,0,0,0|2,0,0]=4 996 B9R1.69 CC1=C(O)C=C(Cl)C=C1 YH05518 [0,2,0,0,0,0|2,0,0]=4 997 B9R1.69 CC1=C(O)C=CC(Br)=C1 LQ2103 [0,2,0,0,0,0|2,0,0]=4 998 B9R1.69 CC1=C(O)C=CC(O)=C1 LQ0285 [0,2,0,0,0,0|2,0,0]=4 999 B9R1.69 CC1=CC(=O)C(O)=CO1 RT15432 [0,2,0,0,0,0|2,0,0]=4 1000 B9R1.69 CC1=CC(=O)C=CC1=O HL0031 [0,2,0,0,0,0|2,0,0]=4 1001 B9R1.69 CC1=CC(Br)=C(N)C=C1 LT1676 [0,2,0,0,0,0|1,0,0]=3 1002 B9R1.69 CC1=CC(Br)=C(N)N=C1 LT0234 [0,2,0,0,0,0|2,0,0]=4 1003 B9R1.69 CC1=CC(Br)=C(O)C=C1 YH12652 [0,2,0,0,0,0|2,0,0]=4 1004 B9R1.69 CC1=CC(Br)=CC=C1F LQ5174 [0,2,0,0,0,0|2,0,0]=4 1005 B9R1.69 CC1=CC(Br)=CC=C1N JZ3670 [0,2,0,0,0,0|1,0,0]=3 1006 B9R1.69 CC1=CC(Br)=CC=C1N LT6207 [0,2,0,0,0,0|1,0,0]=3 1007 B9R1.69 CC1=CC(Br)=NC=C1Br LQ2432 [0,2,0,0,0,0|1,0,0]=3 1008 B9R1.69 CC1=CC(Br)=NC=C1N YH37091 [0,2,0,0,0,0|1,0,0]=3 1009 B9R1.69 CC1=CC(C)=C(S)C=C1 JZ4786 [0,2,0,0,0,0|2,0,0]=4 1010 B9R1.69 CC1=CC(C)=NC=C1N YH27545 [0,2,0,0,0,0|1,0,0]=3 1011 B9R1.69 CC1=CC(Cl)=C(I)C=C1 HL3311 [0,2,0,0,0,0|2,0,0]=4 1012 B9R1.69 CC1=CC(Cl)=CC=C1Br LT1934 [0,2,0,0,0,0|2,0,0]=4 1013 B9R1.69 CC1=CC(Cl)=CC=C1Cl XJ4478 [0,2,0,0,0,0|2,0,0]=4 1014 B9R1.69 CC1=CC(Cl)=CC=C1N LT6087 [0,2,0,0,0,0|1,0,0]=3 1015 B9R1.69 CC1=CC(Cl)=NC=C1Br HL4647 [0,2,0,0,0,0|1,0,0]=3 1016 B9R1.69 CC1=CC(F)=C(Cl)C=C1 CJ2460 [0,2,0,0,0,0|2,0,0]=4 1017 B9R1.69 CC1=CC(I)=CC=C1F XJ0796 [0,2,0,0,0,0|2,0,0]=4 1018 B9R1.69 CC1=CC(I)=CC=C1N JZ3669 [0,2,0,0,0,0|1,0,0]=3 1019 B9R1.69 CC1=CC(I)=CN=C1N LT3297 [0,2,0,0,0,0|2,0,0]=4 1020 B9R1.69 CC1=CC(N)=C(I)C=C1 YH31788 [0,2,0,0,0,0|1,0,0]=3 1021 B9R1.69 CC1=CC(N)=CC=C1Cl RT6370 [0,2,0,0,0,0|1,0,0]=3 1022 B9R1.69 CC1=CC(N)=CC=C1N LQ0284 [0,2,0,0,0,0|1,0,0]=3 1023 B9R1.69 CC1=CC(N)=CC=C1N LT1172 [0,2,0,0,0,0|1,0,0]=3 1024 B9R1.69 CC1=CC(N)=CC=C1O LT2718 [0,2,0,0,0,0|1,0,0]=3 1025 B9R1.69 CC1=CC(N)=CN=C1Br LQ4917 [0,2,0,0,0,0|2,0,0]=4 1026 B9R1.69 CC1=CC(N)=CN=C1Cl CJ2883 [0,2,0,0,0,0|2,0,0]=4 1027 B9R1.69 CC1=CC(N)=CN=C1F HL3758 [0,2,0,0,0,0|2,0,0]=4 1028 B9R1.69 CC1=CC(N)=CN=C1N YH23255 [0,2,0,0,0,0|2,0,0]=4 1029 B9R1.69 CC1=CC(N)=NC=C1Br LT3917 [0,2,0,0,0,0|1,0,0]=3 1030 B9R1.69 CC1=CC(N)=NN=C1Cl YH12699 [0,2,0,0,0,0|2,0,0]=4 1031 B9R1.69 CC1=CC(O)=C(C)C=C1 LQ0291 [0,2,0,0,0,0|2,0,0]=4 1032 B9R1.69 CC1=CC(O)=C(N)N=C1 YH44733 [0,2,0,0,0,0|2,0,0]=4 1033 B9R1.69 CC1=CC(O)=C(O)C=C1 XJ0808 [0,2,0,0,0,0|2,0,0]=4 1034 B9R1.69 CC1=CC(O)=CC=C1Cl YH09016 [0,2,0,0,0,0|2,0,0]=4 1035 B9R1.69 CC1=CC(O)=CC=C1I LX2207 [0,2,0,0,0,0|2,0,0]=4 1036 B9R1.69 CC1=CC(S)=CC=C1O RT13148 [0,2,0,0,0,0|2,0,0]=4 1037 B9R1.69 CC1=CC=C(Br)C(Br)=C1 JZ2179 [0,2,0,0,0,0|2,0,0]=4 1038 B9R1.69 CC1=CC=C(Br)C=C1C XJ1013 [0,2,0,0,0,0|2,0,0]=4 1039 B9R1.69 CC1=CC=C(Br)C=C1N XJ5349 [0,2,0,0,0,0|1,0,0]=3 1040 B9R1.69 CC1=CC=C(C)C(Br)=C1 HL0030 [0,2,0,0,0,0|2,0,0]=4 1041 B9R1.69 CC1=CC=C(C)C(Cl)=C1 LT6510 [0,2,0,0,0,0|2,0,0]=4 1042 B9R1.69 CC1=CC=C(Cl)C(C)=C1 LQ0282 [0,2,0,0,0,0|2,0,0]=4 1043 B9R1.69 CC1=CC=C(Cl)C(O)=C1 LT2298 [0,2,0,0,0,0|2,0,0]=4 1044 B9R1.69 CC1=CC=C(F)C(N)=C1 XJ0807 [0,2,0,0,0,0|1,0,0]=3 1045 B9R1.69 CC1=CC=C(I)C(C)=C1 HL2726 [0,2,0,0,0,0|2,0,0]=4 1046 B9R1.69 CC1=CC=C(N)C(Br)=N1 LQ5485 [0,2,0,0,0,0|2,0,0]=4 1047 B9R1.69 CC1=CC=C(N)C(C)=N1 LT6121 [0,2,0,0,0,0|2,0,0]=4 1048 B9R1.69 CC1=CC=C(N)C(F)=C1 XJ0803 [0,2,0,0,0,0|1,0,0]=3 1049 B9R1.69 CC1=CC=C(N)C=C1Br LT6727 [0,2,0,0,0,0|1,0,0]=3 1050 B9R1.69 CC1=CC=C(N)C=C1Cl JZ3196 [0,2,0,0,0,0|1,0,0]=3 1051 B9R1.69 CC1=CC=C(N)C=C1I LQ4886 [0,2,0,0,0,0|1,0,0]=3 1052 B9R1.69 CC1=CC=C(O)C(F)=C1 HL4211 [0,2,0,0,0,0|2,0,0]=4 1053 B9R1.69 CC1=CC=C(O)C=C1F XJ0802 [0,2,0,0,0,0|2,0,0]=4 1054 B9R1.69 CC1=CC=C([NH3+])C=C1[NH3+] XJ6043 [0,2,0,0,0,0|1,0,1]=4 1055 B9R1.69 CC1=CN=C(Cl)C=C1Cl XJ5761 [0,2,0,0,0,0|1,0,0]=3 1056 B9R1.69 CC1=NC(Cl)=C(N)C=C1 YH59115 [0,2,0,0,0,0|2,0,0]=4 1057 B9R1.69 CC1=NC(Cl)=CC=C1N YH38501 [0,2,0,0,0,0|2,0,0]=4 1058 B9R1.69 CC1=NC(Cl)=NC=C1N YH44336 [0,2,0,0,0,0|2,0,0]=4 1059 B9R1.69 CC1=NC(F)=CC=C1N YH51909 [0,2,0,0,0,0|2,0,0]=4 1060 B9R1.69 CC1=NC(N)=C(Br)C=C1 LQ5482 [0,2,0,0,0,0|2,0,0]=4 1061 B9R1.69 CC1=NC(N)=C(O)C=C1 YH44732 [0,2,0,0,0,0|2,0,0]=4 1062 B9R1.69 CC1=NC=C(Br)C=C1N LX2489 [0,2,0,0,0,0|2,0,0]=4 1063 B9R1.69 ClC1=C(Br)C=CC(Br)=C1 LQ2476 [0,2,0,0,0,0|2,0,0]=4 1064 B9R1.69 ClC1=C(Cl)C=C(I)C=C1 JZ5410 [0,2,0,0,0,0|2,0,0]=4 1065 B9R1.69 ClC1=CC(Br)=C(Cl)C=C1 XJ1748 [0,2,0,0,0,0|2,0,0]=4 1066 B9R1.69 ClC1=CC(Cl)=C(I)C=C1 XJ5016 [0,2,0,0,0,0|2,0,0]=4 1067 B9R1.69 ClC1=CC(Cl)=NC=C1Br YH89415 [0,2,0,0,0,0|1,0,0]=3 1068 B9R1.69 ClC1=CC(Cl)=NC=C1I YH55711 [0,2,0,0,0,0|1,0,0]=3 1069 B9R1.69 ClC1=CC(Cl)=NN=C1Cl JZ2856 [0,2,0,0,0,0|2,0,0]=4 1070 B9R1.69 ClC1=CC(I)=C(Cl)C=C1 XJ4985 [0,2,0,0,0,0|2,0,0]=4 1071 B9R1.69 ClC1=CN=C(Cl)C=C1Cl YH57336 [0,2,0,0,0,0|1,0,0]=3 1072 B9R1.69 ClC1=CN=C(Cl)N=C1Cl YH07978 [0,2,0,0,0,0|2,0,0]=4 1073 B9R1.69 ClC1=NC(Cl)=C(I)C=N1 LQ3673 [0,2,0,0,0,0|2,0,0]=4 1074 B9R1.69 ClC1=NC=C(Br)C(Cl)=N1 LT6083 [0,2,0,0,0,0|2,0,0]=4 1075 B9R1.69 FC1=C(Br)C=C(Cl)N=C1 LX3052 [0,2,0,0,0,0|1,0,0]=3 1076 B9R1.69 FC1=C(Br)C=CC(Br)=C1 YH34611 [0,2,0,0,0,0|2,0,0]=4 1077 B9R1.69 FC1=C(Br)C=CC(Cl)=C1 RT6134 [0,2,0,0,0,0|2,0,0]=4 1078 B9R1.69 FC1=C(Br)C=CC(I)=C1 SY0135 [0,2,0,0,0,0|2,0,0]=4 1079 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 YH09713 [0,2,0,0,0,0|2,0,0]=4 1080 B9R1.69 FC1=C(Cl)C=C(Cl)C=C1 LT0115 [0,2,0,0,0,0|2,0,0]=4 1081 B9R1.69 FC1=C(F)C=C(Br)C=C1 LT0064 [0,2,0,0,0,0|2,0,0]=4 1082 B9R1.69 FC1=C(F)C=C(I)C=C1 HL4271 [0,2,0,0,0,0|2,0,0]=4 1083 B9R1.69 FC1=C(I)C=CC(Br)=C1 SY0084 [0,2,0,0,0,0|2,0,0]=4 1084 B9R1.69 FC1=C(I)C=CC(Cl)=C1 LQ3177 [0,2,0,0,0,0|2,0,0]=4 1085 B9R1.69 FC1=CC(Br)=C(Br)C=C1 LQ2151 [0,2,0,0,0,0|2,0,0]=4 1086 B9R1.69 FC1=CC(Br)=C(F)C=C1 YH59271 [0,2,0,0,0,0|2,0,0]=4 1087 B9R1.69 FC1=CC(Cl)=C(Br)C=C1 LL1861 [0,2,0,0,0,0|2,0,0]=4 1088 B9R1.69 FC1=CC(Cl)=C(F)C=C1 LQ2146 [0,2,0,0,0,0|2,0,0]=4 1089 B9R1.69 FC1=CC(Cl)=C(I)C=C1 YH20879 [0,2,0,0,0,0|2,0,0]=4 1090 B9R1.69 FC1=CC(F)=C(F)C=C1 LT0039 [0,2,0,0,0,0|2,0,0]=4 1091 B9R1.69 FC1=CC(F)=C(S)C=C1 XJ1972 [0,2,0,0,0,0|2,0,0]=4 1092 B9R1.69 FC1=CC(I)=C(Cl)C=C1 YH44645 [0,2,0,0,0,0|2,0,0]=4 1093 B9R1.69 FC1=CC=C(Br)C=C1Br XJ1749 [0,2,0,0,0,0|2,0,0]=4 1094 B9R1.69 FC1=CC=C(Cl)C=C1Br XJ1971 [0,2,0,0,0,0|2,0,0]=4 1095 B9R1.69 FC1=CC=C(F)C(I)=C1 HL2162 [0,2,0,0,0,0|2,0,0]=4 1096 B9R1.69 FC1=CN=C(Cl)C=C1I LX2559 [0,2,0,0,0,0|1,0,0]=3 1097 B9R1.69 FC1=CN=C(Cl)N=C1Cl LX3118 [0,2,0,0,0,0|2,0,0]=4 1098 B9R1.69 FC1=CN=C(F)C=C1Cl YH89729 [0,2,0,0,0,0|1,0,0]=3 1099 B9R1.69 FC1=NC=C(Cl)C(F)=N1 RT16460 [0,2,0,0,0,0|2,0,0]=4 1100 B9R1.69 FC1=NC=C(Cl)C(I)=C1 YH12487 [0,2,0,0,0,0|1,0,0]=3 1101 B9R1.69 NC1=C(Br)C=C(Br)C=C1 LQ1164 [0,2,0,0,0,0|1,0,0]=3 1102 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 YH88167 [0,2,0,0,0,0|1,0,0]=3 1103 B9R1.69 NC1=C(Br)N=C(Br)C=C1 LT5996 [0,2,0,0,0,0|2,0,0]=4 1104 B9R1.69 NC1=C(Cl)C=C(Cl)N=C1 YH16149 [0,2,0,0,0,0|1,0,0]=3 1105 B9R1.69 NC1=C(Cl)C=C(F)C=C1 LT6490 [0,2,0,0,0,0|1,0,0]=3 1106 B9R1.69 NC1=C(Cl)C=C(O)C=C1 LQ4032 [0,2,0,0,0,0|1,0,0]=3 1107 B9R1.69 NC1=C(Cl)C=CC(F)=C1 XJ0806 [0,2,0,0,0,0|1,0,0]=3 1108 B9R1.69 NC1=C(Cl)C=CC(O)=C1 XJ4211 [0,2,0,0,0,0|1,0,0]=3 1109 B9R1.69 NC1=C(F)C=C(Br)C=N1 YH65575 [0,2,0,0,0,0|2,0,0]=4 1110 B9R1.69 NC1=C(F)C=C(Cl)C=N1 HL3920 [0,2,0,0,0,0|2,0,0]=4 1111 B9R1.69 NC1=C(F)C=C(F)C=C1 LT0119 [0,2,0,0,0,0|1,0,0]=3 1112 B9R1.69 NC1=C(F)C=CC(Cl)=C1 LQ2049 [0,2,0,0,0,0|1,0,0]=3 1113 B9R1.69 NC1=C(F)C=CC(F)=C1 LT0148 [0,2,0,0,0,0|1,0,0]=3 1114 B9R1.69 NC1=C(F)C=CC(O)=C1 M0400834 [0,2,0,0,0,0|1,0,0]=3 1115 B9R1.69 NC1=C(I)C=C(Cl)C=C1 YH11063 [0,2,0,0,0,0|1,0,0]=3 1116 B9R1.69 NC1=C(I)C=C(Cl)N=C1 YH56290 [0,2,0,0,0,0|1,0,0]=3 1117 B9R1.69 NC1=C(I)C=NC(=O)N1 YH25083 [0,2,0,0,0,0|1,0,0]=3 1118 B9R1.69 NC1=C(N)C=C(Br)C=C1 LX3245 [0,2,0,0,0,0|1,0,0]=3 1119 B9R1.69 NC1=C(N)C=C(Cl)C=C1 YH98156 [0,2,0,0,0,0|1,0,0]=3 1120 B9R1.69 NC1=C(N)C=C(Cl)N=C1 LX3318 [0,2,0,0,0,0|0,0,0]=2 1121 B9R1.69 NC1=C(O)C=C(F)C=C1 LQ5316 [0,2,0,0,0,0|1,0,0]=3 1122 B9R1.69 NC1=C(O)C=CC(Br)=C1 LT5832 [0,2,0,0,0,0|1,0,0]=3 1123 B9R1.69 NC1=C(O)C=CC(Cl)=C1 LT0241 [0,2,0,0,0,0|1,0,0]=3 1124 B9R1.69 NC1=C(O)C=CC(F)=C1 LQ0755 [0,2,0,0,0,0|1,0,0]=3 1125 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 LT6635 [0,2,0,0,0,0|1,0,0]=3 1126 B9R1.69 NC1=CC(Cl)=C(Cl)N=C1 YH98654 [0,2,0,0,0,0|2,0,0]=4 1127 B9R1.69 NC1=CC(Cl)=C(F)C=C1 LT6753 [0,2,0,0,0,0|1,0,0]=3 1128 B9R1.69 NC1=CC(Cl)=C(N)C=C1 LL1023 [0,2,0,0,0,0|1,0,0]=3 1129 B9R1.69 NC1=CC(Cl)=C(O)C=C1 LT2569 [0,2,0,0,0,0|1,0,0]=3 1130 B9R1.69 NC1=CC(Cl)=CC=C1S HL0207 [0,2,0,0,0,0|1,0,0]=3 1131 B9R1.69 NC1=CC(Cl)=CN=C1Cl LL1416 [0,2,0,0,0,0|2,0,0]=4 1132 B9R1.69 NC1=CC(Cl)=CN=C1N XJ4870 [0,2,0,0,0,0|2,0,0]=4 1133 B9R1.69 NC1=CC(F)=C(Br)C=C1 XJ1267 [0,2,0,0,0,0|1,0,0]=3 1134 B9R1.69 NC1=CC(F)=C(Cl)C=C1 XJ0671 [0,2,0,0,0,0|1,0,0]=3 1135 B9R1.69 NC1=CC(F)=C(F)C=C1 YH58505 [0,2,0,0,0,0|1,0,0]=3 1136 B9R1.69 NC1=CC(F)=CN=C1Br CJ2672 [0,2,0,0,0,0|2,0,0]=4 1137 B9R1.69 NC1=CC(F)=CN=C1N YH46010 [0,2,0,0,0,0|2,0,0]=4 1138 B9R1.69 NC1=CC(O)=C(Cl)C=C1 YH11377 [0,2,0,0,0,0|1,0,0]=3 1139 B9R1.69 NC1=CC(O)=CC=C1Br YH65969 [0,2,0,0,0,0|1,0,0]=3 1140 B9R1.69 NC1=CC=C(Br)C=C1Cl LQ4992 [0,2,0,0,0,0|1,0,0]=3 1141 B9R1.69 NC1=CC=C(Cl)C=C1F LT6189 [0,2,0,0,0,0|1,0,0]=3 1142 B9R1.69 NC1=CC=C(Cl)N=C1Cl LT6699 [0,2,0,0,0,0|2,0,0]=4 1143 B9R1.69 NC1=CC=C(I)C(F)=C1 XJ1268 [0,2,0,0,0,0|1,0,0]=3 1144 B9R1.69 NC1=CC=C(N)C(Cl)=C1 LT2050 [0,2,0,0,0,0|1,0,0]=3 1145 B9R1.69 NC1=CC=C(N)C(N)=C1 HL0206 [0,2,0,0,0,0|1,0,0]=3 1146 B9R1.69 NC1=CC=C(N)C(N)=N1 RT4340 [0,2,0,0,0,0|2,0,0]=4 1147 B9R1.69 NC1=CC=C(O)C(O)=C1 RT6518 [0,2,0,0,0,0|1,0,0]=3 1148 B9R1.69 NC1=CC=C(O)C(S)=C1 RT3602 [0,2,0,0,0,0|1,0,0]=3 1149 B9R1.69 NC1=CC=C(O)C=C1Cl XJ5658 [0,2,0,0,0,0|1,0,0]=3 1150 B9R1.69 NC1=CC=C(O)C=C1F JZ1731 [0,2,0,0,0,0|1,0,0]=3 1151 B9R1.69 NC1=CC=C(O)C=C1F LQ0754 [0,2,0,0,0,0|1,0,0]=3 1152 B9R1.69 NC1=CN=C(Br)C(Cl)=C1 HL3390 [0,2,0,0,0,0|2,0,0]=4 1153 B9R1.69 NC1=CN=C(Cl)C(Br)=C1 HL3391 [0,2,0,0,0,0|2,0,0]=4 1154 B9R1.69 NC1=CN=C(Cl)N=C1Cl LQ2828 [0,2,0,0,0,0|2,0,0]=4 1155 B9R1.69 NC1=NC(=O)NC=C1F LT7678 [0,2,0,0,0,0|1,0,1]=4 1156 B9R1.69 NC1=NC(Cl)=NC=C1F CJ2257 [0,2,0,0,0,0|1,0,0]=3 1157 B9R1.69 NC1=NC(F)=C(I)C=C1 YH92284 [0,2,0,0,0,0|2,0,0]=4 1158 B9R1.69 NC1=NC=C(Br)C=C1Br LT1854 [0,2,0,0,0,0|2,0,0]=4 1159 B9R1.69 NC1=NC=C(Br)C=C1I LT3522 [0,2,0,0,0,0|2,0,0]=4 1160 B9R1.69 NC1=NC=C(Br)C=C1O YH59214 [0,2,0,0,0,0|2,0,0]=4 1161 B9R1.69 NC1=NC=C(Cl)C=C1Br LT3387 [0,2,0,0,0,0|2,0,0]=4 1162 B9R1.69 NC1=NC=C(F)C=C1Br YH90951 [0,2,0,0,0,0|2,0,0]=4 1163 B9R1.69 NC1=NC=C(F)C=C1F HL4478 [0,2,0,0,0,0|2,0,0]=4 1164 B9R1.69 NC1=NC=C(O)C=C1Cl YH45616 [0,2,0,0,0,0|2,0,0]=4 1165 B9R1.69 O=C1C=C(Br)C(F)=CN1 YH92237 [0,2,0,0,0,0|1,0,1]=4 1166 B9R1.69 O=C1C=CC(=O)C(Cl)=C1 LQ1359 [0,2,0,0,0,0|2,0,0]=4 1167 B9R1.69 OC1=C(Br)C=C(F)C=C1 YH03414 [0,2,0,0,0,0|2,0,0]=4 1168 B9R1.69 OC1=C(Br)C=CC(F)=C1 YH35474 [0,2,0,0,0,0|2,0,0]=4 1169 B9R1.69 OC1=C(Cl)C=C(Cl)C=C1 RT6480 [0,2,0,0,0,0|2,0,0]=4 1170 B9R1.69 OC1=C(Cl)C=C(F)C=C1 LT6492 [0,2,0,0,0,0|2,0,0]=4 1171 B9R1.69 OC1=C(Cl)C=C(I)C=C1 YH26303 [0,2,0,0,0,0|2,0,0]=4 1172 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 YH41939 [0,2,0,0,0,0|2,0,0]=4 1173 B9R1.69 OC1=C(F)C=C(Br)C=C1 LT2452 [0,2,0,0,0,0|2,0,0]=4 1174 B9R1.69 OC1=C(F)C=C(F)C=C1 LT0122 [0,2,0,0,0,0|2,0,0]=4 1175 B9R1.69 OC1=C(F)C=CC(F)=C1 LT0150 [0,2,0,0,0,0|2,0,0]=4 1176 B9R1.69 OC1=C(O)C=C(F)C=C1 XJ0674 [0,2,0,0,0,0|2,0,0]=4 1177 B9R1.69 OC1=CC(Br)=C(F)C=C1 YH51297 [0,2,0,0,0,0|2,0,0]=4 1178 B9R1.69 OC1=CC(Cl)=C(Cl)C=C1 RT11985 [0,2,0,0,0,0|2,0,0]=4 1179 B9R1.69 OC1=CC(Cl)=CC=C1Cl XJ1014 [0,2,0,0,0,0|2,0,0]=4 1180 B9R1.69 OC1=CC(F)=C(F)C=C1 LT6641 [0,2,0,0,0,0|2,0,0]=4 1181 B9R1.69 OC1=CC(F)=CC=C1Br HL3565 [0,2,0,0,0,0|2,0,0]=4 1182 B9R1.69 OC1=CC(O)=C(Br)C=C1 YH12647 [0,2,0,0,0,0|2,0,0]=4 1183 B9R1.69 OC1=CC(O)=C(Cl)C=N1 JZ0204 [0,2,0,0,0,0|1,0,0]=3 1184 B9R1.69 OC1=CC=C(Br)C(Cl)=C1 JZ4792 [0,2,0,0,0,0|2,0,0]=4 1185 B9R1.69 OC1=CC=C(Br)C=C1Br LQ1165 [0,2,0,0,0,0|2,0,0]=4 1186 B9R1.69 OC1=CC=C(Cl)C(F)=C1 LQ0717 [0,2,0,0,0,0|2,0,0]=4 1187 B9R1.69 OC1=CC=C(Cl)C=C1Br LQ1358 [0,2,0,0,0,0|2,0,0]=4 1188 B9R1.69 OC1=CC=C(Cl)C=C1O YH46193 [0,2,0,0,0,0|2,0,0]=4 1189 B9R1.69 OC1=CC=C(I)C=C1F LX2511 [0,2,0,0,0,0|2,0,0]=4 1190 B9R1.69 OC1=CC=C(O)C(Br)=C1 YH66624 [0,2,0,0,0,0|2,0,0]=4 1191 B9R1.69 OC1=CC=C(O)C(Cl)=C1 LT1551 [0,2,0,0,0,0|2,0,0]=4 1192 B9R1.69 OC1=NC(O)=C(O)C=N1 XJ0813 [0,2,0,0,0,0|2,0,0]=4 1193 B9R1.69 OC1=NC=C(Cl)C(O)=N1 LT3277 [0,2,0,0,0,0|2,0,0]=4 1194 B9R1.69 OC1=NC=C(I)C(O)=N1 JZ1176 [0,2,0,0,0,0|2,0,0]=4 1195 B9R1.69 SC1=C(Cl)C=C(Cl)C=C1 HL0645 [0,2,0,0,0,0|2,0,0]=4 1196 B9R1.3 BrC1=CC=CC(Br)=C1Br RT17592 [0,2,0,0,0,0|2,0,0]=4 1197 B9R1.3 BrC1=NC=CC(Br)=C1Br CJ3031 [0,2,0,0,0,0|1,0,0]=3 1198 B9R1.3 CC1=C(Br)C(Br)=NC=C1 LX2592 [0,2,0,0,0,0|1,0,0]=3 1199 B9R1.3 CC1=C(Br)C(O)=NC=C1 XJ4439 [0,2,0,0,0,0|1,0,0]=3 1200 B9R1.3 CC1=C(Br)C=NC=C1Br HL2568 [0,2,0,0,0,0|1,0,0]=3 1201 B9R1.3 CC1=C(C)C(Br)=CC=C1 LX2997 [0,2,0,0,0,0|2,0,0]=4 1202 B9R1.3 CC1=C(C)C(N)=CC=C1 LT0096 [0,2,0,0,0,0|1,0,0]=3 1203 B9R1.3 CC1=C(C)C(O)=CC=C1 HL0747 [0,2,0,0,0,0|2,0,0]=4 1204 B9R1.3 CC1=C(Cl)C(Cl)=NC=C1 YH43073 [0,2,0,0,0,0|1,0,0]=3 1205 B9R1.3 CC1=C(Cl)C=CN=C1Cl LX2386 [0,2,0,0,0,0|1,0,0]=3 1206 B9R1.3 CC1=C(Cl)N=CN=C1Cl RT15197 [0,2,0,0,0,0|2,0,0]=4 1207 B9R1.3 CC1=C(Cl)N=CN=C1N LX2300 [0,2,0,0,0,0|1,0,0]=3 1208 B9R1.3 CC1=C(F)C(N)=CC=C1 LX2113 [0,2,0,0,0,0|1,0,0]=3 1209 B9R1.3 CC1=C(F)C(N)=NC=C1 YH20387 [0,2,0,0,0,0|1,0,0]=3 1210 B9R1.3 CC1=C(F)C=CC=C1Br XJ1733 [0,2,0,0,0,0|2,0,0]=4 1211 B9R1.3 CC1=C(F)C=CC=C1N XJ0748 [0,2,0,0,0,0|1,0,0]=3 1212 B9R1.3 CC1=C(I)C=CN=C1F CJ2125 [0,2,0,0,0,0|1,0,0]=3 1213 B9R1.3 CC1=C(N)C(Br)=NC=C1 YH65456 [0,2,0,0,0,0|1,0,0]=3 1214 B9R1.3 CC1=C(N)C(Cl)=CC=C1 RT2932 [0,2,0,0,0,0|1,0,0]=3 1215 B9R1.3 CC1=C(N)C(Cl)=NC=C1 LT3325 [0,2,0,0,0,0|1,0,0]=3 1216 B9R1.3 CC1=C(N)C(F)=CC=C1 XJ0750 [0,2,0,0,0,0|1,0,0]=3 1217 B9R1.3 CC1=C(N)C(F)=NC=C1 LX2093 [0,2,0,0,0,0|1,0,0]=3 1218 B9R1.3 CC1=C(N)C=CC=C1Br YH06839 [0,2,0,0,0,0|1,0,0]=3 1219 B9R1.3 CC1=C(N)C=CC=C1Cl JZ0101 [0,2,0,0,0,0|1,0,0]=3 1220 B9R1.3 CC1=C(N)C=CC=C1N JZ5703 [0,2,0,0,0,0|1,0,0]=3 1221 B9R1.3 CC1=C(N)C=CC=C1N RT3280 [0,2,0,0,0,0|1,0,0]=3 1222 B9R1.3 CC1=C(O)C(=O)C=CO1 LQ0489 [0,2,0,0,0,0|2,0,0]=4 1223 B9R1.3 CC1=C(O)C=CC=C1O LT6596 [0,2,0,0,0,0|2,0,0]=4 1224 B9R1.3 CC1=C(S)C(Cl)=CC=C1 LQ4115 [0,2,0,0,0,0|2,0,0]=4 1225 B9R1.3 CC1=C([O-])C(=O)C=CO1 RT15399 [0,2,0,0,0,0|2,0,0]=4 1226 B9R1.3 CC1=CC=CC(C)=C1Br JZ3826 [0,2,0,0,0,0|2,0,0]=4 1227 B9R1.3 CC1=CC=CC(F)=C1Br XJ5860 [0,2,0,0,0,0|2,0,0]=4 1228 B9R1.3 CC1=CC=CC(F)=C1Cl LL1929 [0,2,0,0,0,0|2,0,0]=4 1229 B9R1.3 CC1=CC=CC(N)=C1N XJ2239 [0,2,0,0,0,0|1,0,0]=3 1230 B9R1.3 CC1=CC=NC(Br)=C1F LX2582 [0,2,0,0,0,0|1,0,0]=3 1231 B9R1.3 CC1=CC=NC(Cl)=C1Br YH06896 [0,2,0,0,0,0|1,0,0]=3 1232 B9R1.3 CC1=NC=CC(N)=C1Cl RT12227 [0,2,0,0,0,0|0,0,0]=2 1233 B9R1.3 CC1=NC=NC(C)=C1N YH94750 [0,2,0,0,0,0|2,0,0]=4 1234 B9R1.3 ClC1=CC=CC(Br)=C1Cl LT1456 [0,2,0,0,0,0|2,0,0]=4 1235 B9R1.3 ClC1=CC=CC(Cl)=C1Br LT0060 [0,2,0,0,0,0|2,0,0]=4 1236 B9R1.3 ClC1=CC=CC(Cl)=C1Cl LQ0212 [0,2,0,0,0,0|2,0,0]=4 1237 B9R1.3 ClC1=CC=CC(Cl)=C1Cl XJ3636 [0,2,0,0,0,0|2,0,0]=4 1238 B9R1.3 ClC1=CC=CC(I)=C1Cl JZ1994 [0,2,0,0,0,0|2,0,0]=4 1239 B9R1.3 ClC1=CN=CC(Cl)=C1Cl LT3950 [0,2,0,0,0,0|1,0,0]=3 1240 B9R1.3 ClC1=NC=NC(Cl)=C1Br YH13995 [0,2,0,0,0,0|2,0,0]=4 1241 B9R1.3 ClC1=NC=NC(Cl)=C1Cl XJ1929 [0,2,0,0,0,0|2,0,0]=4 1242 B9R1.3 FC1=C(Cl)C(Cl)=CC=C1 LT0074 [0,2,0,0,0,0|2,0,0]=4 1243 B9R1.3 FC1=C(Cl)C=CC=C1Cl LT0175 [0,2,0,0,0,0|2,0,0]=4 1244 B9R1.3 FC1=C(Cl)N=CN=C1Cl LL2591 [0,2,0,0,0,0|2,0,0]=4 1245 B9R1.3 FC1=C(F)C(I)=CC=C1 YH11708 [0,2,0,0,0,0|2,0,0]=4 1246 B9R1.3 FC1=C(I)C=CN=C1Cl LL2259 [0,2,0,0,0,0|1,0,0]=3 1247 B9R1.3 FC1=CC=CC(Br)=C1F YH58482 [0,2,0,0,0,0|2,0,0]=4 1248 B9R1.3 FC1=CC=CC(Cl)=C1F LX2928 [0,2,0,0,0,0|2,0,0]=4 1249 B9R1.3 FC1=CC=CC(F)=C1Br HL4270 [0,2,0,0,0,0|2,0,0]=4 1250 B9R1.3 FC1=CC=CC(F)=C1Cl LQ4947 [0,2,0,0,0,0|2,0,0]=4 1251 B9R1.3 FC1=NC=CC(Cl)=C1F YH65917 [0,2,0,0,0,0|1,0,0]=3 1252 B9R1.3 FC1=NC=CC(I)=C1Br YH92209 [0,2,0,0,0,0|1,0,0]=3 1253 B9R1.3 FC1=NC=NC(F)=C1F LQ4015 [0,2,0,0,0,0|2,0,0]=4 1254 B9R1.3 NC1=C(Br)C(Cl)=CC=C1 YH98398 [0,2,0,0,0,0|1,0,0]=3 1255 B9R1.3 NC1=C(Br)C(Cl)=NC=C1 LL2624 [0,2,0,0,0,0|0,0,0]=2 1256 B9R1.3 NC1=C(Br)C(F)=CC=C1 LL1912 [0,2,0,0,0,0|1,0,0]=3 1257 B9R1.3 NC1=C(Br)C=CC=C1Br XJ1061 [0,2,0,0,0,0|1,0,0]=3 1258 B9R1.3 NC1=C(Br)C=CC=C1O YH26385 [0,2,0,0,0,0|1,0,0]=3 1259 B9R1.3 NC1=C(Br)C=NC=C1Br YH65916 [0,2,0,0,0,0|0,0,0]=2 1260 B9R1.3 NC1=C(Cl)C(O)=CC=C1 YH07686 [0,2,0,0,0,0|1,0,0]=3 1261 B9R1.3 NC1=C(Cl)C=CC=C1F LT6504 [0,2,0,0,0,0|1,0,0]=3 1262 B9R1.3 NC1=C(Cl)C=CN=C1Cl LX2858 [0,2,0,0,0,0|1,0,0]=3 1263 B9R1.3 NC1=C(Cl)N=CN=C1Cl LT3437 [0,2,0,0,0,0|2,0,0]=4 1264 B9R1.3 NC1=C(F)C(Cl)=CC=C1 CJ2319 [0,2,0,0,0,0|1,0,0]=3 1265 B9R1.3 NC1=C(F)C(F)=CC=C1 LT0078 [0,2,0,0,0,0|1,0,0]=3 1266 B9R1.3 NC1=C(F)C=CC=C1Br RT1620 [0,2,0,0,0,0|1,0,0]=3 1267 B9R1.3 NC1=C(F)C=CC=C1F LT0183 [0,2,0,0,0,0|1,0,0]=3 1268 B9R1.3 NC1=C(N)C(Br)=CN=C1 YH65822 [0,2,0,0,0,0|0,0,0]=2 1269 B9R1.3 NC1=C(N)C(Cl)=NC=C1 LX3094 [0,2,0,0,0,0|0,0,0]=2 1270 B9R1.3 NC1=C(N)C(O)=NC=C1 LQ4779 [0,2,0,0,0,0|0,0,0]=2 1271 B9R1.3 NC1=C(O)C=CC=C1O JZ2221 [0,2,0,0,0,0|1,0,0]=3 1272 B9R1.3 NC1=C(O)N=CN=C1O YH14299 [0,2,0,0,0,0|2,0,0]=4 1273 B9R1.3 NC1=CC=CC(Br)=C1O YH51700 [0,2,0,0,0,0|1,0,0]=3 1274 B9R1.3 NC1=NC=CC(Br)=C1O YH25648 [0,2,0,0,0,0|1,0,0]=3 1275 B9R1.3 NC1=NC=CC(Cl)=C1O YH20388 [0,2,0,0,0,0|1,0,0]=3 1276 B9R1.3 NC1=NC=CC(F)=C1O LX2500 [0,2,0,0,0,0|1,0,0]=3 1277 B9R1.3 NC1=NC=CC(N)=C1N XJ5639 [0,2,0,0,0,0|0,0,0]=2 1278 B9R1.3 NC1=NC=CC(N)=[N+]1[O-] XJ6292 [0,2,0,0,0,0|1,0,0]=3 1279 B9R1.3 NC1=NC=NC(N)=C1N LT6876 [0,2,0,0,0,0|1,0,0]=3 1280 B9R1.3 NC1=NC=NC(N)=C1N YH27154 [0,2,0,0,0,0|1,0,0]=3 1281 B9R1.3 NC1=NC=NC(O)=C1N RT3389 [0,2,0,0,0,0|1,0,0]=3 1282 B9R1.3 NC1=NC=NC(O)=C1N XJ5632 [0,2,0,0,0,0|1,0,0]=3 1283 B9R1.3 O=C1C(Cl)=CNC=C1Cl LT0956 [0,2,0,0,0,0|1,0,1]=4 1284 B9R1.3 O=C1[15NH][15N]=CC(Cl)=C1Cl RT14744 [0,2,0,0,0,0|2,0,0]=4 1285 B9R1.3 OC1=C(Br)C(F)=CC=C1 LX3114 [0,2,0,0,0,0|2,0,0]=4 1286 B9R1.3 OC1=C(Cl)C=CC=C1Cl LQ0214 [0,2,0,0,0,0|2,0,0]=4 1287 B9R1.3 OC1=C(Cl)C=NC=C1Cl LT5977 [0,2,0,0,0,0|1,0,0]=3 1288 B9R1.3 OC1=C(F)C(F)=CC=C1 LT0080 [0,2,0,0,0,0|2,0,0]=4 1289 B9R1.3 OC1=CC=CC(Cl)=C1Cl JZ5647 [0,2,0,0,0,0|2,0,0]=4 1290 B9R1.3 OC1=CC=CC(O)=C1Cl XJ3064 [0,2,0,0,0,0|2,0,0]=4 1291 B9R1.3 OC1=CC=CC(O)=C1O JZ0368 [0,2,0,0,0,0|2,0,0]=4 1292 B9R1.3 OC1=NC=NC(O)=C1Br LQ3903 [0,2,0,0,0,0|2,0,0]=4 1293 B9R1.3 OC1=NC=NC(O)=C1F YH23466 [0,2,0,0,0,0|2,0,0]=4 1294 B9R1.34 BrC1=CC(Br)=CC(Br)=C1 RT11179 [0,2,0,0,0,0|2,0,0]=4 1295 B9R1.34 C1=C(N)C=C(C)C=C1C HL0749 [0,2,0,0,0,0|1,0,0]=3 1296 B9R1.34 CC1=CC(=O)OC(C)=C1 HL0328 [0,2,0,0,0,0|2,0,0]=4 1297 B9R1.34 CC1=CC(Br)=CC(Br)=C1 XJ1853 [0,2,0,0,0,0|2,0,0]=4 1298 B9R1.34 CC1=CC(Br)=NC(F)=C1 LX2995 [0,2,0,0,0,0|1,0,0]=3 1299 B9R1.34 CC1=CC(C)=CC(C)=C1 LQ3517 [0,2,0,0,0,0|2,0,0]=4 1300 B9R1.34 CC1=CC(C)=CC(Cl)=C1 LQ1017 [0,2,0,0,0,0|2,0,0]=4 1301 B9R1.34 CC1=CC(C)=CC(F)=C1 HL1859 [0,2,0,0,0,0|2,0,0]=4 1302 B9R1.34 CC1=CC(C)=CC(S)=C1 LT6681 [0,2,0,0,0,0|2,0,0]=4 1303 B9R1.34 CC1=CC(C)=NC(Br)=C1 XJ2797 [0,2,0,0,0,0|1,0,0]=3 1304 B9R1.34 CC1=CC(C)=NC(C)=C1 LT0102 [0,2,0,0,0,0|1,0,0]=3 1305 B9R1.34 CC1=CC(C)=NC(Cl)=C1 YH53556 [0,2,0,0,0,0|1,0,0]=3 1306 B9R1.34 CC1=CC(C)=NC(O)=N1 LT6057 [0,2,0,0,0,0|2,0,0]=4 1307 B9R1.34 CC1=CC(Cl)=CC(Br)=C1 YH54768 [0,2,0,0,0,0|2,0,0]=4 1308 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 YH01231 [0,2,0,0,0,0|1,0,0]=3 1309 B9R1.34 CC1=CC(Cl)=NC(C)=N1 XJ2727 [0,2,0,0,0,0|2,0,0]=4 1310 B9R1.34 CC1=CC(Cl)=NC(Cl)=C1 YH59055 [0,2,0,0,0,0|1,0,0]=3 1311 B9R1.34 CC1=CC(F)=CC(F)=C1 LL1943 [0,2,0,0,0,0|2,0,0]=4 1312 B9R1.34 CC1=CC(F)=CC(O)=C1 LL2660 [0,2,0,0,0,0|2,0,0]=4 1313 B9R1.34 CC1=CC(N)=CC(C)=N1 LQ2515 [0,2,0,0,0,0|0,0,0]=2 1314 B9R1.34 CC1=CC(N)=CC(F)=C1 LX2049 [0,2,0,0,0,0|1,0,0]=3 1315 B9R1.34 CC1=CC(N)=NC(C)=C1 HL2944 [0,2,0,0,0,0|1,0,0]=3 1316 B9R1.34 CC1=CC(N)=NC(C)=N1 HL1860 [0,2,0,0,0,0|1,0,0]=3 1317 B9R1.34 CC1=CC(N)=NC(Cl)=C1 LX3080 [0,2,0,0,0,0|1,0,0]=3 1318 B9R1.34 CC1=CC(O)=CC(=O)O1 HL0329 [0,2,0,0,0,0|2,0,0]=4 1319 B9R1.34 CC1=CC(O)=CC(C)=N1 JZ3779 [0,2,0,0,0,0|1,0,0]=3 1320 B9R1.34 CC1=CC(O)=NC(C)=C1 XJ4244 [0,2,0,0,0,0|1,0,0]=3 1321 B9R1.34 CC1=NC(C)=NC(Br)=C1 YH56587 [0,2,0,0,0,0|2,0,0]=4 1322 B9R1.34 CC1=NC(Cl)=CC(N)=N1 YH40249 [0,2,0,0,0,0|1,0,0]=3 1323 B9R1.34 CC1=NC(Cl)=NC(N)=C1 YH34698 [0,2,0,0,0,0|1,0,0]=3 1324 B9R1.34 CC1=NC(N)=NC(O)=C1 JZ2428 [0,2,0,0,0,0|2,0,0]=4 1325 B9R1.34 CC1=NC(O)=CC(O)=N1 LT6881 [0,2,0,0,0,0|2,0,0]=4 1326 B9R1.34 ClC1=CC(Br)=CC(Br)=C1 YH35675 [0,2,0,0,0,0|2,0,0]=4 1327 B9R1.34 ClC1=CC(Cl)=CC(I)=C1 YH65520 [0,2,0,0,0,0|2,0,0]=4 1328 B9R1.34 ClC1=CC(Cl)=NC(Cl)=C1 XJ4222 [0,2,0,0,0,0|1,0,0]=3 1329 B9R1.34 ClC1=CC(I)=CC(Cl)=N1 LL1703 [0,2,0,0,0,0|1,0,0]=3 1330 B9R1.34 FC1=CC(Br)=CC(Br)=C1 YH65690 [0,2,0,0,0,0|2,0,0]=4 1331 B9R1.34 FC1=CC(Br)=NC(F)=C1 YH00569 [0,2,0,0,0,0|1,0,0]=3 1332 B9R1.34 FC1=CC(Cl)=CC(Br)=C1 LT1876 [0,2,0,0,0,0|2,0,0]=4 1333 B9R1.34 FC1=CC(Cl)=CC(Cl)=C1 LT6668 [0,2,0,0,0,0|2,0,0]=4 1334 B9R1.34 FC1=CC(F)=CC(F)=C1 LT0042 [0,2,0,0,0,0|2,0,0]=4 1335 B9R1.34 FC1=CC(F)=NC(F)=C1 LQ2513 [0,2,0,0,0,0|1,0,0]=3 1336 B9R1.34 FC1=CC(F)=NC(F)=N1 LQ1370 [0,2,0,0,0,0|2,0,0]=4 1337 B9R1.34 FC1=CC(I)=CC(Br)=C1 LL2983 [0,2,0,0,0,0|2,0,0]=4 1338 B9R1.34 IC1=CC(I)=CC(I)=C1 SY0031 [0,2,0,0,0,0|2,0,0]=4 1339 B9R1.34 NC1=CC(=O)NC(N)=N1 LT0110 [0,2,0,0,0,0|1,0,1]=4 1340 B9R1.34 NC1=CC(Br)=CC(F)=C1 YH32345 [0,2,0,0,0,0|1,0,0]=3 1341 B9R1.34 NC1=CC(Cl)=CC(Cl)=N1 HL3309 [0,2,0,0,0,0|1,0,0]=3 1342 B9R1.34 NC1=CC(Cl)=CC(F)=C1 XJ2761 [0,2,0,0,0,0|1,0,0]=3 1343 B9R1.34 NC1=CC(Cl)=NC(Cl)=C1 LQ2197 [0,2,0,0,0,0|0,0,0]=2 1344 B9R1.34 NC1=CC(Cl)=NC(N)=N1 RT15174 [0,2,0,0,0,0|1,0,0]=3 1345 B9R1.34 NC1=CC(F)=CC(F)=C1 LT6671 [0,2,0,0,0,0|1,0,0]=3 1346 B9R1.34 NC1=CC(N)=CC(Cl)=C1 LQ4805 [0,2,0,0,0,0|1,0,0]=3 1347 B9R1.34 NC1=CC(N)=NC(N)=N1 LT4061 [0,2,0,0,0,0|1,0,0]=3 1348 B9R1.34 NC1=CC(N)=NC(S)=N1 HL0586 [0,2,0,0,0,0|1,0,0]=3 1349 B9R1.34 NC1=CC(O)=CC(=O)N1 YH22748 [0,2,0,0,0,0|1,0,1]=4 1350 B9R1.34 NC1=CC(O)=NC(N)=N1 RT18296 [0,2,0,0,0,0|1,0,0]=3 1351 B9R1.34 NC1=CC(O)=NC(O)=N1 LT2885 [0,2,0,0,0,0|1,0,0]=3 1352 B9R1.34 NC1=CC(O)=NC(S)=N1 LX2667 [0,2,0,0,0,0|1,0,0]=3 1353 B9R1.34 NC1=NC(=O)C=C(Cl)N1 YH27562 [0,2,0,0,0,0|2,0,0]=4 1354 B9R1.34 NC1=NC(=O)C=C(S)N1 XJ3199 [0,2,0,0,0,0|2,0,0]=4 1355 B9R1.34 NC1=NC(=O)NC(N)=N1 XJ1210 [0,2,0,0,0,0|2,0,0]=4 1356 B9R1.34 NC1=NC(Cl)=CC(Cl)=N1 LT0238 [0,2,0,0,0,0|2,0,0]=4 1357 B9R1.34 NC1=NC(Cl)=NC(=O)N1 RT0314 [0,2,0,0,0,0|2,0,0]=4 1358 B9R1.34 NC1=NC(Cl)=NC(Cl)=N1 JZ4282 [0,2,0,0,0,0|2,0,0]=4 1359 B9R1.34 NC1=NC(F)=CC(F)=C1 RT9284 [0,2,0,0,0,0|1,0,0]=3 1360 B9R1.34 NC1=NC(F)=CC(F)=N1 YH13257 [0,2,0,0,0,0|2,0,0]=4 1361 B9R1.34 NC1=NC(N)=NC(Cl)=N1 RT4345 [0,2,0,0,0,0|2,0,0]=4 1362 B9R1.34 NC1=NC(N)=NC(N)=N1 HL3354 [0,2,0,0,0,0|2,0,0]=4 1363 B9R1.34 NC1=NC(N)=NC(N)=N1 LQ3848 [0,2,0,0,0,0|2,0,0]=4 1364 B9R1.34 NC1=NC(N)=NC(N)=N1 XJ5447 [0,2,0,0,0,0|2,0,0]=4 1365 B9R1.34 NC1=NC(N)=NC(S)=C1 YH07203 [0,2,0,0,0,0|1,0,0]=3 1366 B9R1.34 NC1=NC(S)=NC(O)=C1 LT2648 [0,2,0,0,0,0|1,0,0]=3 1367 B9R1.34 OC1=CC(Br)=CC(Br)=C1 YH10777 [0,2,0,0,0,0|2,0,0]=4 1368 B9R1.34 OC1=CC(Cl)=CC(Br)=C1 YH07687 [0,2,0,0,0,0|2,0,0]=4 1369 B9R1.34 OC1=CC(Cl)=CC(Cl)=C1 YH08828 [0,2,0,0,0,0|2,0,0]=4 1370 B9R1.34 OC1=CC(Cl)=NC(Cl)=C1 XJ4370 [0,2,0,0,0,0|1,0,0]=3 1371 B9R1.34 OC1=CC(F)=CC(Br)=C1 YH01509 [0,2,0,0,0,0|2,0,0]=4 1372 B9R1.34 OC1=CC(F)=CC(F)=C1 LT3078 [0,2,0,0,0,0|2,0,0]=4 1373 B9R1.34 OC1=CC(O)=CC(I)=C1 RT11008 [0,2,0,0,0,0|2,0,0]=4 1374 B9R1.34 OC1=CC(O)=CC(O)=C1 RT10766 [0,2,0,0,0,0|2,0,0]=4 1375 B9R1.34 OC1=CC(O)=CC(O)=C1 YH09800 [0,2,0,0,0,0|2,0,0]=4 1376 B9R2.50 C1=CC=C2CCC2=C1 LQ1353 [0,1,0,1,0,0|2,0,0]=4 1377 B5R1.1 C1=CCC=C1 HL0727 [1,0,0,0,1,0|0,0,1]=3 1378 B5R1.1 C1=CCC=C1 LQ3537 [1,0,0,0,1,0|0,0,1]=3 1379 B5R1.1 C1=CCC=C1 XJ0961 [1,0,0,0,1,0|0,0,1]=3 1380 B5R1.1 C1=CNC=N1 YH35329 [1,0,0,0,1,0|1,0,0]=3 1381 B5R1.1 C1=CNN=C1 LL0624 [1,0,0,0,1,0|1,0,0]=3 1382 B5R1.1 C1=COC=C1 RT8598 [1,0,0,0,1,0|1,0,0]=3 1383 B5R1.1 C1=CON=C1 LL0625 [1,0,0,0,1,0|1,0,0]=3 1384 B5R1.1 C1=CSN=C1 YH52084 [1,0,0,0,1,0|1,0,0]=3 1385 B5R1.1 C1=NC=N[N-]1 LQ5128 [1,0,0,0,1,0|2,0,0]=4 1386 B5R1.1 C1=[C-]CC=C1 LQ3516 [1,0,0,0,1,0|0,0,2]=4