0 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HL1303 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.13 CC(=O)C1=CC=C(C)N=C1 RT18075 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 JZ1119 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 YH07034 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.13 CC(=O)C1=CC=C(F)C=C1 JZ1124 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.13 CC(=O)C1=CC=C(N)C=C1 LT6854 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.13 CC(=O)C1=CC=C(O)C=C1 RT11987 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 HL3496 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CJ2729 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.13 CC(C)C1=CC=C(Br)C=C1 XJ1042 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 CC(N)C1=CC=C(Br)C=C1 YH48936 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.13 CC(O)C1=CC=C(F)C=C1 LQ0797 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.13 CC1=CC=C(B(O)O)C=C1 SY0255 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.13 CC1=CC=C(B(O)O)C=N1 RT6584 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.13 CC1=CC=C(C(=O)O)C=C1 JZ0130 [0,0,0,0,0,0|1,0,0]=1 15 B10R1.13 CC1=CC=C(C(=O)O)C=N1 JZ2268 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.13 CC1=CC=C(C(C)C)C=C1 XJ5623 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.13 CC1=CC=C(C(C)N)C=C1 JZ0723 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.13 CC1=CC=C(C(C)O)C=C1 LL0968 [0,0,0,0,0,0|2,0,1]=3 19 B10R1.13 CC1=CC=C(C(C)O)C=N1 RT2394 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.13 CC1=CC=C(C(N)=O)C=C1 JZ3937 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.13 CC1=CC=C(N(C)C)C=C1 YH99046 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.13 CC1=CC=C(S(=O)O)C=C1 LL0969 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.13 CC1=CC=C(S(N)=O)C=C1 YH66632 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.13 CC1=CN=C(B(O)O)C=C1 YH57645 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.13 CC1=CN=C(C(=O)O)C=C1 YH01820 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.13 CC1=NC=C(C(=O)O)C=N1 YH04926 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.13 CC1=NC=C(C(=O)O)N=C1 LT1326 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 JZ1051 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.13 CN(C)C1=CC=C(Br)C=C1 LT2750 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.13 CN(C)C1=CC=C(N)C=C1 HL1305 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.13 CN(C)C1=CC=C(N)C=C1 LL0967 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.13 CN(C)C1=CC=C(N)C=C1 LQ4413 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.13 CN(C)C1=CC=C(N)C=C1 XJ3077 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 LQ5152 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 YH17516 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 XJ4897 [0,0,0,0,0,0|3,0,1]=4 37 B10R1.13 ClC1=CC=C(C(Cl)Cl)C=C1 LT3445 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 HL3245 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.13 N=C(N)C1=CC=C(N)C=C1 HL2287 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.13 N=C(N)C1=CC=C(N)C=C1 JZ3229 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.13 N=C(N)C1=CC=C(O)C=C1 LT2008 [0,0,0,0,0,0|2,0,0]=2 42 B10R1.13 N=C(N)C1=CC=C(O)C=C1 YH36971 [0,0,0,0,0,0|2,0,0]=2 43 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 LQ1385 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 JZ3938 [0,0,0,0,0,0|2,0,0]=2 45 B10R1.13 NC(=O)C1=CC=C(F)C=C1 JZ4190 [0,0,0,0,0,0|2,0,0]=2 46 B10R1.13 NC(=O)C1=CC=C(I)C=C1 YH59026 [0,0,0,0,0,0|2,0,0]=2 47 B10R1.13 NC(=O)C1=CC=C(O)C=C1 JZ3939 [0,0,0,0,0,0|1,0,0]=1 48 B10R1.13 NC(=O)C1=NC=C(N)C=C1 YH35056 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 YH49579 [0,0,0,0,0,0|2,1,0]=3 50 B10R1.13 NC1=CC=C(B(O)O)C=C1 SY0280 [0,0,0,0,0,0|2,0,1]=3 51 B10R1.13 NC1=CC=C(B(O)O)C=N1 CJ2602 [0,0,0,0,0,0|3,0,1]=4 52 B10R1.13 NC1=CC=C(C(=O)O)C=C1 RT3381 [0,0,0,0,0,0|1,0,0]=1 53 B10R1.13 NC1=CC=C(C(=O)O)C=N1 LT3585 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 LT3105 [0,0,0,0,0,0|1,0,1]=2 55 B10R1.13 NC1=CC=C([As](Cl)Cl)C=C1 RT3259 [0,0,0,0,0,0|4,0,0]=4 56 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 JZ0055 [0,0,0,0,0,0|2,0,1]=3 57 B10R1.13 NC1=CN=C(C(=O)O)C=C1 JZ1163 [0,0,0,0,0,0|2,0,0]=2 58 B10R1.13 NC1=NC=C([N+](=O)[O-])C=C1 CJ2895 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 XJ0449 [0,0,0,0,0,0|2,0,0]=2 60 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 JZ0749 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 JZ1126 [0,0,0,0,0,0|2,0,0]=2 62 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 JZ4692 [0,0,0,0,0,0|2,0,0]=2 63 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 XJ1044 [0,0,0,0,0,0|1,0,0]=1 64 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 JZ0785 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 JZ1200 [0,0,0,0,0,0|2,0,0]=2 66 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 JZ0383 [0,0,0,0,0,0|1,0,0]=1 67 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 LT3592 [0,0,0,0,0,0|2,0,0]=2 68 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 HL2902 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.13 O=C(O)C1=CC=C(F)C=C1 JZ1125 [0,0,0,0,0,0|1,0,0]=1 70 B10R1.13 O=C(O)C1=CC=C(I)C=C1 JZ3940 [0,0,0,0,0,0|1,0,0]=1 71 B10R1.13 O=C(O)C1=CC=C(O)C=C1 JZ0015 [0,0,0,0,0,0|0,0,0]=0 72 B10R1.13 O=C(O)C1=CC=C(O)C=N1 XJ4141 [0,0,0,0,0,0|1,0,0]=1 73 B10R1.13 O=C(O)C1=CC=C(O)N=C1 RT9389 [0,0,0,0,0,0|1,0,0]=1 74 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CJ2890 [0,0,0,0,0,0|2,0,0]=2 75 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 XJ5265 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 LL1597 [0,0,0,0,0,0|2,0,0]=2 77 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 LX2929 [0,0,0,0,0,0|3,0,0]=3 78 B10R1.13 O=C(O)C1=NC=C(F)C=C1 YH23879 [0,0,0,0,0,0|2,0,0]=2 79 B10R1.13 O=C(O)C1=NC=C(O)N=C1 LX2658 [0,0,0,0,0,0|2,0,0]=2 80 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 HL1435 [0,0,0,0,0,0|0,0,1]=1 81 B10R1.13 O=C1C=NC(C(=O)[O-])=CN1 YH18171 [0,0,0,0,0,0|2,0,2]=4 82 B10R1.13 O=S([O-])C1=CC=C(F)C=C1 JZ4192 [0,0,0,0,0,0|2,0,1]=3 83 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 RT13188 [0,0,0,0,0,0|2,0,1]=3 84 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 LT0072 [0,0,0,0,0,0|2,0,1]=3 85 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 RT11294 [0,0,0,0,0,0|1,0,1]=2 86 B10R1.13 O=[N+]([O-])C1=CC=C(O)N=C1 LT1954 [0,0,0,0,0,0|2,0,1]=3 87 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 LT3458 [0,0,0,0,0,0|1,1,1]=3 88 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 RT12985 [0,0,0,0,0,0|1,1,1]=3 89 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=C1 LT1872 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=C1 LT6071 [0,0,0,0,0,0|3,0,1]=4 91 B10R1.13 O=[N+]([O-])C1=NC=C(Br)C=C1 YH59181 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.13 O=[N+]([O-])C1=NC=C(Cl)C=C1 LT1935 [0,0,0,0,0,0|3,0,1]=4 93 B10R1.13 OB(O)C1=CC=C(Br)C=C1 CJ2455 [0,0,0,0,0,0|2,0,1]=3 94 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 LQ1888 [0,0,0,0,0,0|2,0,1]=3 95 B10R1.13 OB(O)C1=CC=C(F)C=C1 XJ1901 [0,0,0,0,0,0|2,0,1]=3 96 B10R1.13 OB(O)C1=CC=C(O)C=C1 XJ6238 [0,0,0,0,0,0|1,0,1]=2 97 B10R1.13 OB(O)C1=CN=C(Br)C=C1 YH47439 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.13 OB(O)C1=CN=C(F)C=C1 LL2843 [0,0,0,0,0,0|3,0,1]=4 99 B9R1.1 BrCC1=CC=C(Br)C=C1 YH08714 [1,0,0,0,0,0|2,0,1]=4 100 B9R1.1 BrCC1=CC=C(I)C=C1 XJ4204 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.1 C#CC1=CC=C(Br)C=C1 HL0382 [1,0,0,0,0,0|2,0,1]=4 102 B9R1.1 C#CC1=CC=C(C)C=C1 HL0383 [1,0,0,0,0,0|2,0,1]=4 103 B9R1.1 C#CC1=CC=C(Cl)C=C1 SY0319 [1,0,0,0,0,0|2,0,1]=4 104 B9R1.1 C#CC1=CC=C(F)C=C1 HL0384 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.1 C#CC1=CC=C(N)C=C1 XJ4023 [1,0,0,0,0,0|2,0,1]=4 106 B9R1.1 C#CC1=CC=C(O)C=C1 YH65749 [1,0,0,0,0,0|1,0,1]=3 107 B9R1.1 C(=O)C1=CC=C(Br)C=C1 HL0659 [1,0,0,0,0,0|1,0,0]=2 108 B9R1.1 C(=O)C1=CC=C(Cl)C=C1 XJ0297 [1,0,0,0,0,0|1,0,0]=2 109 B9R1.1 C(=O)C1=CC=C(Cl)N=C1 JZ0751 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.1 C(=O)C1=CC=C(F)C=C1 RT10834 [1,0,0,0,0,0|1,0,0]=2 111 B9R1.1 C(=O)C1=CC=C(N)N=C1 RT2853 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.1 C=CC1=CC=C(Br)C=C1 XJ2035 [1,0,0,0,0,0|2,0,0]=3 113 B9R1.1 C=CC1=CC=C(C)C=C1 XJ1131 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.1 C=CC1=CC=C(Cl)C=C1 JZ4358 [1,0,0,0,0,0|2,0,0]=3 115 B9R1.1 C=CC1=CC=C(F)C=C1 LQ0811 [1,0,0,0,0,0|2,0,0]=3 116 B9R1.1 C=CC1=CC=C(N)C=C1 LQ1825 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.1 C=CC1=CN=C(C)C=C1 XJ0560 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.1 C=CC1=NC=C(C)C=C1 YH58615 [1,0,0,0,0,0|3,0,0]=4 119 B9R1.1 CC1=CC=C(C#N)C=C1 XJ0295 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.1 CC1=CC=C(C=O)C=C1 XJ0296 [1,0,0,0,0,0|1,0,0]=2 121 B9R1.1 CC1=CC=C(C=O)C=N1 YH05496 [1,0,0,0,0,0|2,0,0]=3 122 B9R1.1 CC1=CC=C(CBr)C=C1 XJ0291 [1,0,0,0,0,0|2,0,1]=4 123 B9R1.1 CC1=CC=C(CN)C=C1 XJ0294 [1,0,0,0,0,0|2,0,1]=4 124 B9R1.1 CC1=CC=C(CO)C=C1 HL0057 [1,0,0,0,0,0|1,0,1]=3 125 B9R1.1 CC1=CC=C(NN)C=C1 JZ4047 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.1 CC1=CC=C(NN)C=C1 XJ0909 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.1 CC1=CN=C(C=O)C=C1 HL2821 [1,0,0,0,0,0|2,0,0]=3 128 B9R1.1 CC1=NC=C(C=O)C=N1 HL4933 [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|2,0,1]=4 130 B9R1.1 CCC1=CC=C(Cl)C=C1 XJ1132 [1,0,0,0,0,0|2,0,1]=4 131 B9R1.1 CCC1=CC=C(I)C=C1 JZ5676 [1,0,0,0,0,0|2,0,1]=4 132 B9R1.1 CCC1=CC=C(O)C=C1 LQ4557 [1,0,0,0,0,0|1,0,1]=3 133 B9R1.1 CNC1=CC=C(N)C=C1 LT5160 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.1 CNC1=CC=C(O)C=C1 LT7433 [1,0,0,0,0,0|2,0,0]=3 135 B9R1.1 COC1=CC=C(Br)C=C1 YH22845 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.1 COC1=CC=C(F)C=C1 RT11598 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.1 COC1=CC=C(N)C=C1 YH22851 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.1 COC1=CC=C(O)C=C1 LQ0608 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.1 COC1=NC=C(O)C=C1 YH04854 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.1 CSC1=CC=C(C)C=C1 XJ1135 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.1 CSC1=CC=C(F)C=C1 XJ0702 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.1 ClC1=CC=C(CBr)C=C1 XJ1130 [1,0,0,0,0,0|2,0,1]=4 143 B9R1.1 ClC1=CC=C([Mg]Br)C=C1 XJ1431 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.1 ClCC1=CC=C(Br)C=C1 HL0056 [1,0,0,0,0,0|2,0,1]=4 145 B9R1.1 ClCC1=CC=C(Cl)C=C1 XJ0293 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.1 FC1=CC=C(CBr)C=C1 RT11193 [1,0,0,0,0,0|2,0,1]=4 147 B9R1.1 FC1=CC=C(CCl)C=C1 LL0673 [1,0,0,0,0,0|2,0,1]=4 148 B9R1.1 FC1=CC=C(CS)C=C1 JZ5068 [1,0,0,0,0,0|1,1,1]=4 149 B9R1.1 FC1=CC=C([Mg]Br)C=C1 LL0674 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.1 N#CC1=CC=C(Br)C=C1 LT6101 [1,0,0,0,0,0|2,0,1]=4 151 B9R1.1 N#CC1=CC=C(Br)C=C1 XJ1133 [1,0,0,0,0,0|2,0,1]=4 152 B9R1.1 N#CC1=CC=C(F)C=C1 LT3074 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.1 N#CC1=CC=C(I)C=C1 HL2444 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.1 N#CC1=CC=C(N)C=C1 RT3702 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.1 N#CC1=CC=C(O)C=C1 LT2823 [1,0,0,0,0,0|1,0,1]=3 156 B9R1.1 N#CC1=NC=C(O)C=C1 CJ2992 [1,0,0,0,0,0|2,0,1]=4 157 B9R1.1 N#[N+]C1=CC=C(F)C=C1 RT6271 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.1 NC1=CC=C(C=O)C=C1 LQ1002 [1,0,0,0,0,0|1,0,0]=2 159 B9R1.1 NC1=CC=C(CO)C=N1 YH25373 [1,0,0,0,0,0|2,0,1]=4 160 B9R1.1 NC1=CC=C(CO)N=C1 YH91412 [1,0,0,0,0,0|2,0,1]=4 161 B9R1.1 NC1=NC=C(C=O)C=N1 YH28209 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.1 NCC1=CC=C(Br)C=C1 YH59044 [1,0,0,0,0,0|2,0,1]=4 163 B9R1.1 NCC1=CC=C(Cl)C=C1 LT2948 [1,0,0,0,0,0|2,0,1]=4 164 B9R1.1 NCC1=CC=C(F)C=C1 RT1536 [1,0,0,0,0,0|2,0,1]=4 165 B9R1.1 NCC1=CC=C(I)C=C1 LT1523 [1,0,0,0,0,0|2,0,1]=4 166 B9R1.1 NCC1=CC=C(N)C=C1 JZ2534 [1,0,0,0,0,0|2,0,1]=4 167 B9R1.1 NCC1=CC=C(O)C=C1 LQ1367 [1,0,0,0,0,0|1,0,1]=3 168 B9R1.1 NNC1=CC=C(Br)C=C1 HL0058 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.1 NNC1=CC=C(Br)C=C1 XJ1129 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.1 NNC1=CC=C(Cl)C=C1 JZ4359 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.1 NNC1=CC=C(Cl)C=C1 JZ4360 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.1 NNC1=CC=C(F)C=C1 LQ1485 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.1 O=CC1=CC=C(Br)N=C1 LT3321 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.1 O=CC1=CC=C(F)N=C1 YH13440 [1,0,0,0,0,0|2,0,0]=3 175 B9R1.1 O=CC1=CC=C(I)C=C1 XJ4171 [1,0,0,0,0,0|1,0,0]=2 176 B9R1.1 O=CC1=CC=C(O)C=C1 RT12842 [1,0,0,0,0,0|0,0,0]=1 177 B9R1.1 O=CC1=CC=C(O)N=C1 LT3365 [1,0,0,0,0,0|1,0,0]=2 178 B9R1.1 O=CC1=CC=C(S)C=C1 RT11108 [1,0,0,0,0,0|0,1,0]=2 179 B9R1.1 O=CC1=NC=C(Br)C=C1 LQ4682 [1,0,0,0,0,0|2,0,0]=3 180 B9R1.1 O=NC1=CC=C(O)C=C1 RT11953 [1,0,0,0,0,0|1,0,0]=2 181 B9R1.1 OC1=CC=C(CBr)C=C1 CJ3032 [1,0,0,0,0,0|1,0,1]=3 182 B9R1.1 OCC1=CC=C(Br)C=C1 XJ1430 [1,0,0,0,0,0|1,0,1]=3 183 B9R1.1 OCC1=CC=C(Cl)C=C1 JZ0815 [1,0,0,0,0,0|1,0,1]=3 184 B9R1.1 OCC1=CC=C(Cl)N=C1 LT1692 [1,0,0,0,0,0|2,0,1]=4 185 B9R1.1 OCC1=CC=C(F)N=C1 YH59200 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.1 OCC1=CC=C(I)C=C1 XJ4412 [1,0,0,0,0,0|1,0,1]=3 187 B9R1.1 OCC1=CC=C(O)C=C1 JZ0347 [1,0,0,0,0,0|0,0,1]=2 188 B9R1.1 OCC1=CN=C(O)C=C1 YH24285 [1,0,0,0,0,0|1,0,1]=3 189 B9R1.1 OCC1=NC=C(Br)C=C1 XJ6558 [1,0,0,0,0,0|2,0,1]=4 190 B9R1.1 ONC1=CC=C(Cl)C=C1 YH88188 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.1 [C-]#[N+]C1=CC=C(Br)C=C1 LQ4762 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.6 C=C(C)C1=CC=CC=C1 XJ0257 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.6 CC(=O)C1=CC=CC=C1 RT11112 [1,0,0,0,0,0|1,0,0]=2 194 B9R1.6 CC(=O)C1=CC=NC=C1 HL0648 [1,0,0,0,0,0|2,0,0]=3 195 B9R1.6 CC(=O)C1=CN=CC=C1 LQ0733 [1,0,0,0,0,0|2,0,0]=3 196 B9R1.6 CC(=O)C1=CN=CN=C1 RT1973 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.6 CC(=O)C1=NC=CC=N1 YH05694 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.6 CC(Br)C1=CC=CC=C1 XJ1034 [1,0,0,0,0,0|2,0,1]=4 199 B9R1.6 CC(N)C1=CC=CC=C1 JZ0721 [1,0,0,0,0,0|2,0,1]=4 200 B9R1.6 CN(N)C1=CC=CC=C1 LQ1214 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.6 CN(N)C1=CC=CC=C1 LX2044 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.6 C[C@@H](N)C1=CC=CC=C1 RT1721 [1,0,0,0,0,0|2,0,1]=4 203 B9R1.6 C[C@@H](O)C1=NC=CC=C1 YH51543 [1,0,0,0,0,0|2,0,1]=4 204 B9R1.6 C[C@H](N)C1=CC=CC=C1 RT1720 [1,0,0,0,0,0|2,0,1]=4 205 B9R1.6 C[Si](=O)C1=CC=CC=C1 XJ3509 [1,0,0,0,0,0|1,1,0]=3 206 B9R1.6 ClC(Cl)C1=CC=CC=C1 LT3671 [1,0,0,0,0,0|2,0,1]=4 207 B9R1.6 ClP(Cl)C1=CC=CC=C1 JZ4097 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 YH96399 [1,0,0,0,0,0|3,0,0]=4 209 B9R1.6 N=C(N)C1=CC=CC=C1 LQ1861 [1,0,0,0,0,0|2,0,0]=3 210 B9R1.6 N=C(N)C1=CC=NC=C1 JZ2903 [1,0,0,0,0,0|3,0,0]=4 211 B9R1.6 N=C(N)C1=CC=NC=C1 YH55019 [1,0,0,0,0,0|3,0,0]=4 212 B9R1.6 NC(=O)C1=CC=CC=C1 CJ3392 [1,0,0,0,0,0|1,0,0]=2 213 B9R1.6 NC(=O)C1=CC=CC=C1 LT4036 [1,0,0,0,0,0|1,0,0]=2 214 B9R1.6 NC(=O)C1=CC=CN=C1 XJ0261 [1,0,0,0,0,0|2,0,0]=3 215 B9R1.6 NC(=O)C1=CC=NC=C1 XJ1788 [1,0,0,0,0,0|2,0,0]=3 216 B9R1.6 NC(=S)C1=CC=CC=C1 XJ2085 [1,0,0,0,0,0|1,1,0]=3 217 B9R1.6 O=C(Cl)C1=CC=CN=C1 JZ0788 [1,0,0,0,0,0|2,0,0]=3 218 B9R1.6 O=C(Cl)C1=CC=CN=C1 LT7313 [1,0,0,0,0,0|2,0,0]=3 219 B9R1.6 O=C(Cl)C1=CN=CC=N1 YH43954 [1,0,0,0,0,0|3,0,0]=4 220 B9R1.6 O=C(Cl)C1=NC=CC=C1 LT5112 [1,0,0,0,0,0|2,0,0]=3 221 B9R1.6 O=C(F)C1=CC=CC=C1 HL1804 [1,0,0,0,0,0|1,0,0]=2 222 B9R1.6 O=C(O)C1=CC=CC=N1 SY0293 [1,0,0,0,0,0|1,0,0]=2 223 B9R1.6 O=C(O)C1=CC=CN=C1 LT7314 [1,0,0,0,0,0|1,0,0]=2 224 B9R1.6 O=C(O)C1=CC=NC=C1 JZ0786 [1,0,0,0,0,0|1,0,0]=2 225 B9R1.6 O=C(O)C1=CN=CN=C1 JZ0399 [1,0,0,0,0,0|2,0,0]=3 226 B9R1.6 O=C(O)C1=CN=NC=C1 XJ5546 [1,0,0,0,0,0|2,0,0]=3 227 B9R1.6 O=C(O)C1=NC=CC=N1 YH53937 [1,0,0,0,0,0|2,0,0]=3 228 B9R1.6 O=C(O)C1=NC=CN=C1 LT6615 [1,0,0,0,0,0|2,0,0]=3 229 B9R1.6 O=C(O)C1=NC=NC=C1 LQ4720 [1,0,0,0,0,0|2,0,0]=3 230 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0026 [1,0,0,0,0,0|0,0,1]=2 231 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0027 [1,0,0,0,0,0|0,0,1]=2 232 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ0044 [1,0,0,0,0,0|0,0,1]=2 233 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ4278 [1,0,0,0,0,0|0,0,1]=2 234 B9R1.6 O=C([O-])C1=CC=CC=C1 LT4848 [1,0,0,0,0,0|0,0,1]=2 235 B9R1.6 O=C([O-])C1=CC=CC=C1 XJ0991 [1,0,0,0,0,0|0,0,1]=2 236 B9R1.6 O=C([O-])C1=CN=CC=C1 LL1069 [1,0,0,0,0,0|1,0,1]=3 237 B9R1.6 O=C([O-])C1=CN=CC=C1 LQ0027 [1,0,0,0,0,0|1,0,1]=3 238 B9R1.6 O=C([O-])C1=NC=CC=C1 JZ5244 [1,0,0,0,0,0|1,0,1]=3 239 B9R1.6 O=C([O-])C1=NC=CC=C1 LQ3798 [1,0,0,0,0,0|1,0,1]=3 240 B9R1.6 O=S(O)C1=CC=CC=C1 LQ1215 [1,0,0,0,0,0|1,0,0]=2 241 B9R1.6 O=S([O-])C1=CC=CC=C1 LL1085 [1,0,0,0,0,0|1,0,1]=3 242 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 XJ0263 [1,0,0,0,0,0|1,0,1]=3 243 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 LQ2210 [1,0,0,0,0,0|2,0,1]=4 244 B9R1.6 O=[P+]([O-])C1=CC=CC=C1 LQ2659 [1,0,0,0,0,0|1,0,1]=3 245 B9R1.6 OB(O)C1=CC=CC=C1 JZ0681 [1,0,0,0,0,0|1,0,1]=3 246 B9R1.6 OB(O)C1=CC=CC=N1 LL2565 [1,0,0,0,0,0|2,0,1]=4 247 B9R1.6 OB(O)C1=CC=CN=C1 LQ1914 [1,0,0,0,0,0|2,0,1]=4 248 B9R1.6 OB(O)C1=CC=NC=C1 CJ2813 [1,0,0,0,0,0|2,0,1]=4 249 B9R1.6 [18O]=C([18OH])C1=CC=CC=C1 RT11444 [1,0,0,0,0,0|0,0,0]=1 250 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|1,0,0]=2 252 B11R1.3 C#CC1=CC=C(N(=O)=O)C=C1 RT11033 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.3 C(=O)C1=CC=C(C(=O)O)C=C1 JZ3943 [0,1,0,0,0,0|0,0,1]=2 254 B11R1.3 C(=O)C1=CC=C([N+](=O)[O-])C=C1 LT6154 [0,1,0,0,0,0|1,0,2]=4 255 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 JZ4383 [0,1,0,0,0,0|1,0,0]=2 256 B11R1.3 C=CC1=CC=C(N(=O)=O)C=C1 HL1249 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.3 CC(C)C1=CC=C(CO)C=C1 LL0970 [0,1,0,0,0,0|2,0,1]=4 258 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 LT3069 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 JZ3941 [0,1,0,0,0,0|1,0,0]=2 260 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 LQ3466 [0,1,0,0,0,0|1,0,0]=2 261 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 HL1250 [0,1,0,0,0,0|2,0,1]=4 262 B11R1.3 COC1=CC=C(B(O)O)C=C1 JZ0684 [0,1,0,0,0,0|1,0,1]=3 263 B11R1.3 COC1=CC=C(B(O)O)C=C1 LQ5149 [0,1,0,0,0,0|1,0,1]=3 264 B11R1.3 COC1=CC=C(C(=N)N)C=C1 RT1606 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 JZ0666 [0,1,0,0,0,0|1,0,0]=2 266 B11R1.3 COC1=CC=C(C(=O)O)C=C1 JZ4549 [0,1,0,0,0,0|0,0,0]=1 267 B11R1.3 COC1=CC=C(C(=O)O)N=C1 RT6533 [0,1,0,0,0,0|1,0,0]=2 268 B11R1.3 COC1=CC=C(C(C)=O)C=C1 JZ1135 [0,1,0,0,0,0|1,0,0]=2 269 B11R1.3 COC1=CC=C(C(N)=O)C=C1 HL2560 [0,1,0,0,0,0|1,0,0]=2 270 B11R1.3 COC1=CC=C(N(C)C)C=C1 YH14709 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.3 COC1=CC=C([C@@H](C)N)C=C1 JZ5490 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.3 COC1=NC=C(B(O)O)C=C1 LL2373 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.3 COC1=NC=C(C(=O)O)C=C1 JZ0752 [0,1,0,0,0,0|1,0,0]=2 274 B11R1.3 COC1=NC=C(C(=O)O)N=C1 YH59418 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.3 CSC1=CC=C(B(O)O)C=C1 LL1731 [0,1,0,0,0,0|1,1,1]=4 276 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 LT3084 [0,1,0,0,0,0|0,1,0]=2 277 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 XJ1918 [0,1,0,0,0,0|1,1,0]=3 278 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 LQ5498 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 JZ2849 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 JZ3942 [0,1,0,0,0,0|1,0,0]=2 281 B11R1.3 N#CC1=CC=C([N+](=O)[O-])C=C1 JZ3944 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 LL1227 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 LQ0055 [0,1,0,0,0,0|1,0,0]=2 284 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CJ2943 [0,1,0,0,0,0|1,0,0]=2 285 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 JZ0800 [0,1,0,0,0,0|1,0,0]=2 286 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 YH66572 [0,1,0,0,0,0|2,0,0]=3 287 B11R1.3 NNC1=CC=C([N+](=O)[O-])C=C1 JZ4034 [0,1,0,0,0,0|2,0,1]=4 288 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 LL2125 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.3 O=C(Cl)C1=CC=C(CCl)C=C1 HL0470 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 RT10589 [0,1,0,0,0,0|1,0,0]=2 291 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 HL4991 [0,1,0,0,0,0|0,0,0]=1 292 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 XJ2357 [0,1,0,0,0,0|0,0,0]=1 293 B11R1.3 O=CC1=CC=C(B(O)O)C=C1 LL1609 [0,1,0,0,0,0|1,0,2]=4 294 B11R1.3 O=[N+]([O-])C1=CC=C(CBr)C=C1 LT2901 [0,1,0,0,0,0|2,0,1]=4 295 B11R1.3 O=[N+]([O-])C1=CC=C(CCl)C=C1 JZ0439 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 LT6151 [0,1,0,0,0,0|1,0,1]=3 297 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 XJ6121 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.3 OCC1=CC=C(B(O)O)C=C1 LQ5464 [0,1,0,0,0,0|1,0,1]=3 299 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 YH45396 [0,1,0,0,0,0|2,0,1]=4 300 B11R1.19 CC1=CC=C(S(=O)(=O)Cl)C=C1 LT7261 [0,1,0,0,0,0|2,0,1]=4 301 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 HL2904 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 LL0357 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 RT4375 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 RT8618 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 XJ3061 [0,1,0,0,0,0|2,0,0]=3 306 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 YH22643 [0,1,0,0,0,0|2,0,0]=3 307 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 XJ1294 [0,1,0,0,0,0|2,0,1]=4 308 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 XJ6642 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH08874 [0,1,0,0,0,0|2,0,1]=4 310 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH65358 [0,1,0,0,0,0|2,0,1]=4 311 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH65582 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.19 CC1=CC=C(S(=O)([O-])=S)C=C1 LQ4605 [0,1,0,0,0,0|2,0,1]=4 313 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 JZ2240 [0,1,0,0,0,0|2,0,1]=4 314 B11R1.19 CC1=NC=C(S(=O)(=O)O)C=C1 YH03032 [0,1,0,0,0,0|3,0,0]=4 315 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 XJ0246 [0,1,0,0,0,0|2,0,1]=4 316 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 HL1799 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 LQ2928 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 JZ4918 [0,1,0,0,0,0|1,0,1]=3 319 B11R1.19 NC1=CC=C(P(=O)(O)O)C=C1 YH05728 [0,1,0,0,0,0|2,0,0]=3 320 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 JZ0129 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.19 NC1=CC=C([As](=O)(O)O)C=C1 XJ0242 [0,1,0,0,0,0|2,0,0]=3 322 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)C=C1 LT2781 [0,1,0,0,0,0|2,0,1]=4 323 B11R1.19 O=S(=O)(Cl)C1=CC=C(Br)C=C1 XJ0247 [0,1,0,0,0,0|2,0,1]=4 324 B11R1.19 O=S(=O)(Cl)C1=CC=C(F)C=C1 LQ0730 [0,1,0,0,0,0|2,0,1]=4 325 B11R1.19 O=S(=O)(Cl)C1=CC=C(I)C=C1 XJ0249 [0,1,0,0,0,0|2,0,1]=4 326 B11R1.19 O=S(=O)(Cl)C1=CC=C(O)C=C1 YH59504 [0,1,0,0,0,0|1,0,1]=3 327 B11R1.19 O=S(=O)(O)C1=CC=C(Cl)C=C1 XJ0251 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.19 O=S(=O)(O)C1=CC=C(O)C=C1 XJ0252 [0,1,0,0,0,0|1,0,0]=2 329 B11R1.19 O=S(=O)([K])C1=CC=C(Br)C=C1 LT2920 [0,1,0,0,0,0|2,0,1]=4 330 B11R1.19 O=S(=O)([K])C1=CC=C(Cl)C=C1 LT2921 [0,1,0,0,0,0|2,0,1]=4 331 B11R1.19 O=S(=O)([K])C1=CC=C(I)C=C1 LT2829 [0,1,0,0,0,0|2,0,1]=4 332 B11R1.19 O=S(=O)([O-])C1=CC=C(O)C=C1 LQ4598 [0,1,0,0,0,0|1,0,1]=3 333 B11R1.19 O=S(=O)([O-])C1=CC=C(O)C=C1 LT3819 [0,1,0,0,0,0|1,0,1]=3 334 B11R1.19 OC1=CC=C(C(F)(F)F)C=C1 LQ0779 [0,1,0,0,0,0|2,0,1]=4 335 B11R1.21 CC(=O)C1=CC(Br)=C(Br)C=C1 LX3134 [0,1,0,0,0,0|2,0,0]=3 336 B11R1.21 CC(=O)C1=CC(Br)=C(Cl)C=C1 YH06604 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 HL0596 [0,1,0,0,0,0|2,0,0]=3 338 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 JZ2152 [0,1,0,0,0,0|2,0,0]=3 339 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 XJ0695 [0,1,0,0,0,0|2,0,0]=3 340 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 LQ0788 [0,1,0,0,0,0|1,0,0]=2 341 B11R1.21 CC(=O)C1=CC(N)=C(F)C=C1 LX2782 [0,1,0,0,0,0|2,0,0]=3 342 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 JZ4491 [0,1,0,0,0,0|1,0,0]=2 343 B11R1.21 CC(=O)C1=CC=C(Br)C(F)=C1 LX2244 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 LL0209 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.21 CC(=O)C1=CC=C(Cl)C(Cl)=C1 JZ2110 [0,1,0,0,0,0|2,0,0]=3 346 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 LQ3334 [0,1,0,0,0,0|1,0,0]=2 347 B11R1.21 CC1=C(Br)C=NC(C(=O)O)=C1 YH92885 [0,1,0,0,0,0|2,0,0]=3 348 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 LQ1233 [0,1,0,0,0,0|1,0,0]=2 349 B11R1.21 CC1=C(C)N=C(C(=O)O)C=N1 YH66048 [0,1,0,0,0,0|3,0,0]=4 350 B11R1.21 CC1=C(Cl)C=C([N+](=O)[O-])C=C1 JZ3720 [0,1,0,0,0,0|2,0,1]=4 351 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 LT6782 [0,1,0,0,0,0|1,0,0]=2 352 B11R1.21 CC1=C(F)C=C([N+](=O)[O-])C=C1 XJ1742 [0,1,0,0,0,0|2,0,1]=4 353 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 LL2170 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 LQ0789 [0,1,0,0,0,0|1,0,0]=2 355 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 LL1505 [0,1,0,0,0,0|1,0,0]=2 356 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 XJ2209 [0,1,0,0,0,0|1,0,0]=2 357 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 LT2618 [0,1,0,0,0,0|1,0,0]=2 358 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 LT2606 [0,1,0,0,0,0|1,0,0]=2 359 B11R1.21 CC1=C(O)C=C([N+](=O)[O-])C=C1 JZ0089 [0,1,0,0,0,0|2,0,1]=4 360 B11R1.21 CC1=CC(C(=O)Cl)=CC=C1Br LQ4321 [0,1,0,0,0,0|2,0,0]=3 361 B11R1.21 CC1=CC(C(=O)O)=CN=C1F LT3944 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.21 CC1=CC([N+](=O)[O-])=CC=C1I JZ2716 [0,1,0,0,0,0|2,0,1]=4 363 B11R1.21 CC1=CC([N+](=O)[O-])=CC=C1N LT6584 [0,1,0,0,0,0|2,0,1]=4 364 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1O JZ5453 [0,1,0,0,0,0|2,0,1]=4 365 B11R1.21 CC1=CC=C(B(O)O)C=C1C LT1839 [0,1,0,0,0,0|2,0,1]=4 366 B11R1.21 CC1=CC=C(C(=O)Cl)C=C1I YH65834 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.21 CC1=CC=C(C(=O)O)C=C1Cl LQ2823 [0,1,0,0,0,0|1,0,0]=2 368 B11R1.21 CC1=CC=C(C(N)=O)C=C1N LT3129 [0,1,0,0,0,0|2,0,0]=3 369 B11R1.21 CC1=CC=C(C(N)=S)C=C1F LL2430 [0,1,0,0,0,0|2,1,0]=4 370 B11R1.21 CC1=CC=C(N(=O)=O)C=C1Br LT1666 [0,1,0,0,0,0|2,0,1]=4 371 B11R1.21 CC1=CN=C(C(=O)O)C=[N+]1[O-] LT4062 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.21 CC1=[N+](C)C=C(C(N)=O)C=C1 RT9402 [0,1,0,0,0,0|3,0,0]=4 373 B11R1.21 N=C(N)C1=CC=C(N)C(N)=C1 YH14015 [0,1,0,0,0,0|3,0,0]=4 374 B11R1.21 NC(=O)C1=CC(N)=C(Cl)C=C1 LT2911 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 LT2770 [0,1,0,0,0,0|1,0,0]=2 376 B11R1.21 NC1=C(Cl)C=CC([N+](=O)[O-])=C1 LT6500 [0,1,0,0,0,0|2,0,1]=4 377 B11R1.21 NC1=C(F)C=C([N+](=O)[O-])C=C1 XJ0696 [0,1,0,0,0,0|2,0,1]=4 378 B11R1.21 NC1=C(F)C=CC(N(=O)=O)=C1 YH57471 [0,1,0,0,0,0|2,0,1]=4 379 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 LQ1234 [0,1,0,0,0,0|1,0,0]=2 380 B11R1.21 NC1=C(N)C=C([N+](=O)[O-])C=C1 HL1288 [0,1,0,0,0,0|2,0,1]=4 381 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 LQ2164 [0,1,0,0,0,0|1,0,0]=2 382 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 JZ0161 [0,1,0,0,0,0|0,0,0]=1 383 B11R1.21 NC1=C(O)C=CC([N+](=O)[O-])=C1 LT2040 [0,1,0,0,0,0|1,0,1]=3 384 B11R1.21 NC1=CC([N+](=O)[O-])=CC=C1Br YH22436 [0,1,0,0,0,0|2,0,1]=4 385 B11R1.21 NC1=CC=C(C(=O)O)C=C1Br YH11091 [0,1,0,0,0,0|1,0,0]=2 386 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl YH49312 [0,1,0,0,0,0|1,0,0]=2 387 B11R1.21 NC1=CC=C(C(=O)O)C=C1F RT1599 [0,1,0,0,0,0|1,0,0]=2 388 B11R1.21 NC1=CC=C(N(=O)=O)C=C1O LT0259 [0,1,0,0,0,0|2,0,1]=4 389 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br RT2374 [0,1,0,0,0,0|3,0,0]=4 390 B11R1.21 O=C(Cl)C1=CC(Br)=C(F)C=C1 HL0321 [0,1,0,0,0,0|2,0,0]=3 391 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Cl)C=C1 LQ2350 [0,1,0,0,0,0|2,0,0]=3 392 B11R1.21 O=C(Cl)C1=CC(Cl)=C(F)C=C1 LL1129 [0,1,0,0,0,0|2,0,0]=3 393 B11R1.21 O=C(Cl)C1=CC(F)=C(F)C=C1 HL4581 [0,1,0,0,0,0|2,0,0]=3 394 B11R1.21 O=C(O)C1=CC(=O)C(O)=CO1 RT15411 [0,1,0,0,0,0|1,0,0]=2 395 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 XJ5456 [0,1,0,0,0,0|1,0,0]=2 396 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 HL1019 [0,1,0,0,0,0|1,0,0]=2 397 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 XJ5455 [0,1,0,0,0,0|2,0,0]=3 398 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 LQ0791 [0,1,0,0,0,0|1,0,0]=2 399 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 LQ5082 [0,1,0,0,0,0|1,0,0]=2 400 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 YH55532 [0,1,0,0,0,0|1,0,0]=2 401 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=C1 LQ5083 [0,1,0,0,0,0|1,0,0]=2 402 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 LT6724 [0,1,0,0,0,0|1,0,0]=2 403 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 LQ0790 [0,1,0,0,0,0|1,0,0]=2 404 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 LQ5176 [0,1,0,0,0,0|1,0,0]=2 405 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 LQ0734 [0,1,0,0,0,0|0,0,0]=1 406 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 LT6644 [0,1,0,0,0,0|0,0,0]=1 407 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 YH65444 [0,1,0,0,0,0|2,0,0]=3 408 B11R1.21 O=N(=O)C1=CC(Cl)=C(F)C=C1 YH56184 [0,1,0,0,0,0|2,0,1]=4 409 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(Cl)C=C1 RT12765 [0,1,0,0,0,0|2,0,1]=4 410 B11R1.21 O=[N+]([O-])C1=CC(F)=C(Br)C=C1 LT6027 [0,1,0,0,0,0|2,0,1]=4 411 B11R1.21 O=[N+]([O-])C1=CC(F)=C(F)C=C1 LT6640 [0,1,0,0,0,0|2,0,1]=4 412 B11R1.21 O=[N+]([O-])C1=CC(F)=C(O)C=C1 LT6536 [0,1,0,0,0,0|1,0,1]=3 413 B11R1.21 O=[N+]([O-])C1=CC(I)=C(O)C=C1 YH93889 [0,1,0,0,0,0|1,0,1]=3 414 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Cl)C=C1 JZ1019 [0,1,0,0,0,0|2,0,1]=4 415 B11R1.21 O=[N+]([O-])C1=CC=C(F)C(O)=C1 YH47570 [0,1,0,0,0,0|2,0,1]=4 416 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Br)=C1 JZ5047 [0,1,0,0,0,0|2,0,1]=4 417 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Cl)=C1 YH47452 [0,1,0,0,0,0|2,0,1]=4 418 B11R1.21 OB(O)C1=CC(Cl)=C(Cl)C=C1 LT1825 [0,1,0,0,0,0|2,0,1]=4 419 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 CJ2235 [0,1,0,0,0,0|2,0,1]=4 420 B11R1.22 C(=O)C(C)C1=CC=C(Cl)C=C1 YH58118 [0,1,0,0,0,0|2,0,1]=4 421 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 YH65417 [0,1,0,0,0,0|2,0,0]=3 422 B11R1.22 CC1=CC=C(C(C)C=O)C=C1 HL1295 [0,1,0,0,0,0|2,0,1]=4 423 B11R1.22 CC1=CC=C(C(O)CN)C=C1 RT1609 [0,1,0,0,0,0|2,0,1]=4 424 B11R1.22 CC1=CC=C(\C(C)=N\O)C=C1 HL2147 [0,1,0,0,0,0|2,0,0]=3 425 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 YH14959 [0,1,0,0,0,0|2,0,0]=3 426 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 RT11202 [0,1,0,0,0,0|1,0,0]=2 427 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 JZ3934 [0,1,0,0,0,0|1,0,0]=2 428 B11R1.22 COC(=O)C1=CC=C(C)N=C1 RT12187 [0,1,0,0,0,0|2,0,0]=3 429 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 HL0691 [0,1,0,0,0,0|1,0,0]=2 430 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 JZ0748 [0,1,0,0,0,0|2,0,0]=3 431 B11R1.22 COC(=O)C1=CC=C(F)C=C1 JZ1260 [0,1,0,0,0,0|1,0,0]=2 432 B11R1.22 COC(=O)C1=CC=C(F)N=C1 XJ1741 [0,1,0,0,0,0|2,0,0]=3 433 B11R1.22 COC(=O)C1=CC=C(I)C=C1 JZ3935 [0,1,0,0,0,0|1,0,0]=2 434 B11R1.22 COC(=O)C1=CC=C(N)C=C1 JZ3936 [0,1,0,0,0,0|1,0,0]=2 435 B11R1.22 COC(=O)C1=CC=C(N)N=C1 JZ1658 [0,1,0,0,0,0|2,0,0]=3 436 B11R1.22 COC(=O)C1=CC=C(O)C=C1 LT7452 [0,1,0,0,0,0|0,0,0]=1 437 B11R1.22 COC(=O)C1=CC=C(O)C=N1 SY0217 [0,1,0,0,0,0|1,0,0]=2 438 B11R1.22 COC(=O)C1=CC=C([O-])C=C1 YH03826 [0,1,0,0,0,0|0,0,1]=2 439 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 LX3189 [0,1,0,0,0,0|2,0,0]=3 440 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 XJ4983 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 YH93944 [0,1,0,0,0,0|3,0,0]=4 442 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 LT5905 [0,1,0,0,0,0|3,0,0]=4 443 B11R1.22 COC(=O)C1=NC=C(O)N=C1 LT5907 [0,1,0,0,0,0|2,0,0]=3 444 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 RT10568 [0,1,0,0,0,0|1,0,0]=2 445 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 RT1562 [0,1,0,0,0,0|2,0,0]=3 446 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 LQ2917 [0,1,0,0,0,0|2,0,0]=3 447 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 RT2897 [0,1,0,0,0,0|2,0,0]=3 448 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 YH17779 [0,1,0,0,0,0|2,0,0]=3 449 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 YH17778 [0,1,0,0,0,0|2,0,0]=3 450 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 HL1815 [0,1,0,0,0,0|2,0,0]=3 451 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 LX2710 [0,1,0,0,0,0|2,0,0]=3 452 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 YH43755 [0,1,0,0,0,0|1,0,0]=2 453 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 LQ2961 [0,1,0,0,0,0|2,0,0]=3 454 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 LL0964 [0,1,0,0,0,0|2,0,0]=3 455 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 HL1818 [0,1,0,0,0,0|2,0,0]=3 456 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 XJ2875 [0,1,0,0,0,0|2,0,0]=3 457 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 LT2239 [0,1,0,0,0,0|2,0,0]=3 458 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 HL1296 [0,1,0,0,0,0|2,0,0]=3 459 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 LT2785 [0,1,0,0,0,0|2,0,0]=3 460 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 RT10679 [0,1,0,0,0,0|1,0,0]=2 461 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 HL1817 [0,1,0,0,0,0|2,0,0]=3 462 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 YH11049 [0,1,0,0,0,0|1,0,0]=2 463 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 YH04927 [0,1,0,0,0,0|1,0,1]=3 464 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 HL0592 [0,1,0,0,0,0|2,0,0]=3 465 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 LX2629 [0,1,0,0,0,0|2,0,0]=3 466 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 YH65890 [0,1,0,0,0,0|2,0,0]=3 467 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 YH65861 [0,1,0,0,0,0|2,0,0]=3 468 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 LL0744 [0,1,0,0,0,0|2,0,0]=3 469 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 HL0874 [0,1,0,0,0,0|2,0,0]=3 470 B11R1.166 CC(=O)C1=CC=C(Br)C=C1Br LX2251 [0,1,0,0,0,0|2,0,0]=3 471 B11R1.166 CC(=O)C1=CC=C(C)C=C1O YH14255 [0,1,0,0,0,0|2,0,0]=3 472 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br YH88248 [0,1,0,0,0,0|2,0,0]=3 473 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1F LL2461 [0,1,0,0,0,0|2,0,0]=3 474 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br YH10272 [0,1,0,0,0,0|1,0,0]=2 475 B11R1.166 CC(=O)C1=CC=C(O)C=C1Cl XJ6151 [0,1,0,0,0,0|1,0,0]=2 476 B11R1.166 CC(=O)C1=CC=C(O)C=C1Cl YH00402 [0,1,0,0,0,0|1,0,0]=2 477 B11R1.166 CC(=O)C1=CC=C(O)C=C1F YH98787 [0,1,0,0,0,0|1,0,0]=2 478 B11R1.166 CC(=O)C1=CC=C(O)C=C1O RT11977 [0,1,0,0,0,0|1,0,0]=2 479 B11R1.166 CC1=C(B(O)O)C=CC(F)=C1 LL2171 [0,1,0,0,0,0|2,0,1]=4 480 B11R1.166 CC1=C(C(=O)O)C=NC(N)=C1 LX3005 [0,1,0,0,0,0|2,0,0]=3 481 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Cl)=C1 XJ2888 [0,1,0,0,0,0|2,0,1]=4 482 B11R1.166 CC1=C([N+](=O)[O-])C=CC(N)=C1 RT6336 [0,1,0,0,0,0|2,0,1]=4 483 B11R1.166 CC1=C([N+](=O)[O-])C=CC(O)=C1 LT3053 [0,1,0,0,0,0|1,0,1]=3 484 B11R1.166 CC1=C([N+](=O)[O-])C=CC(O)=N1 YH51908 [0,1,0,0,0,0|2,0,1]=4 485 B11R1.166 CC1=C([N+](=O)[O-])C=NC(O)=C1 LT3362 [0,1,0,0,0,0|2,0,1]=4 486 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 LQ3335 [0,1,0,0,0,0|1,0,0]=2 487 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 LX2050 [0,1,0,0,0,0|1,0,0]=2 488 B11R1.166 CC1=CC(Cl)=C([N+](=O)[O-])C=C1 YH58663 [0,1,0,0,0,0|2,0,1]=4 489 B11R1.166 CC1=CC(Cl)=CC=C1C(=O)O YH17041 [0,1,0,0,0,0|1,0,0]=2 490 B11R1.166 CC1=CC(F)=C([N+](=O)[O-])C=C1 XJ0766 [0,1,0,0,0,0|2,0,1]=4 491 B11R1.166 CC1=CC(F)=CC=C1[N+](=O)[O-] XJ0765 [0,1,0,0,0,0|2,0,1]=4 492 B11R1.166 CC1=CC(O)=C(C(=O)O)C=N1 YH13201 [0,1,0,0,0,0|2,0,0]=3 493 B11R1.166 CC1=CC(O)=C(C(N)=O)C=C1 LT2462 [0,1,0,0,0,0|2,0,0]=3 494 B11R1.166 CC1=CC(O)=CC=C1B(O)O LL2867 [0,1,0,0,0,0|1,0,1]=3 495 B11R1.166 CC1=CC=C(C(=O)O)C(F)=C1 YH18052 [0,1,0,0,0,0|1,0,0]=2 496 B11R1.166 CC1=CC=C(C(=O)O)C(N)=C1 HL2212 [0,1,0,0,0,0|1,0,0]=2 497 B11R1.166 CC1=CC=C(C(N)=O)C(N)=C1 LT0244 [0,1,0,0,0,0|2,0,0]=3 498 B11R1.166 CC1=NC(F)=CC=C1C(=O)O LX2404 [0,1,0,0,0,0|2,0,0]=3 499 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1Cl XJ2193 [0,1,0,0,0,0|2,0,0]=3 500 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl LL1015 [0,1,0,0,0,0|3,0,0]=4 501 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 YH45406 [0,1,0,0,0,0|1,0,0]=2 502 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 LT0240 [0,1,0,0,0,0|1,0,0]=2 503 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 RT1598 [0,1,0,0,0,0|1,0,0]=2 504 B11R1.166 NC1=C([N+](=O)[O-])C=CC(Cl)=C1 LT3541 [0,1,0,0,0,0|2,0,1]=4 505 B11R1.166 NC1=C([N+](=O)[O-])C=CC(F)=C1 LQ2105 [0,1,0,0,0,0|2,0,1]=4 506 B11R1.166 NC1=CC(Br)=CC=C1[N+](=O)[O-] YH05144 [0,1,0,0,0,0|2,0,1]=4 507 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 XJ2208 [0,1,0,0,0,0|1,0,0]=2 508 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 XJ0046 [0,1,0,0,0,0|1,0,0]=2 509 B11R1.166 NC1=CC=C(C(=O)O)C(F)=C1 LX3182 [0,1,0,0,0,0|1,0,0]=2 510 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 HL3362 [0,1,0,0,0,0|1,0,1]=3 511 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 JZ3312 [0,1,0,0,0,0|1,0,1]=3 512 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 LL0519 [0,1,0,0,0,0|1,0,1]=3 513 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 LQ0597 [0,1,0,0,0,0|1,0,1]=3 514 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 XJ1113 [0,1,0,0,0,0|1,0,0]=2 515 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 HL0593 [0,1,0,0,0,0|1,0,0]=2 516 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 RT11949 [0,1,0,0,0,0|1,0,0]=2 517 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 HL1032 [0,1,0,0,0,0|1,0,0]=2 518 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 YH07341 [0,1,0,0,0,0|0,0,0]=1 519 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 RT12288 [0,1,0,0,0,0|1,0,0]=2 520 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 XJ0764 [0,1,0,0,0,0|1,0,0]=2 521 B11R1.166 O=C(O)C1=C(F)C=C(F)N=C1 YH89414 [0,1,0,0,0,0|2,0,0]=3 522 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 LT2788 [0,1,0,0,0,0|1,0,0]=2 523 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 LQ0700 [0,1,0,0,0,0|1,0,0]=2 524 B11R1.166 O=C(O)C1=C(O)N=C(O)N=C1 RT18056 [0,1,0,0,0,0|2,0,0]=3 525 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O HL0984 [0,1,0,0,0,0|1,0,0]=2 526 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl LQ4961 [0,1,0,0,0,0|2,0,0]=3 527 B11R1.166 O=C(O)C1=CC=C(F)C=C1Cl LT6491 [0,1,0,0,0,0|1,0,0]=2 528 B11R1.166 O=C(O)C1=CC=C(I)C=C1Br YH51932 [0,1,0,0,0,0|1,0,0]=2 529 B11R1.166 O=C(O)C1=CC=C(I)C=C1F LL2023 [0,1,0,0,0,0|1,0,0]=2 530 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl RT11083 [0,1,0,0,0,0|0,0,0]=1 531 B11R1.166 O=C(O)C1=CC=C(S)C=C1Br RT13176 [0,1,0,0,0,0|0,1,0]=2 532 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl HL4459 [0,1,0,0,0,0|2,0,0]=3 533 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl YH27314 [0,1,0,0,0,0|2,0,0]=3 534 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl YH19973 [0,1,0,0,0,0|2,0,0]=3 535 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(F)C=C1 CJ2320 [0,1,0,0,0,0|2,0,1]=4 536 B11R1.166 O=[N+]([O-])C1=C(F)C=C(Br)C=C1 LT6026 [0,1,0,0,0,0|2,0,1]=4 537 B11R1.166 O=[N+]([O-])C1=C(F)C=C(F)C=C1 LT0121 [0,1,0,0,0,0|2,0,1]=4 538 B11R1.166 O=[N+]([O-])C1=C(F)C=C(O)C=C1 LT6783 [0,1,0,0,0,0|1,0,1]=3 539 B11R1.166 O=[N+]([O-])C1=CC=C(F)C=C1Br YH14650 [0,1,0,0,0,0|2,0,1]=4 540 B11R1.166 O=[N+]([O-])C1=CN=C(O)C=C1Cl YH89654 [0,1,0,0,0,0|2,0,1]=4 541 B11R1.166 OB(O)C1=C(Cl)C=C(O)C=C1 CJ2522 [0,1,0,0,0,0|1,0,1]=3 542 B11R1.166 OB(O)C1=C(F)C=C(F)C=C1 LT0124 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.166 OB(O)C1=CC=C(Cl)C=C1Cl CJ2498 [0,1,0,0,0,0|2,0,1]=4 544 B11R1.166 OB(O)C1=CC=C(Cl)C=C1F HL3648 [0,1,0,0,0,0|2,0,1]=4 545 B11R2.34 ClC1=CC=C(C2CO2)C=C1 RT7256 [0,0,0,1,0,0|2,0,1]=4 546 B11R2.34 OC1=CC=C(C2CO2)C=C1 RT7953 [0,0,0,1,0,0|1,0,1]=3 547 B9R1.35 CC(=O)C1=CC(C)=CS1 JZ4815 [0,0,0,0,1,0|3,0,0]=4 548 B9R1.35 CC(=O)C1=CC(Cl)=CS1 XJ5172 [0,0,0,0,1,0|3,0,0]=4 549 B9R1.35 CC(=O)C1=CC=C(Br)S1 XJ2893 [0,0,0,0,1,0|3,0,0]=4 550 B9R1.35 CC(=O)C1=CC=C(C)O1 JZ1181 [0,0,0,0,1,0|3,0,0]=4 551 B9R1.35 CC(=O)C1=CC=C(Cl)S1 LQ1289 [0,0,0,0,1,0|3,0,0]=4 552 B9R1.35 CC(=O)C1=CN(C)C=C1 JZ4275 [0,0,0,0,1,0|3,0,0]=4 553 B9R1.35 CC1=CC(C(=O)O)=NO1 HL2548 [0,0,0,0,1,0|3,0,0]=4 554 B9R1.35 CC1=CC=C(C(=O)Cl)S1 LT0712 [0,0,0,0,1,0|3,0,0]=4 555 B9R1.35 CC1=CC=C(C(=O)O)S1 LQ2018 [0,0,0,0,1,0|2,0,0]=3 556 B9R1.35 CC1=CN=C(C(=O)O)O1 YH02221 [0,0,0,0,1,0|3,0,0]=4 557 B9R1.35 CC1=CN=C(C(=O)O)S1 CJ2740 [0,0,0,0,1,0|3,0,0]=4 558 B9R1.35 CC1=CNC(C(=O)O)=C1 YH42507 [0,0,0,0,1,0|2,0,0]=3 559 B9R1.35 CC1=COC(C(=O)O)=N1 RT15003 [0,0,0,0,1,0|3,0,0]=4 560 B9R1.35 CC1=CSC(C(=O)O)=C1 XJ4050 [0,0,0,0,1,0|2,0,0]=3 561 B9R1.35 CC1=CSC(C(=O)O)=N1 YH35093 [0,0,0,0,1,0|3,0,0]=4 562 B9R1.35 CC1=NC(C(=O)O)=CN1 RT14528 [0,0,0,0,1,0|3,0,0]=4 563 B9R1.35 CC1=NC(C(=O)O)=CO1 RT14087 [0,0,0,0,1,0|3,0,0]=4 564 B9R1.35 CC1=NC=C(C(=O)O)S1 YH59279 [0,0,0,0,1,0|3,0,0]=4 565 B9R1.35 CC1=NNC(C(=O)O)=C1 YH14439 [0,0,0,0,1,0|3,0,0]=4 566 B9R1.35 CC1=NOC(C(=O)O)=C1 LX2905 [0,0,0,0,1,0|3,0,0]=4 567 B9R1.35 CN1C=NC(C(=O)O)=C1 XJ5462 [0,0,0,0,1,0|3,0,0]=4 568 B9R1.35 NC1=NC(C(=O)O)=CS1 LT2287 [0,0,0,0,1,0|3,0,0]=4 569 B9R1.35 O=C(O)C1=CC(Br)=CS1 LQ3954 [0,0,0,0,1,0|2,0,0]=3 570 B9R1.35 O=C(O)C1=CC(Br)=CS1 RT8377 [0,0,0,0,1,0|2,0,0]=3 571 B9R1.35 O=C(O)C1=CC=C(Br)S1 JZ0392 [0,0,0,0,1,0|2,0,0]=3 572 B9R1.35 O=C(O)C1=CC=C(Cl)S1 XJ4788 [0,0,0,0,1,0|2,0,0]=3 573 B9R1.35 O=C(O)C1=COC(F)=N1 RT15298 [0,0,0,0,1,0|3,0,0]=4 574 B9R1.35 O=C(O)C1=CSC(Br)=N1 JZ0401 [0,0,0,0,1,0|3,0,0]=4 575 B9R1.35 O=C(O)C1=NC(Br)=CO1 RT15489 [0,0,0,0,1,0|3,0,0]=4 576 B9R1.35 O=C(O)C1=NNC(Br)=C1 YH32024 [0,0,0,0,1,0|3,0,0]=4 577 B9R1.35 O=C([O-])C1=CC(O)=NS1 RT7884 [0,0,0,0,1,0|2,0,1]=4 578 B9R1.35 O=C1C=C(C(=O)O)CC1 LX3058 [0,0,0,0,1,0|0,0,3]=4 579 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 JZ2786 [0,0,0,0,0,1|2,0,0]=3 580 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 HL1838 [0,0,0,0,0,1|2,0,0]=3 581 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 YH18094 [0,0,0,0,0,1|1,0,0]=2 582 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 LL0348 [0,0,0,0,0,1|2,0,0]=3 583 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 XJ0481 [0,0,0,0,0,1|2,0,0]=3 584 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 RT12770 [0,0,0,0,0,1|1,0,0]=2 585 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 HL0695 [0,0,0,0,0,1|1,1,0]=3 586 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 LT3770 [0,0,0,0,0,1|3,0,0]=4 587 B11R1.20 CC(=O)NC1=NC=C(N)C=C1 XJ5030 [0,0,0,0,0,1|3,0,0]=4 588 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 XJ0551 [0,0,0,0,0,1|2,0,0]=3 589 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 YH54366 [0,0,0,0,0,1|1,0,0]=2 590 B11R1.20 CC(=O)SC1=CC=C(I)C=C1 YH14509 [0,0,0,0,0,1|2,0,0]=3 591 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 JZ4004 [0,0,0,0,0,1|2,0,0]=3 592 B11R1.20 CC1=CC=C(OC(=S)Cl)C=C1 JZ4309 [0,0,0,0,0,1|2,1,0]=4 593 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 RT3249 [0,0,0,0,0,1|3,0,0]=4 594 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 XJ4357 [0,0,0,0,0,1|1,0,0]=2 595 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 XJ0550 [0,0,0,0,0,1|2,0,0]=3 596 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 XJ1279 [0,0,0,0,0,1|2,0,0]=3 597 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 LQ3999 [0,0,0,0,0,1|2,1,0]=4 598 B11R1.20 NC(=S)NC1=CC=C(Cl)C=C1 XJ2569 [0,0,0,0,0,1|2,1,0]=4 599 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 LT3063 [0,0,0,0,0,1|1,0,0]=2 600 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 HL1839 [0,0,0,0,0,1|2,0,0]=3 601 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 LQ3329 [0,0,0,0,0,1|2,0,0]=3 602 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 LQ1955 [0,0,0,0,0,1|1,0,0]=2 603 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 LT3076 [0,0,0,0,0,1|1,0,0]=2 604 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 RT12785 [0,0,0,0,0,1|0,0,0]=1 605 B11R1.20 O=C(O)CC1=CN=C(Cl)C=C1 YH59203 [0,0,0,0,0,1|2,0,0]=3 606 B11R1.20 S=C(Cl)OC1=CC=C(Cl)C=C1 JZ4310 [0,0,0,0,0,1|2,1,0]=4 607 B8R0.28 O=C(O)\C=C\CC(=O)O RT17597 [1,0,1,0,0,0|1,0,1]=4 608 B8R1.2 BrCC1=CC=CC=C1 JZ1264 [2,0,0,0,0,0|1,0,1]=4 609 B8R1.2 Br[Mg]C1=CC=CC=C1 HL1276 [2,0,0,0,0,0|2,0,0]=4 610 B8R1.2 C=CC1=CC=CC=C1 XJ3473 [2,0,0,0,0,0|1,0,0]=3 611 B8R1.2 C=CC1=CC=CN=C1 RT7678 [2,0,0,0,0,0|2,0,0]=4 612 B8R1.2 ClCC1=CC=CC=C1 HL1268 [2,0,0,0,0,0|1,0,1]=4 613 B8R1.2 N#CC1=CC=CC=C1 JZ4954 [2,0,0,0,0,0|1,0,1]=4 614 B8R1.2 N#CC1=CC=CC=C1 XJ4015 [2,0,0,0,0,0|1,0,1]=4 615 B8R1.2 NCC1=CC=CC=C1 LQ1371 [2,0,0,0,0,0|1,0,1]=4 616 B8R1.2 NNC1=CC=CC=C1 HL1279 [2,0,0,0,0,0|2,0,0]=4 617 B8R1.2 NNC1=CC=CC=C1 JZ5772 [2,0,0,0,0,0|2,0,0]=4 618 B8R1.2 O=CC1=CC=CC=N1 JZ0732 [2,0,0,0,0,0|1,0,0]=3 619 B8R1.2 O=CC1=CC=CN=C1 RT10183 [2,0,0,0,0,0|1,0,0]=3 620 B8R1.2 O=CC1=CN=CN=C1 LX3173 [2,0,0,0,0,0|2,0,0]=4 621 B8R1.2 O=CC1=NC=CC=N1 YH51306 [2,0,0,0,0,0|2,0,0]=4 622 B8R1.2 O=CC1=NC=CN=C1 HL3002 [2,0,0,0,0,0|2,0,0]=4 623 B8R1.2 O=CC1=NC=NC=C1 YH48930 [2,0,0,0,0,0|2,0,0]=4 624 B8R1.2 O=CC1=NN=CC=C1 XJ5876 [2,0,0,0,0,0|2,0,0]=4 625 B8R1.2 O=NC1=CC=CC=C1 YH08587 [2,0,0,0,0,0|1,0,0]=3 626 B8R1.2 O=[As]C1=CC=CC=C1 JZ4036 [2,0,0,0,0,0|1,0,0]=3 627 B8R1.2 OCC1=CC=CC=C1 HL1271 [2,0,0,0,0,0|0,0,1]=3 628 B8R1.2 OCC1=CC=CC=N1 LT2170 [2,0,0,0,0,0|1,0,1]=4 629 B8R1.2 OCC1=CN=CC=C1 HL1274 [2,0,0,0,0,0|1,0,1]=4 630 B8R1.2 O[Hg]C1=CC=CC=C1 LQ3360 [2,0,0,0,0,0|1,0,0]=3 631 B8R1.2 SCC1=CC=CC=C1 HL1273 [2,0,0,0,0,0|0,1,1]=4 632 B8R1.2 [C-]#CC1=CC=CC=C1 JZ3648 [2,0,0,0,0,0|1,0,1]=4 633 B8R1.2 [C-]#[N+]C1=CC=CC=C1 YH65599 [2,0,0,0,0,0|2,0,0]=4 634 B8R1.3 BrC1=CC=C(Br)C=C1 LT0052 [2,0,0,0,0,0|2,0,0]=4 635 B8R1.3 BrC1=CC=C(I)C=C1 HL0068 [2,0,0,0,0,0|2,0,0]=4 636 B8R1.3 CC1=CC=C(Cl)C=C1 HL1310 [2,0,0,0,0,0|1,0,1]=4 637 B8R1.3 CC1=CC=C(F)C=C1 LL0677 [2,0,0,0,0,0|1,0,1]=4 638 B8R1.3 CC1=CC=C(I)C=C1 XJ1165 [2,0,0,0,0,0|1,0,1]=4 639 B8R1.3 CC1=CC=C(N)C=C1 RT11917 [2,0,0,0,0,0|1,0,1]=4 640 B8R1.3 CC1=CC=C(N)C=C1 XJ0919 [2,0,0,0,0,0|1,0,1]=4 641 B8R1.3 CC1=CC=C(N)C=C1 XJ0920 [2,0,0,0,0,0|1,0,1]=4 642 B8R1.3 CC1=CC=C(O)C=N1 HL0641 [2,0,0,0,0,0|1,0,1]=4 643 B8R1.3 CC1=CC=C([Hg+])C=C1 RT11940 [2,0,0,0,0,0|1,0,1]=4 644 B8R1.3 CC1=CN=C(O)C=C1 LT3568 [2,0,0,0,0,0|1,0,1]=4 645 B8R1.3 CC1=NC=C(O)C=C1 YH65665 [2,0,0,0,0,0|1,0,1]=4 646 B8R1.3 CN1C=CC(=O)C=C1 RT6737 [2,0,0,0,0,0|2,0,0]=4 647 B8R1.3 ClC1=CC=C(Br)C=C1 XJ0365 [2,0,0,0,0,0|2,0,0]=4 648 B8R1.3 ClC1=CC=C(I)C=C1 JZ4051 [2,0,0,0,0,0|2,0,0]=4 649 B8R1.3 FC1=CC=C(Br)C=C1 LT0069 [2,0,0,0,0,0|2,0,0]=4 650 B8R1.3 FC1=CC=C(Cl)C=C1 LL0678 [2,0,0,0,0,0|2,0,0]=4 651 B8R1.3 FC1=CC=C(I)C=C1 SY0222 [2,0,0,0,0,0|2,0,0]=4 652 B8R1.3 IC1=CC=C(I)C=C1 SY0265 [2,0,0,0,0,0|2,0,0]=4 653 B8R1.3 NC1=CC=C(Br)C=C1 HL1307 [2,0,0,0,0,0|2,0,0]=4 654 B8R1.3 NC1=CC=C(F)C=C1 RT2771 [2,0,0,0,0,0|2,0,0]=4 655 B8R1.3 NC1=CC=C(I)C=C1 XJ0921 [2,0,0,0,0,0|2,0,0]=4 656 B8R1.3 NC1=CC=C(N)C=C1 LQ5353 [2,0,0,0,0,0|2,0,0]=4 657 B8R1.3 NC1=CC=C(N)C=C1 LT7264 [2,0,0,0,0,0|2,0,0]=4 658 B8R1.3 NC1=CC=C(N)C=C1 RT13509 [2,0,0,0,0,0|2,0,0]=4 659 B8R1.3 NC1=CC=C(O)C=C1 RT3071 [2,0,0,0,0,0|1,0,0]=3 660 B8R1.3 NC1=CC=C(O)C=N1 YH07059 [2,0,0,0,0,0|2,0,0]=4 661 B8R1.3 NC1=CC=C(S)C=C1 JZ4463 [2,0,0,0,0,0|1,1,0]=4 662 B8R1.3 NC1=CN=C(O)C=C1 LT3510 [2,0,0,0,0,0|2,0,0]=4 663 B8R1.3 NC1=CN=C(O)C=C1 YH26818 [2,0,0,0,0,0|2,0,0]=4 664 B8R1.3 NC1=CN=C(O)C=C1 YH55281 [2,0,0,0,0,0|2,0,0]=4 665 B8R1.3 O=C1C=CC(=O)C=C1 HL1314 [2,0,0,0,0,0|0,0,1]=3 666 B8R1.3 OC1=CC=C(Br)C=C1 HL1308 [2,0,0,0,0,0|1,0,0]=3 667 B8R1.3 OC1=CC=C(Br)C=N1 YH32505 [2,0,0,0,0,0|2,0,0]=4 668 B8R1.3 OC1=CC=C(I)C=C1 LT6103 [2,0,0,0,0,0|1,0,0]=3 669 B8R1.3 OC1=CC=C(I)C=C1 XJ0922 [2,0,0,0,0,0|1,0,0]=3 670 B8R1.3 OC1=CC=C(I)N=C1 RT14095 [2,0,0,0,0,0|2,0,0]=4 671 B8R1.3 OC1=CC=C(O)C=C1 JZ0106 [2,0,0,0,0,0|0,0,0]=2 672 B8R1.3 OC1=CC=C(O)N=N1 RT0319 [2,0,0,0,0,0|2,0,0]=4 673 B8R1.3 OC1=CN=C(Br)C=C1 RT15425 [2,0,0,0,0,0|2,0,0]=4 674 B8R1.3 OC1=CN=C(Cl)C=C1 LX2869 [2,0,0,0,0,0|2,0,0]=4 675 B8R1.3 OC1=CN=C(F)C=C1 LQ5323 [2,0,0,0,0,0|2,0,0]=4 676 B8R1.3 OC1=NC=C(Cl)C=C1 HL2729 [2,0,0,0,0,0|2,0,0]=4 677 B8R1.3 OC1=NC=C(F)C=C1 YH04459 [2,0,0,0,0,0|2,0,0]=4 678 B8R1.3 OC1=NC=C(I)C=C1 LT3565 [2,0,0,0,0,0|2,0,0]=4 679 B8R1.3 SC1=CC=C(Br)C=C1 HL1316 [2,0,0,0,0,0|1,1,0]=4 680 B8R1.3 [15NH2]C1=CC=C([15NH2])C=C1 RT3027 [2,0,0,0,0,0|2,0,0]=4 681 B10R1.1 Br\C=C\C1=CC=C(Br)C=C1 RT6387 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.1 CC1=CC=C(N=C=O)C=C1 LT3140 [1,1,0,0,0,0|1,0,1]=4 683 B10R1.1 CCOC1=CC=C(O)C=C1 JZ4008 [1,1,0,0,0,0|1,0,1]=4 684 B10R1.1 COCC1=CC=C(O)C=C1 YH05854 [1,1,0,0,0,0|0,0,1]=3 685 B10R1.1 ClC1=CC=C(\C=C\Br)C=C1 RT6043 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.1 NCCC1=CC=C(O)C=C1 RT6525 [1,1,0,0,0,0|1,0,1]=4 687 B10R1.1 NCCC1=CC=C(O)C=C1 YH09355 [1,1,0,0,0,0|1,0,1]=4 688 B10R1.1 O=C=NC1=CC=C(F)C=C1 JZ4482 [1,1,0,0,0,0|1,0,1]=4 689 B10R1.1 O=CCC1=CC=C(F)C=C1 YH40007 [1,1,0,0,0,0|1,0,0]=3 690 B10R1.1 O=CCC1=CC=C(O)C=C1 RT6375 [1,1,0,0,0,0|0,0,0]=2 691 B10R1.1 OCCC1=CC=C(Br)C=C1 LQ2719 [1,1,0,0,0,0|1,0,1]=4 692 B10R1.1 OCCC1=CC=C(F)C=C1 LT2419 [1,1,0,0,0,0|1,0,1]=4 693 B10R1.1 OCCC1=CC=C(O)C=C1 RT12563 [1,1,0,0,0,0|0,0,1]=3 694 B10R1.1 O\N=C\C1=CC=C(F)C=C1 YH02278 [1,1,0,0,0,0|1,0,0]=3 695 B10R1.3 C#CC1=CC=C(CO)C=C1 YH23238 [1,1,0,0,0,0|1,0,1]=4 696 B10R1.3 C#CC1=CC=C(OC)C=C1 HL0395 [1,1,0,0,0,0|1,0,1]=4 697 B10R1.3 C(=O)C1=CC=C(OC)C=C1 JZ1237 [1,1,0,0,0,0|0,0,0]=2 698 B10R1.3 C=CC1=CC=C(C=O)C=C1 YH41162 [1,1,0,0,0,0|1,0,0]=3 699 B10R1.3 C=CC1=CC=C(CCl)C=C1 XJ1818 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.3 C=CC1=CC=C(CO)C=C1 YH23867 [1,1,0,0,0,0|1,0,0]=3 701 B10R1.3 C=CC1=CC=C(OC)C=C1 JZ4048 [1,1,0,0,0,0|1,0,0]=3 702 B10R1.3 CNC1=CC=C(OC)C=C1 LQ2977 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.3 COC1=CC=C(C#N)C=C1 LT2837 [1,1,0,0,0,0|1,0,1]=4 704 B10R1.3 COC1=CC=C(C=O)N=C1 YH47276 [1,1,0,0,0,0|1,0,0]=3 705 B10R1.3 COC1=CC=C(CCl)C=C1 JZ4193 [1,1,0,0,0,0|1,0,1]=4 706 B10R1.3 COC1=CC=C(CN)C=C1 LT3064 [1,1,0,0,0,0|1,0,1]=4 707 B10R1.3 COC1=CC=C(CS)C=C1 LX2163 [1,1,0,0,0,0|0,1,1]=4 708 B10R1.3 COC1=CC=C(NN)C=C1 LL1277 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.3 COC1=CC=C(NN)C=C1 XJ4526 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.3 COC1=CC=C(OC)C=C1 LT7890 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.3 COC1=CC=C(SC)C=C1 LQ1964 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.3 COC1=CC=C([Mg]Br)C=C1 LQ3616 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.3 COC1=NC=C(C=O)C=N1 YH94777 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.3 N#CC1=CC=C(C=O)C=C1 XJ0305 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.3 NCC1=CC=C(CO)C=C1 YH55734 [1,1,0,0,0,0|1,0,1]=4 716 B10R1.3 O=CC1=CC=C(C=O)C=C1 LT7182 [1,1,0,0,0,0|0,0,1]=3 717 B10R1.3 O=CC1=CC=C(CO)C=C1 YH04958 [1,1,0,0,0,0|0,0,0]=2 718 B10R1.3 OCC1=CC=C(CCl)C=C1 YH38510 [1,1,0,0,0,0|1,0,1]=4 719 B10R1.25 C(=O)C1=C(Cl)C=C(F)C=C1 XJ6487 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.25 C(=O)C1=CC=C(Cl)N=C1Cl YH06852 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.25 C=CC1=C(F)C=C(F)C=C1 YH59246 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.25 C=CC1=CC=C(Br)C=C1Cl RT6460 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.25 CC1=C(C=O)C=CC(O)=C1 XJ5425 [1,1,0,0,0,0|0,0,0]=2 724 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 JZ4185 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.25 CC1=CC(C)=C(C=O)C=C1 JZ5009 [1,1,0,0,0,0|1,0,0]=3 726 B10R1.25 CC1=CC(F)=CC=C1C=O YH11075 [1,1,0,0,0,0|1,0,0]=3 727 B10R1.25 CC1=CC(O)=C(C=O)C=C1 LQ1383 [1,1,0,0,0,0|1,0,0]=3 728 B10R1.25 CC1=CC(O)=CC=C1N=O RT11607 [1,1,0,0,0,0|1,0,0]=3 729 B10R1.25 CC1=CC=C(C=O)C(Cl)=C1 XJ5566 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.25 CC1=CC=C(C=O)C(F)=C1 HL3526 [1,1,0,0,0,0|1,0,0]=3 731 B10R1.25 CCC1=CC=C(O)C=C1O LQ2338 [1,1,0,0,0,0|1,0,1]=4 732 B10R1.25 COC1=CC=C(O)C=C1O JZ2877 [1,1,0,0,0,0|2,0,0]=4 733 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 HL3617 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 XJ5762 [1,1,0,0,0,0|0,0,0]=2 735 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 YH06391 [1,1,0,0,0,0|0,0,0]=2 736 B10R1.25 O=CC1=C(F)C=C(O)C=C1 LQ0711 [1,1,0,0,0,0|0,0,0]=2 737 B10R1.25 O=CC1=C(O)C=C(O)C=C1 LT0125 [1,1,0,0,0,0|0,0,0]=2 738 B10R1.25 O=CC1=CC=C(Br)C=C1F LT2238 [1,1,0,0,0,0|1,0,0]=3 739 B10R1.25 O=CC1=CC=C(Br)C=C1O LX2833 [1,1,0,0,0,0|1,0,0]=3 740 B10R1.25 O=CC1=CC=C(Cl)C=C1Br YH65915 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.25 O=CC1=CC=C(Cl)C=C1Cl XJ1439 [1,1,0,0,0,0|1,0,0]=3 742 B10R1.25 O=CC1=CC=C(Cl)C=C1F LT2761 [1,1,0,0,0,0|1,0,0]=3 743 B10R1.25 O=CC1=CC=C(Cl)C=C1O JZ2028 [1,1,0,0,0,0|1,0,0]=3 744 B10R1.25 O=CC1=CC=C(F)C=C1O LQ0712 [1,1,0,0,0,0|1,0,0]=3 745 B10R1.25 O=CC1=CC=C(O)C=C1Br CJ2845 [1,1,0,0,0,0|0,0,0]=2 746 B10R1.25 O=CC1=CC=C(O)C=C1O LT1156 [1,1,0,0,0,0|0,0,0]=2 747 B10R1.25 OCC1=C(Cl)C=C(Cl)C=C1 XJ1917 [1,1,0,0,0,0|1,0,1]=4 748 B10R1.25 OCC1=C(Cl)C=C(F)C=C1 HL3864 [1,1,0,0,0,0|1,0,1]=4 749 B10R1.25 OCC1=C(F)C=C(Br)C=C1 HL3773 [1,1,0,0,0,0|1,0,1]=4 750 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 YH07390 [1,1,0,0,0,0|1,0,1]=4 751 B10R1.176 C#CC1=CC=C(O)C(N)=C1 RT11101 [1,1,0,0,0,0|1,0,1]=4 752 B10R1.176 C(=O)C1=CC(C)=C(O)C=C1 XJ4175 [1,1,0,0,0,0|0,0,0]=2 753 B10R1.176 C(=O)C1=CC=C(Cl)C(F)=C1 YH06829 [1,1,0,0,0,0|1,0,0]=3 754 B10R1.176 C=CC1=CC=C(O)C(O)=C1 RT11606 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.176 CC1=C(C)C=C(CO)C=C1 XJ3179 [1,1,0,0,0,0|1,0,1]=4 756 B10R1.176 CC1=C(I)C=C(C=O)C=C1 YH08545 [1,1,0,0,0,0|1,0,0]=3 757 B10R1.176 CC1=NC(CO)=CC=C1O SY0017 [1,1,0,0,0,0|1,0,1]=4 758 B10R1.176 CCC1=CC=C(O)C(O)=C1 HL0678 [1,1,0,0,0,0|1,0,1]=4 759 B10R1.176 COC1=CC(F)=C(O)C=C1 YH65479 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.176 N#CC1=CC(Br)=C(O)C=C1 LT1670 [1,1,0,0,0,0|1,0,1]=4 761 B10R1.176 N#CC1=CC(O)=C(O)C=C1 LT6099 [1,1,0,0,0,0|1,0,1]=4 762 B10R1.176 N#CC1=CC=C(O)C(F)=C1 LQ0804 [1,1,0,0,0,0|1,0,1]=4 763 B10R1.176 O=CC1=CC(Br)=C(Br)C=C1 LL1331 [1,1,0,0,0,0|1,0,0]=3 764 B10R1.176 O=CC1=CC(Br)=C(Cl)C=C1 YH90433 [1,1,0,0,0,0|1,0,0]=3 765 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 XJ2310 [1,1,0,0,0,0|0,0,0]=2 766 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 YH10936 [1,1,0,0,0,0|1,0,0]=3 767 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 LT6754 [1,1,0,0,0,0|1,0,0]=3 768 B10R1.176 O=CC1=CC(Cl)=C(O)C=C1 LT6758 [1,1,0,0,0,0|0,0,0]=2 769 B10R1.176 O=CC1=CC=C(Br)C(F)=C1 LL2124 [1,1,0,0,0,0|1,0,0]=3 770 B10R1.176 O=CC1=CC=C(F)C(Br)=C1 LT2909 [1,1,0,0,0,0|1,0,0]=3 771 B10R1.176 O=CC1=CC=C(F)C(F)=C1 LT6639 [1,1,0,0,0,0|1,0,0]=3 772 B10R1.176 O=CC1=CC=C(O)C(O)=C1 LT6643 [1,1,0,0,0,0|0,0,0]=2 773 B10R1.176 OCC1=CC=C(Cl)C(Cl)=C1 XJ1957 [1,1,0,0,0,0|1,0,1]=4 774 B10R1.176 OCC1=CC=C(F)C(F)=C1 HL4752 [1,1,0,0,0,0|1,0,1]=4 775 B10R1.15 C#CC(O)C1=CC=CC=C1 HL2705 [1,1,0,0,0,0|1,0,1]=4 776 B10R1.15 C1=CC=C(C(=O)OC)C=C1 LQ3514 [1,1,0,0,0,0|0,0,0]=2 777 B10R1.15 C1=CC=C(N([O-])N=O)C=C1 LT7153 [1,1,0,0,0,0|1,0,1]=4 778 B10R1.15 CC(C=O)C1=CC=CC=C1 HL1224 [1,1,0,0,0,0|1,0,1]=4 779 B10R1.15 CCC(=O)C1=CC=CN=C1 JZ4667 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.15 CN(C=O)C1=CC=CC=C1 JZ0143 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.15 CNC(=O)C1=CC=CC=C1 HL0175 [1,1,0,0,0,0|1,0,0]=3 782 B10R1.15 CNC(=O)C1=NC=CC=C1 RT3529 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.15 COC(=N)C1=NC=CC=C1 RT4090 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.15 COC(=O)C1=CC=CN=C1 JZ0756 [1,1,0,0,0,0|1,0,0]=3 785 B10R1.15 COC(=O)C1=CC=NC=C1 RT1566 [1,1,0,0,0,0|1,0,0]=3 786 B10R1.15 COC(=O)C1=CN=CN=C1 YH55622 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.15 COC(=O)C1=NC=CC=N1 YH55623 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.15 N#CC(O)C1=CC=CC=C1 LL0935 [1,1,0,0,0,0|1,0,1]=4 789 B10R1.15 NCC(=O)C1=CC=CC=C1 LT5895 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.15 NCC(=O)C1=CC=CN=C1 RT4369 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.15 NNC(=O)C1=CC=CC=C1 LT4155 [1,1,0,0,0,0|1,0,0]=3 792 B10R1.15 N\C(=N/O)C1=CC=CC=C1 HL0174 [1,1,0,0,0,0|1,0,0]=3 793 B10R1.15 N\C(=N/O)C1=CC=CN=C1 XJ1823 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.15 O=C(CBr)C1=CC=CC=C1 RT11120 [1,1,0,0,0,0|1,0,0]=3 795 B10R1.15 O=C(CBr)C1=CC=CC=C1 YH43692 [1,1,0,0,0,0|1,0,0]=3 796 B10R1.15 O=C(CBr)C1=CC=NC=C1 XJ2872 [1,1,0,0,0,0|2,0,0]=4 797 B10R1.15 O=C(CBr)C1=NC=CC=C1 LQ4012 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.15 O=C(CCl)C1=CC=CC=C1 LT3832 [1,1,0,0,0,0|1,0,0]=3 799 B10R1.15 O=C(NO)C1=CC=CC=C1 LT6975 [1,1,0,0,0,0|0,0,0]=2 800 B10R1.15 OC(CCl)C1=CC=CC=C1 LQ1871 [1,1,0,0,0,0|1,0,1]=4 801 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 LT6111 [1,1,0,0,0,0|0,0,2]=4 802 B10R1.15 OC[C@H](O)C1=CC=CC=C1 LT6110 [1,1,0,0,0,0|0,0,2]=4 803 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 RT1705 [1,1,0,0,0,0|1,0,1]=4 804 B10R1.28 CC(C)(O)C1=CC=CC=C1 LQ1212 [1,1,0,0,0,0|1,0,1]=4 805 B10R1.28 CP(=O)(Cl)C1=CC=CC=C1 XJ2994 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 LQ2383 [1,1,0,0,0,0|1,0,1]=4 807 B10R1.28 C[Si](C)(O)C1=CC=CC=C1 JZ2662 [1,1,0,0,0,0|1,1,0]=4 808 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 XJ0224 [1,1,0,0,0,0|1,0,1]=4 809 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 RT13210 [1,1,0,0,0,0|1,0,0]=3 810 B10R1.28 O=S(=O)(O)C1=CC=CN=C1 JZ4027 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 YH06116 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.28 O=S(=O)(O)C1=NC=CC=C1 LT5888 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.28 O=S(=O)([Na])C1=CC=CC=C1 LT4044 [1,1,0,0,0,0|1,0,1]=4 814 B10R1.28 O=S(=O)([Zn])C1=CC=CC=C1 LT4045 [1,1,0,0,0,0|1,0,1]=4 815 B10R1.28 O=[As](O)(O)C1=CC=CC=C1 XJ0221 [1,1,0,0,0,0|1,0,0]=3 816 B10R1.61 C=C(C)C1=CC=CC=C1C LQ4513 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.61 CC(=O)C1=C(C)C=CC=C1 JZ3832 [1,1,0,0,0,0|1,0,0]=3 818 B10R1.61 CC(=O)C1=C(F)C=CC=C1 LT6542 [1,1,0,0,0,0|1,0,0]=3 819 B10R1.61 CC(=O)C1=CC=CC=C1Br LQ2085 [1,1,0,0,0,0|1,0,0]=3 820 B10R1.61 CC(=O)C1=CC=CC=C1Cl RT11894 [1,1,0,0,0,0|1,0,0]=3 821 B10R1.61 CC(=O)C1=CC=CN=C1C YH39691 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.61 CC(=O)C1=CC=CN=C1Cl YH07033 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.61 CC(=O)C1=CC=CN=C1N YH12193 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.61 CC(=O)C1=NC=CC=C1F YH65591 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.61 CC(O)C1=CC=CC=C1Cl LQ3656 [1,1,0,0,0,0|1,0,1]=4 826 B10R1.61 CC1=C(C(=O)O)C=CC=C1 LQ0494 [1,1,0,0,0,0|0,0,0]=2 827 B10R1.61 CC1=C(C(=O)O)C=CN=C1 RT9406 [1,1,0,0,0,0|1,0,0]=3 828 B10R1.61 CC1=C(C(=O)O)C=NC=N1 HL3596 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.61 CC1=CC=CC=C1B(O)O LT6617 [1,1,0,0,0,0|1,0,1]=4 830 B10R1.61 CC1=CC=CC=C1C(=O)Cl JZ4285 [1,1,0,0,0,0|1,0,0]=3 831 B10R1.61 CC1=CC=CN=C1C(=O)O LT5691 [1,1,0,0,0,0|1,0,0]=3 832 B10R1.61 CC1=NC=CC=C1C(=O)O JZ2271 [1,1,0,0,0,0|1,0,0]=3 833 B10R1.61 CC1=NC=CN=C1C(=O)O YH00415 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.61 C[N+]1=CC=CC=C1C(=O)[O-] RT7788 [1,1,0,0,0,0|1,0,1]=4 835 B10R1.61 N=C(N)C1=C(O)C=CC=C1 YH65820 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.61 NC(=O)C1=C(N)C=CN=C1 YH16594 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.61 NC(=O)C1=CC=CC=C1N LL0171 [1,1,0,0,0,0|1,0,0]=3 838 B10R1.61 NC(=O)C1=NC=CC=C1N XJ5526 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.61 NC1=C(C(=O)O)C=CC=C1 LT0272 [1,1,0,0,0,0|0,0,0]=2 840 B10R1.61 NC1=C(C(=O)O)C=CN=C1 YH17177 [1,1,0,0,0,0|1,0,0]=3 841 B10R1.61 NC1=C(C(=O)O)C=NC=C1 JZ3131 [1,1,0,0,0,0|1,0,0]=3 842 B10R1.61 NC1=CC=CC=C1B(O)O LT0279 [1,1,0,0,0,0|1,0,1]=4 843 B10R1.61 NC1=CC=CN=C1C(=O)O HL0849 [1,1,0,0,0,0|1,0,0]=3 844 B10R1.61 NC1=NC=CN=C1C(=O)O LT6716 [1,1,0,0,0,0|2,0,0]=4 845 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 RT7792 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 JZ1033 [1,1,0,0,0,0|1,0,0]=3 847 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 XJ1083 [1,1,0,0,0,0|1,0,0]=3 848 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl LT2133 [1,1,0,0,0,0|1,0,0]=3 849 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 LQ0495 [1,1,0,0,0,0|0,0,0]=2 850 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 XJ3548 [1,1,0,0,0,0|1,0,0]=3 851 B10R1.61 O=C(O)C1=C(Cl)N=CC=N1 XJ4919 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.61 O=C(O)C1=C(F)C=CN=C1 LX2749 [1,1,0,0,0,0|1,0,0]=3 853 B10R1.61 O=C(O)C1=C(F)C=NC=C1 HL1748 [1,1,0,0,0,0|1,0,0]=3 854 B10R1.61 O=C(O)C1=C(I)C=CC=C1 LT6566 [1,1,0,0,0,0|0,0,0]=2 855 B10R1.61 O=C(O)C1=C(O)C=CC=C1 RT10607 [1,1,0,0,0,0|0,0,0]=2 856 B10R1.61 O=C(O)C1=C(O)C=CN=C1 XJ1084 [1,1,0,0,0,0|1,0,0]=3 857 B10R1.61 O=C(O)C1=CC=CC=C1Br LL0169 [1,1,0,0,0,0|0,0,0]=2 858 B10R1.61 O=C(O)C1=CC=CC=C1S LQ3223 [1,1,0,0,0,0|0,0,0]=2 859 B10R1.61 O=C(O)C1=CC=CC=C1[O-] LQ0966 [1,1,0,0,0,0|0,0,0]=2 860 B10R1.61 O=C(O)C1=CC=CN=C1Cl LT6516 [1,1,0,0,0,0|1,0,0]=3 861 B10R1.61 O=C(O)C1=CC=CN=C1F HL1749 [1,1,0,0,0,0|1,0,0]=3 862 B10R1.61 O=C(O)C1=CN=CC=C1Br YH36635 [1,1,0,0,0,0|1,0,0]=3 863 B10R1.61 O=C(O)C1=NC=CC=C1Br RT15189 [1,1,0,0,0,0|1,0,0]=3 864 B10R1.61 O=C(O)C1=NC=CC=C1Cl XJ5804 [1,1,0,0,0,0|1,0,0]=3 865 B10R1.61 O=C(O)C1=NC=CC=C1F YH36326 [1,1,0,0,0,0|1,0,0]=3 866 B10R1.61 O=C(O)C1=NC=CC=C1O XJ1437 [1,1,0,0,0,0|1,0,0]=3 867 B10R1.61 O=C(O)C1=NC=CC=C1S RT16346 [1,1,0,0,0,0|1,0,0]=3 868 B10R1.61 O=C(O)C1=NC=CN=C1O YH65414 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.61 O=C([O-])C1=CC=CC=C1O HL0014 [1,1,0,0,0,0|0,0,1]=3 870 B10R1.61 O=C([O-])C1=CC=CC=C1O JZ3839 [1,1,0,0,0,0|0,0,1]=3 871 B10R1.61 O=C([O-])C1=CC=CC=C1O JZ5006 [1,1,0,0,0,0|0,0,1]=3 872 B10R1.61 O=C([O-])C1=CC=CC=C1O LQ0967 [1,1,0,0,0,0|0,0,1]=3 873 B10R1.61 O=C([O-])C1=CC=CC=C1O LQ4134 [1,1,0,0,0,0|0,0,1]=3 874 B10R1.61 O=C([O-])C1=CC=CC=C1[O-] LL1063 [1,1,0,0,0,0|0,0,1]=3 875 B10R1.61 O=C([O-])C1=NC=CC=C1Br RT16520 [1,1,0,0,0,0|1,0,1]=4 876 B10R1.61 O=N(=O)C1=CC=CC=C1O LL0174 [1,1,0,0,0,0|1,0,1]=4 877 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 JZ3833 [1,1,0,0,0,0|1,0,1]=4 878 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 LL0173 [1,1,0,0,0,0|1,0,1]=4 879 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 RT12368 [1,1,0,0,0,0|1,0,1]=4 880 B10R1.61 O=[N+]([O-])C1=C(I)C=CC=C1 XJ1086 [1,1,0,0,0,0|1,0,1]=4 881 B10R1.61 O=[N+]([O-])C1=C(S)C=CC=C1 YH03191 [1,1,0,0,0,0|1,0,1]=4 882 B10R1.61 O=[N+]([O-])C1=CC=CC=C1[O-] LQ1488 [1,1,0,0,0,0|1,0,1]=4 883 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 LT1715 [1,1,0,0,0,0|1,0,1]=4 884 B10R1.61 OB(O)C1=C(F)C=CC=C1 XJ1970 [1,1,0,0,0,0|1,0,1]=4 885 B10R1.113 C=C(C)C1=CC(C)=CC=C1 HL0676 [1,1,0,0,0,0|2,0,0]=4 886 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 LX2618 [1,1,0,0,0,0|2,0,0]=4 887 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 RT15363 [1,1,0,0,0,0|2,0,0]=4 888 B10R1.113 CC(=O)C1=CC(F)=CC=C1 LT6788 [1,1,0,0,0,0|1,0,0]=3 889 B10R1.113 CC(=O)C1=CC(N)=CC=C1 LT6621 [1,1,0,0,0,0|1,0,0]=3 890 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 LQ2084 [1,1,0,0,0,0|1,0,0]=3 891 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 LX2619 [1,1,0,0,0,0|2,0,0]=4 892 B10R1.113 CC(=O)C1=CC=CC(O)=C1 LT6622 [1,1,0,0,0,0|1,0,0]=3 893 B10R1.113 CC(=O)C1=NC=CC(C)=C1 CJ2939 [1,1,0,0,0,0|2,0,0]=4 894 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 JZ3057 [1,1,0,0,0,0|1,0,1]=4 895 B10R1.113 CC(O)C1=CC=CC(N)=C1 XJ2202 [1,1,0,0,0,0|1,0,1]=4 896 B10R1.113 CC1=CC(C(N)=O)=CC=C1 LQ1217 [1,1,0,0,0,0|1,0,0]=3 897 B10R1.113 CC1=CC=CC(B(O)O)=C1 LT6827 [1,1,0,0,0,0|1,0,1]=4 898 B10R1.113 CC1=CC=CC(C(=O)O)=C1 XJ0266 [1,1,0,0,0,0|0,0,0]=2 899 B10R1.113 CC1=CC=CC(C(=O)O)=N1 JZ4291 [1,1,0,0,0,0|1,0,0]=3 900 B10R1.113 CC1=CN=CC(C(=O)O)=C1 LT6022 [1,1,0,0,0,0|1,0,0]=3 901 B10R1.113 CC1=NC(C(=O)O)=CC=N1 JZ4788 [1,1,0,0,0,0|2,0,0]=4 902 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 YH65966 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 XJ3010 [1,1,0,0,0,0|1,0,0]=3 904 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 RT4413 [1,1,0,0,0,0|2,0,0]=4 905 B10R1.113 N=C(N)C1=CC=CC(F)=C1 XJ6333 [1,1,0,0,0,0|2,0,0]=4 906 B10R1.113 N=C(N)C1=CC=CC(N)=C1 LT2228 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 LQ4630 [1,1,0,0,0,0|2,0,0]=4 908 B10R1.113 NC(=O)C1=CC(F)=CC=C1 HL1806 [1,1,0,0,0,0|1,0,0]=3 909 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 LQ1218 [1,1,0,0,0,0|1,0,0]=3 910 B10R1.113 NC(=O)C1=C[N+]([O-])=CC=C1 JZ1859 [1,1,0,0,0,0|2,0,0]=4 911 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 XJ6709 [1,1,0,0,0,0|2,0,0]=4 912 B10R1.113 NC1=CC(C(=O)O)=CN=C1 YH48838 [1,1,0,0,0,0|1,0,0]=3 913 B10R1.113 NC1=CC(C(=O)O)=NC=C1 RT5964 [1,1,0,0,0,0|1,0,0]=3 914 B10R1.113 NC1=CC=CC(B(O)O)=C1 LT2552 [1,1,0,0,0,0|1,0,1]=4 915 B10R1.113 NC1=CC=CC(C(=O)O)=N1 JZ5606 [1,1,0,0,0,0|1,0,0]=3 916 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 XJ0269 [1,1,0,0,0,0|1,0,1]=4 917 B10R1.113 NC1=NC=CC(C(=O)O)=C1 YH32218 [1,1,0,0,0,0|1,0,0]=3 918 B10R1.113 NC1C=CC=C(C(=O)O)C1 RT4711 [1,1,0,0,0,0|0,0,2]=4 919 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 JZ4695 [1,1,0,0,0,0|1,0,0]=3 920 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 LQ1216 [1,1,0,0,0,0|1,0,0]=3 921 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 LT3937 [1,1,0,0,0,0|2,0,0]=4 922 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 LT3027 [1,1,0,0,0,0|1,0,0]=3 923 B10R1.113 O=C(Cl)C1=CC(I)=CC=C1 JZ4696 [1,1,0,0,0,0|1,0,0]=3 924 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 JZ0792 [1,1,0,0,0,0|1,0,0]=3 925 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 LT3007 [1,1,0,0,0,0|0,0,0]=2 926 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 LT6515 [1,1,0,0,0,0|1,0,0]=3 927 B10R1.113 O=C(O)C1=CC(F)=CC=C1 JZ1086 [1,1,0,0,0,0|0,0,0]=2 928 B10R1.113 O=C(O)C1=CC(F)=CN=C1 LQ0786 [1,1,0,0,0,0|1,0,0]=3 929 B10R1.113 O=C(O)C1=CC(I)=CC=C1 LQ1220 [1,1,0,0,0,0|0,0,0]=2 930 B10R1.113 O=C(O)C1=CC(O)=CC=C1 RT13217 [1,1,0,0,0,0|0,0,0]=2 931 B10R1.113 O=C(O)C1=CC(S)=NC=C1 YH42361 [1,1,0,0,0,0|1,0,0]=3 932 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 LT2935 [1,1,0,0,0,0|0,0,0]=2 933 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 JZ4304 [1,1,0,0,0,0|0,0,0]=2 934 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 LQ2733 [1,1,0,0,0,0|1,0,0]=3 935 B10R1.113 O=C(O)C1=CC=CC(F)=N1 LQ0787 [1,1,0,0,0,0|1,0,0]=3 936 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 LT3524 [1,1,0,0,0,0|1,0,0]=3 937 B10R1.113 O=C(O)C1=CN=CC(O)=C1 JZ0794 [1,1,0,0,0,0|1,0,0]=3 938 B10R1.113 O=C(O)C1=C[N+]([O-])=CC=N1 RT9260 [1,1,0,0,0,0|2,0,0]=4 939 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 JZ0754 [1,1,0,0,0,0|1,0,0]=3 940 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 YH48486 [1,1,0,0,0,0|2,0,0]=4 941 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 YH35927 [1,1,0,0,0,0|2,0,0]=4 942 B10R1.113 O=C(O)C1=NC(O)=CC=C1 JZ0755 [1,1,0,0,0,0|1,0,0]=3 943 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 LX2083 [1,1,0,0,0,0|1,0,0]=3 944 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 LQ2927 [1,1,0,0,0,0|1,0,0]=3 945 B10R1.113 O=C(O)C1=NC=NC(Cl)=C1 YH57583 [1,1,0,0,0,0|2,0,0]=4 946 B10R1.113 O=C(O)C1=NC=NC(O)=C1 SY0110 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.113 O=[N+]([O-])C1=CC(Cl)=CC=C1 LL0512 [1,1,0,0,0,0|1,0,1]=4 948 B10R1.113 O=[N+]([O-])C1=CC(I)=CC=C1 JZ4098 [1,1,0,0,0,0|1,0,1]=4 949 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 LT1873 [1,1,0,0,0,0|1,0,1]=4 950 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 LQ0982 [1,1,0,0,0,0|1,0,1]=4 951 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 SY0269 [1,1,0,0,0,0|1,0,1]=4 952 B10R1.113 OB(O)C1=CC(F)=CC=C1 LT2898 [1,1,0,0,0,0|1,0,1]=4 953 B10R1.14 COC(=O)C1=CC(O)=NO1 JZ3359 [0,1,0,0,1,0|2,0,0]=4 954 B10R1.14 COC(=O)C1=CC=C(N)S1 YH35219 [0,1,0,0,1,0|2,0,0]=4 955 B10R1.31 COC1=CN=C(C(=O)O)O1 RT15406 [0,1,0,0,1,0|2,0,0]=4 956 B10R1.31 COC1=CSC(C(=O)Cl)=C1 LX3261 [0,1,0,0,1,0|2,0,0]=4 957 B10R1.31 O=CC1=CC=C(C(=O)O)S1 LX2585 [0,1,0,0,1,0|1,0,1]=4 958 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 LT0623 [0,1,0,0,1,0|2,0,0]=4 959 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 LQ3077 [0,1,0,0,1,0|2,0,0]=4 960 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 LT0658 [0,1,0,0,1,0|2,0,0]=4 961 B10R1.59 CC1=CC(C)=C(C(=O)O)N1 HL2755 [0,1,0,0,1,0|2,0,0]=4 962 B10R1.59 O=C(O)C1=C(Cl)SC(Cl)=C1 LQ4910 [0,1,0,0,1,0|2,0,0]=4 963 B12R1.4 C=CC1=CC=C(OC(C)=O)C=C1 JZ2093 [0,1,0,0,0,1|2,0,0]=4 964 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 LT3061 [0,1,0,0,0,1|1,0,1]=4 965 B12R1.4 CC(=O)OC1=CC=C(CBr)C=C1 CJ3037 [0,1,0,0,0,1|2,0,0]=4 966 B12R1.4 CCC1=CC=C(CC(=O)O)C=C1 LT2917 [0,1,0,0,0,1|1,0,0]=3 967 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 LL0352 [0,1,0,0,0,1|0,0,0]=2 968 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 LT2838 [0,1,0,0,0,1|1,0,0]=3 969 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 RT11360 [0,1,0,0,0,1|1,0,0]=3 970 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 XJ4261 [0,1,0,0,0,1|0,1,0]=3 971 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 LQ2904 [0,1,0,0,0,1|1,0,0]=3 972 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 YH27802 [0,1,0,0,0,1|1,0,0]=3 973 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 XJ3973 [0,1,0,0,0,1|1,0,0]=3 974 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 HL4494 [0,1,0,0,0,1|0,0,0]=2 975 B12R1.19 CC(=O)CC1=CC=C(O)C(O)=C1 RT16870 [0,1,0,0,0,1|1,0,0]=3 976 B12R1.19 NC1=CC(CC(=O)O)=CC=C1O RT0058 [0,1,0,0,0,1|0,0,0]=2 977 B12R1.19 O=C(Cl)CC1=CC=C(Cl)C(Cl)=C1 XJ2380 [0,1,0,0,0,1|2,0,0]=4 978 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 YH14884 [0,1,0,0,0,1|1,0,0]=3 979 B12R1.19 O=C(O)CC1=CC(F)=C(F)C=C1 XJ1277 [0,1,0,0,0,1|1,0,0]=3 980 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 HL1829 [0,1,0,0,0,1|0,0,0]=2 981 B12R1.19 O=C(O)CC1=CC=C(Cl)C(Cl)=C1 YH08292 [0,1,0,0,0,1|1,0,0]=3 982 B12R1.19 O=C(O)CC1=CC=C(O)C(Cl)=C1 LQ4793 [0,1,0,0,0,1|0,0,0]=2 983 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 LQ3474 [0,1,0,0,0,1|2,0,0]=4 984 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 LQ0515 [0,1,0,0,0,1|2,0,0]=4 985 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 JZ4316 [0,1,0,0,0,1|1,0,0]=3 986 B12R1.20 CC(C(=O)O)C1=CC=C(O)C=C1 JZ4317 [0,1,0,0,0,1|0,0,0]=2 987 B12R1.20 CC1=CC=C(C(N)C(=O)O)C=C1 LX2120 [0,1,0,0,0,1|1,0,0]=3 988 B12R1.20 CC1=CC=C(C(O)C(=O)O)C=C1 LQ4697 [0,1,0,0,0,1|1,0,0]=3 989 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 LQ3229 [0,1,0,0,0,1|1,0,0]=3 990 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 JZ0195 [0,1,0,0,0,1|0,0,0]=2 991 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Cl)C=C1 YH13184 [0,1,0,0,0,1|1,0,0]=3 992 B12R1.20 N[C@H](C(=O)O)C1=CC=C(F)C=C1 RT5099 [0,1,0,0,0,1|1,0,0]=3 993 B12R1.20 N[C@H](C(=O)O)C1=CC=C(O)C=C1 YH15246 [0,1,0,0,0,1|0,0,0]=2 994 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 YH66539 [0,1,0,0,0,1|1,0,0]=3 995 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 JZ3059 [0,1,0,0,0,1|1,0,0]=3 996 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 LL0881 [0,1,0,0,0,1|1,0,0]=3 997 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 HL1770 [0,1,0,0,0,1|1,0,0]=3 998 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 JZ4498 [0,1,0,0,0,1|0,0,0]=2 999 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 RT11186 [0,1,0,0,0,1|0,0,0]=2 1000 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 YH54312 [0,1,0,0,0,1|1,0,0]=3 1001 B12R1.20 [C@@H](N)(C(=O)O)C1=CC=C(O)C=C1 YH54440 [0,1,0,0,0,1|0,0,0]=2 1002 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 RT15818 [0,1,0,0,0,1|1,0,0]=3 1003 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 XJ5486 [0,1,0,0,0,1|1,0,0]=3 1004 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 YH05226 [0,1,0,0,0,1|1,0,0]=3 1005 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 JZ4903 [0,1,0,0,0,1|0,0,0]=2 1006 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 YH55824 [0,1,0,0,0,1|2,0,0]=4 1007 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 LT7646 [0,1,0,0,0,1|1,0,1]=4 1008 B12R1.233 CC(=O)NC1=CC=C(Br)C=C1C XJ4799 [0,1,0,0,0,1|2,0,0]=4 1009 B12R1.233 CC(=O)NC1=CC=C(C)C=C1Br HL0195 [0,1,0,0,0,1|2,0,0]=4 1010 B12R1.233 CC(=O)OC1=CC=C(Br)C=C1Br RT11919 [0,1,0,0,0,1|2,0,0]=4 1011 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 YH00198 [0,1,0,0,0,1|1,0,0]=3 1012 B12R1.233 NC1=CC=C(CC(=O)O)C(F)=C1 LX3277 [0,1,0,0,0,1|1,0,0]=3 1013 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 YH05432 [0,1,0,0,0,1|1,0,0]=3 1014 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 YH09917 [0,1,0,0,0,1|1,0,0]=3 1015 B12R1.233 O=C(O)CC1=C(F)C=C(Br)C=C1 CJ2121 [0,1,0,0,0,1|1,0,0]=3 1016 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=C1 LL2528 [0,1,0,0,0,1|1,0,0]=3 1017 B12R1.233 O=C(O)CC1=C(F)C=C(O)C=C1 YH65418 [0,1,0,0,0,1|0,0,0]=2 1018 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1Cl YH43718 [0,1,0,0,0,1|1,0,0]=3 1019 B12R1.233 O=C(O)CC1=CC=C(F)C=C1F LT0123 [0,1,0,0,0,1|1,0,0]=3 1020 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 LL0515 [0,2,0,0,0,0|1,0,0]=3 1021 B12R1.5 COC(=O)C1=CC=C(C#N)C=C1 HL0707 [0,2,0,0,0,0|1,0,0]=3 1022 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 JZ4668 [0,2,0,0,0,0|0,0,1]=3 1023 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 LQ1892 [0,2,0,0,0,0|0,0,1]=3 1024 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 LT5149 [0,2,0,0,0,0|1,0,0]=3 1025 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 LT5150 [0,2,0,0,0,0|1,0,0]=3 1026 B12R1.5 COC(=O)C1=CC=C(CO)C=C1 JZ3023 [0,2,0,0,0,0|0,0,0]=2 1027 B12R1.5 COC(=O)C1=CC=C(OC)N=C1 JZ0753 [0,2,0,0,0,0|1,0,0]=3 1028 B12R1.5 COC(=O)C1=CN=C(C=O)C=C1 YH21073 [0,2,0,0,0,0|1,0,1]=4 1029 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 LQ5359 [0,2,0,0,0,0|1,0,0]=3 1030 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 LT3323 [0,2,0,0,0,0|1,0,0]=3 1031 B12R1.5 COC1=CC=C(C(=O)CN)C=C1 LQ5042 [0,2,0,0,0,0|1,0,0]=3 1032 B12R1.5 COC1=CC=C(C(=O)NN)C=C1 XJ2446 [0,2,0,0,0,0|1,0,0]=3 1033 B12R1.5 N#CC(=O)C1=CC=C(C#N)C=C1 YH65885 [0,2,0,0,0,0|2,0,0]=4 1034 B12R1.5 N#CC1=CC=C(C(=O)CBr)C=C1 LQ4188 [0,2,0,0,0,0|2,0,0]=4 1035 B12R1.6 N#[N+]C1=CC=C(S(=O)(=O)O)C=C1 RT11895 [0,2,0,0,0,0|2,0,0]=4 1036 B12R1.6 NNC1=CC=C(S(=O)(=O)O)C=C1 XJ0253 [0,2,0,0,0,0|2,0,0]=4 1037 B12R1.48 CC(=O)C1=CC=C(C#N)C(Br)=C1 LX2918 [0,2,0,0,0,0|2,0,0]=4 1038 B12R1.48 CCC1=C(N)C=C(C(=O)O)C=C1 YH04521 [0,2,0,0,0,0|1,0,0]=3 1039 B12R1.48 CCC1=C(O)C=C(C(=O)O)C=C1 YH20502 [0,2,0,0,0,0|1,0,0]=3 1040 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=C1 HL1289 [0,2,0,0,0,0|0,0,0]=2 1041 B12R1.48 COC1=C(F)C=C(B(O)O)C=C1 LL2281 [0,2,0,0,0,0|1,0,1]=4 1042 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 LQ0792 [0,2,0,0,0,0|0,0,0]=2 1043 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 LT2590 [0,2,0,0,0,0|1,0,0]=3 1044 B12R1.48 COC1=C(F)C=C([N+](=O)[O-])C=C1 HL1814 [0,2,0,0,0,0|1,0,1]=4 1045 B12R1.48 COC1=C(I)C=C(C(=O)O)C=C1 XJ6188 [0,2,0,0,0,0|0,0,0]=2 1046 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 HL1290 [0,2,0,0,0,0|1,0,1]=4 1047 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 LT2602 [0,2,0,0,0,0|0,0,0]=2 1048 B12R1.48 COC1=CC=C(C(=O)Cl)C=C1Cl RT12029 [0,2,0,0,0,0|1,0,0]=3 1049 B12R1.48 COC1=CC=C(C(=O)O)C=C1N LQ2287 [0,2,0,0,0,0|0,0,0]=2 1050 B12R1.48 COC1=CC=C(C(N)=O)C=C1N LQ3989 [0,2,0,0,0,0|1,0,0]=3 1051 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1Br LQ2838 [0,2,0,0,0,0|1,0,1]=4 1052 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1[NH3+] LT1771 [0,2,0,0,0,0|1,0,1]=4 1053 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1[O-] LT3960 [0,2,0,0,0,0|1,0,1]=4 1054 B12R1.48 N#CC1=C(F)C=C(C(=O)O)C=C1 LL2479 [0,2,0,0,0,0|1,0,0]=3 1055 B12R1.48 O=[N+]([O-])C1=CC(O)=C(CO)C=C1 YH07881 [0,2,0,0,0,0|1,0,1]=4 1056 B12R1.113 CC(=O)C1=CC=C(N=[N+]=[N-])C=C1 RT6139 [0,2,0,0,0,0|2,0,0]=4 1057 B12R1.113 CCCC1=CC=C(C(=O)O)C=C1 XJ2170 [0,2,0,0,0,0|1,0,0]=3 1058 B12R1.113 CCCC1=CC=C(C(C)=O)C=C1 JZ2162 [0,2,0,0,0,0|2,0,0]=4 1059 B12R1.113 CCCC1=CC=C(C(C)=O)C=C1 LT3141 [0,2,0,0,0,0|2,0,0]=4 1060 B12R1.113 CCOC1=CC=C(B(O)O)C=C1 LT2809 [0,2,0,0,0,0|1,0,1]=4 1061 B12R1.113 CCOC1=CC=C(C(=O)Cl)C=C1 LT3071 [0,2,0,0,0,0|1,0,0]=3 1062 B12R1.113 CCOC1=CC=C(C(=O)O)C=C1 JZ3946 [0,2,0,0,0,0|0,0,0]=2 1063 B12R1.113 CCOC1=CC=C(C(N)=O)C=C1 JZ5755 [0,2,0,0,0,0|1,0,0]=3 1064 B12R1.113 O=C(O)C1=CC=C(CCO)C=C1 YH65109 [0,2,0,0,0,0|0,0,0]=2 1065 B12R1.113 O=CNC1=CC=C(C(=O)O)C=C1 RT1570 [0,2,0,0,0,0|0,0,1]=3 1066 B12R1.113 O=N(=O)C1=CC=C(CCO)C=C1 LT3788 [0,2,0,0,0,0|1,0,1]=4 1067 B12R1.113 O=[N+]([O-])C1=CC=C(\C=N\O)C=C1 HL0708 [0,2,0,0,0,0|1,0,1]=4 1068 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 XJ1047 [0,2,0,0,0,0|0,0,1]=3 1069 B12R1.256 CC(=O)C1=CC=C(C(C)C)C=C1 JZ1131 [0,2,0,0,0,0|2,0,0]=4 1070 B12R1.256 CC(Br)C1=CC=C(C(=O)O)C=C1 XJ6874 [0,2,0,0,0,0|1,0,0]=3 1071 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 LL0971 [0,2,0,0,0,0|1,0,0]=3 1072 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=N1 YH47400 [0,2,0,0,0,0|2,0,0]=4 1073 B12R1.256 C[C@H](O)C1=CC=C([N+](=O)[O-])C=C1 HL4961 [0,2,0,0,0,0|1,0,1]=4 1074 B12R1.256 N=C([NH3+])C1=CC=C(C(=O)O)C=C1 YH01256 [0,2,0,0,0,0|1,0,0]=3 1075 B12R1.256 NC(=O)C1=CC=C([N+](=O)[O-])C=C1 LT3086 [0,2,0,0,0,0|1,0,1]=4 1076 B12R1.256 O=C(Cl)C1=CC=C([N+](=O)[O-])C=C1 RT11851 [0,2,0,0,0,0|1,0,1]=4 1077 B12R1.256 O=C(O)C1=CC=C(B(O)O)C=C1 CJ2236 [0,2,0,0,0,0|0,0,0]=2 1078 B12R1.256 O=C(O)C1=CC=C(C(=O)O)N=N1 XJ5805 [0,2,0,0,0,0|2,0,0]=4 1079 B12R1.256 O=C(O)C1=CC=C([N+](=O)[O-])C=C1 LT3088 [0,2,0,0,0,0|0,0,1]=3 1080 B12R1.256 O=C(O)C1=CN=C(C(=O)O)C=N1 XJ0451 [0,2,0,0,0,0|2,0,0]=4 1081 B12R1.256 O=C(O)C1=NC=C([N+](=O)[O-])C=C1 JZ1186 [0,2,0,0,0,0|1,0,1]=4 1082 B12R1.256 O=C([O-])C1=CC=C(C(=O)[O-])C=C1 LQ3372 [0,2,0,0,0,0|0,0,2]=4 1083 B12R1.256 O=C([O-])C1=CC=C([N+](=O)[O-])C=C1 XJ4488 [0,2,0,0,0,0|0,0,2]=4 1084 B12R1.452 COC1=CC(C)=C(B(O)O)C=C1 HL3869 [0,2,0,0,0,0|1,0,1]=4 1085 B12R1.452 COC1=CC(F)=C(B(O)O)C=C1 LL2350 [0,2,0,0,0,0|1,0,1]=4 1086 B12R1.452 COC1=CC(F)=C(C(=O)Cl)C=C1 HL1762 [0,2,0,0,0,0|1,0,0]=3 1087 B12R1.452 COC1=CC(F)=C(C(=O)O)C=C1 XJ0664 [0,2,0,0,0,0|0,0,0]=2 1088 B12R1.452 COC1=CC(N)=C(C(=O)O)C=C1 LQ2654 [0,2,0,0,0,0|0,0,0]=2 1089 B12R1.452 COC1=CC(O)=C(C(N)=O)C=C1 LQ3157 [0,2,0,0,0,0|1,0,0]=3 1090 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=C1 JZ5478 [0,2,0,0,0,0|0,0,0]=2 1091 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 LT2144 [0,2,0,0,0,0|1,0,0]=3 1092 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 LQ4642 [0,2,0,0,0,0|2,0,0]=4 1093 B12R1.9 NC1=CC=C(S(=O)(=O)O[Na])C=C1 HL1939 [0,2,0,0,0,0|2,0,0]=4 1094 B12R1.23 CS(=O)(=O)C1=CC=C(O)C(N)=C1 LT3182 [0,2,0,0,0,0|1,0,1]=4 1095 B12R1.23 NC1=C(O)C=CC(S(N)(=O)=O)=C1 LT1656 [0,2,0,0,0,0|1,0,1]=4 1096 B12R1.23 O=S(=O)([O-])C1=CC=C(O)C(I)=C1 RT13122 [0,2,0,0,0,0|1,0,1]=4 1097 B12R1.56 C(=O)C1=C(O)C=CC([N+](=O)[O-])=C1 LL0276 [0,2,0,0,0,0|1,0,1]=4 1098 B12R1.56 CC(=O)C1=CC(CCl)=C(O)C=C1 RT11901 [0,2,0,0,0,0|1,0,0]=3 1099 B12R1.56 CC(=O)C1=CC=C(Br)C(C#N)=C1 YH30308 [0,2,0,0,0,0|2,0,0]=4 1100 B12R1.56 CCC1=CC(C(=O)O)=CC=C1N YH04730 [0,2,0,0,0,0|1,0,0]=3 1101 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=C1 HL4789 [0,2,0,0,0,0|1,0,0]=3 1102 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 LL1051 [0,2,0,0,0,0|2,0,0]=4 1103 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 HL2265 [0,2,0,0,0,0|1,0,0]=3 1104 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 RT12307 [0,2,0,0,0,0|0,0,0]=2 1105 B12R1.56 COC1=CC(C(=O)O)=CC=C1Br LQ5384 [0,2,0,0,0,0|1,0,0]=3 1106 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1O XJ2400 [0,2,0,0,0,0|1,0,1]=4 1107 B12R1.56 N#CC1=C(O)C=CC(C(=O)O)=C1 LX3093 [0,2,0,0,0,0|0,0,0]=2 1108 B12R1.56 O=CC1=CC(C(=O)O)=CC=C1O CJ2936 [0,2,0,0,0,0|0,0,0]=2 1109 B12R1.56 O=[N+]([O-])C1=CC=C(O)C(CBr)=C1 HL0425 [0,2,0,0,0,0|1,0,1]=4 1110 B12R1.56 O=[N+]([O-])C1=CC=C(O)C(CCl)=C1 XJ2304 [0,2,0,0,0,0|1,0,1]=4 1111 B12R1.232 CC(=O)C1=C(N)C=C(Br)C(F)=C1 YH96748 [0,2,0,0,0,0|2,0,0]=4 1112 B12R1.232 CC(=O)C1=CC(Br)=C(C)C=C1N YH66329 [0,2,0,0,0,0|2,0,0]=4 1113 B12R1.232 CC(=O)C1=CC(Br)=C(Cl)C=C1N YH96749 [0,2,0,0,0,0|2,0,0]=4 1114 B12R1.232 CC(=O)C1=CC(F)=C(Cl)C=C1Cl LT4059 [0,2,0,0,0,0|2,0,0]=4 1115 B12R1.232 CC(=O)C1=CC(F)=C(F)C=C1F LT6017 [0,2,0,0,0,0|2,0,0]=4 1116 B12R1.232 CC1=C(Br)C=C(F)C(C(=O)O)=C1 YH00645 [0,2,0,0,0,0|1,0,0]=3 1117 B12R1.232 CC1=C([N+](=O)[O-])C=C(O)C(O)=C1 RT16568 [0,2,0,0,0,0|1,0,1]=4 1118 B12R1.232 CC1=CC(C)=C(C(=O)O)C=C1C LQ0965 [0,2,0,0,0,0|1,0,0]=3 1119 B12R1.232 CC1=CC(F)=C(C(=O)O)C=C1F LL1805 [0,2,0,0,0,0|1,0,0]=3 1120 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1I LX2614 [0,2,0,0,0,0|1,0,0]=3 1121 B12R1.232 CC1=CC(O)=C(C)C=C1C(=O)O YH51059 [0,2,0,0,0,0|0,0,0]=2 1122 B12R1.232 NC1=CC(Cl)=C(Cl)C=C1C(=O)O CJ2835 [0,2,0,0,0,0|1,0,0]=3 1123 B12R1.232 NC1=CC([N+](=O)[O-])=C(O)C=C1O LT0005 [0,2,0,0,0,0|1,0,1]=4 1124 B12R1.232 O=C(Cl)C1=C(Cl)C=C(Cl)C(F)=C1 LL1561 [0,2,0,0,0,0|2,0,0]=4 1125 B12R1.232 O=C(Cl)C1=C(F)C=C(F)C(F)=C1 XJ6574 [0,2,0,0,0,0|2,0,0]=4 1126 B12R1.232 O=C(O)C1=C(Cl)C=C(Br)C(F)=C1 YH65718 [0,2,0,0,0,0|1,0,0]=3 1127 B12R1.232 O=C(O)C1=C(Cl)C=C(Cl)C(F)=C1 LL1574 [0,2,0,0,0,0|1,0,0]=3 1128 B12R1.232 O=C(O)C1=C(Cl)N=C(Cl)C(F)=C1 YH88295 [0,2,0,0,0,0|2,0,0]=4 1129 B12R1.232 O=C(O)C1=C(F)C=C(Cl)C(Cl)=C1 YH52156 [0,2,0,0,0,0|1,0,0]=3 1130 B12R1.232 O=C(O)C1=C(F)C=C(F)C(Br)=C1 RT11909 [0,2,0,0,0,0|1,0,0]=3 1131 B12R1.232 O=C(O)C1=C(F)C=C(F)C(F)=C1 LT0099 [0,2,0,0,0,0|1,0,0]=3 1132 B12R1.232 O=C(O)C1=CC(Br)=C(O)C=C1O LQ3281 [0,2,0,0,0,0|0,0,0]=2 1133 B12R1.232 O=C(O)C1=CC(Cl)=C(F)C=C1F LX2200 [0,2,0,0,0,0|1,0,0]=3 1134 B12R1.232 O=C(O)C1=CC(F)=C(Cl)C=C1F LL2106 [0,2,0,0,0,0|1,0,0]=3 1135 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1Cl LL1886 [0,2,0,0,0,0|1,0,0]=3 1136 B12R1.367 COC(=O)C1=CC(Br)=C(Cl)N=C1 LL1424 [0,2,0,0,0,0|2,0,0]=4 1137 B12R1.367 COC(=O)C1=CC(Br)=C(N)N=C1 JZ1657 [0,2,0,0,0,0|2,0,0]=4 1138 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=C1 LL2255 [0,2,0,0,0,0|1,0,0]=3 1139 B12R1.367 COC(=O)C1=CC(C)=C(Cl)C=C1 LL1641 [0,2,0,0,0,0|1,0,0]=3 1140 B12R1.367 COC(=O)C1=CC(Cl)=C(N)C=C1 XJ6490 [0,2,0,0,0,0|1,0,0]=3 1141 B12R1.367 COC(=O)C1=CC(I)=C(C)C=C1 HL4891 [0,2,0,0,0,0|1,0,0]=3 1142 B12R1.367 COC(=O)C1=CC(I)=C(Cl)C=C1 YH57244 [0,2,0,0,0,0|1,0,0]=3 1143 B12R1.367 COC(=O)C1=CC(I)=C(O)C=C1 XJ4161 [0,2,0,0,0,0|0,0,0]=2 1144 B12R1.367 COC(=O)C1=CC(N)=C(C)C=C1 RT3244 [0,2,0,0,0,0|1,0,0]=3 1145 B12R1.367 COC(=O)C1=CC(O)=C(C)C=C1 YH56650 [0,2,0,0,0,0|1,0,0]=3 1146 B12R1.367 COC(=O)C1=CC(O)=C(F)C=C1 LL2617 [0,2,0,0,0,0|1,0,0]=3 1147 B12R1.367 COC(=O)C1=CC(O)=C(N)C=C1 YH11298 [0,2,0,0,0,0|1,0,0]=3 1148 B12R1.367 COC(=O)C1=CC=C(Br)C(O)=C1 RT10880 [0,2,0,0,0,0|1,0,0]=3 1149 B12R1.367 COC(=O)C1=CC=C(C)C(Br)=C1 XJ6779 [0,2,0,0,0,0|1,0,0]=3 1150 B12R1.367 COC(=O)C1=CC=C(C)C(N)=C1 YH65012 [0,2,0,0,0,0|1,0,0]=3 1151 B12R1.367 COC(=O)C1=CC=C(Cl)C(N)=C1 LT3014 [0,2,0,0,0,0|1,0,0]=3 1152 B12R1.367 COC(=O)C1=CC=C(I)C(Br)=C1 YH65503 [0,2,0,0,0,0|1,0,0]=3 1153 B12R1.367 COC(=O)C1=CC=C(N)C(C)=C1 LT3146 [0,2,0,0,0,0|1,0,0]=3 1154 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 YH00863 [0,2,0,0,0,0|0,0,0]=2 1155 B12R1.367 COC(=O)C1=CC=C(O)C(N)=C1 RT2941 [0,2,0,0,0,0|0,0,0]=2 1156 B12R1.367 COC(=O)C1=CN(C)C(=O)C=C1 LT5876 [0,2,0,0,0,0|1,0,1]=4 1157 B12R1.367 NCC(O)C1=CC(O)=C(O)C=C1 LT7649 [0,2,0,0,0,0|1,0,1]=4 1158 B12R1.367 NCC(O)C1=CC(O)=C(O)C=C1 YH04566 [0,2,0,0,0,0|1,0,1]=4 1159 B12R1.367 NCC(O)C1=CC=C(O)C(O)=C1 HL3185 [0,2,0,0,0,0|1,0,1]=4 1160 B12R1.367 NCC(O)C1=CC=C(O)C(O)=C1 YH55551 [0,2,0,0,0,0|1,0,1]=4 1161 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 LX2603 [0,2,0,0,0,0|1,0,1]=4 1162 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 LX2787 [0,2,0,0,0,0|1,0,1]=4 1163 B12R1.367 NNC(=O)C1=CC=C(O)C(N)=C1 XJ3311 [0,2,0,0,0,0|1,0,0]=3 1164 B12R1.367 O=C(CBr)C1=CC(Cl)=C(Cl)C=C1 LT1996 [0,2,0,0,0,0|2,0,0]=4 1165 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 XJ0281 [0,2,0,0,0,0|1,0,0]=3 1166 B12R1.893 CC1=CC=C(C(N)=O)C(F)=C1F LL2716 [0,2,0,0,0,0|2,0,0]=4 1167 B12R1.893 NC1=C(F)C(F)=C(C(=O)O)C=C1 LL2533 [0,2,0,0,0,0|1,0,0]=3 1168 B12R1.893 O=C(Cl)C1=C(F)C(F)=C(F)C=C1 HL3600 [0,2,0,0,0,0|2,0,0]=4 1169 B12R1.893 O=C(O)C1=C(F)C(F)=C(Br)C=C1 YH43479 [0,2,0,0,0,0|1,0,0]=3 1170 B12R1.893 O=C(O)C1=C(F)C(F)=C(I)C=C1 YH03758 [0,2,0,0,0,0|1,0,0]=3 1171 B12R1.893 O=C(O)C1=CC=C(F)C(Cl)=C1F LT6749 [0,2,0,0,0,0|1,0,0]=3 1172 B12R1.893 O=C(O)C1=CN=C(F)C(F)=C1Cl YH89725 [0,2,0,0,0,0|2,0,0]=4 1173 B12R1.1005 CC1=C(Br)C=C(C(=O)O)C=C1Br LL1199 [0,2,0,0,0,0|1,0,0]=3 1174 B12R1.1005 CC1=C(F)C=C(C(=O)O)C=C1N CJ2120 [0,2,0,0,0,0|1,0,0]=3 1175 B12R1.1005 CC1=C(O)C=C(C(=O)O)C=C1O LT6673 [0,2,0,0,0,0|1,0,0]=3 1176 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1Br YH90620 [0,2,0,0,0,0|2,0,0]=4 1177 B12R1.1005 NC(=O)C1=CC(I)=C(O)C(I)=C1 RT0870 [0,2,0,0,0,0|1,0,0]=3 1178 B12R1.1005 NC(=O)C1=CC(O)=C(O)C(O)=C1 LQ1224 [0,2,0,0,0,0|1,0,0]=3 1179 B12R1.1005 NC1=C(I)C=C(C(=O)O)C=C1I LQ2067 [0,2,0,0,0,0|1,0,0]=3 1180 B12R1.1005 O=C(O)C1=CC(Cl)=C(F)C(Cl)=C1 YH98672 [0,2,0,0,0,0|1,0,0]=3 1181 B12R1.1005 O=C(O)C1=CC(Cl)=C(O)C(Cl)=C1 XJ2480 [0,2,0,0,0,0|0,0,0]=2 1182 B12R1.1005 O=C(O)C1=CC(I)=C(O)C(I)=C1 LQ1225 [0,2,0,0,0,0|0,0,0]=2 1183 B12R1.1005 O=C(O)C1=CC(O)=C(F)C(F)=C1 YH65577 [0,2,0,0,0,0|1,0,0]=3 1184 B12R1.1005 O=C(O)C1=CC(O)=C(O)C(O)=C1 JZ0366 [0,2,0,0,0,0|0,0,0]=2 1185 B12R1.1005 O=N(=O)C1=CC(F)=C(O)C(F)=C1 YH12415 [0,2,0,0,0,0|1,0,1]=4 1186 B12R1.1005 O=[N+]([O-])C1=CC(Br)=C(O)C(Br)=C1 XJ0276 [0,2,0,0,0,0|1,0,1]=4 1187 B12R1.1005 O=[N+]([O-])C1=CC(I)=C(O)C(I)=C1 XJ0607 [0,2,0,0,0,0|1,0,1]=4 1188 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 RT11080 [0,2,0,0,0,0|2,0,0]=4 1189 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 XJ0996 [0,2,0,0,0,0|2,0,0]=4 1190 B12R1.16 CCOC(=N)C1=CC=C(Cl)C=C1 RT12541 [0,2,0,0,0,0|2,0,0]=4 1191 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 HL3014 [0,2,0,0,0,0|1,0,0]=3 1192 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 LQ3269 [0,2,0,0,0,0|1,0,0]=3 1193 B12R1.16 CCOC(=O)C1=CC=C(Cl)N=C1 LT5203 [0,2,0,0,0,0|2,0,0]=4 1194 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 CJ2917 [0,2,0,0,0,0|1,0,0]=3 1195 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 SY0289 [0,2,0,0,0,0|1,0,0]=3 1196 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 YH48180 [0,2,0,0,0,0|1,0,0]=3 1197 B12R1.16 CCOC(=O)C1=CC=C(N)N=C1 YH65801 [0,2,0,0,0,0|2,0,0]=4 1198 B12R1.16 CCOC(=O)C1=CN=C(O)C=C1 LX3039 [0,2,0,0,0,0|1,0,0]=3 1199 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 JZ3824 [0,2,0,0,0,0|1,0,1]=4 1200 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 LT4056 [0,2,0,0,0,0|1,0,1]=4 1201 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 RT4716 [0,2,0,0,0,0|1,0,1]=4 1202 B12R1.16 N#CCC(=O)C1=CC=C(Cl)C=C1 LQ2708 [0,2,0,0,0,0|2,0,0]=4 1203 B12R1.16 N#CCC(=O)C1=CC=C(F)C=C1 JZ0578 [0,2,0,0,0,0|2,0,0]=4 1204 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 LT4187 [0,2,0,0,0,0|2,0,0]=4 1205 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 LQ0709 [0,2,0,0,0,0|2,0,0]=4 1206 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 RT10798 [0,2,0,0,0,0|1,0,0]=3 1207 B12R1.1703 C=C(CO)C1=CC=C(F)C=C1F RT12351 [0,2,0,0,0,0|2,0,0]=4 1208 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 HL3011 [0,2,0,0,0,0|1,0,0]=3 1209 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=C1 YH91859 [0,2,0,0,0,0|1,0,0]=3 1210 B12R1.1703 COC(=O)C1=C(C)C=C(Cl)C=C1 XJ2408 [0,2,0,0,0,0|1,0,0]=3 1211 B12R1.1703 COC(=O)C1=C(C)N=C(C)C=C1 RT9229 [0,2,0,0,0,0|2,0,0]=4 1212 B12R1.1703 COC(=O)C1=C(Cl)C=C(Cl)N=C1 YH12488 [0,2,0,0,0,0|2,0,0]=4 1213 B12R1.1703 COC(=O)C1=C(F)C=C(F)C=C1 CJ2192 [0,2,0,0,0,0|1,0,0]=3 1214 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 LQ2726 [0,2,0,0,0,0|1,0,0]=3 1215 B12R1.1703 COC(=O)C1=C(O)C=C(F)C=C1 HL1734 [0,2,0,0,0,0|1,0,0]=3 1216 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 LQ2098 [0,2,0,0,0,0|0,0,0]=2 1217 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1Br RT11090 [0,2,0,0,0,0|1,0,0]=3 1218 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1I CJ3332 [0,2,0,0,0,0|1,0,0]=3 1219 B12R1.1703 COC(=O)C1=CC=C(Br)C=C1N YH32748 [0,2,0,0,0,0|1,0,0]=3 1220 B12R1.1703 COC(=O)C1=CC=C(N)C=C1C YH14295 [0,2,0,0,0,0|1,0,0]=3 1221 B12R1.1703 COC(=O)C1=CC=C(N)C=C1Cl YH02304 [0,2,0,0,0,0|1,0,0]=3 1222 B12R1.1703 COC(=O)C1=CC=C(N)C=C1O LT5969 [0,2,0,0,0,0|1,0,0]=3 1223 B12R1.1703 N#CC(=O)C1=CC=C(Cl)C=C1Cl RT6233 [0,2,0,0,0,0|2,0,0]=4 1224 B12R1.1703 NC1=CC(Cl)=CC=C1C(=O)CCl RT1619 [0,2,0,0,0,0|2,0,0]=4 1225 B12R1.1703 NC1=CC(O)=C(C(=O)O[Na])C=C1 CJ2106 [0,2,0,0,0,0|1,0,0]=3 1226 B12R1.1703 NCC(=O)C1=C(Cl)C=C(Cl)C=C1 YH53846 [0,2,0,0,0,0|2,0,0]=4 1227 B12R1.1703 NNC(=O)C1=C(O)C=C(O)C=C1 JZ3686 [0,2,0,0,0,0|1,0,0]=3 1228 B12R1.1703 NNC(=O)C1=CC=C(Cl)C=C1Cl HL3029 [0,2,0,0,0,0|2,0,0]=4 1229 B12R1.1703 O=C(CBr)C1=C(O)C=C(O)C=C1 YH49339 [0,2,0,0,0,0|1,0,0]=3 1230 B12R1.1703 O=C(CBr)C1=CC=C(Cl)C=C1Cl JZ2098 [0,2,0,0,0,0|2,0,0]=4 1231 B12R1.1703 O=C(CBr)C1=CC=C(F)C=C1F HL3116 [0,2,0,0,0,0|2,0,0]=4 1232 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=C1 XJ5832 [0,2,0,0,0,0|1,0,0]=3 1233 B12R1.57 COC1=C(C(=O)O)C=CC(F)=C1 HL1776 [0,2,0,0,0,0|1,0,0]=3 1234 B12R1.57 COC1=C(C(=O)O)C=CC(O)=C1 YH94301 [0,2,0,0,0,0|0,0,0]=2 1235 B12R1.57 N#CC1=CC(O)=CC=C1[N+](=O)[O-] YH32899 [0,2,0,0,0,0|1,0,1]=4 1236 B12R1.1000 CC(=O)C1=C(C)C=C(O)C=C1O RT12806 [0,2,0,0,0,0|1,0,0]=3 1237 B12R1.1000 CC(=O)C1=C(O)C=C(C)C=C1O RT11067 [0,2,0,0,0,0|2,0,0]=4 1238 B12R1.1000 CC1=C(C(=O)O)C(O)=CC(O)=C1 LQ0892 [0,2,0,0,0,0|0,0,0]=2 1239 B12R1.1000 CC1=CC(C)=C(C(=O)Cl)C(C)=C1 JZ0980 [0,2,0,0,0,0|2,0,0]=4 1240 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(N)=N1 LT3915 [0,2,0,0,0,0|2,0,0]=4 1241 B12R1.1000 CC1=CC(F)=CC(C)=C1C(=O)O YH38742 [0,2,0,0,0,0|1,0,0]=3 1242 B12R1.1000 O=C(Cl)C1=C(Cl)C=C(Cl)C=C1Cl HL2652 [0,2,0,0,0,0|2,0,0]=4 1243 B12R1.1000 O=C(Cl)C1=C(F)C=C(F)C=C1F XJ6387 [0,2,0,0,0,0|2,0,0]=4 1244 B12R1.1000 O=C(O)C1=C(Br)C=C(Br)C=C1Br YH11221 [0,2,0,0,0,0|1,0,0]=3 1245 B12R1.1000 O=C(O)C1=C(Cl)C=C(Cl)C=C1Cl YH03973 [0,2,0,0,0,0|1,0,0]=3 1246 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1F YH41803 [0,2,0,0,0,0|1,0,0]=3 1247 B12R1.1000 O=C(O)C1=C(O)C=C(O)C=C1O HL1142 [0,2,0,0,0,0|0,0,0]=2 1248 B10R2.6 C1=CC=C(C2CO2)C=C1 XJ4585 [1,0,0,1,0,0|1,0,1]=4 1249 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 XJ4586 [1,0,0,1,0,0|1,0,1]=4 1250 B10R2.320 O=C1CC2=CC=CC=C12 YH55957 [1,0,0,1,0,0|1,0,0]=3 1251 B12R2.606 CC1=CC2=C(C=CC(O)=C2)N1 JZ3731 [0,0,0,1,0,1|2,0,0]=4 1252 B12R2.606 ClC1=CC=C2N=C(Cl)OC2=C1 YH57053 [0,0,0,1,0,1|2,0,0]=4 1253 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 LX2743 [0,0,0,1,0,1|2,0,0]=4 1254 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 XJ4617 [0,0,0,1,0,1|2,0,0]=4 1255 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 XJ6692 [0,0,0,1,0,1|2,0,0]=4 1256 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 LQ5396 [0,0,0,1,0,1|2,0,0]=4 1257 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 CJ2887 [0,0,0,1,0,1|2,0,0]=4 1258 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 JZ1167 [0,0,0,1,0,1|2,0,0]=4 1259 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 LT3275 [0,0,0,1,0,1|1,0,0]=3 1260 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 LT6085 [0,0,0,1,0,1|2,0,0]=4 1261 B12R2.606 O=C1CC2=CC(O)=CC=C2O1 RT7759 [0,0,0,1,0,1|1,0,0]=3 1262 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 LT3654 [0,0,0,1,0,1|2,0,0]=4 1263 B12R2.606 O=C1CC2=CC=C(O)C=C2N1 JZ3003 [0,0,0,1,0,1|1,0,0]=3 1264 B12R2.606 O=C1NC2=CC(Cl)=CC=C2S1 LT3533 [0,0,0,1,0,1|2,0,0]=4 1265 B12R2.606 O=C1NC2=CC=C(F)C=C2S1 YH11468 [0,0,0,1,0,1|1,1,0]=4 1266 B12R2.606 OC1=CC=C2NC(=S)NC2=C1 RT14982 [0,0,0,1,0,1|1,1,0]=4 1267 B12R2.606 OC1=NC2=CC=C(Cl)C=C2S1 YH10534 [0,0,0,1,0,1|1,1,0]=4 1268 B12R2.606 SC1=NC2=CC=C(Cl)C=C2O1 YH47896 [0,0,0,1,0,1|1,1,0]=4 1269 B12R2.1384 O=C(O)C1=CC=C2C=CC2=C1 LX2808 [0,1,0,1,0,0|1,0,0]=3 1270 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 HL2805 [0,1,0,1,0,0|2,0,0]=4 1271 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 LQ2490 [0,1,0,1,0,0|2,0,0]=4 1272 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 LQ2487 [0,1,0,1,0,0|1,0,0]=3 1273 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 XJ5153 [0,1,0,1,0,0|2,0,0]=4 1274 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 YH01019 [0,1,0,1,0,0|2,0,0]=4 1275 B12R2.612 O=C1CCC2=CC(F)=CC=C12 JZ4104 [0,1,0,1,0,0|2,0,0]=4 1276 B12R2.612 O=C1COC2=CC(Br)=CC=C12 YH44457 [0,1,0,1,0,0|1,0,0]=3 1277 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 XJ2407 [0,1,0,1,0,0|1,0,0]=3 1278 B12R2.612 O=C1NSC2=CC(F)=CC=C12 HL3634 [0,1,0,1,0,0|1,1,0]=4 1279 B8R0.23 C(C(=O)O)=C(/C)C(=O)O XJ0826 [0,0,1,0,1,0|1,0,1]=4 1280 B8R0.23 C=C(CC(=O)O)C(=O)O LT3976 [0,0,1,0,1,0|1,0,1]=4 1281 B8R0.23 C\C(=C/C(=O)O)C(=O)O XJ0827 [0,0,1,0,1,0|1,0,1]=4 1282 B8R1.1 CC1=CC=C(C=O)S1 JZ4813 [1,0,0,0,1,0|2,0,0]=4 1283 B8R1.1 CC1=CSC(C=O)=C1 YH65858 [1,0,0,0,1,0|2,0,0]=4 1284 B8R1.1 O=CC1=CC(Br)=CN1 RT4583 [1,0,0,0,1,0|2,0,0]=4 1285 B8R1.1 O=CC1=CC(Br)=CO1 JZ5461 [1,0,0,0,1,0|2,0,0]=4 1286 B8R1.1 O=CC1=CC(Br)=CS1 LQ4096 [1,0,0,0,1,0|2,0,0]=4 1287 B8R1.1 O=CC1=CC=C(Br)O1 RT15017 [1,0,0,0,1,0|2,0,0]=4 1288 B8R1.1 O=CC1=CC=C(I)O1 XJ2246 [1,0,0,0,1,0|2,0,0]=4 1289 B8R1.7 CC(=O)C1=CC=CS1 LT4058 [1,0,0,0,1,0|2,0,0]=4 1290 B8R1.7 CC(=O)C1=CNC=C1 JZ4350 [1,0,0,0,1,0|2,0,0]=4 1291 B8R1.7 CC(=O)C1=CSC=C1 LT2539 [1,0,0,0,1,0|2,0,0]=4 1292 B8R1.7 O=C(Cl)C1=CC=CO1 LQ0957 [1,0,0,0,1,0|2,0,0]=4 1293 B8R1.7 O=C(Cl)C1=CC=CS1 RT9297 [1,0,0,0,1,0|2,0,0]=4 1294 B8R1.7 O=C(Cl)C1=COC=C1 YH50424 [1,0,0,0,1,0|2,0,0]=4 1295 B8R1.7 O=C(Cl)C1=CSC=C1 YH00609 [1,0,0,0,1,0|2,0,0]=4 1296 B8R1.7 O=C(O)C1=CC=CN1 LQ1319 [1,0,0,0,1,0|1,0,0]=3 1297 B8R1.7 O=C(O)C1=CC=CO1 LQ4516 [1,0,0,0,1,0|1,0,0]=3 1298 B8R1.7 O=C(O)C1=CC=CO1 LT6552 [1,0,0,0,1,0|1,0,0]=3 1299 B8R1.7 O=C(O)C1=CC=NS1 YH21736 [1,0,0,0,1,0|2,0,0]=4 1300 B8R1.7 O=C(O)C1=CN=CN1 JZ4351 [1,0,0,0,1,0|2,0,0]=4 1301 B8R1.7 O=C(O)C1=CN=CS1 LQ3747 [1,0,0,0,1,0|2,0,0]=4 1302 B8R1.7 O=C(O)C1=CNN=C1 RT14194 [1,0,0,0,1,0|2,0,0]=4 1303 B8R1.7 O=C(O)C1=COC=N1 LQ4340 [1,0,0,0,1,0|2,0,0]=4 1304 B8R1.7 O=C(O)C1=CSC=C1 LT6654 [1,0,0,0,1,0|1,0,0]=3 1305 B8R1.7 O=C(O)C1=NC=CS1 JZ4900 [1,0,0,0,1,0|2,0,0]=4 1306 B8R1.7 O=C(O)C1=NNC=C1 XJ1870 [1,0,0,0,1,0|2,0,0]=4 1307 B8R1.7 O=C(O)C1=NOC=C1 JZ2260 [1,0,0,0,1,0|2,0,0]=4 1308 B8R1.7 O=C(O)C1C=CC=C1 LT5432 [1,0,0,0,1,0|0,0,1]=3 1309 B10R1.18 BrC(Br)=CC1=CC=CC=C1 YH16676 [1,0,0,0,0,1|2,0,0]=4 1310 B10R1.18 CC(=O)CC1=CC=CC=C1 YH22297 [1,0,0,0,0,1|1,0,0]=3 1311 B10R1.18 CC(=O)CC1=CC=NC=C1 LQ3035 [1,0,0,0,0,1|2,0,0]=4 1312 B10R1.18 CC(=O)NC1=NC=CC=C1 LQ2855 [1,0,0,0,0,1|2,0,0]=4 1313 B10R1.18 CC(=O)OC1=NC=CC=C1 RT9785 [1,0,0,0,0,1|2,0,0]=4 1314 B10R1.18 CC(=S)NC1=CC=CC=C1 JZ4043 [1,0,0,0,0,1|1,1,0]=4 1315 B10R1.18 CS(=O)CC1=CC=CC=C1 RT13178 [1,0,0,0,0,1|2,0,0]=4 1316 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 RT11145 [1,0,0,0,0,1|1,0,1]=4 1317 B10R1.18 N=C(N)NC1=CC=CC=C1 LQ3733 [1,0,0,0,0,1|2,0,0]=4 1318 B10R1.18 N=C(N)NC1=CC=CC=C1 YH65018 [1,0,0,0,0,1|2,0,0]=4 1319 B10R1.18 NC(=O)CC1=CC=CC=C1 LL0344 [1,0,0,0,0,1|1,0,0]=3 1320 B10R1.18 NC(=O)CC1=CC=CN=C1 HL2586 [1,0,0,0,0,1|2,0,0]=4 1321 B10R1.18 NC(=O)NC1=CC=CC=C1 XJ0031 [1,0,0,0,0,1|1,0,0]=3 1322 B10R1.18 NC(=O)OC1=CC=CC=C1 JZ4003 [1,0,0,0,0,1|1,0,0]=3 1323 B10R1.18 NC(=S)CC1=CC=CC=C1 XJ1206 [1,0,0,0,0,1|1,1,0]=4 1324 B10R1.18 O=C(Cl)CC1=CC=CC=C1 LL0343 [1,0,0,0,0,1|1,0,0]=3 1325 B10R1.18 O=C(Cl)OC1=CC=CC=C1 LQ1974 [1,0,0,0,0,1|1,0,0]=3 1326 B10R1.18 O=C(O)CC1=CC=CC=C1 LL0345 [1,0,0,0,0,1|0,0,0]=2 1327 B10R1.18 O=C(O)CC1=CC=CN=C1 LT2642 [1,0,0,0,0,1|1,0,0]=3 1328 B10R1.18 O=C(O)CC1=CC=CN=C1 XJ0855 [1,0,0,0,0,1|1,0,0]=3 1329 B10R1.18 O=C(O)CC1=CC=NC=C1 JZ0762 [1,0,0,0,0,1|1,0,0]=3 1330 B10R1.18 O=C(O)CC1=CC=NC=C1 LT3467 [1,0,0,0,0,1|1,0,0]=3 1331 B10R1.18 O=C(O)CC1=CN=CN=C1 YH05329 [1,0,0,0,0,1|2,0,0]=4 1332 B10R1.18 O=C(O)CC1=NC=CC=C1 JZ0740 [1,0,0,0,0,1|1,0,0]=3 1333 B10R1.18 O=C(O)CC1=NC=CC=C1 YH65464 [1,0,0,0,0,1|1,0,0]=3 1334 B10R1.18 S=C(Cl)OC1=CC=CC=C1 HL0590 [1,0,0,0,0,1|1,1,0]=4 1335 B12R1.21 CC(O)CCC1=CC=C(O)C=C1 RT12643 [0,0,0,0,0,2|1,0,1]=4 1336 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 JZ4325 [0,0,0,0,0,2|1,0,0]=3 1337 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 JZ2437 [0,0,0,0,0,2|1,0,0]=3 1338 B12R1.21 C[C@@H](O)CCC1=CC=C(O)C=C1 YH03782 [0,0,0,0,0,2|1,0,1]=4 1339 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 JZ1980 [0,0,0,0,0,2|1,0,0]=3 1340 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 HL0948 [0,0,0,0,0,2|1,0,0]=3 1341 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 RT6283 [0,0,0,0,0,2|0,0,0]=2 1342 B12R1.21 O=C(O)CCC1=CC=C(S)C=C1 RT16522 [0,0,0,0,0,2|0,1,0]=3 1343 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 LT7384 [0,0,0,0,0,2|0,0,0]=2 1344 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 LQ1962 [0,0,0,0,0,2|1,0,0]=3 1345 B12R1.21 O=C(O)\C=C/C1=CC=C(O)C=C1 RT11084 [0,0,0,0,0,2|0,0,0]=2 1346 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 XJ1623 [0,0,0,0,0,2|1,0,0]=3 1347 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 RT6457 [0,0,0,0,0,2|1,0,0]=3 1348 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 LT2333 [0,0,0,0,0,2|0,0,0]=2 1349 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 XJ0856 [0,0,0,0,0,2|0,0,0]=2 1350 B12R1.21 O=C(O)\C=C\C1=CC=C(S)C=C1 RT13144 [0,0,0,0,0,2|0,1,0]=3