0 B10R1.13 C=C(C)C1CC=C(C)CC1 JZ3299 [0,0,0,0,0,0|0,0,4]=4 1 B10R1.13 C=C(C)C1CC=C(C)CC1 JZ3330 [0,0,0,0,0,0|0,0,4]=4 2 B10R1.13 C=C(C)C1CC=C(C)CC1 LQ0986 [0,0,0,0,0,0|0,0,4]=4 3 B10R1.13 C=C(C)C1CC=C(C)CC1 LT5280 [0,0,0,0,0,0|0,0,4]=4 4 B10R1.13 C=C(C)[C@H]1CC=C(C)CC1 LQ3000 [0,0,0,0,0,0|0,0,4]=4 5 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HL1303 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.13 CC(=O)C1=CC=C(C)N=C1 RT18075 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 JZ1119 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 YH07034 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.13 CC(=O)C1=CC=C(F)C=C1 JZ1124 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.13 CC(=O)C1=CC=C(N)C=C1 LT6854 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.13 CC(=O)C1=CC=C(O)C=C1 RT11987 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 HL3496 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CJ2729 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.13 CC(C)C1=CC=C(Br)C=C1 XJ1042 [0,0,0,0,0,0|1,0,2]=3 15 B10R1.13 CC(C)C1=CC=C(N)C=N1 YH00023 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.13 CC(N)C1=CC=C(Br)C=C1 YH48936 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.13 CC(N)C1=NC=C(F)C=C1 SY0015 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.13 CC(O)C1=CC=C(F)C=C1 LQ0797 [0,0,0,0,0,0|2,0,1]=3 19 B10R1.13 CC1=CC=C(B(O)O)C=C1 SY0255 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.13 CC1=CC=C(B(O)O)C=N1 RT6584 [0,0,0,0,0,0|4,0,0]=4 21 B10R1.13 CC1=CC=C(C(=O)O)C=C1 JZ0130 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.13 CC1=CC=C(C(=O)O)C=N1 JZ2268 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.13 CC1=CC=C(C(C)C)C=C1 XJ5623 [0,0,0,0,0,0|0,0,2]=2 24 B10R1.13 CC1=CC=C(C(C)N)C=C1 JZ0723 [0,0,0,0,0,0|1,0,1]=2 25 B10R1.13 CC1=CC=C(C(C)O)C=C1 LL0968 [0,0,0,0,0,0|1,0,1]=2 26 B10R1.13 CC1=CC=C(C(C)O)C=N1 RT2394 [0,0,0,0,0,0|2,0,1]=3 27 B10R1.13 CC1=CC=C(C(N)=O)C=C1 JZ3937 [0,0,0,0,0,0|2,0,0]=2 28 B10R1.13 CC1=CC=C(N(C)C)C=C1 YH99046 [0,0,0,0,0,0|1,0,1]=2 29 B10R1.13 CC1=CC=C(S(=O)O)C=C1 LL0969 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.13 CC1=CC=C(S(N)=O)C=C1 YH66632 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.13 CC1=CN=C(B(O)O)C=C1 YH57645 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.13 CC1=CN=C(C(=O)O)C=C1 YH01820 [0,0,0,0,0,0|3,0,0]=3 33 B10R1.13 CC1=NC=C(C(=O)O)C=N1 YH04926 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.13 CC1=NC=C(C(=O)O)N=C1 LT1326 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.13 CC1=NC=C(C(C)N)C=N1 RT2400 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 JZ1051 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.13 CN(C)C1=CC=C(Br)C=C1 LT2750 [0,0,0,0,0,0|2,0,1]=3 38 B10R1.13 CN(C)C1=CC=C(N)C=C1 HL1305 [0,0,0,0,0,0|2,0,1]=3 39 B10R1.13 CN(C)C1=CC=C(N)C=C1 LL0967 [0,0,0,0,0,0|2,0,1]=3 40 B10R1.13 CN(C)C1=CC=C(N)C=C1 LQ4413 [0,0,0,0,0,0|2,0,1]=3 41 B10R1.13 CN(C)C1=CC=C(N)C=C1 XJ3077 [0,0,0,0,0,0|2,0,1]=3 42 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 LQ5152 [0,0,0,0,0,0|2,0,1]=3 43 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 YH17516 [0,0,0,0,0,0|2,0,1]=3 44 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 XJ4897 [0,0,0,0,0,0|2,0,1]=3 45 B10R1.13 ClC1=CC=C(C(Cl)Cl)C=C1 LT3445 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 HL3245 [0,0,0,0,0,0|3,0,0]=3 47 B10R1.13 N=C(N)C1=CC=C(N)C=C1 HL2287 [0,0,0,0,0,0|3,0,0]=3 48 B10R1.13 N=C(N)C1=CC=C(N)C=C1 JZ3229 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.13 N=C(N)C1=CC=C(O)C=C1 LT2008 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.13 N=C(N)C1=CC=C(O)C=C1 YH36971 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 LQ1385 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 JZ3938 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.13 NC(=O)C1=CC=C(F)C=C1 JZ4190 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.13 NC(=O)C1=CC=C(I)C=C1 YH59026 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.13 NC(=O)C1=CC=C(O)C=C1 JZ3939 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.13 NC(=O)C1=NC=C(N)C=C1 YH35056 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 YH49579 [0,0,0,0,0,0|3,0,0]=3 58 B10R1.13 NC1=CC=C(B(O)O)C=C1 SY0280 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.13 NC1=CC=C(C(=O)O)C=C1 RT3381 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.13 NC1=CC=C(C(=O)O)C=N1 LT3585 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 LT3105 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.13 NC1=CC=C([As](Cl)Cl)C=C1 RT3259 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 JZ0055 [0,0,0,0,0,0|4,0,0]=4 64 B10R1.13 NC1=CN=C(C(=O)O)C=C1 JZ1163 [0,0,0,0,0,0|4,0,0]=4 65 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 XJ0449 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 JZ0749 [0,0,0,0,0,0|4,0,0]=4 67 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 JZ1126 [0,0,0,0,0,0|3,0,0]=3 68 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 JZ4692 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 XJ1044 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 JZ0785 [0,0,0,0,0,0|4,0,0]=4 71 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 JZ1200 [0,0,0,0,0,0|4,0,0]=4 72 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 JZ0383 [0,0,0,0,0,0|3,0,0]=3 73 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 LT3592 [0,0,0,0,0,0|4,0,0]=4 74 B10R1.13 O=C(O)C1=CC=C(F)C=C1 JZ1125 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.13 O=C(O)C1=CC=C(I)C=C1 JZ3940 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.13 O=C(O)C1=CC=C(O)C=C1 JZ0015 [0,0,0,0,0,0|3,0,0]=3 77 B10R1.13 O=C(O)C1=CC=C(O)C=N1 XJ4141 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.13 O=C(O)C1=CC=C(O)N=C1 RT9389 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CJ2890 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 LL1597 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.13 O=C(O)C1=NC=C(F)C=C1 YH23879 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 HL1435 [0,0,0,0,0,0|3,0,0]=3 83 B10R1.13 O=S([O-])C1=CC=C(F)C=C1 JZ4192 [0,0,0,0,0,0|4,0,0]=4 84 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 RT13188 [0,0,0,0,0,0|4,0,0]=4 85 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 LT0072 [0,0,0,0,0,0|4,0,0]=4 86 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 RT11294 [0,0,0,0,0,0|4,0,0]=4 87 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 LT3458 [0,0,0,0,0,0|4,0,0]=4 88 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 RT12985 [0,0,0,0,0,0|4,0,0]=4 89 B10R1.13 OB(O)C1=CC=C(Br)C=C1 CJ2455 [0,0,0,0,0,0|4,0,0]=4 90 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 LQ1888 [0,0,0,0,0,0|4,0,0]=4 91 B10R1.13 OB(O)C1=CC=C(F)C=C1 XJ1901 [0,0,0,0,0,0|4,0,0]=4 92 B10R1.13 OB(O)C1=CC=C(O)C=C1 XJ6238 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.1 BrCC1=CC=C(Br)C=C1 YH08714 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.1 BrCC1=CC=C(I)C=C1 XJ4204 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.1 C#CC1=CC=C(Br)C=C1 HL0382 [1,0,0,0,0,0|1,0,2]=4 96 B9R1.1 C#CC1=CC=C(C)C=C1 HL0383 [1,0,0,0,0,0|0,0,2]=3 97 B9R1.1 C#CC1=CC=C(Cl)C=C1 SY0319 [1,0,0,0,0,0|1,0,2]=4 98 B9R1.1 C#CC1=CC=C(F)C=C1 HL0384 [1,0,0,0,0,0|1,0,2]=4 99 B9R1.1 C#CC1=CC=C(N)C=C1 XJ4023 [1,0,0,0,0,0|1,0,2]=4 100 B9R1.1 C#CC1=CC=C(O)C=C1 YH65749 [1,0,0,0,0,0|1,0,2]=4 101 B9R1.1 C(=O)C1=CC=C(Br)C=C1 HL0659 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.1 C(=O)C1=CC=C(Cl)C=C1 XJ0297 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.1 C(=O)C1=CC=C(Cl)N=C1 JZ0751 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.1 C(=O)C1=CC=C(F)C=C1 RT10834 [1,0,0,0,0,0|2,0,0]=3 105 B9R1.1 C(=O)C1=CC=C(N)N=C1 RT2853 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.1 C=CC1=CC=C(Br)C=C1 XJ2035 [1,0,0,0,0,0|1,0,0]=2 107 B9R1.1 C=CC1=CC=C(C)C=C1 XJ1131 [1,0,0,0,0,0|0,0,0]=1 108 B9R1.1 C=CC1=CC=C(Cl)C=C1 JZ4358 [1,0,0,0,0,0|1,0,0]=2 109 B9R1.1 C=CC1=CC=C(F)C=C1 LQ0811 [1,0,0,0,0,0|1,0,0]=2 110 B9R1.1 C=CC1=CC=C(N)C=C1 LQ1825 [1,0,0,0,0,0|1,0,0]=2 111 B9R1.1 C=CC1=CN=C(C)C=C1 XJ0560 [1,0,0,0,0,0|1,0,0]=2 112 B9R1.1 C=CC1=CN=C(C)C=N1 LT2115 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.1 C=CC1=NC=C(C)C=C1 YH58615 [1,0,0,0,0,0|1,0,0]=2 114 B9R1.1 CC1=CC=C(C#N)C=C1 XJ0295 [1,0,0,0,0,0|1,0,1]=3 115 B9R1.1 CC1=CC=C(C=O)C=C1 XJ0296 [1,0,0,0,0,0|1,0,0]=2 116 B9R1.1 CC1=CC=C(C=O)C=N1 YH05496 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.1 CC1=CC=C(CBr)C=C1 XJ0291 [1,0,0,0,0,0|1,0,1]=3 118 B9R1.1 CC1=CC=C(CN)C=C1 XJ0294 [1,0,0,0,0,0|1,0,1]=3 119 B9R1.1 CC1=CC=C(CN)C=N1 RT4381 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.1 CC1=CC=C(CO)C=C1 HL0057 [1,0,0,0,0,0|1,0,1]=3 121 B9R1.1 CC1=CC=C(NN)C=C1 JZ4047 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.1 CC1=CC=C(NN)C=C1 XJ0909 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.1 CC1=CN=C(C#N)C=C1 XJ1868 [1,0,0,0,0,0|2,0,1]=4 124 B9R1.1 CC1=CN=C(C=O)C=C1 HL2821 [1,0,0,0,0,0|2,0,0]=3 125 B9R1.1 CC1=NC=C(C#N)C=C1 JZ2269 [1,0,0,0,0,0|2,0,1]=4 126 B9R1.1 CC1=NC=C(C=O)C=N1 HL4933 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.1 CC1=NC=C(CCl)C=C1 RT12579 [1,0,0,0,0,0|2,0,1]=4 128 B9R1.1 CC1=NC=C(NN)C=C1 YH93974 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.1 CCC1=CC=C(Br)C=C1 LT0068 [1,0,0,0,0,0|1,0,1]=3 130 B9R1.1 CCC1=CC=C(Cl)C=C1 XJ1132 [1,0,0,0,0,0|1,0,1]=3 131 B9R1.1 CCC1=CC=C(I)C=C1 JZ5676 [1,0,0,0,0,0|1,0,1]=3 132 B9R1.1 CCC1=CC=C(O)C=C1 LQ4557 [1,0,0,0,0,0|1,0,1]=3 133 B9R1.1 CCC1=CC=[N+]([O-])C=C1 RT11871 [1,0,0,0,0,0|2,0,1]=4 134 B9R1.1 CCC1=CN=C(C)C=C1 YH20573 [1,0,0,0,0,0|1,0,1]=3 135 B9R1.1 CCC1=CNC(=O)C=C1 YH05768 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.1 CNC1=CC=C(N)C=C1 LT5160 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.1 CNC1=CC=C(O)C=C1 LT7433 [1,0,0,0,0,0|2,0,0]=3 138 B9R1.1 CNC1=NC=C(Cl)C=C1 RT2598 [1,0,0,0,0,0|3,0,0]=4 139 B9R1.1 COC1=CC=C(Br)C=C1 YH22845 [1,0,0,0,0,0|2,0,0]=3 140 B9R1.1 COC1=CC=C(Br)C=N1 LT3369 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 COC1=CC=C(C)N=C1 LX2638 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.1 COC1=CC=C(F)C=C1 RT11598 [1,0,0,0,0,0|2,0,0]=3 143 B9R1.1 COC1=CC=C(F)C=N1 YH04458 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.1 COC1=CC=C(N)C=C1 YH22851 [1,0,0,0,0,0|2,0,0]=3 145 B9R1.1 COC1=CC=C(N)C=N1 LT3597 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.1 COC1=CC=C(N)N=C1 XJ3542 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.1 COC1=CC=C(O)C=C1 LQ0608 [1,0,0,0,0,0|2,0,0]=3 148 B9R1.1 COC1=CC=[N+]([O-])C=C1 RT6739 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.1 COC1=CN=C(Cl)C=C1 HL3515 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.1 COC1=NC=C(C)N=C1 LT2163 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.1 COC1=NC=C(I)C=C1 YH32542 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.1 COC1=NC=C(O)C=C1 YH04854 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.1 CSC1=CC=C(C)C=C1 XJ1135 [1,0,0,0,0,0|1,0,0]=2 154 B9R1.1 CSC1=CC=C(F)C=C1 XJ0702 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.1 CSC1=CN=C(N)C=C1 RT4644 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.1 CSC1=NC=C(C)N=C1 LT2312 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.1 ClC1=CC=C(CBr)C=C1 XJ1130 [1,0,0,0,0,0|2,0,1]=4 158 B9R1.1 ClC1=CC=C([Mg]Br)C=C1 XJ1431 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.1 ClCC1=CC=C(Br)C=C1 HL0056 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.1 ClCC1=CC=C(Cl)C=C1 XJ0293 [1,0,0,0,0,0|2,0,1]=4 161 B9R1.1 FC1=CC=C(CBr)C=C1 RT11193 [1,0,0,0,0,0|2,0,1]=4 162 B9R1.1 FC1=CC=C(CCl)C=C1 LL0673 [1,0,0,0,0,0|2,0,1]=4 163 B9R1.1 FC1=CC=C(CS)C=C1 JZ5068 [1,0,0,0,0,0|2,0,1]=4 164 B9R1.1 FC1=CC=C([Mg]Br)C=C1 LL0674 [1,0,0,0,0,0|3,0,0]=4 165 B9R1.1 N#CC1=CC=C(Br)C=C1 LT6101 [1,0,0,0,0,0|2,0,1]=4 166 B9R1.1 N#CC1=CC=C(Br)C=C1 XJ1133 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.1 N#CC1=CC=C(F)C=C1 LT3074 [1,0,0,0,0,0|2,0,1]=4 168 B9R1.1 N#CC1=CC=C(I)C=C1 HL2444 [1,0,0,0,0,0|2,0,1]=4 169 B9R1.1 N#CC1=CC=C(N)C=C1 RT3702 [1,0,0,0,0,0|2,0,1]=4 170 B9R1.1 N#CC1=CC=C(O)C=C1 LT2823 [1,0,0,0,0,0|2,0,1]=4 171 B9R1.1 N#[N+]C1=CC=C(F)C=C1 RT6271 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.1 NC1=CC=C(C=O)C=C1 LQ1002 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.1 NCC1=CC=C(Br)C=C1 YH59044 [1,0,0,0,0,0|2,0,1]=4 174 B9R1.1 NCC1=CC=C(Cl)C=C1 LT2948 [1,0,0,0,0,0|2,0,1]=4 175 B9R1.1 NCC1=CC=C(F)C=C1 RT1536 [1,0,0,0,0,0|2,0,1]=4 176 B9R1.1 NCC1=CC=C(I)C=C1 LT1523 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.1 NCC1=CC=C(N)C=C1 JZ2534 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.1 NCC1=CC=C(O)C=C1 LQ1367 [1,0,0,0,0,0|2,0,1]=4 179 B9R1.1 NNC1=CC=C(Br)C=C1 HL0058 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.1 NNC1=CC=C(Br)C=C1 XJ1129 [1,0,0,0,0,0|3,0,0]=4 181 B9R1.1 NNC1=CC=C(Cl)C=C1 JZ4359 [1,0,0,0,0,0|3,0,0]=4 182 B9R1.1 NNC1=CC=C(Cl)C=C1 JZ4360 [1,0,0,0,0,0|3,0,0]=4 183 B9R1.1 NNC1=CC=C(F)C=C1 LQ1485 [1,0,0,0,0,0|3,0,0]=4 184 B9R1.1 O=CC1=CC=C(Br)N=C1 LT3321 [1,0,0,0,0,0|3,0,0]=4 185 B9R1.1 O=CC1=CC=C(F)N=C1 YH13440 [1,0,0,0,0,0|3,0,0]=4 186 B9R1.1 O=CC1=CC=C(I)C=C1 XJ4171 [1,0,0,0,0,0|2,0,0]=3 187 B9R1.1 O=CC1=CC=C(O)C=C1 RT12842 [1,0,0,0,0,0|2,0,0]=3 188 B9R1.1 O=CC1=CC=C(O)N=C1 LT3365 [1,0,0,0,0,0|3,0,0]=4 189 B9R1.1 O=CC1=CC=C(S)C=C1 RT11108 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.1 O=CC1=NC=C(Br)C=C1 LQ4682 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.1 O=NC1=CC=C(O)C=C1 RT11953 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.1 OC1=CC=C(CBr)C=C1 CJ3032 [1,0,0,0,0,0|2,0,1]=4 193 B9R1.1 OCC1=CC=C(Br)C=C1 XJ1430 [1,0,0,0,0,0|2,0,1]=4 194 B9R1.1 OCC1=CC=C(Cl)C=C1 JZ0815 [1,0,0,0,0,0|2,0,1]=4 195 B9R1.1 OCC1=CC=C(I)C=C1 XJ4412 [1,0,0,0,0,0|2,0,1]=4 196 B9R1.1 OCC1=CC=C(O)C=C1 JZ0347 [1,0,0,0,0,0|2,0,1]=4 197 B9R1.1 ONC1=CC=C(Cl)C=C1 YH88188 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.1 [C-]#[N+]C1=CC=C(Br)C=C1 LQ4762 [1,0,0,0,0,0|2,0,1]=4 199 B9R1.6 C=C(C)C1=CC=CC=C1 XJ0257 [1,0,0,0,0,0|0,0,0]=1 200 B9R1.6 CC(=O)C1=CC=CC=C1 RT11112 [1,0,0,0,0,0|1,0,0]=2 201 B9R1.6 CC(=O)C1=CC=NC=C1 HL0648 [1,0,0,0,0,0|2,0,0]=3 202 B9R1.6 CC(=O)C1=CN=CC=C1 LQ0733 [1,0,0,0,0,0|2,0,0]=3 203 B9R1.6 CC(=O)C1=CN=CN=C1 RT1973 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.6 CC(=O)C1=NC=CC=N1 YH05694 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.6 CC(Br)C1=CC=CC=C1 XJ1034 [1,0,0,0,0,0|1,0,1]=3 206 B9R1.6 CC(N)C1=CC=CC=C1 JZ0721 [1,0,0,0,0,0|1,0,1]=3 207 B9R1.6 CN(C)C1=CC=NC=C1 LT3039 [1,0,0,0,0,0|2,0,1]=4 208 B9R1.6 CN(C)C1=NC=CC=C1 XJ2942 [1,0,0,0,0,0|2,0,1]=4 209 B9R1.6 CN(N)C1=CC=CC=C1 LQ1214 [1,0,0,0,0,0|2,0,0]=3 210 B9R1.6 CN(N)C1=CC=CC=C1 LX2044 [1,0,0,0,0,0|2,0,0]=3 211 B9R1.6 C[C@@H](N)C1=CC=CC=C1 RT1721 [1,0,0,0,0,0|1,0,1]=3 212 B9R1.6 C[C@@H](N)C1=NC=CC=C1 YH51514 [1,0,0,0,0,0|2,0,1]=4 213 B9R1.6 C[C@@H](O)C1=NC=CC=C1 YH51543 [1,0,0,0,0,0|2,0,1]=4 214 B9R1.6 C[C@H](N)C1=CC=CC=C1 RT1720 [1,0,0,0,0,0|1,0,1]=3 215 B9R1.6 C[Si](=O)C1=CC=CC=C1 XJ3509 [1,0,0,0,0,0|1,1,0]=3 216 B9R1.6 ClC(Cl)C1=CC=CC=C1 LT3671 [1,0,0,0,0,0|2,0,1]=4 217 B9R1.6 ClP(Cl)C1=CC=CC=C1 JZ4097 [1,0,0,0,0,0|3,0,0]=4 218 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 YH96399 [1,0,0,0,0,0|3,0,0]=4 219 B9R1.6 N=C(N)C1=CC=CC=C1 LQ1861 [1,0,0,0,0,0|2,0,0]=3 220 B9R1.6 N=C(N)C1=CC=NC=C1 JZ2903 [1,0,0,0,0,0|3,0,0]=4 221 B9R1.6 N=C(N)C1=CC=NC=C1 YH55019 [1,0,0,0,0,0|3,0,0]=4 222 B9R1.6 NC(=O)C1=CC=CC=C1 CJ3392 [1,0,0,0,0,0|2,0,0]=3 223 B9R1.6 NC(=O)C1=CC=CC=C1 LT4036 [1,0,0,0,0,0|2,0,0]=3 224 B9R1.6 NC(=O)C1=CC=CN=C1 XJ0261 [1,0,0,0,0,0|3,0,0]=4 225 B9R1.6 NC(=O)C1=CC=NC=C1 XJ1788 [1,0,0,0,0,0|3,0,0]=4 226 B9R1.6 NC(=S)C1=CC=CC=C1 XJ2085 [1,0,0,0,0,0|2,0,0]=3 227 B9R1.6 O=C(Cl)C1=CC=CN=C1 JZ0788 [1,0,0,0,0,0|3,0,0]=4 228 B9R1.6 O=C(Cl)C1=CC=CN=C1 LT7313 [1,0,0,0,0,0|3,0,0]=4 229 B9R1.6 O=C(Cl)C1=NC=CC=C1 LT5112 [1,0,0,0,0,0|3,0,0]=4 230 B9R1.6 O=C(F)C1=CC=CC=C1 HL1804 [1,0,0,0,0,0|2,0,0]=3 231 B9R1.6 O=C(O)C1=CC=CC=N1 SY0293 [1,0,0,0,0,0|3,0,0]=4 232 B9R1.6 O=C(O)C1=CC=CN=C1 LT7314 [1,0,0,0,0,0|3,0,0]=4 233 B9R1.6 O=C(O)C1=CC=NC=C1 JZ0786 [1,0,0,0,0,0|3,0,0]=4 234 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0026 [1,0,0,0,0,0|2,0,0]=3 235 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0027 [1,0,0,0,0,0|2,0,0]=3 236 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ0044 [1,0,0,0,0,0|2,0,0]=3 237 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ4278 [1,0,0,0,0,0|2,0,0]=3 238 B9R1.6 O=C([O-])C1=CC=CC=C1 LT4848 [1,0,0,0,0,0|2,0,0]=3 239 B9R1.6 O=C([O-])C1=CC=CC=C1 XJ0991 [1,0,0,0,0,0|2,0,0]=3 240 B9R1.6 O=C([O-])C1=CN=CC=C1 LL1069 [1,0,0,0,0,0|3,0,0]=4 241 B9R1.6 O=C([O-])C1=CN=CC=C1 LQ0027 [1,0,0,0,0,0|3,0,0]=4 242 B9R1.6 O=C([O-])C1=NC=CC=C1 JZ5244 [1,0,0,0,0,0|3,0,0]=4 243 B9R1.6 O=C([O-])C1=NC=CC=C1 LQ3798 [1,0,0,0,0,0|3,0,0]=4 244 B9R1.6 O=S(O)C1=CC=CC=C1 LQ1215 [1,0,0,0,0,0|3,0,0]=4 245 B9R1.6 O=S([O-])C1=CC=CC=C1 LL1085 [1,0,0,0,0,0|3,0,0]=4 246 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 XJ0263 [1,0,0,0,0,0|3,0,0]=4 247 B9R1.6 O=[P+]([O-])C1=CC=CC=C1 LQ2659 [1,0,0,0,0,0|3,0,0]=4 248 B9R1.6 OB(O)C1=CC=CC=C1 JZ0681 [1,0,0,0,0,0|3,0,0]=4 249 B9R1.6 [18O]=C([18OH])C1=CC=CC=C1 RT11444 [1,0,0,0,0,0|2,0,0]=3 250 B9R1.6 [SiH](Cl)(Cl)C1=CC=CC=C1 HL0912 [1,0,0,0,0,0|2,1,0]=4 251 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 YH23236 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 YH40649 [0,1,0,0,0,0|1,0,2]=4 253 B11R1.3 C(=O)C1=CC=C(C(=O)O)C=C1 JZ3943 [0,1,0,0,0,0|2,0,1]=4 254 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 JZ4383 [0,1,0,0,0,0|2,0,1]=4 255 B11R1.3 CC(C)C1=CC=C(CO)C=C1 LL0970 [0,1,0,0,0,0|0,0,2]=3 256 B11R1.3 CC(C)C1=CC=C(NN)C=C1 LL1986 [0,1,0,0,0,0|1,0,2]=4 257 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 LT3069 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 JZ3941 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 HL1247 [0,1,0,0,0,0|1,0,2]=4 260 B11R1.3 CN(C)C1=CC=C(N=O)C=C1 XJ0531 [0,1,0,0,0,0|2,0,1]=4 261 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 LQ3466 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 HL1250 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.3 COC1=CC=C(B(O)O)C=C1 JZ0684 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.3 COC1=CC=C(B(O)O)C=C1 LQ5149 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.3 COC1=CC=C(C(=N)N)C=C1 RT1606 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 JZ0666 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.3 COC1=CC=C(C(=O)O)C=C1 JZ4549 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.3 COC1=CC=C(C(=O)O)N=C1 RT6533 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.3 COC1=CC=C(C(C)=O)C=C1 JZ1135 [0,1,0,0,0,0|1,0,0]=2 270 B11R1.3 COC1=CC=C(C(N)=O)C=C1 HL2560 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.3 COC1=CC=C(N(C)C)C=C1 YH14709 [0,1,0,0,0,0|1,0,1]=3 272 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 JZ5490 [0,1,0,0,0,0|1,0,1]=3 273 B11R1.3 COC1=NC=C(C(=O)O)C=C1 JZ0752 [0,1,0,0,0,0|3,0,0]=4 274 B11R1.3 CSC1=CC=C(B(O)O)C=C1 LL1731 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 LT3084 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 XJ1918 [0,1,0,0,0,0|1,0,0]=2 277 B11R1.3 FC(F)C1=CC=C(CBr)C=C1 CJ3499 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 JZ2849 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 JZ3942 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 LQ0055 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CJ2943 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 JZ0800 [0,1,0,0,0,0|3,0,0]=4 283 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 YH66572 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.3 O=C(Cl)C1=CC=C(CCl)C=C1 HL0470 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 RT10589 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 HL4991 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 XJ2357 [0,1,0,0,0,0|2,0,0]=3 288 B11R1.3 O=[N+]([O-])C1=CC=C(CBr)C=C1 LT2901 [0,1,0,0,0,0|3,0,0]=4 289 B11R1.3 O=[N+]([O-])C1=CC=C(CCl)C=C1 JZ0439 [0,1,0,0,0,0|3,0,0]=4 290 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 LT6151 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 XJ6121 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.3 OCC1=CC=C(B(O)O)C=C1 LQ5464 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 JZ2422 [0,1,0,0,0,0|1,0,2]=4 294 B11R1.19 CC(C)(C)C1=CC=C(Cl)C=C1 LT3700 [0,1,0,0,0,0|1,0,2]=4 295 B11R1.19 CC(C)(N)C1=CC=C(F)C=C1 YH40959 [0,1,0,0,0,0|1,0,2]=4 296 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 YH45396 [0,1,0,0,0,0|1,0,2]=4 297 B11R1.19 CC1=CC=C(S(=O)(=O)Cl)C=C1 LT7261 [0,1,0,0,0,0|3,0,0]=4 298 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 HL2904 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 LL0357 [0,1,0,0,0,0|3,0,0]=4 300 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 RT4375 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 RT8618 [0,1,0,0,0,0|3,0,0]=4 302 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 XJ3061 [0,1,0,0,0,0|3,0,0]=4 303 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 YH22643 [0,1,0,0,0,0|3,0,0]=4 304 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 XJ1294 [0,1,0,0,0,0|3,0,0]=4 305 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 XJ6642 [0,1,0,0,0,0|3,0,0]=4 306 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH08874 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH65358 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH65582 [0,1,0,0,0,0|3,0,0]=4 309 B11R1.19 CC1=CC=C(S(=O)([O-])=S)C=C1 LQ4605 [0,1,0,0,0,0|3,0,0]=4 310 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 JZ2240 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 XJ0246 [0,1,0,0,0,0|3,0,0]=4 312 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 HL1799 [0,1,0,0,0,0|3,0,0]=4 313 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 LQ2928 [0,1,0,0,0,0|3,0,0]=4 314 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 JZ4918 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.21 C=C(C)[C@@H]1CC=C(C)C(=O)C1 XJ3135 [0,1,0,0,0,0|0,0,3]=4 316 B11R1.21 CC(=O)C1=CC(Br)=C(Br)C=C1 LX3134 [0,1,0,0,0,0|2,0,0]=3 317 B11R1.21 CC(=O)C1=CC(Br)=C(Cl)C=C1 YH06604 [0,1,0,0,0,0|2,0,0]=3 318 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 HL0596 [0,1,0,0,0,0|2,0,0]=3 319 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 JZ2152 [0,1,0,0,0,0|2,0,0]=3 320 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 XJ0695 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 LQ0788 [0,1,0,0,0,0|2,0,0]=3 322 B11R1.21 CC(=O)C1=CC(N)=C(F)C=C1 LX2782 [0,1,0,0,0,0|2,0,0]=3 323 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 JZ4491 [0,1,0,0,0,0|2,0,0]=3 324 B11R1.21 CC(=O)C1=CC=C(Br)C(F)=C1 LX2244 [0,1,0,0,0,0|2,0,0]=3 325 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 LL0209 [0,1,0,0,0,0|1,0,0]=2 326 B11R1.21 CC(=O)C1=CC=C(Cl)C(Cl)=C1 JZ2110 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 LQ3334 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 LQ1233 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.21 CC1=C(Cl)C=C([N+](=O)[O-])C=C1 JZ3720 [0,1,0,0,0,0|3,0,0]=4 330 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 LT6782 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.21 CC1=C(F)C=C([N+](=O)[O-])C=C1 XJ1742 [0,1,0,0,0,0|3,0,0]=4 332 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 LQ0789 [0,1,0,0,0,0|3,0,0]=4 333 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 LL1505 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 XJ2209 [0,1,0,0,0,0|2,0,0]=3 335 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 LT2618 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 LT2606 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.21 CC1=C(O)C=C([N+](=O)[O-])C=C1 JZ0089 [0,1,0,0,0,0|3,0,0]=4 338 B11R1.21 CC1=CC(C(=O)Cl)=CC=C1Br LQ4321 [0,1,0,0,0,0|3,0,0]=4 339 B11R1.21 CC1=CC=C(B(O)O)C=C1C LT1839 [0,1,0,0,0,0|3,0,0]=4 340 B11R1.21 CC1=CC=C(C(=O)Cl)C=C1I YH65834 [0,1,0,0,0,0|2,0,0]=3 341 B11R1.21 CC1=CC=C(C(=O)O)C=C1Cl LQ2823 [0,1,0,0,0,0|2,0,0]=3 342 B11R1.21 CC1=CC=C(C(N)=O)C=C1N LT3129 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.21 CC1=CC=C(C(N)=S)C=C1F LL2430 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.21 CC1=CC=C(N(=O)=O)C=C1Br LT1666 [0,1,0,0,0,0|3,0,0]=4 345 B11R1.21 CC1=[N+](C)C=C(C(N)=O)C=C1 RT9402 [0,1,0,0,0,0|3,0,0]=4 346 B11R1.21 N=C(N)C1=CC=C(N)C(N)=C1 YH14015 [0,1,0,0,0,0|3,0,0]=4 347 B11R1.21 NC(=O)C1=CC(N)=C(Cl)C=C1 LT2911 [0,1,0,0,0,0|3,0,0]=4 348 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 LT2770 [0,1,0,0,0,0|3,0,0]=4 349 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 LQ1234 [0,1,0,0,0,0|3,0,0]=4 350 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 LQ2164 [0,1,0,0,0,0|3,0,0]=4 351 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 JZ0161 [0,1,0,0,0,0|3,0,0]=4 352 B11R1.21 NC1=CC=C(C(=O)O)C=C1Br YH11091 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl YH49312 [0,1,0,0,0,0|3,0,0]=4 354 B11R1.21 NC1=CC=C(C(=O)O)C=C1F RT1599 [0,1,0,0,0,0|3,0,0]=4 355 B11R1.21 O=C(Cl)C1=CC(Br)=C(F)C=C1 HL0321 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Cl)C=C1 LQ2350 [0,1,0,0,0,0|3,0,0]=4 357 B11R1.21 O=C(Cl)C1=CC(Cl)=C(F)C=C1 LL1129 [0,1,0,0,0,0|3,0,0]=4 358 B11R1.21 O=C(Cl)C1=CC(F)=C(F)C=C1 HL4581 [0,1,0,0,0,0|3,0,0]=4 359 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 HL1019 [0,1,0,0,0,0|3,0,0]=4 360 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 LQ0791 [0,1,0,0,0,0|3,0,0]=4 361 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 LQ5082 [0,1,0,0,0,0|3,0,0]=4 362 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 YH55532 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=C1 LQ5083 [0,1,0,0,0,0|3,0,0]=4 364 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 LT6724 [0,1,0,0,0,0|3,0,0]=4 365 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 LQ0790 [0,1,0,0,0,0|3,0,0]=4 366 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 LQ5176 [0,1,0,0,0,0|3,0,0]=4 367 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 LQ0734 [0,1,0,0,0,0|3,0,0]=4 368 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 LT6644 [0,1,0,0,0,0|3,0,0]=4 369 B11R1.22 C(=O)C(C)C1=CC=C(Cl)C=C1 YH58118 [0,1,0,0,0,0|1,0,1]=3 370 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 YH65417 [0,1,0,0,0,0|1,0,0]=2 371 B11R1.22 CC1=CC=C(C(C)C=O)C=C1 HL1295 [0,1,0,0,0,0|0,0,1]=2 372 B11R1.22 CC1=CC=C(C(O)CN)C=C1 RT1609 [0,1,0,0,0,0|1,0,1]=3 373 B11R1.22 CC1=CC=C(\C(C)=N\O)C=C1 HL2147 [0,1,0,0,0,0|1,0,0]=2 374 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 YH14959 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 RT11202 [0,1,0,0,0,0|2,0,0]=3 376 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 LT4307 [0,1,0,0,0,0|1,0,2]=4 377 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 JZ3934 [0,1,0,0,0,0|2,0,0]=3 378 B11R1.22 COC(=O)C1=CC=C(C)N=C1 RT12187 [0,1,0,0,0,0|2,0,0]=3 379 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 HL0691 [0,1,0,0,0,0|2,0,0]=3 380 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 JZ0748 [0,1,0,0,0,0|3,0,0]=4 381 B11R1.22 COC(=O)C1=CC=C(F)C=C1 JZ1260 [0,1,0,0,0,0|2,0,0]=3 382 B11R1.22 COC(=O)C1=CC=C(F)N=C1 XJ1741 [0,1,0,0,0,0|3,0,0]=4 383 B11R1.22 COC(=O)C1=CC=C(I)C=C1 JZ3935 [0,1,0,0,0,0|2,0,0]=3 384 B11R1.22 COC(=O)C1=CC=C(N)C=C1 JZ3936 [0,1,0,0,0,0|2,0,0]=3 385 B11R1.22 COC(=O)C1=CC=C(N)N=C1 JZ1658 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.22 COC(=O)C1=CC=C(O)C=C1 LT7452 [0,1,0,0,0,0|2,0,0]=3 387 B11R1.22 COC(=O)C1=CC=C(O)C=N1 SY0217 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.22 COC(=O)C1=CC=C([O-])C=C1 YH03826 [0,1,0,0,0,0|2,0,0]=3 389 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 LX3189 [0,1,0,0,0,0|3,0,0]=4 390 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 XJ4983 [0,1,0,0,0,0|3,0,0]=4 391 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 RT10568 [0,1,0,0,0,0|2,0,0]=3 392 B11R1.22 FC1=CC=C(C(Br)CBr)C=C1 YH56190 [0,1,0,0,0,0|2,0,1]=4 393 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 RT1562 [0,1,0,0,0,0|2,0,0]=3 394 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 LQ2917 [0,1,0,0,0,0|2,0,0]=3 395 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 RT2897 [0,1,0,0,0,0|2,0,0]=3 396 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 YH17779 [0,1,0,0,0,0|2,0,0]=3 397 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 YH17778 [0,1,0,0,0,0|2,0,0]=3 398 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 HL1815 [0,1,0,0,0,0|2,0,0]=3 399 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 LX2710 [0,1,0,0,0,0|2,0,0]=3 400 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 YH43755 [0,1,0,0,0,0|2,0,0]=3 401 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 LQ2961 [0,1,0,0,0,0|3,0,0]=4 402 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 LL0964 [0,1,0,0,0,0|3,0,0]=4 403 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 HL1818 [0,1,0,0,0,0|3,0,0]=4 404 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 XJ2875 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 LT2239 [0,1,0,0,0,0|3,0,0]=4 406 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 HL1296 [0,1,0,0,0,0|2,0,0]=3 407 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 LT2785 [0,1,0,0,0,0|2,0,0]=3 408 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 RT10679 [0,1,0,0,0,0|2,0,0]=3 409 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 HL1817 [0,1,0,0,0,0|2,0,0]=3 410 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 YH11049 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 YH04927 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 HL0592 [0,1,0,0,0,0|2,0,0]=3 413 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 LX2629 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 YH65890 [0,1,0,0,0,0|2,0,0]=3 415 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 YH65861 [0,1,0,0,0,0|2,0,0]=3 416 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 LL0744 [0,1,0,0,0,0|2,0,0]=3 417 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 HL0874 [0,1,0,0,0,0|2,0,0]=3 418 B11R1.166 CC(=O)C1=CC=C(Br)C=C1Br LX2251 [0,1,0,0,0,0|2,0,0]=3 419 B11R1.166 CC(=O)C1=CC=C(C)C=C1O YH14255 [0,1,0,0,0,0|1,0,0]=2 420 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br YH88248 [0,1,0,0,0,0|2,0,0]=3 421 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1F LL2461 [0,1,0,0,0,0|2,0,0]=3 422 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br YH10272 [0,1,0,0,0,0|2,0,0]=3 423 B11R1.166 CC(=O)C1=CC=C(O)C=C1Cl XJ6151 [0,1,0,0,0,0|2,0,0]=3 424 B11R1.166 CC(=O)C1=CC=C(O)C=C1Cl YH00402 [0,1,0,0,0,0|2,0,0]=3 425 B11R1.166 CC(=O)C1=CC=C(O)C=C1F YH98787 [0,1,0,0,0,0|2,0,0]=3 426 B11R1.166 CC(=O)C1=CC=C(O)C=C1O RT11977 [0,1,0,0,0,0|2,0,0]=3 427 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 LQ3335 [0,1,0,0,0,0|2,0,0]=3 428 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 LX2050 [0,1,0,0,0,0|2,0,0]=3 429 B11R1.166 CC1=CC(Cl)=C([N+](=O)[O-])C=C1 YH58663 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.166 CC1=CC(Cl)=CC=C1C(=O)O YH17041 [0,1,0,0,0,0|3,0,0]=4 431 B11R1.166 CC1=CC(F)=C([N+](=O)[O-])C=C1 XJ0766 [0,1,0,0,0,0|3,0,0]=4 432 B11R1.166 CC1=CC(N)=CC=C1C(C)C HL2774 [0,1,0,0,0,0|1,0,2]=4 433 B11R1.166 CC1=CC(O)=C(C(=O)O)C=N1 YH13201 [0,1,0,0,0,0|3,0,0]=4 434 B11R1.166 CC1=CC(O)=C(C(N)=O)C=C1 LT2462 [0,1,0,0,0,0|2,0,0]=3 435 B11R1.166 CC1=CC=C(C(=O)O)C(F)=C1 YH18052 [0,1,0,0,0,0|2,0,0]=3 436 B11R1.166 CC1=CC=C(C(=O)O)C(N)=C1 HL2212 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.166 CC1=CC=C(C(N)=O)C(N)=C1 LT0244 [0,1,0,0,0,0|2,0,0]=3 438 B11R1.166 C[C@@H](N)C1=CC=C(Br)C=C1F YH89064 [0,1,0,0,0,0|2,0,1]=4 439 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1O RT3352 [0,1,0,0,0,0|2,0,1]=4 440 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1Cl XJ2193 [0,1,0,0,0,0|3,0,0]=4 441 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 YH45406 [0,1,0,0,0,0|3,0,0]=4 442 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 LT0240 [0,1,0,0,0,0|3,0,0]=4 443 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 RT1598 [0,1,0,0,0,0|3,0,0]=4 444 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 XJ2208 [0,1,0,0,0,0|3,0,0]=4 445 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 XJ0046 [0,1,0,0,0,0|3,0,0]=4 446 B11R1.166 NC1=CC=C(C(=O)O)C(F)=C1 LX3182 [0,1,0,0,0,0|3,0,0]=4 447 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 HL3362 [0,1,0,0,0,0|3,0,0]=4 448 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 JZ3312 [0,1,0,0,0,0|3,0,0]=4 449 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 LL0519 [0,1,0,0,0,0|3,0,0]=4 450 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 LQ0597 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 XJ1113 [0,1,0,0,0,0|3,0,0]=4 452 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 HL0593 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 RT11949 [0,1,0,0,0,0|3,0,0]=4 454 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 HL1032 [0,1,0,0,0,0|3,0,0]=4 455 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 YH07341 [0,1,0,0,0,0|3,0,0]=4 456 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 RT12288 [0,1,0,0,0,0|3,0,0]=4 457 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 XJ0764 [0,1,0,0,0,0|3,0,0]=4 458 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 LT2788 [0,1,0,0,0,0|3,0,0]=4 459 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 LQ0700 [0,1,0,0,0,0|3,0,0]=4 460 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O HL0984 [0,1,0,0,0,0|3,0,0]=4 461 B11R1.166 O=C(O)C1=CC=C(F)C=C1Cl LT6491 [0,1,0,0,0,0|3,0,0]=4 462 B11R1.166 O=C(O)C1=CC=C(I)C=C1Br YH51932 [0,1,0,0,0,0|3,0,0]=4 463 B11R1.166 O=C(O)C1=CC=C(I)C=C1F LL2023 [0,1,0,0,0,0|3,0,0]=4 464 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl RT11083 [0,1,0,0,0,0|3,0,0]=4 465 B11R1.166 O=C(O)C1=CC=C(S)C=C1Br RT13176 [0,1,0,0,0,0|3,0,0]=4 466 B9R0.1 C=C\C(C)=C\CC=C(C)C RT1294 [0,0,1,0,0,0|0,0,2]=3 467 B9R0.1 C\C=C(C)\C=C\C=C(C)C RT1305 [0,0,1,0,0,0|0,0,2]=3 468 B11R2.34 ClC1=CC=C(C2CO2)C=C1 RT7256 [0,0,0,1,0,0|2,0,1]=4 469 B11R2.34 OC1=CC=C(C2CO2)C=C1 RT7953 [0,0,0,1,0,0|2,0,1]=4 470 B9R1.35 CC(=O)C1=CC(C)=CS1 JZ4815 [0,0,0,0,1,0|2,0,0]=3 471 B9R1.35 CC(=O)C1=CC(Cl)=CS1 XJ5172 [0,0,0,0,1,0|3,0,0]=4 472 B9R1.35 CC(=O)C1=CC=C(Br)S1 XJ2893 [0,0,0,0,1,0|3,0,0]=4 473 B9R1.35 CC(=O)C1=CC=C(C)O1 JZ1181 [0,0,0,0,1,0|2,0,0]=3 474 B9R1.35 CC(=O)C1=CC=C(Cl)S1 LQ1289 [0,0,0,0,1,0|3,0,0]=4 475 B9R1.35 CC(=O)C1=CN(C)C=C1 JZ4275 [0,0,0,0,1,0|2,0,0]=3 476 B9R1.35 CC1=CC=C(C(=O)Cl)S1 LT0712 [0,0,0,0,1,0|3,0,0]=4 477 B9R1.35 CC1=CC=C(C(=O)O)S1 LQ2018 [0,0,0,0,1,0|3,0,0]=4 478 B9R1.35 CC1=CNC(C(=O)O)=C1 YH42507 [0,0,0,0,1,0|3,0,0]=4 479 B9R1.35 CC1=CSC(C(=O)O)=C1 XJ4050 [0,0,0,0,1,0|3,0,0]=4 480 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 JZ2786 [0,0,0,0,0,1|2,0,0]=3 481 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 HL1838 [0,0,0,0,0,1|2,0,0]=3 482 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 YH18094 [0,0,0,0,0,1|2,0,0]=3 483 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 LL0348 [0,0,0,0,0,1|2,0,0]=3 484 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 XJ0481 [0,0,0,0,0,1|2,0,0]=3 485 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 RT12770 [0,0,0,0,0,1|2,0,0]=3 486 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 HL0695 [0,0,0,0,0,1|2,0,0]=3 487 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 LT3770 [0,0,0,0,0,1|3,0,0]=4 488 B11R1.20 CC(=O)NC1=NC=C(N)C=C1 XJ5030 [0,0,0,0,0,1|3,0,0]=4 489 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 XJ0551 [0,0,0,0,0,1|1,0,0]=2 490 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 YH54366 [0,0,0,0,0,1|2,0,0]=3 491 B11R1.20 CC(=O)SC1=CC=C(I)C=C1 YH14509 [0,0,0,0,0,1|2,0,0]=3 492 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 LX2745 [0,0,0,0,0,1|1,0,2]=4 493 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 HL0415 [0,0,0,0,0,1|1,0,2]=4 494 B11R1.20 CC(C)OC1=CC=C(N)C=C1 LQ3314 [0,0,0,0,0,1|1,0,2]=4 495 B11R1.20 CC(N)CC1=CC=C(F)C=C1 HL1836 [0,0,0,0,0,1|2,0,1]=4 496 B11R1.20 CC(N)CC1=CC=C(F)C=C1 LL1086 [0,0,0,0,0,1|2,0,1]=4 497 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 JZ4004 [0,0,0,0,0,1|2,0,0]=3 498 B11R1.20 CC1=CC=C(OC(=S)Cl)C=C1 JZ4309 [0,0,0,0,0,1|2,0,0]=3 499 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 RT3249 [0,0,0,0,0,1|3,0,0]=4 500 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 XJ4357 [0,0,0,0,0,1|3,0,0]=4 501 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 XJ0550 [0,0,0,0,0,1|3,0,0]=4 502 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 XJ1279 [0,0,0,0,0,1|3,0,0]=4 503 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 LQ3999 [0,0,0,0,0,1|3,0,0]=4 504 B11R1.20 NC(=S)NC1=CC=C(Cl)C=C1 XJ2569 [0,0,0,0,0,1|3,0,0]=4 505 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 LT3063 [0,0,0,0,0,1|3,0,0]=4 506 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 HL1839 [0,0,0,0,0,1|3,0,0]=4 507 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 LQ3329 [0,0,0,0,0,1|3,0,0]=4 508 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 LQ1955 [0,0,0,0,0,1|3,0,0]=4 509 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 LT3076 [0,0,0,0,0,1|3,0,0]=4 510 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 RT12785 [0,0,0,0,0,1|3,0,0]=4 511 B11R1.20 S=C(Cl)OC1=CC=C(Cl)C=C1 JZ4310 [0,0,0,0,0,1|3,0,0]=4 512 B8R0.9 C=C\C(C)=C\CC(=C)C LT4353 [1,0,1,0,0,0|0,0,2]=4 513 B8R1.2 BrCC1=CC=CC=C1 JZ1264 [2,0,0,0,0,0|1,0,1]=4 514 B8R1.2 Br[Mg]C1=CC=CC=C1 HL1276 [2,0,0,0,0,0|2,0,0]=4 515 B8R1.2 C=CC1=CC=CC=C1 XJ3473 [2,0,0,0,0,0|0,0,0]=2 516 B8R1.2 C=CC1=CC=CN=C1 RT7678 [2,0,0,0,0,0|1,0,0]=3 517 B8R1.2 C=CC1=NC=CN=C1 JZ1744 [2,0,0,0,0,0|2,0,0]=4 518 B8R1.2 CCC1=CC=CN=C1 JZ1084 [2,0,0,0,0,0|1,0,1]=4 519 B8R1.2 CCC1=CC=NC=C1 LL0974 [2,0,0,0,0,0|1,0,1]=4 520 B8R1.2 CNC1=CC=CN=C1 LT2493 [2,0,0,0,0,0|2,0,0]=4 521 B8R1.2 CNC1=CC=NC=C1 LT6892 [2,0,0,0,0,0|2,0,0]=4 522 B8R1.2 COC1=CC=CN=C1 LT6817 [2,0,0,0,0,0|2,0,0]=4 523 B8R1.2 COC1=NC=CC=C1 LT2109 [2,0,0,0,0,0|2,0,0]=4 524 B8R1.2 CSC1=NC=CC=C1 LT2167 [2,0,0,0,0,0|2,0,0]=4 525 B8R1.2 ClCC1=CC=CC=C1 HL1268 [2,0,0,0,0,0|1,0,1]=4 526 B8R1.2 N#CC1=CC=CC=C1 JZ4954 [2,0,0,0,0,0|1,0,1]=4 527 B8R1.2 N#CC1=CC=CC=C1 XJ4015 [2,0,0,0,0,0|1,0,1]=4 528 B8R1.2 NCC1=CC=CC=C1 LQ1371 [2,0,0,0,0,0|1,0,1]=4 529 B8R1.2 NNC1=CC=CC=C1 HL1279 [2,0,0,0,0,0|2,0,0]=4 530 B8R1.2 NNC1=CC=CC=C1 JZ5772 [2,0,0,0,0,0|2,0,0]=4 531 B8R1.2 O=CC1=CC=CC=N1 JZ0732 [2,0,0,0,0,0|2,0,0]=4 532 B8R1.2 O=CC1=CC=CN=C1 RT10183 [2,0,0,0,0,0|2,0,0]=4 533 B8R1.2 O=NC1=CC=CC=C1 YH08587 [2,0,0,0,0,0|2,0,0]=4 534 B8R1.2 O=[As]C1=CC=CC=C1 JZ4036 [2,0,0,0,0,0|2,0,0]=4 535 B8R1.2 OCC1=CC=CC=C1 HL1271 [2,0,0,0,0,0|1,0,1]=4 536 B8R1.2 O[Hg]C1=CC=CC=C1 LQ3360 [2,0,0,0,0,0|2,0,0]=4 537 B8R1.2 SCC1=CC=CC=C1 HL1273 [2,0,0,0,0,0|1,0,1]=4 538 B8R1.2 [C-]#CC1=CC=CC=C1 JZ3648 [2,0,0,0,0,0|0,0,2]=4 539 B8R1.2 [C-]#[N+]C1=CC=CC=C1 YH65599 [2,0,0,0,0,0|1,0,1]=4 540 B8R1.3 BrC1=CC=C(Br)C=C1 LT0052 [2,0,0,0,0,0|2,0,0]=4 541 B8R1.3 BrC1=CC=C(I)C=C1 HL0068 [2,0,0,0,0,0|2,0,0]=4 542 B8R1.3 CC1=CC=C(C)N=C1 JZ0986 [2,0,0,0,0,0|1,0,0]=3 543 B8R1.3 CC1=CC=C(Cl)C=C1 HL1310 [2,0,0,0,0,0|1,0,0]=3 544 B8R1.3 CC1=CC=C(F)C=C1 LL0677 [2,0,0,0,0,0|1,0,0]=3 545 B8R1.3 CC1=CC=C(F)C=N1 LQ4679 [2,0,0,0,0,0|2,0,0]=4 546 B8R1.3 CC1=CC=C(I)C=C1 XJ1165 [2,0,0,0,0,0|1,0,0]=3 547 B8R1.3 CC1=CC=C(N)C=C1 RT11917 [2,0,0,0,0,0|1,0,0]=3 548 B8R1.3 CC1=CC=C(N)C=C1 XJ0919 [2,0,0,0,0,0|1,0,0]=3 549 B8R1.3 CC1=CC=C(N)C=C1 XJ0920 [2,0,0,0,0,0|1,0,0]=3 550 B8R1.3 CC1=CC=C(O)C=N1 HL0641 [2,0,0,0,0,0|2,0,0]=4 551 B8R1.3 CC1=CC=C([Hg+])C=C1 RT11940 [2,0,0,0,0,0|1,0,0]=3 552 B8R1.3 CC1=CC=[N+]([O-])C=C1 HL0579 [2,0,0,0,0,0|2,0,0]=4 553 B8R1.3 CC1=CN=C(C)C=N1 JZ0984 [2,0,0,0,0,0|2,0,0]=4 554 B8R1.3 CC1=CN=C(Cl)C=C1 YH41921 [2,0,0,0,0,0|2,0,0]=4 555 B8R1.3 CC1=CN=C(F)C=C1 LQ2150 [2,0,0,0,0,0|2,0,0]=4 556 B8R1.3 CC1=CN=C(N)C=C1 RT2045 [2,0,0,0,0,0|2,0,0]=4 557 B8R1.3 CC1=CN=C(O)C=C1 LT3568 [2,0,0,0,0,0|2,0,0]=4 558 B8R1.3 CC1=NC=C(Br)C=C1 JZ0784 [2,0,0,0,0,0|2,0,0]=4 559 B8R1.3 CC1=NC=C(I)C=C1 YH65880 [2,0,0,0,0,0|2,0,0]=4 560 B8R1.3 CC1=NC=C(N)C=C1 JZ1162 [2,0,0,0,0,0|2,0,0]=4 561 B8R1.3 CC1=NC=C(O)C=C1 YH65665 [2,0,0,0,0,0|2,0,0]=4 562 B8R1.3 CN1C=CC(=O)C=C1 RT6737 [2,0,0,0,0,0|2,0,0]=4 563 B8R1.3 ClC1=CC=C(Br)C=C1 XJ0365 [2,0,0,0,0,0|2,0,0]=4 564 B8R1.3 ClC1=CC=C(I)C=C1 JZ4051 [2,0,0,0,0,0|2,0,0]=4 565 B8R1.3 FC1=CC=C(Br)C=C1 LT0069 [2,0,0,0,0,0|2,0,0]=4 566 B8R1.3 FC1=CC=C(Cl)C=C1 LL0678 [2,0,0,0,0,0|2,0,0]=4 567 B8R1.3 FC1=CC=C(I)C=C1 SY0222 [2,0,0,0,0,0|2,0,0]=4 568 B8R1.3 IC1=CC=C(I)C=C1 SY0265 [2,0,0,0,0,0|2,0,0]=4 569 B8R1.3 NC1=CC=C(Br)C=C1 HL1307 [2,0,0,0,0,0|2,0,0]=4 570 B8R1.3 NC1=CC=C(F)C=C1 RT2771 [2,0,0,0,0,0|2,0,0]=4 571 B8R1.3 NC1=CC=C(I)C=C1 XJ0921 [2,0,0,0,0,0|2,0,0]=4 572 B8R1.3 NC1=CC=C(N)C=C1 LQ5353 [2,0,0,0,0,0|2,0,0]=4 573 B8R1.3 NC1=CC=C(N)C=C1 LT7264 [2,0,0,0,0,0|2,0,0]=4 574 B8R1.3 NC1=CC=C(N)C=C1 RT13509 [2,0,0,0,0,0|2,0,0]=4 575 B8R1.3 NC1=CC=C(O)C=C1 RT3071 [2,0,0,0,0,0|2,0,0]=4 576 B8R1.3 NC1=CC=C(S)C=C1 JZ4463 [2,0,0,0,0,0|2,0,0]=4 577 B8R1.3 O=C1C=CC(=O)C=C1 HL1314 [2,0,0,0,0,0|2,0,0]=4 578 B8R1.3 OC1=CC=C(Br)C=C1 HL1308 [2,0,0,0,0,0|2,0,0]=4 579 B8R1.3 OC1=CC=C(I)C=C1 LT6103 [2,0,0,0,0,0|2,0,0]=4 580 B8R1.3 OC1=CC=C(I)C=C1 XJ0922 [2,0,0,0,0,0|2,0,0]=4 581 B8R1.3 OC1=CC=C(O)C=C1 JZ0106 [2,0,0,0,0,0|2,0,0]=4 582 B8R1.3 SC1=CC=C(Br)C=C1 HL1316 [2,0,0,0,0,0|2,0,0]=4 583 B8R1.3 [15NH2]C1=CC=C([15NH2])C=C1 RT3027 [2,0,0,0,0,0|2,0,0]=4 584 B10R0.44 C=C\C(C)=C\C(=O)C=C(C)C RT0549 [0,1,1,0,0,0|0,0,1]=3 585 B10R0.93 C=C(C)C(=O)OC(=O)C(=C)C YH17589 [0,1,1,0,0,0|2,0,0]=4 586 B10R1.1 Br\C=C\C1=CC=C(Br)C=C1 RT6387 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.1 CC1=CC=C(CC#N)C=C1 JZ2192 [1,1,0,0,0,0|0,0,2]=4 588 B10R1.1 CC1=CC=C(CCN)C=C1 XJ2410 [1,1,0,0,0,0|0,0,1]=3 589 B10R1.1 CC1=CC=C(N=C=O)C=C1 LT3140 [1,1,0,0,0,0|1,0,1]=4 590 B10R1.1 CC1=CN=C(CCN)C=C1 YH88428 [1,1,0,0,0,0|1,0,1]=4 591 B10R1.1 CCCC1=CC=C(N)C=C1 XJ2253 [1,1,0,0,0,0|1,0,1]=4 592 B10R1.1 CCNC1=CC=C(C)C=C1 JZ4006 [1,1,0,0,0,0|0,0,1]=3 593 B10R1.1 CCNC1=CC=C(Cl)C=C1 YH66088 [1,1,0,0,0,0|1,0,1]=4 594 B10R1.1 CCOC1=CC=C(I)C=C1 LQ1391 [1,1,0,0,0,0|1,0,1]=4 595 B10R1.1 CCOC1=CC=C(N)C=C1 RT3081 [1,1,0,0,0,0|1,0,1]=4 596 B10R1.1 CCOC1=CC=C(O)C=C1 JZ4008 [1,1,0,0,0,0|1,0,1]=4 597 B10R1.1 COCC1=CC=C(O)C=C1 YH05854 [1,1,0,0,0,0|1,0,1]=4 598 B10R1.1 ClC1=CC=C(CCBr)C=C1 XJ3158 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.1 ClC1=CC=C(\C=C\Br)C=C1 RT6043 [1,1,0,0,0,0|1,0,0]=3 600 B10R1.1 FC1=CC=C(CCBr)C=C1 RT12501 [1,1,0,0,0,0|1,0,1]=4 601 B10R1.1 NCCC1=CC=C(Br)C=C1 LL1320 [1,1,0,0,0,0|1,0,1]=4 602 B10R1.1 NCCC1=CC=C(Cl)C=C1 LQ0644 [1,1,0,0,0,0|1,0,1]=4 603 B10R1.1 NCCC1=CC=C(F)C=C1 LT3075 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.1 NCCC1=CC=C(N)C=C1 LT0213 [1,1,0,0,0,0|1,0,1]=4 605 B10R1.1 NCCC1=CC=C(O)C=C1 RT6525 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.1 NCCC1=CC=C(O)C=C1 YH09355 [1,1,0,0,0,0|1,0,1]=4 607 B10R1.1 O=CCC1=CC=C(F)C=C1 YH40007 [1,1,0,0,0,0|1,0,1]=4 608 B10R1.1 O=CCC1=CC=C(O)C=C1 RT6375 [1,1,0,0,0,0|1,0,1]=4 609 B10R1.1 OCCC1=CC=C(Br)C=C1 LQ2719 [1,1,0,0,0,0|1,0,1]=4 610 B10R1.1 OCCC1=CC=C(F)C=C1 LT2419 [1,1,0,0,0,0|1,0,1]=4 611 B10R1.1 OCCC1=CC=C(O)C=C1 RT12563 [1,1,0,0,0,0|1,0,1]=4 612 B10R1.1 O\N=C\C1=CC=C(F)C=C1 YH02278 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.3 BrCC1=CC=C(CBr)C=C1 XJ1138 [1,1,0,0,0,0|1,0,1]=4 614 B10R1.3 C#CC1=CC=C(CO)C=C1 YH23238 [1,1,0,0,0,0|0,0,2]=4 615 B10R1.3 C#CC1=CC=C(OC)C=C1 HL0395 [1,1,0,0,0,0|0,0,2]=4 616 B10R1.3 C(=O)C1=CC=C(OC)C=C1 JZ1237 [1,1,0,0,0,0|1,0,0]=3 617 B10R1.3 C=CC1=CC=C(C=O)C=C1 YH41162 [1,1,0,0,0,0|0,0,1]=3 618 B10R1.3 C=CC1=CC=C(CCl)C=C1 XJ1818 [1,1,0,0,0,0|0,0,0]=2 619 B10R1.3 C=CC1=CC=C(CO)C=C1 YH23867 [1,1,0,0,0,0|0,0,0]=2 620 B10R1.3 C=CC1=CC=C(OC)C=C1 JZ4048 [1,1,0,0,0,0|0,0,0]=2 621 B10R1.3 CCC1=CC=C(C#N)C=C1 JZ5677 [1,1,0,0,0,0|0,0,2]=4 622 B10R1.3 CCC1=CC=C(CC)C=C1 XJ0304 [1,1,0,0,0,0|0,0,1]=3 623 B10R1.3 CCC1=CC=C(NN)C=C1 LQ5282 [1,1,0,0,0,0|1,0,1]=4 624 B10R1.3 CNC1=CC=C(NC)C=C1 RT3267 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.3 CNC1=CC=C(OC)C=C1 LQ2977 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.3 COC1=CC=C(C#N)C=C1 LT2837 [1,1,0,0,0,0|1,0,1]=4 627 B10R1.3 COC1=CC=C(C=O)N=C1 YH47276 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.3 COC1=CC=C(CCl)C=C1 JZ4193 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.3 COC1=CC=C(CN)C=C1 LT3064 [1,1,0,0,0,0|1,0,0]=3 630 B10R1.3 COC1=CC=C(CS)C=C1 LX2163 [1,1,0,0,0,0|1,0,0]=3 631 B10R1.3 COC1=CC=C(NN)C=C1 LL1277 [1,1,0,0,0,0|2,0,0]=4 632 B10R1.3 COC1=CC=C(NN)C=C1 XJ4526 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.3 COC1=CC=C(OC)C=C1 LT7890 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.3 COC1=CC=C(SC)C=C1 LQ1964 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.3 COC1=CC=C([Mg]Br)C=C1 LQ3616 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.3 N#CC1=CC=C(C=O)C=C1 XJ0305 [1,1,0,0,0,0|1,0,1]=4 637 B10R1.3 N#CC1=CC=C(CBr)C=C1 LT6906 [1,1,0,0,0,0|1,0,1]=4 638 B10R1.3 N#CC1=CC=C(CBr)C=C1 XJ4361 [1,1,0,0,0,0|1,0,1]=4 639 B10R1.3 N#CC1=CC=C(CCl)C=C1 XJ1447 [1,1,0,0,0,0|1,0,1]=4 640 B10R1.3 N#CC1=CC=C(CN)C=C1 XJ4200 [1,1,0,0,0,0|1,0,1]=4 641 B10R1.3 NCC1=CC=C(CO)C=C1 YH55734 [1,1,0,0,0,0|1,0,1]=4 642 B10R1.3 O=CC1=CC=C(C=O)C=C1 LT7182 [1,1,0,0,0,0|1,0,1]=4 643 B10R1.3 O=CC1=CC=C(CO)C=C1 YH04958 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.3 OCC1=CC=C(CCl)C=C1 YH38510 [1,1,0,0,0,0|1,0,1]=4 645 B10R1.3 SCC1=CC=C(CS)C=C1 XJ0306 [1,1,0,0,0,0|1,0,1]=4 646 B10R1.25 C(=O)C1=C(Cl)C=C(F)C=C1 XJ6487 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.25 C=CC1=C(F)C=C(F)C=C1 YH59246 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.25 C=CC1=CC=C(Br)C=C1Cl RT6460 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.25 CC1=C(C=O)C=CC(O)=C1 XJ5425 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 JZ4185 [1,1,0,0,0,0|1,0,0]=3 651 B10R1.25 CC1=CC(C)=C(C=O)C=C1 JZ5009 [1,1,0,0,0,0|1,0,0]=3 652 B10R1.25 CC1=CC(C)=C(CCl)C=C1 JZ4186 [1,1,0,0,0,0|1,0,1]=4 653 B10R1.25 CC1=CC(C)=C(NN)C=C1 XJ5904 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 YH46254 [1,1,0,0,0,0|1,0,1]=4 655 B10R1.25 CC1=CC(Cl)=C(NN)C=C1 HL4914 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.25 CC1=CC(F)=C(C#N)C=C1 HL4738 [1,1,0,0,0,0|1,0,1]=4 657 B10R1.25 CC1=CC(F)=CC=C1C=O YH11075 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.25 CC1=CC(O)=C(C=O)C=C1 LQ1383 [1,1,0,0,0,0|1,0,0]=3 659 B10R1.25 CC1=CC=C(C#N)C(N)=C1 JZ5711 [1,1,0,0,0,0|1,0,1]=4 660 B10R1.25 CC1=CC=C(C=O)C(Cl)=C1 XJ5566 [1,1,0,0,0,0|1,0,0]=3 661 B10R1.25 CC1=CC=C(C=O)C(F)=C1 HL3526 [1,1,0,0,0,0|1,0,0]=3 662 B10R1.25 CC1=CC=C(CBr)C(F)=C1 LL1994 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.25 CC1=CC=C(NN)C(Cl)=C1 YH47820 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.25 CCC1=CC=C(O)C=C1O LQ2338 [1,1,0,0,0,0|1,0,1]=4 665 B10R1.25 CNC1=CC=C(C)C=C1C RT10900 [1,1,0,0,0,0|1,0,0]=3 666 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 XJ5918 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.25 COC1=C(Br)C=C(N)C=C1 YH19588 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.25 COC1=C(C)C=C(F)C=C1 LQ0747 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.25 COC1=C(Cl)C=C(F)C=C1 HL2164 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.25 COC1=C(Cl)C=C(N)C=C1 LT2912 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.25 COC1=C(F)C=C(F)C=C1 XJ0790 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.25 COC1=C(F)C=C(N)C=C1 LL0749 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.25 COC1=C(N)C=C(F)C=C1 JZ1845 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.25 COC1=C(O)C=C(Br)C=C1 JZ1166 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.25 COC1=CC=C(C)C=C1F LQ0748 [1,1,0,0,0,0|1,0,0]=3 676 B10R1.25 COC1=CC=C(C)C=C1O JZ4479 [1,1,0,0,0,0|1,0,0]=3 677 B10R1.25 COC1=CC=C(Cl)C=C1I YH05404 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.25 COC1=CC=C(N)C=C1N LT0111 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.25 COC1=CC=C(O)C=C1O JZ2877 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 HL3617 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 XJ5762 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 YH06391 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.25 O=CC1=C(F)C=C(O)C=C1 LQ0711 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.25 O=CC1=C(O)C=C(O)C=C1 LT0125 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.25 O=CC1=CC=C(Br)C=C1F LT2238 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.25 O=CC1=CC=C(Br)C=C1O LX2833 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.25 O=CC1=CC=C(Cl)C=C1Br YH65915 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.25 O=CC1=CC=C(Cl)C=C1Cl XJ1439 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.25 O=CC1=CC=C(Cl)C=C1F LT2761 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.25 O=CC1=CC=C(Cl)C=C1O JZ2028 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.25 O=CC1=CC=C(F)C=C1O LQ0712 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.25 O=CC1=CC=C(O)C=C1Br CJ2845 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.25 O=CC1=CC=C(O)C=C1O LT1156 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.176 C(=O)C1=CC(C)=C(O)C=C1 XJ4175 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.176 C(=O)C1=CC=C(Cl)C(F)=C1 YH06829 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.176 C=CC1=CC=C(O)C(O)=C1 RT11606 [1,1,0,0,0,0|1,0,0]=3 697 B10R1.176 CC1=C(C)C=C(CCl)C=C1 LQ0361 [1,1,0,0,0,0|1,0,1]=4 698 B10R1.176 CC1=C(C)C=C(CN)C=C1 LQ0363 [1,1,0,0,0,0|1,0,1]=4 699 B10R1.176 CC1=C(C)C=C(CO)C=C1 XJ3179 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.176 CC1=C(Cl)C=C(C#N)C=C1 YH46253 [1,1,0,0,0,0|1,0,1]=4 701 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 LL1194 [1,1,0,0,0,0|1,0,1]=4 702 B10R1.176 CC1=C(F)C=C(C#N)C=C1 LT2790 [1,1,0,0,0,0|1,0,1]=4 703 B10R1.176 CC1=C(I)C=C(C=O)C=C1 YH08545 [1,1,0,0,0,0|1,0,0]=3 704 B10R1.176 CC1=C(N)C=C(C#N)C=C1 XJ5929 [1,1,0,0,0,0|1,0,1]=4 705 B10R1.176 CC1=CC=C(CCl)C=C1Cl XJ2275 [1,1,0,0,0,0|1,0,1]=4 706 B10R1.176 CC1=CC=C(NN)C=C1C JZ4793 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.176 CCC1=CC=C(O)C(O)=C1 HL0678 [1,1,0,0,0,0|1,0,1]=4 708 B10R1.176 CNC1=CC=C(C)C(C)=C1 RT10968 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.176 COC1=CC(Br)=C(N)C=C1 LX2826 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.176 COC1=CC(C)=C(Br)C=C1 LT2382 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.176 COC1=CC(Cl)=C(C)C=C1 XJ5702 [1,1,0,0,0,0|1,0,0]=3 712 B10R1.176 COC1=CC(F)=C(C)C=C1 LQ0806 [1,1,0,0,0,0|1,0,0]=3 713 B10R1.176 COC1=CC(F)=C(O)C=C1 YH65479 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.176 COC1=CC(O)=C(Br)C=C1 YH11385 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.176 COC1=CC=C(Br)C(Br)=C1 YH65860 [1,1,0,0,0,0|2,0,0]=4 716 B10R1.176 COC1=CC=C(Br)C(F)=C1 HL1834 [1,1,0,0,0,0|2,0,0]=4 717 B10R1.176 COC1=CC=C(Cl)C(C)=C1 XJ3845 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.176 COC1=CC=C(Cl)C(N)=C1 JZ1995 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.176 COC1=CC=C(F)C(N)=C1 LX2519 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.176 COC1=CC=C(F)C(O)=C1 YH66401 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.176 COC1=CC=C(I)C(N)=C1 YH36677 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.176 COC1=CC=C(N)C(I)=C1 YH43064 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.176 CSC1=CC(Cl)=C(Cl)C=C1 LT2372 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.176 O=CC1=CC(Br)=C(Br)C=C1 LL1331 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.176 O=CC1=CC(Br)=C(Cl)C=C1 YH90433 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 XJ2310 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 YH10936 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 LT6754 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.176 O=CC1=CC(Cl)=C(O)C=C1 LT6758 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.176 O=CC1=CC=C(Br)C(F)=C1 LL2124 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.176 O=CC1=CC=C(F)C(Br)=C1 LT2909 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.176 O=CC1=CC=C(F)C(F)=C1 LT6639 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.176 O=CC1=CC=C(O)C(O)=C1 LT6643 [1,1,0,0,0,0|2,0,0]=4 734 B10R1.15 BrCC(Br)C1=CC=CC=C1 HL1223 [1,1,0,0,0,0|1,0,1]=4 735 B10R1.15 C1=CC=C(C(=O)OC)C=C1 LQ3514 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.15 CC(C=O)C1=CC=CC=C1 HL1224 [1,1,0,0,0,0|0,0,1]=3 737 B10R1.15 CC(CBr)C1=CC=CC=C1 HL0832 [1,1,0,0,0,0|0,0,2]=4 738 B10R1.15 CCC(=O)C1=CC=CN=C1 JZ4667 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.15 CCC(C)C1=CC=CC=C1 LL0562 [1,1,0,0,0,0|0,0,2]=4 740 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 HL2472 [1,1,0,0,0,0|1,0,1]=4 741 B10R1.15 CN(C=O)C1=CC=CC=C1 JZ0143 [1,1,0,0,0,0|1,0,0]=3 742 B10R1.15 CNC(=O)C1=CC=CC=C1 HL0175 [1,1,0,0,0,0|1,0,0]=3 743 B10R1.15 CNC(=O)C1=NC=CC=C1 RT3529 [1,1,0,0,0,0|2,0,0]=4 744 B10R1.15 COC(=N)C1=NC=CC=C1 RT4090 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.15 COC(=O)C1=CC=CN=C1 JZ0756 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.15 COC(=O)C1=CC=NC=C1 RT1566 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.15 NCC(=O)C1=CC=CC=C1 LT5895 [1,1,0,0,0,0|1,0,0]=3 748 B10R1.15 NCC(=O)C1=CC=CN=C1 RT4369 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.15 NNC(=O)C1=CC=CC=C1 LT4155 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.15 N\C(=N/O)C1=CC=CC=C1 HL0174 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.15 O=C(CBr)C1=CC=CC=C1 RT11120 [1,1,0,0,0,0|1,0,0]=3 752 B10R1.15 O=C(CBr)C1=CC=CC=C1 YH43692 [1,1,0,0,0,0|1,0,0]=3 753 B10R1.15 O=C(CBr)C1=CC=NC=C1 XJ2872 [1,1,0,0,0,0|2,0,0]=4 754 B10R1.15 O=C(CBr)C1=NC=CC=C1 LQ4012 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.15 O=C(CCl)C1=CC=CC=C1 LT3832 [1,1,0,0,0,0|1,0,0]=3 756 B10R1.15 O=C(NO)C1=CC=CC=C1 LT6975 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.15 OC(CCl)C1=CC=CC=C1 LQ1871 [1,1,0,0,0,0|1,0,1]=4 758 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 LT6111 [1,1,0,0,0,0|1,0,1]=4 759 B10R1.15 OC[C@H](O)C1=CC=CC=C1 LT6110 [1,1,0,0,0,0|1,0,1]=4 760 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 RT1705 [1,1,0,0,0,0|1,0,1]=4 761 B10R1.28 CC(C)(C)C1=CC=CC=C1 XJ0222 [1,1,0,0,0,0|0,0,2]=4 762 B10R1.28 CC(C)(N)C1=CC=CC=C1 XJ1030 [1,1,0,0,0,0|0,0,2]=4 763 B10R1.28 CC(C)(O)C1=CC=CC=C1 LQ1212 [1,1,0,0,0,0|0,0,2]=4 764 B10R1.28 CC(C)(S)C1=CC=CC=C1 YH38274 [1,1,0,0,0,0|0,0,2]=4 765 B10R1.28 CP(=O)(Cl)C1=CC=CC=C1 XJ2994 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 LQ2383 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 HL2720 [1,1,0,0,0,0|1,0,1]=4 768 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 HL0392 [1,1,0,0,0,0|0,1,1]=4 769 B10R1.28 C[Si](C)(O)C1=CC=CC=C1 JZ2662 [1,1,0,0,0,0|0,1,1]=4 770 B10R1.28 C[Si](C)([O-])C1=CC=CC=C1 LQ3287 [1,1,0,0,0,0|0,1,1]=4 771 B10R1.61 C=C(C)C1=CC=CC=C1C LQ4513 [1,1,0,0,0,0|0,0,0]=2 772 B10R1.61 CC(=O)C1=C(C)C=CC=C1 JZ3832 [1,1,0,0,0,0|1,0,0]=3 773 B10R1.61 CC(=O)C1=C(F)C=CC=C1 LT6542 [1,1,0,0,0,0|1,0,0]=3 774 B10R1.61 CC(=O)C1=CC=CC=C1Br LQ2085 [1,1,0,0,0,0|1,0,0]=3 775 B10R1.61 CC(=O)C1=CC=CC=C1Cl RT11894 [1,1,0,0,0,0|1,0,0]=3 776 B10R1.61 CC(=O)C1=CC=CN=C1C YH39691 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.61 CC(=O)C1=CC=CN=C1Cl YH07033 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.61 CC(=O)C1=CC=CN=C1N YH12193 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.61 CC(=O)C1=NC=CC=C1F YH65591 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.61 CC(C)C1=C(Br)C=CC=C1 XJ3244 [1,1,0,0,0,0|0,0,2]=4 781 B10R1.61 CC(C)C1=C(N)C=CC=C1 JZ4085 [1,1,0,0,0,0|0,0,2]=4 782 B10R1.61 CC(C)C1=C(O)C=CC=C1 LL0172 [1,1,0,0,0,0|0,0,2]=4 783 B10R1.61 CC(N)C1=CC=CC=C1O YH66634 [1,1,0,0,0,0|1,0,1]=4 784 B10R1.61 CC(O)C1=CC=CC=C1Cl LQ3656 [1,1,0,0,0,0|1,0,1]=4 785 B10R1.61 CC1=C(C(=O)O)C=CC=C1 LQ0494 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.61 CC1=CC=CC=C1C(=O)Cl JZ4285 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.61 CC1=CC=CC=C1N(C)C XJ1085 [1,1,0,0,0,0|1,0,1]=4 788 B10R1.61 CN(C)C1=CC=CC=C1Cl LQ1380 [1,1,0,0,0,0|1,0,1]=4 789 B10R1.61 C[C@@H](N)C1=CC=CC=C1O YH29387 [1,1,0,0,0,0|1,0,1]=4 790 B10R1.61 N=C(N)C1=C(O)C=CC=C1 YH65820 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.61 NC(=O)C1=CC=CC=C1N LL0171 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.61 NC1=C(C(=O)O)C=CC=C1 LT0272 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 JZ1033 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 XJ1083 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl LT2133 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 LQ0495 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.61 O=C(O)C1=C(I)C=CC=C1 LT6566 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.61 O=C(O)C1=C(O)C=CC=C1 RT10607 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.61 O=C(O)C1=CC=CC=C1Br LL0169 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.61 O=C(O)C1=CC=CC=C1S LQ3223 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.61 O=C(O)C1=CC=CC=C1[O-] LQ0966 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.61 O=C([O-])C1=CC=CC=C1O HL0014 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.61 O=C([O-])C1=CC=CC=C1O JZ3839 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.61 O=C([O-])C1=CC=CC=C1O JZ5006 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.61 O=C([O-])C1=CC=CC=C1O LQ0967 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.61 O=C([O-])C1=CC=CC=C1O LQ4134 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.61 O=C([O-])C1=CC=CC=C1[O-] LL1063 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.113 C=C(C)C1=CC(C)=CC=C1 HL0676 [1,1,0,0,0,0|0,0,0]=2 809 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 LX2618 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 RT15363 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.113 CC(=O)C1=CC(F)=CC=C1 LT6788 [1,1,0,0,0,0|1,0,0]=3 812 B10R1.113 CC(=O)C1=CC(N)=CC=C1 LT6621 [1,1,0,0,0,0|1,0,0]=3 813 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 LQ2084 [1,1,0,0,0,0|1,0,0]=3 814 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 LX2619 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.113 CC(=O)C1=CC=CC(O)=C1 LT6622 [1,1,0,0,0,0|1,0,0]=3 816 B10R1.113 CC(=O)C1=NC=CC(C)=C1 CJ2939 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.113 CC(C)C1=CC(Br)=CC=C1 HL2984 [1,1,0,0,0,0|0,0,2]=4 818 B10R1.113 CC(C)C1=CC(O)=CC=C1 RT10578 [1,1,0,0,0,0|0,0,2]=4 819 B10R1.113 CC(C)C1=CC=CC(N)=C1 XJ2891 [1,1,0,0,0,0|0,0,2]=4 820 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 RT2925 [1,1,0,0,0,0|1,0,1]=4 821 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 JZ3057 [1,1,0,0,0,0|1,0,1]=4 822 B10R1.113 CC(O)C1=CC=CC(N)=C1 XJ2202 [1,1,0,0,0,0|1,0,1]=4 823 B10R1.113 CC1=CC(C(N)=O)=CC=C1 LQ1217 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.113 CC1=CC(N(C)C)=CC=C1 LL0511 [1,1,0,0,0,0|1,0,1]=4 825 B10R1.113 CC1=CC=CC(C(=O)O)=C1 XJ0266 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.113 N=C(N)C1=CC=CC(F)=C1 XJ6333 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.113 N=C(N)C1=CC=CC(N)=C1 LT2228 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.113 NC(=O)C1=CC(F)=CC=C1 HL1806 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 LQ1218 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 JZ4695 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 LQ1216 [1,1,0,0,0,0|2,0,0]=4 832 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 LT3027 [1,1,0,0,0,0|2,0,0]=4 833 B10R1.113 O=C(Cl)C1=CC(I)=CC=C1 JZ4696 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 LT3007 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.113 O=C(O)C1=CC(F)=CC=C1 JZ1086 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.113 O=C(O)C1=CC(I)=CC=C1 LQ1220 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.113 O=C(O)C1=CC(O)=CC=C1 RT13217 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 LT2935 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 JZ4304 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.31 CCC1=CC=C(C(C)=O)O1 YH48755 [0,1,0,0,1,0|2,0,0]=4 841 B10R1.59 CC(=O)C1=C(C)OC(C)=C1 LT2352 [0,1,0,0,1,0|2,0,0]=4 842 B10R1.59 CC(=O)C1=C(C)SC(C)=C1 LQ2189 [0,1,0,0,1,0|2,0,0]=4 843 B12R1.4 C=CC1=CC=C(OC(C)=O)C=C1 JZ2093 [0,1,0,0,0,1|1,0,1]=4 844 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 LT3061 [0,1,0,0,0,1|1,0,1]=4 845 B12R1.4 CC(=O)OC1=CC=C(CBr)C=C1 CJ3037 [0,1,0,0,0,1|1,0,0]=3 846 B12R1.4 CCC1=CC=C(CC(=O)O)C=C1 LT2917 [0,1,0,0,0,1|2,0,0]=4 847 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 LL0352 [0,1,0,0,0,1|2,0,0]=4 848 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 LT2838 [0,1,0,0,0,1|1,0,0]=3 849 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 RT11360 [0,1,0,0,0,1|1,0,0]=3 850 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 XJ4261 [0,1,0,0,0,1|2,0,0]=4 851 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 YH27802 [0,1,0,0,0,1|2,0,0]=4 852 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 XJ3973 [0,1,0,0,0,1|2,0,0]=4 853 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 HL4494 [0,1,0,0,0,1|2,0,0]=4 854 B12R1.19 CC(=O)CC1=CC=C(O)C(O)=C1 RT16870 [0,1,0,0,0,1|2,0,0]=4 855 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 LQ3474 [0,1,0,0,0,1|2,0,0]=4 856 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 LQ0515 [0,1,0,0,0,1|2,0,0]=4 857 B12R1.20 CC1=CC=C(C(=O)C(C)Cl)C=C1 YH47530 [0,1,0,0,0,1|1,0,1]=4 858 B12R1.20 CC1=CC=C(C(N)C(=O)O)C=C1 LX2120 [0,1,0,0,0,1|2,0,0]=4 859 B12R1.20 CC1=CC=C(C(O)C(=O)O)C=C1 LQ4697 [0,1,0,0,0,1|2,0,0]=4 860 B12R1.49 CC1=CC=C(CC(C)C=O)C=C1 XJ5434 [0,1,0,0,0,1|0,0,1]=3 861 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 RT15818 [0,1,0,0,0,1|2,0,0]=4 862 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 XJ5486 [0,1,0,0,0,1|2,0,0]=4 863 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 YH05226 [0,1,0,0,0,1|2,0,0]=4 864 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 JZ4903 [0,1,0,0,0,1|2,0,0]=4 865 B12R1.233 CC(=O)NC1=CC=C(Br)C=C1C XJ4799 [0,1,0,0,0,1|2,0,0]=4 866 B12R1.233 CC(=O)NC1=CC=C(C)C=C1Br HL0195 [0,1,0,0,0,1|1,0,0]=3 867 B12R1.233 CC(=O)OC1=CC=C(Br)C=C1Br RT11919 [0,1,0,0,0,1|2,0,0]=4 868 B12R1.233 CC1=CC=C(CC(=N)N)C(C)=C1 YH19455 [0,1,0,0,0,1|2,0,0]=4 869 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 LL0515 [0,2,0,0,0,0|1,0,0]=3 870 B12R1.5 COC(=O)C1=CC=C(C#N)C=C1 HL0707 [0,2,0,0,0,0|1,0,1]=4 871 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 JZ4668 [0,2,0,0,0,0|1,0,1]=4 872 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 LQ1892 [0,2,0,0,0,0|1,0,1]=4 873 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 LT5149 [0,2,0,0,0,0|1,0,0]=3 874 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 LT5150 [0,2,0,0,0,0|1,0,0]=3 875 B12R1.5 COC(=O)C1=CC=C(CO)C=C1 JZ3023 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.5 COC(=O)C1=CC=C(OC)N=C1 JZ0753 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 LQ5359 [0,2,0,0,0,0|2,0,0]=4 878 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 LT3323 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 LQ5042 [0,2,0,0,0,0|1,0,0]=3 880 B12R1.5 COC1=CC=C(C(=O)NN)C=C1 XJ2446 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.5 N#CC1=CC=C(C(=O)CBr)C=C1 LQ4188 [0,2,0,0,0,0|1,0,1]=4 882 B12R1.6 CC(C)(C)C1=CC=C(CBr)C=C1 LT3792 [0,2,0,0,0,0|0,0,2]=4 883 B12R1.6 CC(C)(C)C1=CC=C(CN)C=C1 LT5866 [0,2,0,0,0,0|0,0,2]=4 884 B12R1.6 CSC1=CC=C(C(C)(C)C)C=C1 LT3699 [0,2,0,0,0,0|0,0,2]=4 885 B12R1.48 CC(=O)C1=CC=C(C#N)C(Br)=C1 LX2918 [0,2,0,0,0,0|1,0,1]=4 886 B12R1.48 CCC1=C(N)C=C(C(=O)O)C=C1 YH04521 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.48 CCC1=C(O)C=C(C(=O)O)C=C1 YH20502 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=C1 HL1289 [0,2,0,0,0,0|2,0,0]=4 889 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 LQ0792 [0,2,0,0,0,0|2,0,0]=4 890 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 LT2590 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.48 COC1=C(I)C=C(C(=O)O)C=C1 XJ6188 [0,2,0,0,0,0|2,0,0]=4 892 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 LT2602 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.48 COC1=CC=C(C(=O)Cl)C=C1Cl RT12029 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.48 COC1=CC=C(C(=O)O)C=C1N LQ2287 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.48 COC1=CC=C(C(N)=O)C=C1N LQ3989 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.113 CC(=O)C1=CC=C(N=[N+]=[N-])C=C1 RT6139 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.113 CCCC1=CC=C(C(=O)O)C=C1 XJ2170 [0,2,0,0,0,0|2,0,0]=4 898 B12R1.113 CCCC1=CC=C(C(C)=O)C=C1 JZ2162 [0,2,0,0,0,0|1,0,0]=3 899 B12R1.113 CCCC1=CC=C(C(C)=O)C=C1 LT3141 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.113 CCOC1=CC=C(C(=O)Cl)C=C1 LT3071 [0,2,0,0,0,0|2,0,0]=4 901 B12R1.113 CCOC1=CC=C(C(=O)O)C=C1 JZ3946 [0,2,0,0,0,0|2,0,0]=4 902 B12R1.113 CCOC1=CC=C(C(N)=O)C=C1 JZ5755 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.113 O=C(O)C1=CC=C(CCO)C=C1 YH65109 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 XJ1047 [0,2,0,0,0,0|1,0,1]=4 905 B12R1.256 CC(=O)C1=CC=C(C(C)C)C=C1 JZ1131 [0,2,0,0,0,0|1,0,0]=3 906 B12R1.256 CC(Br)C1=CC=C(C(=O)O)C=C1 XJ6874 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 LL0971 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.256 C[C@@H](N)C1=CC=C(N(C)C)C=C1 LX2301 [0,2,0,0,0,0|1,0,1]=4 909 B12R1.256 C[C@H](N)C1=CC=C(N(C)C)C=C1 LX3156 [0,2,0,0,0,0|1,0,1]=4 910 B12R1.452 COC1=CC(F)=C(C(=O)Cl)C=C1 HL1762 [0,2,0,0,0,0|2,0,0]=4 911 B12R1.452 COC1=CC(F)=C(C(=O)O)C=C1 XJ0664 [0,2,0,0,0,0|2,0,0]=4 912 B12R1.452 COC1=CC(N)=C(C(=O)O)C=C1 LQ2654 [0,2,0,0,0,0|2,0,0]=4 913 B12R1.452 COC1=CC(O)=C(C(N)=O)C=C1 LQ3157 [0,2,0,0,0,0|2,0,0]=4 914 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=C1 JZ5478 [0,2,0,0,0,0|2,0,0]=4 915 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 LT2144 [0,2,0,0,0,0|1,0,0]=3 916 B12R1.9 CC1=CC=C(S(=O)(=O)CI)C=C1 SY0109 [0,2,0,0,0,0|2,0,0]=4 917 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 LQ4642 [0,2,0,0,0,0|2,0,0]=4 918 B12R1.23 CC1=C(C)C=C(C(C)(C)C)C=C1 JZ3115 [0,2,0,0,0,0|0,0,2]=4 919 B12R1.23 CC1=CC=C(C(C)(C)C)C=C1S LQ3274 [0,2,0,0,0,0|0,0,2]=4 920 B12R1.23 CC1=CC=C(S(C)(=O)=O)C=C1Cl LX3236 [0,2,0,0,0,0|2,0,0]=4 921 B12R1.126 CC1=CC(O)=C(C(C)(C)C)C=C1 LT3394 [0,2,0,0,0,0|0,0,2]=4 922 B12R1.56 CC(=O)C1=CC(CCl)=C(O)C=C1 RT11901 [0,2,0,0,0,0|2,0,0]=4 923 B12R1.56 CC(=O)C1=CC=C(Br)C(C#N)=C1 YH30308 [0,2,0,0,0,0|2,0,0]=4 924 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 LL1051 [0,2,0,0,0,0|2,0,0]=4 925 B12R1.232 CC(=O)C1=C(N)C=C(Br)C(F)=C1 YH96748 [0,2,0,0,0,0|2,0,0]=4 926 B12R1.232 CC(=O)C1=CC(Br)=C(C)C=C1N YH66329 [0,2,0,0,0,0|1,0,0]=3 927 B12R1.232 CC(=O)C1=CC(Br)=C(Cl)C=C1N YH96749 [0,2,0,0,0,0|2,0,0]=4 928 B12R1.232 CC(=O)C1=CC(F)=C(Cl)C=C1Cl LT4059 [0,2,0,0,0,0|2,0,0]=4 929 B12R1.232 CC(=O)C1=CC(F)=C(F)C=C1F LT6017 [0,2,0,0,0,0|2,0,0]=4 930 B12R1.232 CC1=CC(=O)C(C(C)C)=CC1=O RT18760 [0,2,0,0,0,0|0,0,2]=4 931 B12R1.232 CC1=CC(C)=C(C(=O)O)C=C1C LQ0965 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1F LL1805 [0,2,0,0,0,0|2,0,0]=4 933 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1I LX2614 [0,2,0,0,0,0|2,0,0]=4 934 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1Cl LL0205 [0,2,0,0,0,0|0,0,2]=4 935 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=C1 LL2255 [0,2,0,0,0,0|2,0,0]=4 936 B12R1.367 COC(=O)C1=CC(C)=C(Cl)C=C1 LL1641 [0,2,0,0,0,0|2,0,0]=4 937 B12R1.367 COC(=O)C1=CC(Cl)=C(N)C=C1 XJ6490 [0,2,0,0,0,0|2,0,0]=4 938 B12R1.367 COC(=O)C1=CC(I)=C(C)C=C1 HL4891 [0,2,0,0,0,0|1,0,0]=3 939 B12R1.367 COC(=O)C1=CC(I)=C(Cl)C=C1 YH57244 [0,2,0,0,0,0|2,0,0]=4 940 B12R1.367 COC(=O)C1=CC(I)=C(O)C=C1 XJ4161 [0,2,0,0,0,0|2,0,0]=4 941 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 RT3244 [0,2,0,0,0,0|1,0,0]=3 942 B12R1.367 COC(=O)C1=CC(O)=C(C)C=C1 YH56650 [0,2,0,0,0,0|1,0,0]=3 943 B12R1.367 COC(=O)C1=CC(O)=C(F)C=C1 LL2617 [0,2,0,0,0,0|2,0,0]=4 944 B12R1.367 COC(=O)C1=CC(O)=C(N)C=C1 YH11298 [0,2,0,0,0,0|2,0,0]=4 945 B12R1.367 COC(=O)C1=CC=C(Br)C(O)=C1 RT10880 [0,2,0,0,0,0|2,0,0]=4 946 B12R1.367 COC(=O)C1=CC=C(C)C(Br)=C1 XJ6779 [0,2,0,0,0,0|1,0,0]=3 947 B12R1.367 COC(=O)C1=CC=C(C)C(N)=C1 YH65012 [0,2,0,0,0,0|1,0,0]=3 948 B12R1.367 COC(=O)C1=CC=C(Cl)C(N)=C1 LT3014 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.367 COC(=O)C1=CC=C(I)C(Br)=C1 YH65503 [0,2,0,0,0,0|2,0,0]=4 950 B12R1.367 COC(=O)C1=CC=C(N)C(C)=C1 LT3146 [0,2,0,0,0,0|2,0,0]=4 951 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 YH00863 [0,2,0,0,0,0|2,0,0]=4 952 B12R1.367 COC(=O)C1=CC=C(O)C(N)=C1 RT2941 [0,2,0,0,0,0|2,0,0]=4 953 B12R1.367 O=C(CBr)C1=CC(Cl)=C(Cl)C=C1 LT1996 [0,2,0,0,0,0|2,0,0]=4 954 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 XJ0281 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.893 CC1=CC=C(C(N)=O)C(F)=C1F LL2716 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.1005 CC1=C(Br)C=C(C(=O)O)C=C1Br LL1199 [0,2,0,0,0,0|2,0,0]=4 957 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1N CJ2120 [0,2,0,0,0,0|2,0,0]=4 958 B12R1.1005 CC1=C(O)C=C(C(=O)O)C=C1O LT6673 [0,2,0,0,0,0|2,0,0]=4 959 B12R1.12 CCN(CC)C1=CC=C(C)C=C1 HL0164 [0,2,0,0,0,0|1,0,1]=4 960 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 RT11080 [0,2,0,0,0,0|1,0,0]=3 961 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 XJ0996 [0,2,0,0,0,0|2,0,0]=4 962 B12R1.16 CCOC(=N)C1=CC=C(Cl)C=C1 RT12541 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 HL3014 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 LQ3269 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 CJ2917 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 SY0289 [0,2,0,0,0,0|2,0,0]=4 967 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 YH48180 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.16 N#CCC(=O)C1=CC=C(Cl)C=C1 LQ2708 [0,2,0,0,0,0|2,0,0]=4 969 B12R1.16 N#CCC(=O)C1=CC=C(F)C=C1 JZ0578 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 LT4187 [0,2,0,0,0,0|2,0,0]=4 971 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 LQ0709 [0,2,0,0,0,0|2,0,0]=4 972 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 RT10798 [0,2,0,0,0,0|2,0,0]=4 973 B12R1.1703 C=C(CBr)C1=CC=C(F)C=C1F RT12382 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.1703 C=C(CO)C1=CC=C(F)C=C1F RT12351 [0,2,0,0,0,0|1,0,0]=3 975 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 HL3011 [0,2,0,0,0,0|2,0,0]=4 976 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=C1 YH91859 [0,2,0,0,0,0|1,0,0]=3 977 B12R1.1703 COC(=O)C1=C(C)C=C(Cl)C=C1 XJ2408 [0,2,0,0,0,0|2,0,0]=4 978 B12R1.1703 COC(=O)C1=C(C)N=C(C)C=C1 RT9229 [0,2,0,0,0,0|2,0,0]=4 979 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=C1 CJ2192 [0,2,0,0,0,0|2,0,0]=4 980 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 LQ2726 [0,2,0,0,0,0|1,0,0]=3 981 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 HL1734 [0,2,0,0,0,0|2,0,0]=4 982 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 LQ2098 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1Br RT11090 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1I CJ3332 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1N YH32748 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.1703 COC(=O)C1=CC=C(N)C=C1C YH14295 [0,2,0,0,0,0|2,0,0]=4 987 B12R1.1703 COC(=O)C1=CC=C(N)C=C1Cl YH02304 [0,2,0,0,0,0|2,0,0]=4 988 B12R1.1703 COC(=O)C1=CC=C(N)C=C1O LT5969 [0,2,0,0,0,0|2,0,0]=4 989 B12R1.1703 NC1=CC(Cl)=CC=C1C(=O)CCl RT1619 [0,2,0,0,0,0|2,0,0]=4 990 B12R1.1703 NCC(=O)C1=C(Cl)C=C(Cl)C=C1 YH53846 [0,2,0,0,0,0|2,0,0]=4 991 B12R1.1703 O=C(CBr)C1=C(O)C=C(O)C=C1 YH49339 [0,2,0,0,0,0|2,0,0]=4 992 B12R1.1703 O=C(CBr)C1=CC=C(Cl)C=C1Cl JZ2098 [0,2,0,0,0,0|2,0,0]=4 993 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1F HL3116 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.1000 CC(=O)C1=C(C)C=C(O)C=C1O RT12806 [0,2,0,0,0,0|2,0,0]=4 995 B12R1.1000 CC(=O)C1=C(O)C=C(C)C=C1O RT11067 [0,2,0,0,0,0|1,0,0]=3 996 B12R1.1000 CC1=CC(C)=C(C(=O)Cl)C(C)=C1 JZ0980 [0,2,0,0,0,0|2,0,0]=4 997 B10R2.31 BrC1=CC=C2CCC2=C1 LX2503 [1,0,0,1,0,0|1,0,1]=4 998 B10R2.31 NC1=CC=C2CCC2=C1 YH07057 [1,0,0,1,0,0|1,0,1]=4 999 B10R2.6 C1=CC=C(C2CN2)C=C1 RT8683 [1,0,0,1,0,0|1,0,1]=4 1000 B10R2.6 C1=CC=C(C2CO2)C=C1 XJ4585 [1,0,0,1,0,0|1,0,1]=4 1001 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 XJ4586 [1,0,0,1,0,0|1,0,1]=4 1002 B10R2.320 O=C1CC2=CC=CC=C12 YH55957 [1,0,0,1,0,0|1,0,0]=3 1003 B12R2.606 CC1=CC2=C(C=C1)NC(C)=C2 JZ4489 [0,0,0,1,0,1|0,0,0]=2 1004 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)N1 JZ4380 [0,0,0,1,0,1|1,0,0]=3 1005 B12R2.606 CC1=CC2=C(C=CC(F)=C2)N1 LQ0751 [0,0,0,1,0,1|1,0,0]=3 1006 B12R2.606 CC1=CC2=C(C=CC(O)=C2)N1 JZ3731 [0,0,0,1,0,1|1,0,0]=3 1007 B12R2.606 CC1=CC2=CC(Br)=CN=C2N1 YH24834 [0,0,0,1,0,1|2,0,0]=4 1008 B12R2.606 CC1=CC2=CC(N)=CC=C2N1 LT5845 [0,0,0,1,0,1|1,0,0]=3 1009 B12R2.606 CC1=CC=C2N=C(Cl)SC2=C1 LQ2510 [0,0,0,1,0,1|2,0,0]=4 1010 B12R2.606 CC1=CC=C2N=C(N)SC2=C1 LQ2216 [0,0,0,1,0,1|2,0,0]=4 1011 B12R2.606 CC1=CC=C2OC(C)=NC2=C1 LT0158 [0,0,0,1,0,1|1,0,0]=3 1012 B12R2.606 CC1=CC=C2SC(C)=NC2=C1 LQ0265 [0,0,0,1,0,1|1,0,0]=3 1013 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 LT3538 [0,0,0,1,0,1|2,0,0]=4 1014 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)S1 LT3537 [0,0,0,1,0,1|2,0,0]=4 1015 B12R2.606 CC1=NC2=CC=C(I)C=C2N1 YH66367 [0,0,0,1,0,1|2,0,0]=4 1016 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 XJ4617 [0,0,0,1,0,1|2,0,0]=4 1017 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 CJ2887 [0,0,0,1,0,1|2,0,0]=4 1018 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 JZ1167 [0,0,0,1,0,1|2,0,0]=4 1019 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 LT3275 [0,0,0,1,0,1|2,0,0]=4 1020 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 LT6085 [0,0,0,1,0,1|2,0,0]=4 1021 B12R2.606 O=C1CC2=CC(O)=CC=C2O1 RT7759 [0,0,0,1,0,1|2,0,0]=4 1022 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 HL2805 [0,1,0,1,0,0|1,0,0]=3 1023 B12R2.612 CN1C=CC2=C1C=CC(Br)=C2 JZ3361 [0,1,0,1,0,0|2,0,0]=4 1024 B12R2.612 CN1C=CC2=CC(N)=CC=C21 HL3112 [0,1,0,1,0,0|2,0,0]=4 1025 B12R2.612 CN1N=CC2=CC(Br)=CC=C21 YH02476 [0,1,0,1,0,0|2,0,0]=4 1026 B12R2.612 CN1N=CC2=CC(N)=CC=C21 YH04063 [0,1,0,1,0,0|2,0,0]=4 1027 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 LQ2490 [0,1,0,1,0,0|2,0,0]=4 1028 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 LQ2487 [0,1,0,1,0,0|2,0,0]=4 1029 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 XJ5153 [0,1,0,1,0,0|2,0,0]=4 1030 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 YH01019 [0,1,0,1,0,0|2,0,0]=4 1031 B12R2.612 O=C1CCC2=CC(F)=CC=C12 JZ4104 [0,1,0,1,0,0|2,0,0]=4 1032 B12R2.612 O=C1COC2=CC(Br)=CC=C12 YH44457 [0,1,0,1,0,0|2,0,0]=4 1033 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 XJ2407 [0,1,0,1,0,0|2,0,0]=4 1034 B8R1.1 C=CC1=NC(C)=CS1 LT1724 [1,0,0,0,1,0|2,0,0]=4 1035 B8R1.1 CC1=CC=C(C=O)S1 JZ4813 [1,0,0,0,1,0|2,0,0]=4 1036 B8R1.1 CC1=CSC(C=O)=C1 YH65858 [1,0,0,0,1,0|2,0,0]=4 1037 B8R1.7 CC(=O)C1=CC=CS1 LT4058 [1,0,0,0,1,0|2,0,0]=4 1038 B8R1.7 CC(=O)C1=CNC=C1 JZ4350 [1,0,0,0,1,0|2,0,0]=4 1039 B8R1.7 CC(=O)C1=CSC=C1 LT2539 [1,0,0,0,1,0|2,0,0]=4 1040 B10R1.18 BrC(Br)=CC1=CC=CC=C1 YH16676 [1,0,0,0,0,1|2,0,0]=4 1041 B10R1.18 CC(=O)CC1=CC=CC=C1 YH22297 [1,0,0,0,0,1|1,0,0]=3 1042 B10R1.18 CC(=O)CC1=CC=NC=C1 LQ3035 [1,0,0,0,0,1|2,0,0]=4 1043 B10R1.18 CC(=O)NC1=NC=CC=C1 LQ2855 [1,0,0,0,0,1|2,0,0]=4 1044 B10R1.18 CC(=O)OC1=NC=CC=C1 RT9785 [1,0,0,0,0,1|2,0,0]=4 1045 B10R1.18 CC(=S)NC1=CC=CC=C1 JZ4043 [1,0,0,0,0,1|1,0,0]=3 1046 B10R1.18 CC(C)NC1=CC=CC=C1 HL0393 [1,0,0,0,0,1|0,0,2]=4 1047 B10R1.18 CN(C)CC1=CC=CC=C1 YH22302 [1,0,0,0,0,1|1,0,1]=4 1048 B10R1.18 CS(=O)CC1=CC=CC=C1 RT13178 [1,0,0,0,0,1|2,0,0]=4 1049 B10R1.18 C[C@@H](N)CC1=CC=CC=C1 YH66589 [1,0,0,0,0,1|1,0,1]=4 1050 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 RT11145 [1,0,0,0,0,1|1,0,1]=4 1051 B10R1.18 N=C(N)NC1=CC=CC=C1 LQ3733 [1,0,0,0,0,1|2,0,0]=4 1052 B10R1.18 N=C(N)NC1=CC=CC=C1 YH65018 [1,0,0,0,0,1|2,0,0]=4 1053 B10R1.18 NC(=O)CC1=CC=CC=C1 LL0344 [1,0,0,0,0,1|2,0,0]=4 1054 B10R1.18 NC(=O)NC1=CC=CC=C1 XJ0031 [1,0,0,0,0,1|2,0,0]=4 1055 B10R1.18 NC(=O)OC1=CC=CC=C1 JZ4003 [1,0,0,0,0,1|2,0,0]=4 1056 B10R1.18 NC(=S)CC1=CC=CC=C1 XJ1206 [1,0,0,0,0,1|2,0,0]=4 1057 B10R1.18 O=C(Cl)CC1=CC=CC=C1 LL0343 [1,0,0,0,0,1|2,0,0]=4 1058 B10R1.18 O=C(Cl)OC1=CC=CC=C1 LQ1974 [1,0,0,0,0,1|2,0,0]=4 1059 B10R1.18 O=C(O)CC1=CC=CC=C1 LL0345 [1,0,0,0,0,1|2,0,0]=4 1060 B10R1.18 S=C(Cl)OC1=CC=CC=C1 HL0590 [1,0,0,0,0,1|2,0,0]=4 1061 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 JZ4325 [0,0,0,0,0,2|2,0,0]=4 1062 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 JZ2437 [0,0,0,0,0,2|2,0,0]=4