0 B9R1.6 C=C(C)C1=CC=CC=C1 XJ0257 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.6 CC(=O)C1=CC=CC=C1 RT11112 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 CC(=O)C1=CC=NC=C1 HL0648 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 CC(=O)C1=CN=CC=C1 LQ0733 [0,0,0,0,0,0|1,0,0]=1 4 B9R1.6 CC(=O)C1=CN=CN=C1 RT1973 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.6 CC(=O)C1=NC=CC=N1 YH05694 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.6 CC(Br)C1=CC=CC=C1 XJ1034 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.6 CC(C)C1=NC=CN=C1 JZ1741 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.6 CC(N)C1=CC=CC=C1 JZ0721 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.6 CC(O)C1=CN=CN=C1 RT9947 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.6 CN(N)C1=CC=CC=C1 LQ1214 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.6 CN(N)C1=CC=CC=C1 LX2044 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.6 C[C@@H](N)C1=CC=CC=C1 RT1721 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.6 C[C@@H](N)C1=NC=CC=C1 YH51514 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.6 C[C@H](N)C1=CC=CC=C1 RT1720 [0,0,0,0,0,0|2,0,1]=3 15 B9R1.6 C[Si](=O)C1=CC=CC=C1 XJ3509 [0,0,0,0,0,0|2,1,0]=3 16 B9R1.6 ClC(Cl)C1=CC=CC=C1 LT3671 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.6 ClP(Cl)C1=CC=CC=C1 JZ4097 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 YH96399 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.6 N=C(N)C1=CC=CC=C1 LQ1861 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.6 N=C(N)C1=CC=NC=C1 JZ2903 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.6 N=C(N)C1=CC=NC=C1 YH55019 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.6 N=C(N)C1=NC=CC=N1 LQ5148 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.6 N=C(N)C1=NC=CN=C1 HL3481 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.6 NC(=O)C1=CC=CC=C1 CJ3392 [0,0,0,0,0,0|1,0,0]=1 25 B9R1.6 NC(=O)C1=CC=CC=C1 LT4036 [0,0,0,0,0,0|1,0,0]=1 26 B9R1.6 NC(=O)C1=CC=CN=C1 XJ0261 [0,0,0,0,0,0|0,0,0]=0 27 B9R1.6 NC(=O)C1=CC=NC=C1 XJ1788 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.6 NC(=S)C1=CC=CC=C1 XJ2085 [0,0,0,0,0,0|1,1,0]=2 29 B9R1.6 O=C(Cl)C1=CC=CN=C1 JZ0788 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.6 O=C(Cl)C1=CC=CN=C1 LT7313 [0,0,0,0,0,0|1,0,0]=1 31 B9R1.6 O=C(Cl)C1=CN=CC=N1 YH43954 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.6 O=C(Cl)C1=NC=CC=C1 LT5112 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.6 O=C(F)C1=CC=CC=C1 HL1804 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.6 O=C(O)C1=CC=CC=N1 SY0293 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 O=C(O)C1=CC=CN=C1 LT7314 [0,0,0,0,0,0|1,0,0]=1 36 B9R1.6 O=C(O)C1=CC=NC=C1 JZ0786 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.6 O=C(O)C1=CN=CN=C1 JZ0399 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.6 O=C(O)C1=CN=NC=C1 XJ5546 [0,0,0,0,0,0|2,0,0]=2 39 B9R1.6 O=C(O)C1=NC=CC=N1 YH53937 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.6 O=C(O)C1=NC=CN=C1 LT6615 [0,0,0,0,0,0|2,0,0]=2 41 B9R1.6 O=C(O)C1=NC=NC=C1 LQ4720 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0026 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0027 [0,0,0,0,0,0|2,0,0]=2 44 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ0044 [0,0,0,0,0,0|2,0,0]=2 45 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ4278 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.6 O=C([O-])C1=CC=CC=C1 LT4848 [0,0,0,0,0,0|2,0,0]=2 47 B9R1.6 O=C([O-])C1=CC=CC=C1 XJ0991 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.6 O=C([O-])C1=CN=CC=C1 LL1069 [0,0,0,0,0,0|1,0,0]=1 49 B9R1.6 O=C([O-])C1=CN=CC=C1 LQ0027 [0,0,0,0,0,0|1,0,0]=1 50 B9R1.6 O=C([O-])C1=NC=CC=C1 JZ5244 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.6 O=C([O-])C1=NC=CC=C1 LQ3798 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.6 O=S(O)C1=CC=CC=C1 LQ1215 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.6 O=S([O-])C1=CC=CC=C1 LL1085 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 XJ0263 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 LQ2210 [0,0,0,0,0,0|2,0,0]=2 56 B9R1.6 O=[N+]([O-])C1=CN=CN=C1 JZ4849 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.6 O=[P+]([O-])C1=CC=CC=C1 LQ2659 [0,0,0,0,0,0|3,0,0]=3 58 B9R1.6 OB(O)C1=CC=CC=C1 JZ0681 [0,0,0,0,0,0|3,0,1]=4 59 B9R1.6 OB(O)C1=CC=CN=C1 LQ1914 [0,0,0,0,0,0|2,0,1]=3 60 B9R1.6 OB(O)C1=CN=CN=C1 HL3222 [0,0,0,0,0,0|3,0,1]=4 61 B9R1.6 [18O]=C([18OH])C1=CC=CC=C1 RT11444 [0,0,0,0,0,0|2,0,0]=2 62 B9R1.6 [SiH](Cl)(Cl)C1=CC=CC=C1 HL0912 [0,0,0,0,0,0|3,1,0]=4 63 B8R1.2 BrCC1=CC=CC=C1 JZ1264 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.2 BrCC1=CC=CN=C1 YH03265 [1,0,0,0,0,0|1,0,1]=3 65 B8R1.2 BrCC1=CC=CN=C1 YH65568 [1,0,0,0,0,0|1,0,1]=3 66 B8R1.2 BrCC1=CN=CN=C1 YH49551 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.2 Br[Mg]C1=CC=CC=C1 HL1276 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.2 C=CC1=CC=CC=C1 XJ3473 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.2 C=CC1=CC=CN=C1 RT7678 [1,0,0,0,0,0|1,0,0]=2 70 B8R1.2 C=CC1=NC=CN=C1 JZ1744 [1,0,0,0,0,0|2,0,0]=3 71 B8R1.2 CCC1=CC=CN=C1 JZ1084 [1,0,0,0,0,0|1,0,1]=3 72 B8R1.2 CNC1=CC=CN=C1 LT2493 [1,0,0,0,0,0|2,0,0]=3 73 B8R1.2 COC1=CC=CN=C1 LT6817 [1,0,0,0,0,0|2,0,0]=3 74 B8R1.2 COC1=NC=CN=C1 LT2105 [1,0,0,0,0,0|3,0,0]=4 75 B8R1.2 CSC1=NC=CN=C1 LT1494 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.2 ClCC1=CC=CC=C1 HL1268 [1,0,0,0,0,0|2,0,1]=4 77 B8R1.2 ClCC1=CC=CN=C1 JZ0781 [1,0,0,0,0,0|1,0,1]=3 78 B8R1.2 ClCC1=CC=CN=C1 YH53620 [1,0,0,0,0,0|1,0,1]=3 79 B8R1.2 ClCC1=CN=CN=C1 YH20882 [1,0,0,0,0,0|2,0,1]=4 80 B8R1.2 ClCC1=NC=CN=C1 YH58834 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.2 ClCC1=NC=CN=C1 YH66696 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.2 N#CC1=CC=CC=C1 JZ4954 [1,0,0,0,0,0|1,0,2]=4 83 B8R1.2 N#CC1=CC=CC=C1 XJ4015 [1,0,0,0,0,0|1,0,2]=4 84 B8R1.2 N#CC1=CC=CN=C1 LT3052 [1,0,0,0,0,0|0,0,2]=3 85 B8R1.2 NCC1=CC=CC=C1 LQ1371 [1,0,0,0,0,0|1,0,1]=3 86 B8R1.2 NCC1=CC=CN=C1 RT2311 [1,0,0,0,0,0|0,0,1]=2 87 B8R1.2 NCC1=CC=NC=C1 LL1070 [1,0,0,0,0,0|2,0,1]=4 88 B8R1.2 NCC1=CC=NC=C1 RT10176 [1,0,0,0,0,0|2,0,1]=4 89 B8R1.2 NCC1=NC=CC=C1 HL2591 [1,0,0,0,0,0|2,0,1]=4 90 B8R1.2 NCC1=NC=CN=C1 YH58835 [1,0,0,0,0,0|1,0,1]=3 91 B8R1.2 NNC1=CC=CC=C1 HL1279 [1,0,0,0,0,0|2,0,0]=3 92 B8R1.2 NNC1=CC=CC=C1 JZ5772 [1,0,0,0,0,0|2,0,0]=3 93 B8R1.2 NNC1=CC=CN=C1 YH00904 [1,0,0,0,0,0|1,0,0]=2 94 B8R1.2 NNC1=CC=CN=C1 YH12082 [1,0,0,0,0,0|1,0,0]=2 95 B8R1.2 NNC1=CC=CN=C1 YH57193 [1,0,0,0,0,0|1,0,0]=2 96 B8R1.2 NNC1=NC=CN=C1 YH06483 [1,0,0,0,0,0|2,0,0]=3 97 B8R1.2 O=CC1=CC=CC=N1 JZ0732 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.2 O=CC1=CC=CN=C1 RT10183 [1,0,0,0,0,0|0,0,0]=1 99 B8R1.2 O=CC1=CN=CN=C1 LX3173 [1,0,0,0,0,0|1,0,0]=2 100 B8R1.2 O=CC1=NC=CC=N1 YH51306 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.2 O=CC1=NC=CN=C1 HL3002 [1,0,0,0,0,0|1,0,0]=2 102 B8R1.2 O=CC1=NC=NC=C1 YH48930 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.2 O=CC1=NN=CC=C1 XJ5876 [1,0,0,0,0,0|1,0,0]=2 104 B8R1.2 O=NC1=CC=CC=C1 YH08587 [1,0,0,0,0,0|2,0,0]=3 105 B8R1.2 O=[As]C1=CC=CC=C1 JZ4036 [1,0,0,0,0,0|2,0,0]=3 106 B8R1.2 OCC1=CC=CC=C1 HL1271 [1,0,0,0,0,0|1,0,2]=4 107 B8R1.2 OCC1=CN=CC=C1 HL1274 [1,0,0,0,0,0|0,0,2]=3 108 B8R1.2 OCC1=CN=CN=C1 LX3222 [1,0,0,0,0,0|1,0,2]=4 109 B8R1.2 OCC1=NC=CN=C1 YH13049 [1,0,0,0,0,0|1,0,2]=4 110 B8R1.2 O[Hg]C1=CC=CC=C1 LQ3360 [1,0,0,0,0,0|2,0,1]=4 111 B8R1.2 SCC1=CC=CC=C1 HL1273 [1,0,0,0,0,0|1,1,1]=4 112 B8R1.2 SCC1=NC=CN=C1 LQ5467 [1,0,0,0,0,0|1,1,1]=4 113 B8R1.2 [C-]#CC1=CC=CC=C1 JZ3648 [1,0,0,0,0,0|2,0,1]=4 114 B8R1.2 [C-]#[N+]C1=CC=CC=C1 YH65599 [1,0,0,0,0,0|3,0,0]=4 115 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HL1303 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.13 CC(=O)C1=CC=C(C)N=C1 RT18075 [0,1,0,0,0,0|1,0,0]=2 117 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 JZ1119 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 YH07034 [0,1,0,0,0,0|1,0,0]=2 119 B10R1.13 CC(=O)C1=CC=C(F)C=C1 JZ1124 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.13 CC(=O)C1=CC=C(N)C=C1 LT6854 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.13 CC(=O)C1=CC=C(O)C=C1 RT11987 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 HL3496 [0,1,0,0,0,0|1,0,0]=2 123 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CJ2729 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.13 CC(N)C1=CC=C(Br)C=C1 YH48936 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.13 CC1=CC=C(B(O)O)C=N1 RT6584 [0,1,0,0,0,0|2,0,1]=4 126 B10R1.13 CC1=CC=C(C(=O)O)C=C1 JZ0130 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.13 CC1=CC=C(C(=O)O)C=N1 JZ2268 [0,1,0,0,0,0|1,0,0]=2 128 B10R1.13 CC1=CC=C(C(C)N)C=C1 JZ0723 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.13 CC1=CC=C(C(C)O)C=N1 RT2394 [0,1,0,0,0,0|1,0,2]=4 130 B10R1.13 CC1=CC=C(C(N)=O)C=C1 JZ3937 [0,1,0,0,0,0|1,0,0]=2 131 B10R1.13 CC1=CC=C(S(=O)O)C=C1 LL0969 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.13 CC1=CC=C(S(N)=O)C=C1 YH66632 [0,1,0,0,0,0|2,0,0]=3 133 B10R1.13 CC1=CN=C(C(=O)O)C=C1 YH01820 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.13 CC1=NC=C(C(=O)O)C=N1 YH04926 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.13 CC1=NC=C(C(=O)O)N=C1 LT1326 [0,1,0,0,0,0|2,0,0]=3 136 B10R1.13 CC1=NC=C(C(C)N)C=N1 RT2400 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 JZ1051 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 LQ5152 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 YH17516 [0,1,0,0,0,0|2,0,1]=4 140 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 XJ4897 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 HL3245 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.13 N=C(N)C1=CC=C(N)C=C1 HL2287 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.13 N=C(N)C1=CC=C(N)C=C1 JZ3229 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.13 N=C(N)C1=CC=C(O)C=C1 LT2008 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.13 N=C(N)C1=CC=C(O)C=C1 YH36971 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 LQ1385 [0,1,0,0,0,0|1,0,0]=2 147 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 JZ3938 [0,1,0,0,0,0|1,0,0]=2 148 B10R1.13 NC(=O)C1=CC=C(F)C=C1 JZ4190 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.13 NC(=O)C1=CC=C(I)C=C1 YH59026 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.13 NC(=O)C1=CC=C(O)C=C1 JZ3939 [0,1,0,0,0,0|1,0,0]=2 151 B10R1.13 NC(=O)C1=NC=C(N)C=C1 YH35056 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 YH49579 [0,1,0,0,0,0|1,1,0]=3 153 B10R1.13 NC1=CC=C(B(O)O)C=N1 CJ2602 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.13 NC1=CC=C(C(=O)O)C=C1 RT3381 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.13 NC1=CC=C(C(=O)O)C=N1 LT3585 [0,1,0,0,0,0|1,0,0]=2 156 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 LT3105 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 JZ0055 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.13 NC1=CN=C(C(=O)O)C=C1 JZ1163 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.13 NC1=NC=C([N+](=O)[O-])C=C1 CJ2895 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.13 NC1=NC=C([N+](=O)[O-])C=N1 LT0260 [0,1,0,0,0,0|3,0,0]=4 161 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 XJ0449 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 JZ0749 [0,1,0,0,0,0|1,0,0]=2 163 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 JZ1126 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 JZ4692 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 XJ1044 [0,1,0,0,0,0|2,0,0]=3 166 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 JZ0785 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 JZ1200 [0,1,0,0,0,0|1,0,0]=2 168 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 JZ0383 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 LT3592 [0,1,0,0,0,0|1,0,0]=2 170 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 HL2902 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.13 O=C(O)C1=CC=C(F)C=C1 JZ1125 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.13 O=C(O)C1=CC=C(I)C=C1 JZ3940 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.13 O=C(O)C1=CC=C(O)C=C1 JZ0015 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.13 O=C(O)C1=CC=C(O)C=N1 XJ4141 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.13 O=C(O)C1=CC=C(O)N=C1 RT9389 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CJ2890 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 LL1597 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.13 O=C(O)C1=NC=C(Cl)N=C1 LX2929 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.13 O=C(O)C1=NC=C(F)C=C1 YH23879 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.13 O=C(O)C1=NC=C(O)N=C1 LX2658 [0,1,0,0,0,0|2,0,0]=3 181 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 HL1435 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.13 O=C1C=NC(C(=O)[O-])=CN1 YH18171 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.13 O=S([O-])C1=CC=C(F)C=C1 JZ4192 [0,1,0,0,0,0|3,0,0]=4 184 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 RT13188 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 LT0072 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 RT11294 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.13 O=[N+]([O-])C1=CC=C(O)N=C1 LT1954 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 LT3458 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 RT12985 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=C1 LT1872 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=C1 LT6071 [0,1,0,0,0,0|2,0,0]=3 192 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)N=C1 LX2361 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.13 OB(O)C1=CN=C(Br)C=C1 YH47439 [0,1,0,0,0,0|2,0,1]=4 194 B10R1.13 OB(O)C1=CN=C(F)C=C1 LL2843 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.15 C1=CC=C(C(=O)OC)C=C1 LQ3514 [0,1,0,0,0,0|2,0,0]=3 196 B10R1.15 C1=CC=C(N([O-])N=O)C=C1 LT7153 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.15 CC(C=O)C1=CC=CC=C1 HL1224 [0,1,0,0,0,0|2,0,1]=4 198 B10R1.15 CCC(=O)C1=CC=CN=C1 JZ4667 [0,1,0,0,0,0|1,0,0]=2 199 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 HL2472 [0,1,0,0,0,0|2,0,1]=4 200 B10R1.15 CN(C=O)C1=CC=CC=C1 JZ0143 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.15 CNC(=O)C1=CC=CC=C1 HL0175 [0,1,0,0,0,0|1,0,0]=2 202 B10R1.15 CNC(=O)C1=NC=CC=C1 RT3529 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.15 COC(=O)C1=CC=CN=C1 JZ0756 [0,1,0,0,0,0|1,0,0]=2 204 B10R1.15 COC(=O)C1=CC=NC=C1 RT1566 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.15 COC(=O)C1=CN=CN=C1 YH55622 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.15 NCC(=O)C1=CC=CC=C1 LT5895 [0,1,0,0,0,0|1,0,0]=2 207 B10R1.15 NCC(=O)C1=CC=CN=C1 RT4369 [0,1,0,0,0,0|0,0,0]=1 208 B10R1.15 NNC(=O)C1=CC=CC=C1 LT4155 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.15 N\C(=N/O)C1=CC=CC=C1 HL0174 [0,1,0,0,0,0|1,0,1]=3 210 B10R1.15 N\C(=N/O)C1=CC=CN=C1 XJ1823 [0,1,0,0,0,0|0,0,1]=2 211 B10R1.15 O=C(CBr)C1=CC=CC=C1 RT11120 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.15 O=C(CBr)C1=CC=CC=C1 YH43692 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.15 O=C(CBr)C1=CC=NC=C1 XJ2872 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.15 O=C(CBr)C1=NC=CC=C1 LQ4012 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.15 O=C(CBr)C1=NC=CN=C1 RT9592 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.15 O=C(CCl)C1=CC=CC=C1 LT3832 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.15 O=C(NO)C1=CC=CC=C1 LT6975 [0,1,0,0,0,0|1,0,0]=2 218 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 RT1705 [0,1,0,0,0,0|1,0,2]=4 219 B10R1.28 CC(C)(N)C1=CC=CC=C1 XJ1030 [0,1,0,0,0,0|2,0,1]=4 220 B10R1.28 CC(C)(N)C1=CN=CC=C1 YH99047 [0,1,0,0,0,0|1,0,1]=3 221 B10R1.28 CP(=O)(Cl)C1=CC=CC=C1 XJ2994 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 LQ2383 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.28 FC(F)(F)C1=CC=CN=C1 HL2646 [0,1,0,0,0,0|2,0,1]=4 224 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 XJ0224 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.28 O=S(=O)(Cl)C1=CC=CN=C1 YH01299 [0,1,0,0,0,0|2,0,0]=3 226 B10R1.28 O=S(=O)(Cl)C1=CC=CN=C1 YH37912 [0,1,0,0,0,0|2,0,0]=3 227 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 RT13210 [0,1,0,0,0,0|3,0,0]=4 228 B10R1.28 O=S(=O)(O)C1=CC=CN=C1 JZ4027 [0,1,0,0,0,0|2,0,0]=3 229 B10R1.28 O=S(=O)([Na])C1=CC=CC=C1 LT4044 [0,1,0,0,0,0|3,0,0]=4 230 B10R1.28 O=S(=O)([Zn])C1=CC=CC=C1 LT4045 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.28 O=[As](O)(O)C1=CC=CC=C1 XJ0221 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.61 C=C(C)C1=CC=CC=C1C LQ4513 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.61 CC(=O)C1=C(C)C=CC=C1 JZ3832 [0,1,0,0,0,0|2,0,0]=3 234 B10R1.61 CC(=O)C1=C(F)C=CC=C1 LT6542 [0,1,0,0,0,0|2,0,0]=3 235 B10R1.61 CC(=O)C1=CC=CC=C1Br LQ2085 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.61 CC(=O)C1=CC=CC=C1Cl RT11894 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.61 CC(=O)C1=CC=CN=C1C YH39691 [0,1,0,0,0,0|1,0,0]=2 238 B10R1.61 CC(=O)C1=CC=CN=C1Cl YH07033 [0,1,0,0,0,0|1,0,0]=2 239 B10R1.61 CC(=O)C1=CC=CN=C1N YH12193 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.61 CC(=O)C1=NC=CC=C1F YH65591 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.61 CC(=O)C1=NC=CN=C1C XJ4743 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.61 CC(N)C1=CC=CC=C1O YH66634 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.61 CC1=C(B(O)O)C=CC=N1 HL4849 [0,1,0,0,0,0|2,0,1]=4 244 B10R1.61 CC1=C(B(O)O)C=NC=C1 LL2253 [0,1,0,0,0,0|2,0,1]=4 245 B10R1.61 CC1=C(C(=O)O)C=CC=C1 LQ0494 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.61 CC1=C(C(=O)O)C=CN=C1 RT9406 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.61 CC1=C(C(=O)O)C=NC=N1 HL3596 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 HL3039 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.61 CC1=CC=CC=C1C(=O)Cl JZ4285 [0,1,0,0,0,0|2,0,0]=3 250 B10R1.61 CC1=CC=CN=C1C(=O)O LT5691 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.61 CC1=NC=CC=C1C(=O)O JZ2271 [0,1,0,0,0,0|1,0,0]=2 252 B10R1.61 CC1=NC=CC=C1[N+](=O)[O-] JZ1050 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.61 CC1=NC=CN=C1C(=O)O YH00415 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.61 C[C@@H](N)C1=CC=CC=C1O YH29387 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.61 C[N+]1=CC=CC=C1C(=O)[O-] RT7788 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.61 N=C(N)C1=C(O)C=CC=C1 YH65820 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.61 NC(=O)C1=C(N)C=CN=C1 YH16594 [0,1,0,0,0,0|0,0,0]=1 258 B10R1.61 NC(=O)C1=CC=CC=C1N LL0171 [0,1,0,0,0,0|1,0,0]=2 259 B10R1.61 NC(=O)C1=NC=CC=C1N XJ5526 [0,1,0,0,0,0|2,0,0]=3 260 B10R1.61 NC1=C(C(=O)O)C=CC=C1 LT0272 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.61 NC1=C(C(=O)O)C=CN=C1 YH17177 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.61 NC1=C(C(=O)O)C=NC=C1 JZ3131 [0,1,0,0,0,0|1,0,0]=2 263 B10R1.61 NC1=C([N+](=O)[O-])C=NC=C1 LQ1898 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.61 NC1=CC=CN=C1C(=O)O HL0849 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.61 NC1=NC=CN=C1C(=O)O LT6716 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 RT7792 [0,1,0,0,0,0|1,0,0]=2 267 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 JZ1033 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 XJ1083 [0,1,0,0,0,0|2,0,0]=3 269 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl LT2133 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 LQ0495 [0,1,0,0,0,0|2,0,0]=3 271 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 XJ3548 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.61 O=C(O)C1=C(Cl)N=CC=N1 XJ4919 [0,1,0,0,0,0|2,0,0]=3 273 B10R1.61 O=C(O)C1=C(F)C=CN=C1 LX2749 [0,1,0,0,0,0|1,0,0]=2 274 B10R1.61 O=C(O)C1=C(F)C=NC=C1 HL1748 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.61 O=C(O)C1=C(I)C=CC=C1 LT6566 [0,1,0,0,0,0|2,0,0]=3 276 B10R1.61 O=C(O)C1=C(O)C=CC=C1 RT10607 [0,1,0,0,0,0|2,0,0]=3 277 B10R1.61 O=C(O)C1=C(O)C=CN=C1 XJ1084 [0,1,0,0,0,0|1,0,0]=2 278 B10R1.61 O=C(O)C1=CC=CC=C1Br LL0169 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.61 O=C(O)C1=CC=CC=C1S LQ3223 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.61 O=C(O)C1=CC=CC=C1[O-] LQ0966 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.61 O=C(O)C1=CC=CN=C1Cl LT6516 [0,1,0,0,0,0|1,0,0]=2 282 B10R1.61 O=C(O)C1=CC=CN=C1F HL1749 [0,1,0,0,0,0|1,0,0]=2 283 B10R1.61 O=C(O)C1=CN=CC=C1Br YH36635 [0,1,0,0,0,0|1,0,0]=2 284 B10R1.61 O=C(O)C1=NC=CC=C1Br RT15189 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.61 O=C(O)C1=NC=CC=C1Cl XJ5804 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.61 O=C(O)C1=NC=CC=C1F YH36326 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.61 O=C(O)C1=NC=CC=C1O XJ1437 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.61 O=C(O)C1=NC=CC=C1S RT16346 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.61 O=C(O)C1=NC=CN=C1O YH65414 [0,1,0,0,0,0|2,0,0]=3 290 B10R1.61 O=C([O-])C1=CC=CC=C1O HL0014 [0,1,0,0,0,0|2,0,0]=3 291 B10R1.61 O=C([O-])C1=CC=CC=C1O JZ3839 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.61 O=C([O-])C1=CC=CC=C1O JZ5006 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.61 O=C([O-])C1=CC=CC=C1O LQ0967 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.61 O=C([O-])C1=CC=CC=C1O LQ4134 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.61 O=C([O-])C1=CC=CC=C1[O-] LL1063 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.61 O=C([O-])C1=NC=CC=C1Br RT16520 [0,1,0,0,0,0|3,0,0]=4 297 B10R1.61 O=C1C=CNC=C1[N+](=O)[O-] JZ1129 [0,1,0,0,0,0|2,0,1]=4 298 B10R1.61 O=N(=O)C1=CC=CC=C1O LL0174 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 JZ3833 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 LL0173 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 LQ3593 [0,1,0,0,0,0|2,0,0]=3 302 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 RT12368 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.61 O=[N+]([O-])C1=C(F)C=CN=C1 LX3221 [0,1,0,0,0,0|2,0,0]=3 304 B10R1.61 O=[N+]([O-])C1=C(I)C=CC=C1 XJ1086 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.61 O=[N+]([O-])C1=C(O)N=CC=C1 LT1881 [0,1,0,0,0,0|2,0,0]=3 306 B10R1.61 O=[N+]([O-])C1=C(S)C=CC=C1 YH03191 [0,1,0,0,0,0|3,0,0]=4 307 B10R1.61 O=[N+]([O-])C1=CC=CC=C1[O-] LQ1488 [0,1,0,0,0,0|3,0,0]=4 308 B10R1.61 O=[N+]([O-])C1=CC=CN=C1F HL0872 [0,1,0,0,0,0|2,0,0]=3 309 B10R1.61 O=[N+]([O-])C1=CN=CC=C1O LT2633 [0,1,0,0,0,0|2,0,0]=3 310 B10R1.61 OB(O)C1=C(Br)N=CC=C1 HL4074 [0,1,0,0,0,0|2,0,1]=4 311 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 YH02131 [0,1,0,0,0,0|2,0,1]=4 312 B10R1.61 OB(O)C1=C(Cl)N=CC=C1 LT3713 [0,1,0,0,0,0|2,0,1]=4 313 B10R1.61 OB(O)C1=CC=CN=C1F HL3682 [0,1,0,0,0,0|2,0,1]=4 314 B10R1.113 C=C(C)C1=CC(C)=CC=C1 HL0676 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 LX2618 [0,1,0,0,0,0|1,0,0]=2 316 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 RT15363 [0,1,0,0,0,0|3,0,0]=4 317 B10R1.113 CC(=O)C1=CC(F)=CC=C1 LT6788 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.113 CC(=O)C1=CC(N)=CC=C1 LT6621 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 LQ2084 [0,1,0,0,0,0|2,0,0]=3 320 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 LX2619 [0,1,0,0,0,0|3,0,0]=4 321 B10R1.113 CC(=O)C1=CC=CC(O)=C1 LT6622 [0,1,0,0,0,0|2,0,0]=3 322 B10R1.113 CC(=O)C1=NC=CC(C)=C1 CJ2939 [0,1,0,0,0,0|3,0,0]=4 323 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 RT2925 [0,1,0,0,0,0|2,0,1]=4 324 B10R1.113 CC1=CC(B(O)O)=CN=C1 HL3668 [0,1,0,0,0,0|2,0,1]=4 325 B10R1.113 CC1=CC(C(N)=O)=CC=C1 LQ1217 [0,1,0,0,0,0|1,0,0]=2 326 B10R1.113 CC1=CC(C(N)=S)=CC=N1 RT8267 [0,1,0,0,0,0|2,1,0]=4 327 B10R1.113 CC1=CC=CC(C(=O)O)=C1 XJ0266 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.113 CC1=CC=CC(C(=O)O)=N1 JZ4291 [0,1,0,0,0,0|3,0,0]=4 329 B10R1.113 CC1=CN=CC(C(=O)O)=C1 LT6022 [0,1,0,0,0,0|1,0,0]=2 330 B10R1.113 CN1C=CCC(C(N)=O)=C1 RT11880 [0,1,0,0,0,0|0,0,2]=3 331 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 YH65966 [0,1,0,0,0,0|0,0,1]=2 332 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 XJ3010 [0,1,0,0,0,0|1,0,1]=3 333 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 RT4413 [0,1,0,0,0,0|0,0,1]=2 334 B10R1.113 C[NH+]1C=CC=C(C(N)=O)C1 RT4410 [0,1,0,0,0,0|0,0,2]=3 335 B10R1.113 N=C(N)C1=CC=CC(F)=C1 XJ6333 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.113 N=C(N)C1=CC=CC(N)=C1 LT2228 [0,1,0,0,0,0|2,0,0]=3 337 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 LQ4630 [0,1,0,0,0,0|0,0,0]=1 338 B10R1.113 NC(=O)C1=CC(F)=CC=C1 HL1806 [0,1,0,0,0,0|1,0,0]=2 339 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 LQ1218 [0,1,0,0,0,0|1,0,0]=2 340 B10R1.113 NC(=O)C1=C[N+]([O-])=CC=C1 JZ1859 [0,1,0,0,0,0|0,0,1]=2 341 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 XJ6709 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.113 NC1=CC(C(=O)O)=CN=C1 YH48838 [0,1,0,0,0,0|1,0,0]=2 343 B10R1.113 NC1=CC(C(=O)O)=NC=C1 RT5964 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.113 NC1=CC=CC(C(=O)O)=N1 JZ5606 [0,1,0,0,0,0|3,0,0]=4 345 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 XJ0269 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.113 NC1=NC=CC(C(=O)O)=C1 YH32218 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.113 NC1C=CC=C(C(=O)O)C1 RT4711 [0,1,0,0,0,0|2,0,1]=4 348 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 JZ4695 [0,1,0,0,0,0|2,0,0]=3 349 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 LQ1216 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 LT3937 [0,1,0,0,0,0|3,0,0]=4 351 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 LT3027 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.113 O=C(Cl)C1=CC(I)=CC=C1 JZ4696 [0,1,0,0,0,0|2,0,0]=3 353 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 JZ0792 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 LT3007 [0,1,0,0,0,0|2,0,0]=3 355 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 LT6515 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.113 O=C(O)C1=CC(F)=CC=C1 JZ1086 [0,1,0,0,0,0|2,0,0]=3 357 B10R1.113 O=C(O)C1=CC(F)=CN=C1 LQ0786 [0,1,0,0,0,0|1,0,0]=2 358 B10R1.113 O=C(O)C1=CC(I)=CC=C1 LQ1220 [0,1,0,0,0,0|2,0,0]=3 359 B10R1.113 O=C(O)C1=CC(O)=CC=C1 RT13217 [0,1,0,0,0,0|2,0,0]=3 360 B10R1.113 O=C(O)C1=CC(S)=NC=C1 YH42361 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 LT2935 [0,1,0,0,0,0|2,0,0]=3 362 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 JZ4304 [0,1,0,0,0,0|2,0,0]=3 363 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 LQ2733 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.113 O=C(O)C1=CC=CC(F)=N1 LQ0787 [0,1,0,0,0,0|3,0,0]=4 365 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 LT3524 [0,1,0,0,0,0|1,0,0]=2 366 B10R1.113 O=C(O)C1=CN=CC(O)=C1 JZ0794 [0,1,0,0,0,0|1,0,0]=2 367 B10R1.113 O=C(O)C1=C[N+]([O-])=CC=N1 RT9260 [0,1,0,0,0,0|2,0,1]=4 368 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 JZ0754 [0,1,0,0,0,0|3,0,0]=4 369 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 YH48486 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.113 O=C(O)C1=NC(O)=CC=C1 JZ0755 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 LX2083 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 LQ2927 [0,1,0,0,0,0|3,0,0]=4 373 B10R1.113 O=[N+]([O-])C1=CC(Cl)=CC=C1 LL0512 [0,1,0,0,0,0|3,0,0]=4 374 B10R1.113 O=[N+]([O-])C1=CC(I)=CC=C1 JZ4098 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 LT1873 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 LQ0982 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.113 O=[N+]([O-])C1=CN=CC(Br)=C1 JZ5045 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.113 O=[N+]([O-])C1=CN=CC(Cl)=C1 XJ4679 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 YH65925 [0,1,0,0,0,0|2,0,1]=4 380 B10R1.113 OB(O)C1=CC(F)=CN=C1 LT4964 [0,1,0,0,0,0|2,0,1]=4 381 B10R1.113 OB(O)C1=CN=CC(Br)=C1 HL4075 [0,1,0,0,0,0|2,0,1]=4 382 B10R2.6 C1=CC=C(C2CN2)C=C1 RT8683 [0,0,0,1,0,0|2,0,1]=4 383 B10R2.320 O=C1CC2=CC=CC=C12 YH55957 [0,0,0,1,0,0|2,0,0]=3 384 B8R1.7 CC(=O)C1=CC=CS1 LT4058 [0,0,0,0,1,0|2,0,0]=3 385 B8R1.7 CC(=O)C1=CN=NS1 YH33246 [0,0,0,0,1,0|3,0,0]=4 386 B8R1.7 CC(=O)C1=CNC=C1 JZ4350 [0,0,0,0,1,0|1,0,1]=3 387 B8R1.7 CC(=O)C1=CNC=N1 YH10387 [0,0,0,0,1,0|2,0,0]=3 388 B8R1.7 CC(=O)C1=CSC=C1 LT2539 [0,0,0,0,1,0|2,0,0]=3 389 B8R1.7 CC(=O)N1C=CN=C1 YH49188 [0,0,0,0,1,0|2,0,0]=3 390 B8R1.7 CC(N)C1=CN=CO1 RT14536 [0,0,0,0,1,0|2,0,1]=4 391 B8R1.7 C[C@@H](N)C1=CC=CO1 RT3868 [0,0,0,0,1,0|2,0,1]=4 392 B8R1.7 N=C(N)C1=CC=CS1 LT0593 [0,0,0,0,1,0|2,0,0]=3 393 B8R1.7 N=C(N)N1C=CC=N1 LT5837 [0,0,0,0,1,0|2,0,0]=3 394 B8R1.7 N=C(N)N1C=NC=N1 SY0040 [0,0,0,0,1,0|3,0,0]=4 395 B8R1.7 NC(=O)C1=NNC=N1 YH57164 [0,0,0,0,1,0|2,0,0]=3 396 B8R1.7 O=C(Cl)C1=CC=CO1 LQ0957 [0,0,0,0,1,0|2,0,0]=3 397 B8R1.7 O=C(Cl)C1=CC=CS1 RT9297 [0,0,0,0,1,0|2,0,0]=3 398 B8R1.7 O=C(Cl)C1=COC=C1 YH50424 [0,0,0,0,1,0|2,0,0]=3 399 B8R1.7 O=C(Cl)C1=CSC=C1 YH00609 [0,0,0,0,1,0|2,0,0]=3 400 B8R1.7 O=C(Cl)N1C=CN=C1 YH16896 [0,0,0,0,1,0|2,0,0]=3 401 B8R1.7 O=C(O)C1=CC=CN1 LQ1319 [0,0,0,0,1,0|1,0,1]=3 402 B8R1.7 O=C(O)C1=CC=CO1 LQ4516 [0,0,0,0,1,0|2,0,0]=3 403 B8R1.7 O=C(O)C1=CC=CO1 LT6552 [0,0,0,0,1,0|2,0,0]=3 404 B8R1.7 O=C(O)C1=CC=NS1 YH21736 [0,0,0,0,1,0|2,0,0]=3 405 B8R1.7 O=C(O)C1=CN=CN1 JZ4351 [0,0,0,0,1,0|2,0,0]=3 406 B8R1.7 O=C(O)C1=CN=CS1 LQ3747 [0,0,0,0,1,0|2,0,0]=3 407 B8R1.7 O=C(O)C1=CN=NN1 LT6005 [0,0,0,0,1,0|3,0,0]=4 408 B8R1.7 O=C(O)C1=CNN=C1 RT14194 [0,0,0,0,1,0|2,0,0]=3 409 B8R1.7 O=C(O)C1=COC=N1 LQ4340 [0,0,0,0,1,0|2,0,0]=3 410 B8R1.7 O=C(O)C1=CSC=C1 LT6654 [0,0,0,0,1,0|2,0,0]=3 411 B8R1.7 O=C(O)C1=NC=CS1 JZ4900 [0,0,0,0,1,0|2,0,0]=3 412 B8R1.7 O=C(O)C1=NNC=C1 XJ1870 [0,0,0,0,1,0|2,0,0]=3 413 B8R1.7 O=C(O)C1=NOC=C1 JZ2260 [0,0,0,0,1,0|2,0,0]=3 414 B8R1.7 O=C(O)C1C=CC=C1 LT5432 [0,0,0,0,1,0|1,0,1]=3 415 B8R1.7 O=[N+]([O-])C1=CC=CS1 XJ1078 [0,0,0,0,1,0|3,0,0]=4 416 B8R1.7 O=[N+]([O-])C1=CN=CN1 LT2856 [0,0,0,0,1,0|3,0,0]=4 417 B8R1.7 O=[N+]([O-])C1=CNN=C1 HL2127 [0,0,0,0,1,0|3,0,0]=4 418 B8R1.7 O=[N+]([O-])C1=NC=CN1 LT5924 [0,0,0,0,1,0|3,0,0]=4 419 B8R1.7 O=[N+]([O-])C1=NC=CN1 XJ5239 [0,0,0,0,1,0|3,0,0]=4 420 B8R1.7 O=[S@@]([Fe+])C1=CC=CC1 HL3389 [0,0,0,0,1,0|2,0,1]=4 421 B10R1.18 BrC(Br)=CC1=CC=CC=C1 YH16676 [0,0,0,0,0,1|3,0,0]=4 422 B10R1.18 CC(=O)CC1=CC=CC=C1 YH22297 [0,0,0,0,0,1|2,0,0]=3 423 B10R1.18 CC(=O)CC1=CC=NC=C1 LQ3035 [0,0,0,0,0,1|3,0,0]=4 424 B10R1.18 CC(=O)NC1=NC=CC=C1 LQ2855 [0,0,0,0,0,1|3,0,0]=4 425 B10R1.18 CC(=O)OC1=NC=CC=C1 RT9785 [0,0,0,0,0,1|3,0,0]=4 426 B10R1.18 CC(=S)NC1=CC=CC=C1 JZ4043 [0,0,0,0,0,1|2,1,0]=4 427 B10R1.18 CC(C)CC1=CC=CN=C1 LT3805 [0,0,0,0,0,1|2,0,1]=4 428 B10R1.18 CS(=O)CC1=CC=CC=C1 RT13178 [0,0,0,0,0,1|3,0,0]=4 429 B10R1.18 C[C@@H](N)CC1=CC=CC=C1 YH66589 [0,0,0,0,0,1|2,0,1]=4 430 B10R1.18 N=C(N)NC1=CC=CC=C1 LQ3733 [0,0,0,0,0,1|2,0,0]=3 431 B10R1.18 N=C(N)NC1=CC=CC=C1 YH65018 [0,0,0,0,0,1|2,0,0]=3 432 B10R1.18 NC(=O)CC1=CC=CC=C1 LL0344 [0,0,0,0,0,1|1,0,0]=2 433 B10R1.18 NC(=O)CC1=CC=CN=C1 HL2586 [0,0,0,0,0,1|0,0,0]=1 434 B10R1.18 NC(=O)NC1=CC=CC=C1 XJ0031 [0,0,0,0,0,1|1,0,0]=2 435 B10R1.18 NC(=O)OC1=CC=CC=C1 JZ4003 [0,0,0,0,0,1|1,0,0]=2 436 B10R1.18 NC(=S)CC1=CC=CC=C1 XJ1206 [0,0,0,0,0,1|1,1,0]=3 437 B10R1.18 O=C(Cl)CC1=CC=CC=C1 LL0343 [0,0,0,0,0,1|2,0,0]=3 438 B10R1.18 O=C(Cl)OC1=CC=CC=C1 LQ1974 [0,0,0,0,0,1|2,0,0]=3 439 B10R1.18 O=C(O)CC1=CC=CC=C1 LL0345 [0,0,0,0,0,1|2,0,0]=3 440 B10R1.18 O=C(O)CC1=CC=CN=C1 LT2642 [0,0,0,0,0,1|1,0,0]=2 441 B10R1.18 O=C(O)CC1=CC=CN=C1 XJ0855 [0,0,0,0,0,1|1,0,0]=2 442 B10R1.18 O=C(O)CC1=CC=NC=C1 JZ0762 [0,0,0,0,0,1|3,0,0]=4 443 B10R1.18 O=C(O)CC1=CC=NC=C1 LT3467 [0,0,0,0,0,1|3,0,0]=4 444 B10R1.18 O=C(O)CC1=CN=CN=C1 YH05329 [0,0,0,0,0,1|2,0,0]=3 445 B10R1.18 O=C(O)CC1=NC=CC=C1 JZ0740 [0,0,0,0,0,1|3,0,0]=4 446 B10R1.18 O=C(O)CC1=NC=CC=C1 YH65464 [0,0,0,0,0,1|3,0,0]=4 447 B10R1.18 S=C(Cl)OC1=CC=CC=C1 HL0590 [0,0,0,0,0,1|2,1,0]=4 448 B7R0.1 CC\C=C\C=C\C=O LQ2607 [1,0,1,0,0,0|1,0,1]=4 449 B7R0.4 C\C=C\C=C\C(=O)[O-] LQ4414 [1,0,1,0,0,0|1,0,1]=4 450 B7R1.3 BrC1=CC=NN=C1 LT0310 [2,0,0,0,0,0|2,0,0]=4 451 B7R1.3 BrC1=CC=NN=C1 RT8678 [2,0,0,0,0,0|2,0,0]=4 452 B7R1.3 BrC1=CN=CC=C1 LT6741 [2,0,0,0,0,0|1,0,0]=3 453 B7R1.3 CC1=CN=CC=C1 JZ1098 [2,0,0,0,0,0|0,0,1]=3 454 B7R1.3 CC1=CN=CN=C1 XJ2026 [2,0,0,0,0,0|1,0,1]=4 455 B7R1.3 ClC1=CC=CN=C1 LT6769 [2,0,0,0,0,0|1,0,0]=3 456 B7R1.3 ClC1=CC=CN=N1 XJ1615 [2,0,0,0,0,0|2,0,0]=4 457 B7R1.3 ClC1=CC=NN=C1 YH39647 [2,0,0,0,0,0|2,0,0]=4 458 B7R1.3 ClC1=CN=CC=N1 LT6518 [2,0,0,0,0,0|2,0,0]=4 459 B7R1.3 Cl[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 RT11347 [2,0,0,0,0,0|2,0,0]=4 460 B7R1.3 FC1=CN=CC=C1 LT2946 [2,0,0,0,0,0|1,0,0]=3 461 B7R1.3 FC1=CN=CN=C1 HL0332 [2,0,0,0,0,0|2,0,0]=4 462 B7R1.3 IC1=CC=CC=C1 HL0102 [2,0,0,0,0,0|2,0,0]=4 463 B7R1.3 IC1=CC=CN=C1 XJ1614 [2,0,0,0,0,0|1,0,0]=3 464 B7R1.3 NC1=CC=CC=C1 XJ0949 [2,0,0,0,0,0|1,0,0]=3 465 B7R1.3 NC1=CC=CN=C1 LT6719 [2,0,0,0,0,0|0,0,0]=2 466 B7R1.3 NC1=CC=NC=C1 CJ2909 [2,0,0,0,0,0|2,0,0]=4 467 B7R1.3 NC1=CC=NN=C1 XJ4576 [2,0,0,0,0,0|1,0,0]=3 468 B7R1.3 NC1=NC=CC=C1 LT1809 [2,0,0,0,0,0|2,0,0]=4 469 B7R1.3 NC1=NN=CC=C1 YH93684 [2,0,0,0,0,0|1,0,0]=3 470 B7R1.3 O=C1C=CC=NN1 XJ0875 [2,0,0,0,0,0|1,0,0]=3 471 B7R1.3 OC1=CC=CC=C1 HL1861 [2,0,0,0,0,0|1,0,1]=4 472 B7R1.3 OC1=CC=CN=C1 LT6810 [2,0,0,0,0,0|0,0,1]=3 473 B7R1.3 OC1=CC=NN=C1 YH45348 [2,0,0,0,0,0|1,0,1]=4 474 B7R1.3 OC1=CN=CN=C1 M0300483 [2,0,0,0,0,0|1,0,1]=4 475 B7R1.3 SC1=CC=CN=C1 YH37913 [2,0,0,0,0,0|0,1,0]=3 476 B7R1.3 SC1=NC=CN=C1 LQ4963 [2,0,0,0,0,0|1,1,0]=4 477 B7R1.3 [15NH2]C1=NC=CC=C1 RT2238 [2,0,0,0,0,0|2,0,0]=4 478 B7R1.3 [Hg+]C1=CC=CC=C1 HL1275 [2,0,0,0,0,0|2,0,0]=4 479 B7R1.3 [Hg+]C1=CC=CC=C1 LQ0034 [2,0,0,0,0,0|2,0,0]=4 480 B7R1.3 [Li]C1=CC=CC=C1 HL0103 [2,0,0,0,0,0|2,0,0]=4 481 B7R1.3 [O-]C1=CC=CC=C1 LQ3910 [2,0,0,0,0,0|1,0,1]=4 482 B7R1.3 [SH2+]C1=CC=CC=C1 RT12088 [2,0,0,0,0,0|1,1,0]=4 483 B9R1.1 C#CC1=CN=C(Br)C=C1 RT18788 [1,1,0,0,0,0|1,0,1]=4 484 B9R1.1 C#CC1=CN=C(Cl)C=C1 RT15378 [1,1,0,0,0,0|1,0,1]=4 485 B9R1.1 C(=O)C1=CC=C(Br)C=C1 HL0659 [1,1,0,0,0,0|1,0,0]=3 486 B9R1.1 C(=O)C1=CC=C(Cl)C=C1 XJ0297 [1,1,0,0,0,0|1,0,0]=3 487 B9R1.1 C(=O)C1=CC=C(Cl)N=C1 JZ0751 [1,1,0,0,0,0|0,0,0]=2 488 B9R1.1 C(=O)C1=CC=C(F)C=C1 RT10834 [1,1,0,0,0,0|1,0,0]=3 489 B9R1.1 C(=O)C1=CC=C(N)N=C1 RT2853 [1,1,0,0,0,0|0,0,0]=2 490 B9R1.1 C=CC1=CC=C(Br)C=C1 XJ2035 [1,1,0,0,0,0|2,0,0]=4 491 B9R1.1 C=CC1=CC=C(C)C=C1 XJ1131 [1,1,0,0,0,0|2,0,0]=4 492 B9R1.1 C=CC1=CC=C(Cl)C=C1 JZ4358 [1,1,0,0,0,0|2,0,0]=4 493 B9R1.1 C=CC1=CC=C(F)C=C1 LQ0811 [1,1,0,0,0,0|2,0,0]=4 494 B9R1.1 C=CC1=CC=C(N)C=C1 LQ1825 [1,1,0,0,0,0|2,0,0]=4 495 B9R1.1 C=CC1=CN=C(C)C=C1 XJ0560 [1,1,0,0,0,0|1,0,0]=3 496 B9R1.1 C=CC1=CN=C(C)C=N1 LT2115 [1,1,0,0,0,0|2,0,0]=4 497 B9R1.1 CC1=CC=C(C=O)C=C1 XJ0296 [1,1,0,0,0,0|1,0,0]=3 498 B9R1.1 CC1=CC=C(C=O)C=N1 YH05496 [1,1,0,0,0,0|0,0,0]=2 499 B9R1.1 CC1=CC=C(CN)C=C1 XJ0294 [1,1,0,0,0,0|1,0,1]=4 500 B9R1.1 CC1=CC=C(CN)C=N1 RT4381 [1,1,0,0,0,0|0,0,1]=3 501 B9R1.1 CC1=CC=C(NN)C=C1 JZ4047 [1,1,0,0,0,0|2,0,0]=4 502 B9R1.1 CC1=CC=C(NN)C=C1 XJ0909 [1,1,0,0,0,0|2,0,0]=4 503 B9R1.1 CC1=CN=C(C=O)C=C1 HL2821 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.1 CC1=NC=C(C#N)C=C1 JZ2269 [1,1,0,0,0,0|0,0,2]=4 505 B9R1.1 CC1=NC=C(C=O)C=N1 HL4933 [1,1,0,0,0,0|1,0,0]=3 506 B9R1.1 CC1=NC=C(CCl)C=C1 RT12579 [1,1,0,0,0,0|1,0,1]=4 507 B9R1.1 CC1=NC=C(NN)C=C1 YH93974 [1,1,0,0,0,0|1,0,0]=3 508 B9R1.1 CCC1=CN=C(C)C=C1 YH20573 [1,1,0,0,0,0|1,0,1]=4 509 B9R1.1 COC1=CC=C(C)N=C1 LX2638 [1,1,0,0,0,0|2,0,0]=4 510 B9R1.1 COC1=CC=C(N)N=C1 XJ3542 [1,1,0,0,0,0|2,0,0]=4 511 B9R1.1 COC1=CN=C(Cl)C=C1 HL3515 [1,1,0,0,0,0|2,0,0]=4 512 B9R1.1 CSC1=CN=C(N)C=C1 RT4644 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.1 ClC1=NC=C(CBr)C=C1 YH41777 [1,1,0,0,0,0|1,0,1]=4 514 B9R1.1 ClCC1=CN=C(Cl)C=C1 LT3696 [1,1,0,0,0,0|1,0,1]=4 515 B9R1.1 N#CC1=CN=C(Br)C=C1 HL3516 [1,1,0,0,0,0|0,0,2]=4 516 B9R1.1 NC1=CC=C(C=O)C=C1 LQ1002 [1,1,0,0,0,0|1,0,0]=3 517 B9R1.1 NC1=CC=C(CO)C=N1 YH25373 [1,1,0,0,0,0|0,0,2]=4 518 B9R1.1 NC1=NC=C(C=O)C=N1 YH28209 [1,1,0,0,0,0|1,0,0]=3 519 B9R1.1 NCC1=CC=C(Br)C=C1 YH59044 [1,1,0,0,0,0|1,0,1]=4 520 B9R1.1 NCC1=CC=C(Cl)C=C1 LT2948 [1,1,0,0,0,0|1,0,1]=4 521 B9R1.1 NCC1=CC=C(F)C=C1 RT1536 [1,1,0,0,0,0|1,0,1]=4 522 B9R1.1 NCC1=CC=C(I)C=C1 LT1523 [1,1,0,0,0,0|1,0,1]=4 523 B9R1.1 NCC1=CC=C(N)C=C1 JZ2534 [1,1,0,0,0,0|1,0,1]=4 524 B9R1.1 NCC1=CC=C(O)C=C1 LQ1367 [1,1,0,0,0,0|1,0,1]=4 525 B9R1.1 NCC1=CN=C(Cl)C=C1 HL4996 [1,1,0,0,0,0|0,0,1]=3 526 B9R1.1 NNC1=CC=C(Br)C=C1 HL0058 [1,1,0,0,0,0|2,0,0]=4 527 B9R1.1 NNC1=CC=C(Br)C=C1 XJ1129 [1,1,0,0,0,0|2,0,0]=4 528 B9R1.1 NNC1=CC=C(Cl)C=C1 JZ4359 [1,1,0,0,0,0|2,0,0]=4 529 B9R1.1 NNC1=CC=C(Cl)C=C1 JZ4360 [1,1,0,0,0,0|2,0,0]=4 530 B9R1.1 NNC1=CC=C(F)C=C1 LQ1485 [1,1,0,0,0,0|2,0,0]=4 531 B9R1.1 NNC1=NC=C(Br)N=C1 YH20189 [1,1,0,0,0,0|2,0,0]=4 532 B9R1.1 O=CC1=CC=C(Br)N=C1 LT3321 [1,1,0,0,0,0|0,0,0]=2 533 B9R1.1 O=CC1=CC=C(F)N=C1 YH13440 [1,1,0,0,0,0|0,0,0]=2 534 B9R1.1 O=CC1=CC=C(I)C=C1 XJ4171 [1,1,0,0,0,0|1,0,0]=3 535 B9R1.1 O=CC1=CC=C(O)C=C1 RT12842 [1,1,0,0,0,0|1,0,0]=3 536 B9R1.1 O=CC1=CC=C(O)N=C1 LT3365 [1,1,0,0,0,0|0,0,0]=2 537 B9R1.1 O=CC1=CC=C(S)C=C1 RT11108 [1,1,0,0,0,0|1,0,0]=3 538 B9R1.1 O=CC1=NC=C(Br)C=C1 LQ4682 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.1 O=NC1=CC=C(O)C=C1 RT11953 [1,1,0,0,0,0|2,0,0]=4 540 B9R1.1 OCC1=CC=C(Cl)N=C1 LT1692 [1,1,0,0,0,0|0,0,2]=4 541 B9R1.1 OCC1=CC=C(F)N=C1 YH59200 [1,1,0,0,0,0|0,0,2]=4 542 B9R1.1 OCC1=CN=C(O)C=C1 YH24285 [1,1,0,0,0,0|0,0,2]=4 543 B9R1.2 C=CC1=CC(Br)=CC=C1 LT6743 [1,1,0,0,0,0|2,0,0]=4 544 B9R1.2 C=CC1=CC(Cl)=CC=C1 XJ2036 [1,1,0,0,0,0|2,0,0]=4 545 B9R1.2 C=CC1=CC(F)=CC=C1 LT6798 [1,1,0,0,0,0|2,0,0]=4 546 B9R1.2 C=CC1=CC(O)=CC=C1 RT11655 [1,1,0,0,0,0|2,0,0]=4 547 B9R1.2 C=CC1=CC=CC(C)=C1 LQ4468 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.2 CC1=CC(C=O)=CC=C1 JZ3952 [1,1,0,0,0,0|1,0,0]=3 549 B9R1.2 CC1=CC(CN)=CC=C1 LQ0295 [1,1,0,0,0,0|1,0,1]=4 550 B9R1.2 CC1=CC(NN)=CC=C1 LL0975 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.2 CC1=CC=CC(C=O)=N1 HL0653 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.2 COC1=CC(Br)=CN=C1 LT3954 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.2 COC1=CN=CC(I)=C1 LT3416 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.2 COC1=CN=CC(N)=C1 LL1064 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.2 N#CC1=CN=CC(N)=C1 YH32932 [1,1,0,0,0,0|0,0,2]=4 556 B9R1.2 N#CC1=CN=CC(O)=C1 YH36436 [1,1,0,0,0,0|0,0,2]=4 557 B9R1.2 NC1=CN=CC(CO)=C1 YH01842 [1,1,0,0,0,0|0,0,2]=4 558 B9R1.2 NCC1=CC(Br)=CC=C1 XJ3599 [1,1,0,0,0,0|1,0,1]=4 559 B9R1.2 NCC1=CC(I)=CC=C1 LQ1363 [1,1,0,0,0,0|1,0,1]=4 560 B9R1.2 NCC1=CC(N)=CC=C1 LT2553 [1,1,0,0,0,0|1,0,1]=4 561 B9R1.2 NCC1=CC=CC(Cl)=C1 LT6763 [1,1,0,0,0,0|1,0,1]=4 562 B9R1.2 NNC1=CC=CC(Cl)=C1 HL2219 [1,1,0,0,0,0|2,0,0]=4 563 B9R1.2 NNC1=CC=CC(F)=C1 JZ2155 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.2 O=CC1=CC(Br)=CN=C1 LT3730 [1,1,0,0,0,0|0,0,0]=2 565 B9R1.2 O=CC1=CC(Br)=NC=C1 LL1981 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.2 O=CC1=CC(Cl)=CC=C1 XJ1050 [1,1,0,0,0,0|1,0,0]=3 567 B9R1.2 O=CC1=CC(F)=CC=C1 LT6791 [1,1,0,0,0,0|1,0,0]=3 568 B9R1.2 O=CC1=CC(F)=CN=C1 YH65531 [1,1,0,0,0,0|0,0,0]=2 569 B9R1.2 O=CC1=CC(O)=NC=C1 YH65488 [1,1,0,0,0,0|2,0,0]=4 570 B9R1.2 O=CC1=CC=CC(Br)=C1 LQ2404 [1,1,0,0,0,0|1,0,0]=3 571 B9R1.2 O=CC1=CC=CC(Cl)=N1 YH06167 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.2 O=CC1=CC=CC(O)=C1 JZ0346 [1,1,0,0,0,0|1,0,0]=3 573 B9R1.2 O=CC1=CC=NC(Cl)=C1 LX3013 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.2 O=CC1=CC=NC(F)=C1 HL3440 [1,1,0,0,0,0|2,0,0]=4 575 B9R1.2 OCC1=CC(Br)=CN=C1 CJ2881 [1,1,0,0,0,0|0,0,2]=4 576 B9R1.8 C=CSC1=CC=CC=C1 HL0999 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.8 CNCC1=CC=CC=C1 RT3204 [1,1,0,0,0,0|1,0,1]=4 578 B9R1.8 CNCC1=CC=CN=C1 LQ4200 [1,1,0,0,0,0|0,0,1]=3 579 B9R1.8 COCC1=CC=CN=C1 LQ5401 [1,1,0,0,0,0|0,0,2]=4 580 B9R1.8 C\C=C\C1=CC=CC=C1 RT6350 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.8 C\C=C\C1=CC=CC=C1 RT6415 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.8 N#CCC1=CC=CN=C1 LT6846 [1,1,0,0,0,0|0,0,2]=4 583 B9R1.8 NCCC1=CC=CN=C1 LQ4201 [1,1,0,0,0,0|0,0,1]=3 584 B9R1.8 NNCC1=CC=CC=C1 LQ1000 [1,1,0,0,0,0|1,0,1]=4 585 B9R1.8 NNCC1=CC=CC=C1 LX3048 [1,1,0,0,0,0|1,0,1]=4 586 B9R1.8 NOCC1=CC=CC=C1 LT5864 [1,1,0,0,0,0|1,0,1]=4 587 B9R1.8 O=C=NC1=CC=CC=C1 LL0339 [1,1,0,0,0,0|1,0,1]=4 588 B9R1.8 O=CCC1=CC=CC=C1 XJ0479 [1,1,0,0,0,0|1,0,0]=3 589 B9R1.8 O=CCC1=CC=CN=C1 RT9275 [1,1,0,0,0,0|0,0,0]=2 590 B9R1.8 O=COC1=CC=CC=C1 HL2038 [1,1,0,0,0,0|1,0,0]=3 591 B9R1.8 O=N\C=C1\C=CC=CN1 RT8508 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.8 O\N=C\C1=CC=CC=C1 RT6343 [1,1,0,0,0,0|1,0,1]=4 593 B9R1.8 [2H]\C=C\C1=CC=CC=C1 RT11345 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.15 C(=O)C1=C(Br)C=CC=N1 YH00040 [1,1,0,0,0,0|2,0,0]=4 595 B9R1.15 C(=O)C1=C(Cl)C=CC=C1 XJ0153 [1,1,0,0,0,0|1,0,0]=3 596 B9R1.15 C(=O)C1=C(F)C=CC=C1 LT6545 [1,1,0,0,0,0|1,0,0]=3 597 B9R1.15 C(=O)C1=CN=CC=C1Br YH36722 [1,1,0,0,0,0|0,0,0]=2 598 B9R1.15 C(=O)C1=CN=CC=C1Cl YH25552 [1,1,0,0,0,0|0,0,0]=2 599 B9R1.15 C=CC1=C(Br)C=CC=C1 XJ2039 [1,1,0,0,0,0|2,0,0]=4 600 B9R1.15 C=CC1=C(F)C=CC=C1 HL1763 [1,1,0,0,0,0|2,0,0]=4 601 B9R1.15 C=CC1=CC=CC=C1C XJ1115 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.15 C=CC1=CC=CC=C1O RT11656 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.15 CC1=C(C#N)C=NC=C1 LQ2868 [1,1,0,0,0,0|0,0,2]=4 604 B9R1.15 CC1=C(C=O)C=CC=N1 YH09284 [1,1,0,0,0,0|0,0,0]=2 605 B9R1.15 CC1=CC=CC=C1C=O LQ0970 [1,1,0,0,0,0|1,0,0]=3 606 B9R1.15 CC1=CC=CC=C1CN XJ0151 [1,1,0,0,0,0|1,0,1]=4 607 B9R1.15 CC1=CC=CN=C1C=O LX3316 [1,1,0,0,0,0|2,0,0]=4 608 B9R1.15 CC1=NC=CC=C1CCl RT8738 [1,1,0,0,0,0|1,0,1]=4 609 B9R1.15 CCC1=C(C)C=CN=C1 LQ0971 [1,1,0,0,0,0|1,0,1]=4 610 B9R1.15 CCC1=C(F)N=CC=C1 LT3213 [1,1,0,0,0,0|1,0,1]=4 611 B9R1.15 CCC1=CC=CN=C1N RT2490 [1,1,0,0,0,0|1,0,1]=4 612 B9R1.15 COC1=CC=CN=C1Br XJ4798 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.15 COC1=CC=CN=C1C YH50584 [1,1,0,0,0,0|2,0,0]=4 614 B9R1.15 COC1=CC=CN=C1Cl XJ5647 [1,1,0,0,0,0|2,0,0]=4 615 B9R1.15 COC1=CC=CN=C1N XJ3561 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.15 N#CC1=C(F)C=CN=C1 YH23267 [1,1,0,0,0,0|0,0,2]=4 617 B9R1.15 N#CC1=CC=CN=C1Cl LT6486 [1,1,0,0,0,0|0,0,2]=4 618 B9R1.15 N#CC1=CC=CN=C1F LQ2597 [1,1,0,0,0,0|0,0,2]=4 619 B9R1.15 N#CC1=CC=CN=C1N LT3414 [1,1,0,0,0,0|0,0,2]=4 620 B9R1.15 N#CC1=CC=CN=C1O RT18046 [1,1,0,0,0,0|0,0,2]=4 621 B9R1.15 N#CC1=CC=CN=C1O XJ2928 [1,1,0,0,0,0|0,0,2]=4 622 B9R1.15 N#CC1=CN=CC=C1Cl RT9283 [1,1,0,0,0,0|0,0,2]=4 623 B9R1.15 N#CC1=CN=CC=C1O YH93754 [1,1,0,0,0,0|0,0,2]=4 624 B9R1.15 NC1=C(C=O)C=CN=C1 RT2203 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.15 NC1=C(C=O)C=NC=C1 YH01035 [1,1,0,0,0,0|0,0,0]=2 626 B9R1.15 NC1=C(C=O)N=CC=C1 RT2315 [1,1,0,0,0,0|2,0,0]=4 627 B9R1.15 NC1=C(CO)C=NC=C1 HL3458 [1,1,0,0,0,0|0,0,2]=4 628 B9R1.15 NC1=NC=CC=C1C=O LX3234 [1,1,0,0,0,0|0,0,0]=2 629 B9R1.15 NC1=NC=CC=C1CO JZ5602 [1,1,0,0,0,0|0,0,2]=4 630 B9R1.15 NCC1=C(I)C=CC=C1 YH59249 [1,1,0,0,0,0|1,0,1]=4 631 B9R1.15 NCC1=C(N)C=CC=C1 YH52512 [1,1,0,0,0,0|1,0,1]=4 632 B9R1.15 NCC1=C(O)C=CC=C1 LQ1562 [1,1,0,0,0,0|1,0,1]=4 633 B9R1.15 NCC1=CC=CC=C1Br LT0305 [1,1,0,0,0,0|1,0,1]=4 634 B9R1.15 NCC1=CC=CC=C1Cl LT6512 [1,1,0,0,0,0|1,0,1]=4 635 B9R1.15 NCC1=CC=CN=C1Cl YH66504 [1,1,0,0,0,0|0,0,1]=3 636 B9R1.15 NCC1=CC=CNC1=O RT2213 [1,1,0,0,0,0|0,0,2]=4 637 B9R1.15 NNC1=C(F)C=CC=C1 JZ2154 [1,1,0,0,0,0|2,0,0]=4 638 B9R1.15 NNC1=CC=CC=C1Br XJ5550 [1,1,0,0,0,0|2,0,0]=4 639 B9R1.15 NNC1=CC=CC=C1F LT1512 [1,1,0,0,0,0|2,0,0]=4 640 B9R1.15 O=CC1=C(Br)C=CC=C1 LT0299 [1,1,0,0,0,0|1,0,0]=3 641 B9R1.15 O=CC1=C(Br)C=NC=C1 YH14731 [1,1,0,0,0,0|2,0,0]=4 642 B9R1.15 O=CC1=C(F)C=NC=C1 LT3415 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.15 O=CC1=C(O)C=NC=C1 YH42136 [1,1,0,0,0,0|2,0,0]=4 644 B9R1.15 O=CC1=CC=CN=C1Br LQ5548 [1,1,0,0,0,0|0,0,0]=2 645 B9R1.15 O=CC1=CC=CN=C1Cl LT3322 [1,1,0,0,0,0|0,0,0]=2 646 B9R1.15 O=CC1=CC=CN=C1F LT3359 [1,1,0,0,0,0|0,0,0]=2 647 B9R1.15 O=CC1=NC=CC=C1F LQ4687 [1,1,0,0,0,0|2,0,0]=4 648 B9R1.15 O=CC1=NC=CC=C1O LX2628 [1,1,0,0,0,0|2,0,0]=4 649 B9R1.15 O=CC1=NC=CN=C1Cl JZ0394 [1,1,0,0,0,0|1,0,0]=3 650 B9R1.15 OCC1=C(Cl)C=CN=C1 HL3791 [1,1,0,0,0,0|0,0,2]=4 651 B9R1.15 OCC1=C(F)N=CC=C1 LT3420 [1,1,0,0,0,0|0,0,2]=4 652 B9R1.11 CCC(=O)C1=CC=CN1 JZ4355 [0,1,0,0,1,0|1,0,1]=4 653 B9R1.11 CCC(=O)C1=CC=CO1 JZ2245 [0,1,0,0,1,0|2,0,0]=4 654 B9R1.11 CCC(=O)C1=CC=CS1 JZ4817 [0,1,0,0,1,0|2,0,0]=4 655 B9R1.11 CCC(=O)C1=CC=CS1 LT0591 [0,1,0,0,1,0|2,0,0]=4 656 B9R1.11 COC(=O)C1=CC=CO1 LX2989 [0,1,0,0,1,0|2,0,0]=4 657 B9R1.11 COC(=O)C1=CNC=C1 YH51079 [0,1,0,0,1,0|1,0,1]=4 658 B9R1.11 COC(=O)C1=CNC=N1 LX2313 [0,1,0,0,1,0|2,0,0]=4 659 B9R1.11 COC(=O)C1=NNC=C1 RT8686 [0,1,0,0,1,0|2,0,0]=4 660 B9R1.11 CSC(=O)C1=CC=CO1 JZ4812 [0,1,0,0,1,0|2,0,0]=4 661 B9R1.11 C\N=C(/N)N1C=CC=N1 LL2534 [0,1,0,0,1,0|2,0,0]=4 662 B9R1.11 N=C(NO)C1=CC=CS1 LT0733 [0,1,0,0,1,0|2,0,0]=4 663 B9R1.11 NNC(=O)C1=CC=CO1 XJ2474 [0,1,0,0,1,0|1,0,0]=3 664 B9R1.11 NNC(=O)C1=CC=CS1 LQ2134 [0,1,0,0,1,0|1,0,0]=3 665 B9R1.11 O=C(CCl)C1=CC=CS1 LT0548 [0,1,0,0,1,0|2,0,0]=4 666 B9R1.19 NS(=O)(=O)C1=CC=CS1 LQ3099 [0,1,0,0,1,0|2,0,0]=4 667 B9R1.19 NS(=O)(=O)C1=CNC=N1 YH08624 [0,1,0,0,1,0|2,0,0]=4 668 B9R1.35 CC(=O)C1=CC(C)=CS1 JZ4815 [0,1,0,0,1,0|2,0,0]=4 669 B9R1.35 CC(=O)C1=CC(Cl)=CS1 XJ5172 [0,1,0,0,1,0|2,0,0]=4 670 B9R1.35 CC(=O)C1=CC=C(Br)S1 XJ2893 [0,1,0,0,1,0|2,0,0]=4 671 B9R1.35 CC(=O)C1=CC=C(C)O1 JZ1181 [0,1,0,0,1,0|2,0,0]=4 672 B9R1.35 CC(=O)C1=CC=C(Cl)S1 LQ1289 [0,1,0,0,1,0|2,0,0]=4 673 B9R1.35 CC(=O)C1=CN(C)C=C1 JZ4275 [0,1,0,0,1,0|1,0,1]=4 674 B9R1.35 CC1=CC(C(=O)Cl)=NO1 XJ5355 [0,1,0,0,1,0|2,0,0]=4 675 B9R1.35 CC1=CC(C(=O)O)=NO1 HL2548 [0,1,0,0,1,0|2,0,0]=4 676 B9R1.35 CC1=CC=C(C(=O)Cl)S1 LT0712 [0,1,0,0,1,0|2,0,0]=4 677 B9R1.35 CC1=CC=C(C(=O)O)S1 LQ2018 [0,1,0,0,1,0|2,0,0]=4 678 B9R1.35 CC1=CN=C(C(=O)O)O1 YH02221 [0,1,0,0,1,0|2,0,0]=4 679 B9R1.35 CC1=CN=C(C(=O)O)S1 CJ2740 [0,1,0,0,1,0|2,0,0]=4 680 B9R1.35 CC1=CNC(C(=O)O)=C1 YH42507 [0,1,0,0,1,0|1,0,1]=4 681 B9R1.35 CC1=COC(C(=O)O)=N1 RT15003 [0,1,0,0,1,0|2,0,0]=4 682 B9R1.35 CC1=CSC(C(=O)O)=C1 XJ4050 [0,1,0,0,1,0|2,0,0]=4 683 B9R1.35 CC1=CSC(C(=O)O)=N1 YH35093 [0,1,0,0,1,0|2,0,0]=4 684 B9R1.35 CC1=NC(C(=O)O)=CN1 RT14528 [0,1,0,0,1,0|2,0,0]=4 685 B9R1.35 CC1=NC(C(=O)O)=CO1 RT14087 [0,1,0,0,1,0|2,0,0]=4 686 B9R1.35 CC1=NC=C(C(=O)O)S1 YH59279 [0,1,0,0,1,0|2,0,0]=4 687 B9R1.35 CC1=NNC(C(=O)O)=C1 YH14439 [0,1,0,0,1,0|2,0,0]=4 688 B9R1.35 CC1=NOC(C(=O)O)=C1 LX2905 [0,1,0,0,1,0|2,0,0]=4 689 B9R1.35 CN1C=NC(C(=O)O)=C1 XJ5462 [0,1,0,0,1,0|2,0,0]=4 690 B9R1.35 NC(=O)C1=CC([O-])=NO1 RT4110 [0,1,0,0,1,0|1,0,0]=3 691 B9R1.35 NC1=NC(C(=O)O)=CS1 LT2287 [0,1,0,0,1,0|2,0,0]=4 692 B9R1.35 O=C(O)C1=CC(Br)=CS1 LQ3954 [0,1,0,0,1,0|2,0,0]=4 693 B9R1.35 O=C(O)C1=CC(Br)=CS1 RT8377 [0,1,0,0,1,0|2,0,0]=4 694 B9R1.35 O=C(O)C1=CC=C(Br)S1 JZ0392 [0,1,0,0,1,0|2,0,0]=4 695 B9R1.35 O=C(O)C1=CC=C(Cl)S1 XJ4788 [0,1,0,0,1,0|2,0,0]=4 696 B9R1.35 O=C(O)C1=COC(F)=N1 RT15298 [0,1,0,0,1,0|2,0,0]=4 697 B9R1.35 O=C(O)C1=CSC(Br)=N1 JZ0401 [0,1,0,0,1,0|2,0,0]=4 698 B9R1.35 O=C(O)C1=NC(Br)=CO1 RT15489 [0,1,0,0,1,0|2,0,0]=4 699 B9R1.35 O=C(O)C1=NNC(Br)=C1 YH32024 [0,1,0,0,1,0|2,0,0]=4 700 B9R1.35 O=C([O-])C1=CC(O)=NS1 RT7884 [0,1,0,0,1,0|2,0,0]=4 701 B9R1.41 CC(=O)C1=C(C)C=CS1 JZ4814 [0,1,0,0,1,0|2,0,0]=4 702 B9R1.41 CC(=O)C1=CC=CN1C JZ0998 [0,1,0,0,1,0|1,0,1]=4 703 B9R1.41 CC1=C(C(=O)Cl)C=CO1 JZ2760 [0,1,0,0,1,0|2,0,0]=4 704 B9R1.41 CC1=C(C(=O)Cl)C=NO1 LT3452 [0,1,0,0,1,0|2,0,0]=4 705 B9R1.41 CC1=C(C(=O)Cl)SC=N1 YH06262 [0,1,0,0,1,0|2,0,0]=4 706 B9R1.41 CC1=C(C(=O)O)C=CO1 JZ3070 [0,1,0,0,1,0|2,0,0]=4 707 B9R1.41 CC1=C(C(=O)O)C=NO1 LQ5080 [0,1,0,0,1,0|2,0,0]=4 708 B9R1.41 CC1=C(C(=O)O)N=CO1 YH22337 [0,1,0,0,1,0|2,0,0]=4 709 B9R1.41 CC1=C(C(=O)O)N=CS1 YH65662 [0,1,0,0,1,0|2,0,0]=4 710 B9R1.41 CC1=C(C(=O)O)NC=C1 YH94680 [0,1,0,0,1,0|1,0,1]=4 711 B9R1.41 CC1=C(C(=O)O)OC=C1 JZ2549 [0,1,0,0,1,0|2,0,0]=4 712 B9R1.41 CC1=C(C(=O)O)OC=N1 RT15059 [0,1,0,0,1,0|2,0,0]=4 713 B9R1.41 CC1=C(C(=O)O)ON=C1 YH50311 [0,1,0,0,1,0|2,0,0]=4 714 B9R1.41 CC1=C(C(=O)O)SC=C1 LT2617 [0,1,0,0,1,0|2,0,0]=4 715 B9R1.41 CC1=C(C(=O)O)SC=N1 JZ5396 [0,1,0,0,1,0|2,0,0]=4 716 B9R1.41 CC1=CNC=C1C(=O)O RT10098 [0,1,0,0,1,0|1,0,1]=4 717 B9R1.41 CC1=CON=C1C(=O)O YH46481 [0,1,0,0,1,0|2,0,0]=4 718 B9R1.41 CN1C=CN=C1C(=O)O JZ5397 [0,1,0,0,1,0|2,0,0]=4 719 B9R1.41 CN1C=NC=C1C(=O)O XJ5475 [0,1,0,0,1,0|2,0,0]=4 720 B9R1.41 CN1N=CC=C1C(=O)O YH37728 [0,1,0,0,1,0|2,0,0]=4 721 B9R1.41 NC(=O)C1=C(N)N=CN1 LX3324 [0,1,0,0,1,0|1,0,0]=3 722 B9R1.41 NC(=O)C1=C(N)NC=N1 YH65889 [0,1,0,0,1,0|1,0,0]=3 723 B9R1.41 NC(=O)C1=C(N)NN=C1 RT2462 [0,1,0,0,1,0|1,0,0]=3 724 B9R1.41 NC(=O)C1=C(N)OC=N1 YH53109 [0,1,0,0,1,0|1,0,0]=3 725 B9R1.41 NC(=O)C1=C(N)SC=N1 YH66366 [0,1,0,0,1,0|1,0,0]=3 726 B9R1.41 NC(=O)C1=C(O)NC=N1 RT14153 [0,1,0,0,1,0|1,0,0]=3 727 B9R1.41 NC(=O)C1=CNN=C1N RT2053 [0,1,0,0,1,0|1,0,0]=3 728 B9R1.41 NC1=C(C(=O)O)C=NN1 LT6718 [0,1,0,0,1,0|2,0,0]=4 729 B9R1.41 NC1=C(C(=O)O)SC=C1 YH06872 [0,1,0,0,1,0|2,0,0]=4 730 B9R1.41 NC1=C(C(=O)[O-])C=CS1 LT0567 [0,1,0,0,1,0|2,0,0]=4 731 B9R1.41 NC1=NNC=C1C(=O)O YH00680 [0,1,0,0,1,0|2,0,0]=4 732 B9R1.41 O=C(O)C1=C(F)C=CS1 YH54410 [0,1,0,0,1,0|2,0,0]=4 733 B9R1.41 O=C(O)C1=C(F)SC=C1 CJ3042 [0,1,0,0,1,0|2,0,0]=4 734 B9R1.41 O=C(O)C1=NOC=C1O RT18938 [0,1,0,0,1,0|2,0,0]=4 735 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 JZ2786 [0,1,0,0,0,1|2,0,0]=4 736 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 HL1838 [0,1,0,0,0,1|2,0,0]=4 737 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 YH18094 [0,1,0,0,0,1|2,0,0]=4 738 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 LL0348 [0,1,0,0,0,1|2,0,0]=4 739 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 XJ0481 [0,1,0,0,0,1|2,0,0]=4 740 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 RT12770 [0,1,0,0,0,1|2,0,0]=4 741 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 HL0695 [0,1,0,0,0,1|2,0,0]=4 742 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 XJ0551 [0,1,0,0,0,1|2,0,0]=4 743 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 YH54366 [0,1,0,0,0,1|2,0,0]=4 744 B11R1.20 CC(=O)SC1=CC=C(I)C=C1 YH14509 [0,1,0,0,0,1|2,0,0]=4 745 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 JZ4004 [0,1,0,0,0,1|1,0,0]=3 746 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 RT3249 [0,1,0,0,0,1|2,0,0]=4 747 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 XJ4357 [0,1,0,0,0,1|1,0,0]=3 748 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 XJ0550 [0,1,0,0,0,1|1,0,0]=3 749 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 XJ1279 [0,1,0,0,0,1|1,0,0]=3 750 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 LQ3999 [0,1,0,0,0,1|1,1,0]=4 751 B11R1.20 NC(=S)NC1=CC=C(Cl)C=C1 XJ2569 [0,1,0,0,0,1|1,1,0]=4 752 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 LT3063 [0,1,0,0,0,1|2,0,0]=4 753 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 HL1839 [0,1,0,0,0,1|2,0,0]=4 754 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 LQ3329 [0,1,0,0,0,1|2,0,0]=4 755 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 LQ1955 [0,1,0,0,0,1|2,0,0]=4 756 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 LT3076 [0,1,0,0,0,1|2,0,0]=4 757 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 RT12785 [0,1,0,0,0,1|2,0,0]=4 758 B11R1.20 O=C(O)CC1=CN=C(Cl)C=C1 YH59203 [0,1,0,0,0,1|1,0,0]=3 759 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 LL0879 [0,1,0,0,0,1|2,0,0]=4 760 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 JZ3849 [0,1,0,0,0,1|2,0,0]=4 761 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 HL0407 [0,1,0,0,0,1|2,0,0]=4 762 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 YH58730 [0,1,0,0,0,1|2,0,0]=4 763 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 JZ3850 [0,1,0,0,0,1|2,0,0]=4 764 B11R1.36 CN(C(=O)Cl)C1=CC=CC=C1 LQ2649 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 JZ0182 [0,1,0,0,0,1|1,0,0]=3 766 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 JZ0158 [0,1,0,0,0,1|2,0,0]=4 767 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 LT4728 [0,1,0,0,0,1|2,0,0]=4 768 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 YH52440 [0,1,0,0,0,1|2,0,0]=4 769 B11R1.36 O=C(Cl)C(Cl)C1=CC=CC=C1 LT6908 [0,1,0,0,0,1|2,0,0]=4 770 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 XJ1125 [0,1,0,0,0,1|2,0,0]=4 771 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 XJ2766 [0,1,0,0,0,1|2,0,0]=4 772 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 YH66089 [0,1,0,0,0,1|2,0,0]=4 773 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 JZ1417 [0,1,0,0,0,1|2,0,0]=4 774 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 LX2232 [0,1,0,0,0,1|2,0,0]=4 775 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 XJ0179 [0,1,0,0,0,1|2,0,0]=4 776 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 XJ4358 [0,1,0,0,0,1|2,0,0]=4 777 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 LT4732 [0,1,0,0,0,1|2,0,0]=4 778 B11R1.36 [C@H](C)(C(=O)O)C1=CC=CC=C1 JZ0854 [0,1,0,0,0,1|2,0,0]=4 779 B11R1.40 CNC(C)CC1=CC=CN=C1 RT1972 [0,1,0,0,0,1|1,0,1]=4 780 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 LQ0316 [0,1,0,0,0,1|2,0,0]=4 781 B11R1.40 NCC(=O)CC1=CC=CC=C1 RT12543 [0,1,0,0,0,1|1,0,0]=3 782 B11R1.40 NNC(=O)CC1=CC=CC=C1 JZ4307 [0,1,0,0,0,1|1,0,0]=3 783 B11R1.40 NNC(=O)CC1=CC=CN=C1 YH43733 [0,1,0,0,0,1|0,0,0]=2 784 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 RT9532 [0,1,0,0,0,1|2,0,0]=4 785 B11R1.40 NNC(=O)OC1=CC=CC=C1 LT4161 [0,1,0,0,0,1|1,0,0]=3 786 B11R1.40 O=C(CBr)CC1=CC=CC=C1 RT10869 [0,1,0,0,0,1|2,0,0]=4 787 B11R1.40 O=C(CBr)OC1=CC=CC=C1 JZ3957 [0,1,0,0,0,1|2,0,0]=4 788 B11R1.40 O=C(CCl)NC1=CC=CC=C1 YH08620 [0,1,0,0,0,1|2,0,0]=4 789 B11R1.40 O=C(CO)CC1=CC=CC=C1 RT6783 [0,1,0,0,0,1|2,0,0]=4 790 B11R1.40 O=C\C(Cl)=C\C1=CC=CC=C1 XJ4438 [0,1,0,0,0,1|2,0,0]=4 791 B11R1.86 CC(=O)CC1=CC=CC=C1Br RT11899 [0,1,0,0,0,1|2,0,0]=4 792 B11R1.86 CC(=O)NC1=CC=CC=C1Cl LL0941 [0,1,0,0,0,1|2,0,0]=4 793 B11R1.86 CC(=O)OC1=CC=CC=C1Br RT11882 [0,1,0,0,0,1|2,0,0]=4 794 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 LT2142 [0,1,0,0,0,1|2,0,0]=4 795 B11R1.86 CC1=CC=CC=C1NC(N)=O HL0193 [0,1,0,0,0,1|1,0,0]=3 796 B11R1.86 NC(=O)NC1=CC=CC=C1F XJ1260 [0,1,0,0,0,1|1,0,0]=3 797 B11R1.86 NC(=S)NC1=CC=CC=C1Cl XJ2860 [0,1,0,0,0,1|1,1,0]=4 798 B11R1.86 NC(=S)NC1=CC=CC=C1O LQ1826 [0,1,0,0,0,1|1,1,0]=4 799 B11R1.86 O=C(Cl)CC1=C(F)C=CC=C1 XJ0788 [0,1,0,0,0,1|2,0,0]=4 800 B11R1.86 O=C(Cl)OC1=CC=CC=C1Cl XJ4468 [0,1,0,0,0,1|2,0,0]=4 801 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 LT6517 [0,1,0,0,0,1|2,0,0]=4 802 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 LT6567 [0,1,0,0,0,1|2,0,0]=4 803 B11R1.86 O=C(O)CC1=CC=CC=C1Br LT6480 [0,1,0,0,0,1|2,0,0]=4 804 B11R1.86 O=C(O)CC1=CC=CC=C1S RT19094 [0,1,0,0,0,1|2,0,0]=4 805 B11R1.86 O=C(O)CC1=CC=CN=C1Cl YH66545 [0,1,0,0,0,1|1,0,0]=3 806 B11R1.86 O=C([O-])CC1=CC=CC=C1O JZ0260 [0,1,0,0,0,1|2,0,0]=4 807 B11R1.157 CC(=O)CC1=CC=CC(C)=C1 LQ4107 [0,1,0,0,0,1|2,0,0]=4 808 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 LL0985 [0,1,0,0,0,1|2,0,0]=4 809 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 HL0043 [0,1,0,0,0,1|2,0,0]=4 810 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 LQ0740 [0,1,0,0,0,1|2,0,0]=4 811 B11R1.157 CC1=CC(CC(=O)O)=CC=C1 JZ3970 [0,1,0,0,0,1|2,0,0]=4 812 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 YH66558 [0,1,0,0,0,1|1,0,0]=3 813 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 XJ4094 [0,1,0,0,0,1|2,0,0]=4 814 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 YH59202 [0,1,0,0,0,1|1,0,0]=3 815 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 LT3102 [0,1,0,0,0,1|2,0,0]=4 816 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 LQ1956 [0,1,0,0,0,1|2,0,0]=4 817 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 LQ1954 [0,1,0,0,0,1|2,0,0]=4 818 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 LT6766 [0,1,0,0,0,1|2,0,0]=4 819 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 LT3028 [0,1,0,0,0,1|2,0,0]=4 820 B11R1.157 O=C(O)CC1=CC=CC(S)=C1 RT19096 [0,1,0,0,0,1|2,0,0]=4 821 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 YH23236 [0,2,0,0,0,0|2,0,0]=4 822 B11R1.3 C(=O)C1=CC=C(C(=O)O)C=C1 JZ3943 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 JZ4383 [0,2,0,0,0,0|2,0,0]=4 824 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 LT3069 [0,2,0,0,0,0|2,0,0]=4 825 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 JZ3941 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 LQ3466 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.3 COC1=CC=C(C(=N)N)C=C1 RT1606 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 JZ0666 [0,2,0,0,0,0|2,0,0]=4 829 B11R1.3 COC1=CC=C(C(=O)O)C=C1 JZ4549 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.3 COC1=CC=C(C(C)=O)C=C1 JZ1135 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.3 COC1=CC=C(C(N)=O)C=C1 HL2560 [0,2,0,0,0,0|1,0,0]=3 832 B11R1.3 COC1=NC=C(C(=O)O)C=C1 JZ0752 [0,2,0,0,0,0|1,0,0]=3 833 B11R1.3 COC1=NC=C(C(=O)O)N=C1 YH59418 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 LT3084 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 XJ1918 [0,2,0,0,0,0|2,0,0]=4 836 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 JZ2849 [0,2,0,0,0,0|2,0,0]=4 837 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 JZ3942 [0,2,0,0,0,0|2,0,0]=4 838 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 LL1227 [0,2,0,0,0,0|1,0,0]=3 839 B11R1.3 N#CC1=NC=C([N+](=O)[O-])C=C1 LT3390 [0,2,0,0,0,0|2,0,0]=4 840 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 LQ0055 [0,2,0,0,0,0|2,0,0]=4 841 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CJ2943 [0,2,0,0,0,0|2,0,0]=4 842 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 JZ0800 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 YH66572 [0,2,0,0,0,0|1,0,0]=3 844 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 LL2125 [0,2,0,0,0,0|1,0,0]=3 845 B11R1.3 O=C(Cl)C1=CC=C(CCl)C=C1 HL0470 [0,2,0,0,0,0|2,0,0]=4 846 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 RT10589 [0,2,0,0,0,0|2,0,0]=4 847 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 HL4991 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 XJ2357 [0,2,0,0,0,0|2,0,0]=4 849 B11R1.3 O=CC1=NC=C([N+](=O)[O-])C=C1 YH56896 [0,2,0,0,0,0|2,0,0]=4 850 B11R1.19 CC1=NC=C(S(=O)(=O)Cl)C=C1 YH02892 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.19 CC1=NC=C(S(=O)(=O)O)C=C1 YH03032 [0,2,0,0,0,0|2,0,0]=4 852 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=N1 RT10485 [0,2,0,0,0,0|1,0,0]=3 853 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)C=C1 LT2781 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)N=C1 LX2170 [0,2,0,0,0,0|1,0,0]=3 855 B11R1.19 O=S(=O)(Cl)C1=CC=C(Cl)N=C1 LQ3132 [0,2,0,0,0,0|2,0,0]=4 856 B11R1.19 O=S(=O)(Cl)C1=CN=C(Br)C=C1 YH92953 [0,2,0,0,0,0|2,0,0]=4 857 B11R1.21 CC(=O)C1=CC(Br)=C(Br)C=C1 LX3134 [0,2,0,0,0,0|2,0,0]=4 858 B11R1.21 CC(=O)C1=CC(Br)=C(Cl)C=C1 YH06604 [0,2,0,0,0,0|2,0,0]=4 859 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 HL0596 [0,2,0,0,0,0|2,0,0]=4 860 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 JZ2152 [0,2,0,0,0,0|2,0,0]=4 861 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 XJ0695 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 LQ0788 [0,2,0,0,0,0|2,0,0]=4 863 B11R1.21 CC(=O)C1=CC(N)=C(F)C=C1 LX2782 [0,2,0,0,0,0|2,0,0]=4 864 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 JZ4491 [0,2,0,0,0,0|2,0,0]=4 865 B11R1.21 CC(=O)C1=CC=C(Br)C(F)=C1 LX2244 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 LL0209 [0,2,0,0,0,0|2,0,0]=4 867 B11R1.21 CC(=O)C1=CC=C(Cl)C(Cl)=C1 JZ2110 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 LQ3334 [0,2,0,0,0,0|2,0,0]=4 869 B11R1.21 CC1=C(Br)N=CC([N+](=O)[O-])=C1 LQ4368 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 LQ1233 [0,2,0,0,0,0|2,0,0]=4 871 B11R1.21 CC1=C(C)N=C(C(=O)O)C=N1 YH66048 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 LT6782 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 LQ0789 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 LL1505 [0,2,0,0,0,0|2,0,0]=4 875 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 XJ2209 [0,2,0,0,0,0|2,0,0]=4 876 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 LT2618 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.21 CC1=C(N)N=CC([N+](=O)[O-])=C1 XJ4430 [0,2,0,0,0,0|2,0,0]=4 878 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 LT2606 [0,2,0,0,0,0|2,0,0]=4 879 B11R1.21 CC1=CC(C(=O)Cl)=CC=C1Br LQ4321 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.21 CC1=CC(C(=O)O)=CN=C1F LT3944 [0,2,0,0,0,0|1,0,0]=3 881 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1F JZ5359 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1O JZ5453 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.21 CC1=CC=C(C(=O)Cl)C=C1I YH65834 [0,2,0,0,0,0|2,0,0]=4 884 B11R1.21 CC1=CC=C(C(=O)O)C=C1Cl LQ2823 [0,2,0,0,0,0|2,0,0]=4 885 B11R1.21 CC1=CC=C(C(N)=O)C=C1N LT3129 [0,2,0,0,0,0|1,0,0]=3 886 B11R1.21 CC1=CC=C(C(N)=S)C=C1F LL2430 [0,2,0,0,0,0|1,1,0]=4 887 B11R1.21 CC1=NC=C([N+](=O)[O-])C=C1Br YH42439 [0,2,0,0,0,0|2,0,0]=4 888 B11R1.21 CC1=[N+](C)C=C(C(N)=O)C=C1 RT9402 [0,2,0,0,0,0|0,0,1]=3 889 B11R1.21 N=C(N)C1=CC=C(N)C(N)=C1 YH14015 [0,2,0,0,0,0|2,0,0]=4 890 B11R1.21 NC(=O)C1=CC(N)=C(Cl)C=C1 LT2911 [0,2,0,0,0,0|1,0,0]=3 891 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 LT2770 [0,2,0,0,0,0|2,0,0]=4 892 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 LQ1234 [0,2,0,0,0,0|2,0,0]=4 893 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 LQ2164 [0,2,0,0,0,0|2,0,0]=4 894 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 JZ0161 [0,2,0,0,0,0|2,0,0]=4 895 B11R1.21 NC1=CC=C(C(=O)O)C=C1Br YH11091 [0,2,0,0,0,0|2,0,0]=4 896 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl YH49312 [0,2,0,0,0,0|2,0,0]=4 897 B11R1.21 NC1=CC=C(C(=O)O)C=C1F RT1599 [0,2,0,0,0,0|2,0,0]=4 898 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br RT2374 [0,2,0,0,0,0|2,0,0]=4 899 B11R1.21 NC1=NC=C([N+](=O)[O-])C=C1Br JZ5046 [0,2,0,0,0,0|2,0,0]=4 900 B11R1.21 O=C(Cl)C1=CC(Br)=C(F)C=C1 HL0321 [0,2,0,0,0,0|2,0,0]=4 901 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Cl)C=C1 LQ2350 [0,2,0,0,0,0|2,0,0]=4 902 B11R1.21 O=C(Cl)C1=CC(Cl)=C(F)C=C1 LL1129 [0,2,0,0,0,0|2,0,0]=4 903 B11R1.21 O=C(Cl)C1=CC(F)=C(F)C=C1 HL4581 [0,2,0,0,0,0|2,0,0]=4 904 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 XJ5456 [0,2,0,0,0,0|1,0,0]=3 905 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 HL1019 [0,2,0,0,0,0|2,0,0]=4 906 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 XJ5455 [0,2,0,0,0,0|1,0,0]=3 907 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 LQ0791 [0,2,0,0,0,0|2,0,0]=4 908 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 LQ5082 [0,2,0,0,0,0|2,0,0]=4 909 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 YH55532 [0,2,0,0,0,0|2,0,0]=4 910 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=C1 LQ5083 [0,2,0,0,0,0|2,0,0]=4 911 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 LT6724 [0,2,0,0,0,0|2,0,0]=4 912 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 LQ0790 [0,2,0,0,0,0|2,0,0]=4 913 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 LQ5176 [0,2,0,0,0,0|2,0,0]=4 914 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 LQ0734 [0,2,0,0,0,0|2,0,0]=4 915 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 LT6644 [0,2,0,0,0,0|2,0,0]=4 916 B11R1.21 O=[N+]([O-])C1=CN=C(Br)C(Br)=C1 JZ5049 [0,2,0,0,0,0|2,0,0]=4 917 B11R1.21 O=[N+]([O-])C1=CN=C(Cl)C(Br)=C1 LQ2926 [0,2,0,0,0,0|2,0,0]=4 918 B11R1.21 O=[N+]([O-])C1=CN=C(Cl)C(Cl)=C1 XJ4680 [0,2,0,0,0,0|2,0,0]=4 919 B11R1.21 O=[N+]([O-])C1=CN=C(F)C(Br)=C1 YH42487 [0,2,0,0,0,0|2,0,0]=4 920 B11R1.21 O=[N+]([O-])C1=CN=C(F)C(F)=C1 YH97874 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Br)=C1 JZ5047 [0,2,0,0,0,0|2,0,0]=4 922 B11R1.21 O=[N+]([O-])C1=CN=C(O)C(Cl)=C1 YH47452 [0,2,0,0,0,0|2,0,0]=4 923 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 YH65417 [0,2,0,0,0,0|1,0,0]=3 924 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 YH14959 [0,2,0,0,0,0|2,0,0]=4 925 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 RT11202 [0,2,0,0,0,0|2,0,0]=4 926 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 JZ3934 [0,2,0,0,0,0|2,0,0]=4 927 B11R1.22 COC(=O)C1=CC=C(C)N=C1 RT12187 [0,2,0,0,0,0|1,0,0]=3 928 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 HL0691 [0,2,0,0,0,0|2,0,0]=4 929 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 JZ0748 [0,2,0,0,0,0|1,0,0]=3 930 B11R1.22 COC(=O)C1=CC=C(F)C=C1 JZ1260 [0,2,0,0,0,0|2,0,0]=4 931 B11R1.22 COC(=O)C1=CC=C(F)N=C1 XJ1741 [0,2,0,0,0,0|1,0,0]=3 932 B11R1.22 COC(=O)C1=CC=C(I)C=C1 JZ3935 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.22 COC(=O)C1=CC=C(N)C=C1 JZ3936 [0,2,0,0,0,0|2,0,0]=4 934 B11R1.22 COC(=O)C1=CC=C(N)N=C1 JZ1658 [0,2,0,0,0,0|1,0,0]=3 935 B11R1.22 COC(=O)C1=CC=C(O)C=C1 LT7452 [0,2,0,0,0,0|2,0,0]=4 936 B11R1.22 COC(=O)C1=CC=C([O-])C=C1 YH03826 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 LX3189 [0,2,0,0,0,0|1,0,0]=3 938 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 LT5905 [0,2,0,0,0,0|2,0,0]=4 939 B11R1.22 COC(=O)C1=NC=C(O)N=C1 LT5907 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 RT1562 [0,2,0,0,0,0|2,0,0]=4 941 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 LQ2917 [0,2,0,0,0,0|1,0,0]=3 942 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 RT2897 [0,2,0,0,0,0|1,0,0]=3 943 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 YH17779 [0,2,0,0,0,0|1,0,0]=3 944 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 YH17778 [0,2,0,0,0,0|1,0,0]=3 945 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 HL1815 [0,2,0,0,0,0|1,0,0]=3 946 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 LX2710 [0,2,0,0,0,0|1,0,0]=3 947 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 YH43755 [0,2,0,0,0,0|1,0,0]=3 948 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 LQ2961 [0,2,0,0,0,0|1,0,0]=3 949 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 LL0964 [0,2,0,0,0,0|1,0,0]=3 950 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 HL1818 [0,2,0,0,0,0|1,0,0]=3 951 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 XJ2875 [0,2,0,0,0,0|1,0,0]=3 952 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 LT2239 [0,2,0,0,0,0|1,0,1]=4 953 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 HL1296 [0,2,0,0,0,0|2,0,0]=4 954 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 LT2785 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 RT10679 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 HL1817 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 YH11049 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 YH04927 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 HL0592 [0,2,0,0,0,0|2,0,0]=4 960 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 LX2629 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 YH65890 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 YH65861 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 LL0744 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 HL0874 [0,2,0,0,0,0|2,0,0]=4 965 B11R1.166 CC(=O)C1=CC=C(Br)C=C1Br LX2251 [0,2,0,0,0,0|2,0,0]=4 966 B11R1.166 CC(=O)C1=CC=C(C)C=C1O YH14255 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br YH88248 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1F LL2461 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.166 CC(=O)C1=CC=C(O)C=C1Br YH10272 [0,2,0,0,0,0|2,0,0]=4 970 B11R1.166 CC(=O)C1=CC=C(O)C=C1Cl XJ6151 [0,2,0,0,0,0|2,0,0]=4 971 B11R1.166 CC(=O)C1=CC=C(O)C=C1Cl YH00402 [0,2,0,0,0,0|2,0,0]=4 972 B11R1.166 CC(=O)C1=CC=C(O)C=C1F YH98787 [0,2,0,0,0,0|2,0,0]=4 973 B11R1.166 CC(=O)C1=CC=C(O)C=C1O RT11977 [0,2,0,0,0,0|2,0,0]=4 974 B11R1.166 CC1=C(C(=O)O)C=NC(N)=C1 LX3005 [0,2,0,0,0,0|1,0,0]=3 975 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Cl)=N1 LT5202 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.166 CC1=C([N+](=O)[O-])C=CC(F)=N1 YH42344 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.166 CC1=C([N+](=O)[O-])C=CC(N)=N1 LT3600 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.166 CC1=C([N+](=O)[O-])C=CC(O)=N1 YH51908 [0,2,0,0,0,0|2,0,0]=4 979 B11R1.166 CC1=C([N+](=O)[O-])C=NC(O)=C1 LT3362 [0,2,0,0,0,0|2,0,0]=4 980 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 LQ3335 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.166 CC1=CC(Br)=NC=C1[N+](=O)[O-] LT3315 [0,2,0,0,0,0|2,0,0]=4 982 B11R1.166 CC1=CC(C)=C([N+](=O)[O-])C=N1 JZ4376 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 LX2050 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.166 CC1=CC(Cl)=CC=C1C(=O)O YH17041 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.166 CC1=CC(Cl)=NC=C1[N+](=O)[O-] LQ4352 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.166 CC1=CC(N)=NC=C1[N+](=O)[O-] LT6119 [0,2,0,0,0,0|2,0,0]=4 987 B11R1.166 CC1=CC(O)=C(C(=O)O)C=N1 YH13201 [0,2,0,0,0,0|1,0,0]=3 988 B11R1.166 CC1=CC(O)=C(C(N)=O)C=C1 LT2462 [0,2,0,0,0,0|1,0,0]=3 989 B11R1.166 CC1=CC=C(C(=O)O)C(F)=C1 YH18052 [0,2,0,0,0,0|2,0,0]=4 990 B11R1.166 CC1=CC=C(C(=O)O)C(N)=C1 HL2212 [0,2,0,0,0,0|2,0,0]=4 991 B11R1.166 CC1=CC=C(C(N)=O)C(N)=C1 LT0244 [0,2,0,0,0,0|1,0,0]=3 992 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Br)=N1 LT3922 [0,2,0,0,0,0|2,0,0]=4 993 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Cl)=N1 LQ5363 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.166 CC1=CC=C([N+](=O)[O-])C(N)=N1 YH46785 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.166 CC1=CC=C([N+](=O)[O-])C(O)=N1 LX3241 [0,2,0,0,0,0|2,0,0]=4 996 B11R1.166 CC1=NC(Br)=CC=C1[N+](=O)[O-] LT3316 [0,2,0,0,0,0|2,0,0]=4 997 B11R1.166 CC1=NC(F)=C([N+](=O)[O-])C=C1 JZ5358 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.166 CC1=NC(F)=CC=C1C(=O)O LX2404 [0,2,0,0,0,0|1,0,0]=3 999 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1Cl XJ2193 [0,2,0,0,0,0|1,0,0]=3 1000 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl LL1015 [0,2,0,0,0,0|0,0,0]=2 1001 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 YH45406 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 LT0240 [0,2,0,0,0,0|2,0,0]=4 1003 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 RT1598 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 XJ2208 [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.166 NC1=CC(Cl)=NC=C1N(=O)=O JZ2059 [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 XJ0046 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.166 NC1=CC=C(C(=O)O)C(F)=C1 LX3182 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 HL3362 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 JZ3312 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 LL0519 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 LQ0597 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.166 NC1=NC(Cl)=CC=C1[N+](=O)[O-] LT5957 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.166 O=C(Cl)C1=CN=C(Cl)N=C1Cl JZ2214 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 XJ1113 [0,2,0,0,0,0|2,0,0]=4 1015 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 HL0593 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 RT11949 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 HL1032 [0,2,0,0,0,0|2,0,0]=4 1018 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 YH07341 [0,2,0,0,0,0|2,0,0]=4 1019 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 RT12288 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 XJ0764 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.166 O=C(O)C1=C(F)C=C(F)N=C1 YH89414 [0,2,0,0,0,0|1,0,0]=3 1022 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 LT2788 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 LQ0700 [0,2,0,0,0,0|2,0,0]=4 1024 B11R1.166 O=C(O)C1=C(O)N=C(O)N=C1 RT18056 [0,2,0,0,0,0|2,0,0]=4 1025 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O HL0984 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl LQ4961 [0,2,0,0,0,0|1,0,0]=3 1027 B11R1.166 O=C(O)C1=CC=C(F)C=C1Cl LT6491 [0,2,0,0,0,0|2,0,0]=4 1028 B11R1.166 O=C(O)C1=CC=C(I)C=C1Br YH51932 [0,2,0,0,0,0|2,0,0]=4 1029 B11R1.166 O=C(O)C1=CC=C(I)C=C1F LL2023 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl RT11083 [0,2,0,0,0,0|2,0,0]=4 1031 B11R1.166 O=C(O)C1=CC=C(S)C=C1Br RT13176 [0,2,0,0,0,0|2,0,0]=4 1032 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl HL4459 [0,2,0,0,0,0|1,0,0]=3 1033 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)N=C1Br YH65943 [0,2,0,0,0,0|2,0,0]=4 1034 B11R1.166 O=[N+]([O-])C1=CC=C(Cl)N=C1Cl LQ3687 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.166 O=[N+]([O-])C1=CN=C(Br)C=C1Br RT8705 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.166 O=[N+]([O-])C1=CN=C(Cl)C=C1Cl XJ2744 [0,2,0,0,0,0|2,0,0]=4 1037 B11R1.166 O=[N+]([O-])C1=CN=C(O)C=C1Cl YH89654 [0,2,0,0,0,0|2,0,0]=4 1038 B11R1.16 CCNC(C)C1=CC=CN=C1 RT2509 [0,2,0,0,0,0|1,0,1]=4 1039 B11R1.16 CCOC(=O)C1=CC=CC=C1 HL1235 [0,2,0,0,0,0|2,0,0]=4 1040 B11R1.16 CCOC(=O)C1=CC=CC=C1 XJ5129 [0,2,0,0,0,0|2,0,0]=4 1041 B11R1.16 CCOC(=O)C1=CC=NN=C1 YH58768 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.16 CCOC(=O)C1=CN=CC=C1 JZ0757 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.16 COCC(=O)C1=CC=CC=C1 XJ2596 [0,2,0,0,0,0|2,0,0]=4 1044 B11R1.16 N#CCC(=O)C1=CC=CC=C1 LT6989 [0,2,0,0,0,0|1,0,1]=4 1045 B11R1.16 O=C(CCBr)C1=CC=CC=C1 YH65517 [0,2,0,0,0,0|2,0,0]=4 1046 B11R1.16 O=C(CCCl)C1=CC=CC=C1 YH58599 [0,2,0,0,0,0|2,0,0]=4 1047 B11R1.16 O=C(N=C=S)C1=CC=CC=C1 LL0937 [0,2,0,0,0,0|1,0,1]=4 1048 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 LQ3566 [0,2,0,0,0,0|1,0,0]=3 1049 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 RT12028 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 YH65453 [0,2,0,0,0,0|2,0,0]=4 1051 B11R1.23 CCC(=O)C1=CC=CC(O)=C1 LQ3598 [0,2,0,0,0,0|2,0,0]=4 1052 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 RT2023 [0,2,0,0,0,0|2,0,0]=4 1053 B11R1.23 COC(=O)C1=CC(Cl)=NN=C1 YH24417 [0,2,0,0,0,0|2,0,0]=4 1054 B11R1.23 COC(=O)C1=CC(N)=CN=C1 YH56942 [0,2,0,0,0,0|1,0,0]=3 1055 B11R1.23 COC(=O)C1=CC(O)=CC=C1 XJ4508 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.23 COC(=O)C1=CC=CC(C)=C1 XJ0280 [0,2,0,0,0,0|2,0,0]=4 1057 B11R1.23 COC(=O)C1=CC=CC(N)=C1 HL2757 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 XJ0840 [0,2,0,0,0,0|1,0,0]=3 1059 B11R1.23 N\C(=N/O)C1=CC(Cl)=CC=C1 YH47269 [0,2,0,0,0,0|1,0,1]=4 1060 B11R1.23 O=C(CCl)C1=CC=CC(Cl)=C1 LQ4318 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.222 CCC(=O)C1=CC=CC=C1F XJ0760 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.222 CNC(=O)C1=CC=CC=C1N HL2654 [0,2,0,0,0,0|1,0,0]=3 1063 B11R1.222 COC(=O)C1=C(C)C=CC=C1 LT7460 [0,2,0,0,0,0|2,0,0]=4 1064 B11R1.222 COC(=O)C1=C(I)C=CC=C1 LT1761 [0,2,0,0,0,0|2,0,0]=4 1065 B11R1.222 COC(=O)C1=C(N)N=CC=N1 LT5963 [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.222 COC(=O)C1=C(O)C=CN=C1 YH13199 [0,2,0,0,0,0|1,0,0]=3 1067 B11R1.222 COC(=O)C1=C(O)N=CN=C1 JZ2595 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.222 COC(=O)C1=CC=CC=C1O JZ3307 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.222 COC(=O)C1=CC=CN=C1C XJ6093 [0,2,0,0,0,0|1,0,0]=3 1070 B11R1.222 COC(=O)C1=CC=CN=C1F XJ0762 [0,2,0,0,0,0|1,0,0]=3 1071 B11R1.222 COC(=O)C1=CC=CN=C1N LQ3812 [0,2,0,0,0,0|1,0,0]=3 1072 B11R1.222 COC(=O)C1=CN=CN=C1C HL3598 [0,2,0,0,0,0|2,0,0]=4 1073 B11R1.222 C\C(NO)=C1\C=CC=CC1=O RT6027 [0,2,0,0,0,0|2,0,0]=4 1074 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 YH08544 [0,2,0,0,0,0|1,0,0]=3 1075 B11R1.222 NCC(=O)C1=C(Cl)C=CC=C1 HL4533 [0,2,0,0,0,0|1,0,0]=3 1076 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 YH16342 [0,2,0,0,0,0|1,0,0]=3 1077 B11R1.222 NNC(=O)C1=C(Cl)C=CC=C1 HL3028 [0,2,0,0,0,0|1,0,0]=3 1078 B11R1.222 NNC(=O)C1=C(O)C=CC=C1 JZ0198 [0,2,0,0,0,0|1,0,0]=3 1079 B11R1.222 NNC(=O)C1=CC=CC=C1Cl YH66690 [0,2,0,0,0,0|1,0,0]=3 1080 B11R1.222 O=C(CBr)C1=CC=CC=C1Cl HL2832 [0,2,0,0,0,0|2,0,0]=4 1081 B11R1.222 O=C(CCl)C1=CC=CC=C1F RT11088 [0,2,0,0,0,0|2,0,0]=4 1082 B11R1.222 O=C(NO)C1=CC=CC=C1O JZ1752 [0,2,0,0,0,0|1,0,0]=3 1083 B11R1.222 [2H]OC(=O)C1=CC=CC=C1Cl RT12698 [0,2,0,0,0,0|2,0,0]=4 1084 B11R1.87 NC1=CC=CC=C1S(N)(=O)=O LT1659 [0,2,0,0,0,0|2,0,0]=4 1085 B11R1.87 NS(=O)(=O)C1=C(F)C=CC=C1 XJ5043 [0,2,0,0,0,0|2,0,0]=4 1086 B11R1.87 O=S(=O)(Cl)C1=CC=CN=C1Cl LQ3131 [0,2,0,0,0,0|2,0,0]=4 1087 B11R1.155 NS(=O)(=O)C1=CC(Br)=CN=C1 YH10399 [0,2,0,0,0,0|1,0,0]=3 1088 B11R1.155 O=S(=O)(Cl)C1=CC(Br)=CN=C1 LL1120 [0,2,0,0,0,0|2,0,0]=4 1089 B11R1.155 O=S(=O)(Cl)C1=CC(F)=CN=C1 RT9267 [0,2,0,0,0,0|2,0,0]=4 1090 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 YH55244 [0,2,0,0,0,0|2,0,0]=4 1091 B11R1.53 C=CC1=CC=CC=C1C(=O)[O-] HL0409 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.53 CNC1=CC=CC=C1C(=O)O LQ0517 [0,2,0,0,0,0|2,0,0]=4 1093 B11R1.53 CNC1=NC=CC=C1C(=O)O XJ5069 [0,2,0,0,0,0|1,0,0]=3 1094 B11R1.53 COC1=C(C(=O)O)C=CC=C1 XJ0973 [0,2,0,0,0,0|2,0,0]=4 1095 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 YH54114 [0,2,0,0,0,0|2,0,0]=4 1096 B11R1.53 COC1=CC=CC=C1C(N)=O LT1774 [0,2,0,0,0,0|1,0,0]=3 1097 B11R1.53 COC1=NC=CC=C1C(=O)O JZ0743 [0,2,0,0,0,0|1,0,0]=3 1098 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] LT3946 [0,2,0,0,0,0|2,0,0]=4 1099 B11R1.53 NNC1=CC=CC=C1C(=O)O JZ0801 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.53 O=C(Cl)C1=CC=CC=C1CCl LQ5091 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.53 O=C(O)C1=CC=CC=C1CBr HL4661 [0,2,0,0,0,0|2,0,0]=4 1102 B11R1.53 O=C(O)C1=CC=CC=C1CBr YH15164 [0,2,0,0,0,0|2,0,0]=4 1103 B11R1.53 O=C(O)C1=CC=CC=C1CCl HL4793 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F XJ6510 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.156 CC(=O)C1=C(F)C=CC=C1F JZ4800 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.156 CC(=O)C1=C(F)C=CC=C1O XJ6632 [0,2,0,0,0,0|2,0,0]=4 1107 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=C1 LT1967 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.156 CC1=C([N+](=O)[O-])C(Cl)=NC=C1 LT6494 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.156 CC1=C([N+](=O)[O-])C(F)=NC=C1 JZ5357 [0,2,0,0,0,0|2,0,0]=4 1110 B11R1.156 CC1=C([N+](=O)[O-])C(N)=NC=C1 RT2066 [0,2,0,0,0,0|2,0,0]=4 1111 B11R1.156 CC1=C([N+](=O)[O-])C(O)=NC=C1 JZ5452 [0,2,0,0,0,0|2,0,0]=4 1112 B11R1.156 CC1=CC=CC(C)=C1C(=O)O LQ1302 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.156 CC1=CC=CC(F)=C1C(=O)O HL4871 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.156 CC1=CC=CC(N)=C1C(=O)O JZ2518 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.156 CC1=CC=NC(Br)=C1[N+](=O)[O-] LT3309 [0,2,0,0,0,0|2,0,0]=4 1116 B11R1.156 CC1=NC=CC(C)=C1C(=O)O YH06860 [0,2,0,0,0,0|1,0,0]=3 1117 B11R1.156 CC1=NC=CC(Cl)=C1C(=O)O LX3014 [0,2,0,0,0,0|1,0,0]=3 1118 B11R1.156 CC1=NC=NC(C)=C1C(=O)O HL3597 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.156 N=C(N)C1=C(F)C=CC=C1F LT2214 [0,2,0,0,0,0|2,0,0]=4 1120 B11R1.156 NC(=O)C1=C(Cl)C=CC=C1Cl XJ1986 [0,2,0,0,0,0|1,0,0]=3 1121 B11R1.156 NC(=O)C1=C(F)C=CC=C1F LT2216 [0,2,0,0,0,0|1,0,0]=3 1122 B11R1.156 NC1=C([N+](=O)[O-])C(Cl)=NC=C1 HL2362 [0,2,0,0,0,0|2,0,0]=4 1123 B11R1.156 NC1=C([N+](=O)[O-])C(O)=NC=C1 XJ6582 [0,2,0,0,0,0|2,0,0]=4 1124 B11R1.156 NC1=CC=CC(Cl)=C1C(=O)O LQ2094 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.156 NC1=CC=CC(F)=C1C(=O)O LX2855 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.156 O=C(Cl)C1=C(Cl)C=CC=C1Cl LQ2722 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1Br YH65618 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1Cl LT1699 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1I LL1917 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Br XJ6625 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl HL1052 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.156 O=C(O)C1=C(Cl)N=CN=C1Cl YH91681 [0,2,0,0,0,0|2,0,0]=4 1133 B11R1.156 O=C(O)C1=C(F)C=CC=C1Br CJ2844 [0,2,0,0,0,0|2,0,0]=4 1134 B11R1.156 O=C(O)C1=C(F)C=CC=C1Cl LL0816 [0,2,0,0,0,0|2,0,0]=4 1135 B11R1.156 O=C(O)C1=C(F)C=CC=C1O CJ3041 [0,2,0,0,0,0|2,0,0]=4 1136 B11R1.156 O=[N+]([O-])C1=C(Br)C=CN=C1Br YH28455 [0,2,0,0,0,0|2,0,0]=4 1137 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CN=C1Cl LQ2989 [0,2,0,0,0,0|2,0,0]=4 1138 B11R1.159 CC(=O)C1=C(F)C(Br)=CC=C1 LL2344 [0,2,0,0,0,0|2,0,0]=4 1139 B11R1.159 CC(=O)C1=C(F)C(F)=CC=C1 XJ4433 [0,2,0,0,0,0|2,0,0]=4 1140 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 LL1297 [0,2,0,0,0,0|2,0,0]=4 1141 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 LT6157 [0,2,0,0,0,0|2,0,0]=4 1142 B11R1.159 CC(=O)C1=CC=CC(C)=C1N YH05913 [0,2,0,0,0,0|2,0,0]=4 1143 B11R1.159 CC(=O)C1=CC=CC(C)=C1O YH14631 [0,2,0,0,0,0|2,0,0]=4 1144 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl LQ5361 [0,2,0,0,0,0|2,0,0]=4 1145 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1F LL2343 [0,2,0,0,0,0|2,0,0]=4 1146 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1O RT6217 [0,2,0,0,0,0|2,0,0]=4 1147 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br RT11196 [0,2,0,0,0,0|2,0,0]=4 1148 B11R1.159 CC1=C(C(=O)O)C=CC=C1F YH14630 [0,2,0,0,0,0|2,0,0]=4 1149 B11R1.159 CC1=C(C(=O)O)C=CC=C1N LT2464 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.159 CC1=C(C(=O)O)C=CC=C1O JZ3890 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.159 CC1=C(N)C(C(=O)O)=CC=C1 LT5949 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.159 CC1=C(N)C(C(N)=O)=CC=C1 LX3202 [0,2,0,0,0,0|1,0,0]=3 1153 B11R1.159 CC1=C(O)C(C(=O)O)=CC=C1 JZ0027 [0,2,0,0,0,0|2,0,0]=4 1154 B11R1.159 CC1=CC=CC(C(=O)Cl)=C1C JZ5449 [0,2,0,0,0,0|2,0,0]=4 1155 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br SY0004 [0,2,0,0,0,0|2,0,0]=4 1156 B11R1.159 CC1=CC=CC(C(=O)O)=C1F YH53947 [0,2,0,0,0,0|2,0,0]=4 1157 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 YH15128 [0,2,0,0,0,0|1,0,0]=3 1158 B11R1.159 NC(=O)C1=CC=CC(N)=C1N YH66480 [0,2,0,0,0,0|1,0,0]=3 1159 B11R1.159 NC(=O)C1=CC=CC(O)=C1O RT11182 [0,2,0,0,0,0|1,0,0]=3 1160 B11R1.159 NC1=C(Br)C=NC=C1[N+](=O)[O-] YH93730 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.159 NC1=C(C(=O)O)C=CC=C1Br LX2293 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.159 NC1=C(C(=O)O)C=CC=C1F YH88243 [0,2,0,0,0,0|2,0,0]=4 1163 B11R1.159 NC1=C(N)C([N+](=O)[O-])=CN=C1 YH01452 [0,2,0,0,0,0|2,0,0]=4 1164 B11R1.159 NC1=C(O)C=CC=C1C(=O)O HL1999 [0,2,0,0,0,0|2,0,0]=4 1165 B11R1.159 NC1=CC=CC(C(=O)O)=C1F LX3096 [0,2,0,0,0,0|2,0,0]=4 1166 B11R1.159 NC1=CC=CC(C(=O)O)=C1N JZ3891 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.159 O=C(Cl)C1=C(F)C(Cl)=CC=C1 HL4768 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.159 O=C(Cl)C1=C(F)C(F)=CC=C1 XJ4431 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.159 O=C(O)C1=C(Br)C(F)=CC=C1 YH31972 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=C1 HL1046 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.159 O=C(O)C1=C(F)C(Br)=CC=C1 CJ3147 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 LL2342 [0,2,0,0,0,0|2,0,0]=4 1173 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 YH58619 [0,2,0,0,0,0|2,0,0]=4 1174 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 LQ0677 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 LT0082 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Cl YH07680 [0,2,0,0,0,0|2,0,0]=4 1177 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Br YH07679 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl HL3142 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.159 O=C(O)C1=CC=CC(F)=C1F YH02098 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.159 O=C(O)C1=CC=CC(F)=C1I LX2296 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.159 O=[N+]([O-])C1=CN=CC(Br)=C1Cl YH65787 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 XJ0758 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 XJ1781 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 LT3535 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F YH24829 [0,2,0,0,0,0|1,0,0]=3 1186 B11R1.167 CC(=O)C1=CC(C)=CC=C1O XJ1779 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1Cl HL2255 [0,2,0,0,0,0|2,0,0]=4 1188 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1N YH39071 [0,2,0,0,0,0|2,0,0]=4 1189 B11R1.167 CC(=O)C1=CC(F)=CC=C1Cl JZ2207 [0,2,0,0,0,0|2,0,0]=4 1190 B11R1.167 CC(=O)C1=CC(F)=CC=C1I LX2394 [0,2,0,0,0,0|2,0,0]=4 1191 B11R1.167 CC(=O)C1=CC(O)=CC=C1O LL0869 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 LX2060 [0,2,0,0,0,0|2,0,0]=4 1193 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 XJ5704 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 LQ2276 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 CJ2738 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 XJ3183 [0,2,0,0,0,0|2,0,0]=4 1197 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 XJ0662 [0,2,0,0,0,0|2,0,0]=4 1198 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 YH05261 [0,2,0,0,0,0|2,0,0]=4 1199 B11R1.167 CC1=CC=C(Cl)C(C(=O)O)=C1 LQ3105 [0,2,0,0,0,0|2,0,0]=4 1200 B11R1.167 CC1=CC=C(N)C(C(N)=O)=C1 YH00062 [0,2,0,0,0,0|1,0,0]=3 1201 B11R1.167 CC1=CC=C(N)C=C1C(=O)O LT5979 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.167 CC1=CC=[N+](C)C=C1C(N)=O LL1890 [0,2,0,0,0,0|0,0,1]=3 1203 B11R1.167 CC1=CN=C(Br)C([N+](=O)[O-])=C1 YH48050 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.167 CC1=CN=C(Cl)C([N+](=O)[O-])=C1 LQ4353 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.167 CC1=CN=C(O)C([N+](=O)[O-])=C1 XJ3326 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.167 CC1=NC=C(Br)C=C1[N+](=O)[O-] HL4937 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.167 N=C1C=CC(=O)C(C(=O)O)=C1 RT11743 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 LT0249 [0,2,0,0,0,0|1,0,0]=3 1209 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1F LL2689 [0,2,0,0,0,0|1,0,0]=3 1210 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1O LT3548 [0,2,0,0,0,0|1,0,0]=3 1211 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 LT0252 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 HL1758 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.167 NC1=C([N+](=O)[O-])C=C(Cl)C=N1 HL2949 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.167 NC1=CC=C(Br)C=C1C(=O)O LT0246 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.167 NC1=CC=C(O)C(C(=O)O)=C1 RT11771 [0,2,0,0,0,0|2,0,0]=4 1216 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O JZ1003 [0,2,0,0,0,0|1,0,0]=3 1217 B11R1.167 NC1=NC=C(Br)C=C1[N+](=O)[O-] JZ0589 [0,2,0,0,0,0|2,0,0]=4 1218 B11R1.167 NC1=NC=C(Br)N=C1C(=O)O LL2859 [0,2,0,0,0,0|2,0,0]=4 1219 B11R1.167 NC1=NC=C(Cl)C=C1C(=O)O YH05416 [0,2,0,0,0,0|1,0,0]=3 1220 B11R1.167 NC1=NC=C(F)C=C1[N+](=O)[O-] LX2265 [0,2,0,0,0,0|2,0,0]=4 1221 B11R1.167 O=C(Cl)C1=C(Cl)C=CC(Cl)=C1 LQ2351 [0,2,0,0,0,0|2,0,0]=4 1222 B11R1.167 O=C(Cl)C1=C(Cl)C=CC(F)=C1 JZ5450 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.167 O=C(Cl)C1=C(F)C=CC(Cl)=C1 HL1756 [0,2,0,0,0,0|2,0,0]=4 1224 B11R1.167 O=C(Cl)C1=C(F)C=CC(F)=C1 LQ4861 [0,2,0,0,0,0|2,0,0]=4 1225 B11R1.167 O=C(Cl)C1=CC(Cl)=CN=C1Cl LT3869 [0,2,0,0,0,0|1,0,0]=3 1226 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 YH09854 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 LQ4295 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 HL1755 [0,2,0,0,0,0|2,0,0]=4 1229 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 JZ5666 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 LQ4294 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 HL1034 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.167 O=C(O)C1=C(Cl)N=NC(Cl)=C1 LX2708 [0,2,0,0,0,0|2,0,0]=4 1233 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 YH35267 [0,2,0,0,0,0|2,0,0]=4 1234 B11R1.167 O=C(O)C1=C(F)C=CC(O)=C1 LQ5175 [0,2,0,0,0,0|2,0,0]=4 1235 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 LQ4296 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 XJ3893 [0,2,0,0,0,0|2,0,0]=4 1237 B11R1.167 O=C(O)C1=C(O)C=CC(I)=C1 LQ0504 [0,2,0,0,0,0|2,0,0]=4 1238 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 LT0154 [0,2,0,0,0,0|2,0,0]=4 1239 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O YH22672 [0,2,0,0,0,0|1,0,0]=3 1240 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1Cl YH09173 [0,2,0,0,0,0|1,0,0]=3 1241 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl LQ4919 [0,2,0,0,0,0|1,0,0]=3 1242 B11R1.167 O=C(O)C1=CC(F)=CN=C1F YH89730 [0,2,0,0,0,0|1,0,0]=3 1243 B11R1.167 O=C(O)C1=CC(F)=CN=C1O YH92224 [0,2,0,0,0,0|1,0,0]=3 1244 B11R1.167 O=C(O)C1=CC(I)=CC=C1Cl YH43007 [0,2,0,0,0,0|2,0,0]=4 1245 B11R1.167 O=C(O)C1=CC(I)=CC=C1I YH34226 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.167 O=C([O-])C1=CC(O)=CC=C1O LX3018 [0,2,0,0,0,0|2,0,0]=4 1247 B11R1.167 O=[N+]([O-])C1=C(Br)N=CC(F)=C1 YH65564 [0,2,0,0,0,0|2,0,0]=4 1248 B11R1.167 O=[N+]([O-])C1=C(O)N=CC(Br)=C1 JZ5048 [0,2,0,0,0,0|2,0,0]=4 1249 B11R1.167 O=[N+]([O-])C1=C(O)N=CC(Cl)=C1 RT18049 [0,2,0,0,0,0|2,0,0]=4 1250 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1Br JZ5050 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.167 O=[N+]([O-])C1=CC(Br)=CN=C1Cl HL4344 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1Br YH65578 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.167 O=[N+]([O-])C1=CC(Cl)=CN=C1F XJ5877 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.167 O=[N+]([O-])C1=CC(F)=CN=C1Cl YH33239 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.167 O=[N+]([O-])C1=CC(F)=CN=C1O LX3286 [0,2,0,0,0,0|2,0,0]=4 1256 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 YH34723 [0,2,0,0,0,0|2,0,0]=4 1257 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 LT1858 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 LT6620 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.74 CC1=CC(C(=O)O)=CC(N)=C1 LX2350 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.74 CC1=CC(C)=CC(C(=O)Cl)=C1 LT2527 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 XJ0834 [0,2,0,0,0,0|2,0,0]=4 1262 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 YH08537 [0,2,0,0,0,0|2,0,0]=4 1263 B11R1.74 NC(=O)C1=CC(O)=CC(O)=C1 YH53924 [0,2,0,0,0,0|1,0,0]=3 1264 B11R1.74 NC(=S)C1=CC(F)=CC(F)=C1 CJ2657 [0,2,0,0,0,0|1,1,0]=4 1265 B11R1.74 NC1=CC(Br)=CC(C(=O)O)=C1 LT5960 [0,2,0,0,0,0|2,0,0]=4 1266 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 LT5229 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.74 O=C(Cl)C1=CC(Cl)=CC(Cl)=C1 LT2956 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.74 O=C(Cl)C1=CC(F)=CC(F)=C1 LT2384 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 LT2922 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 YH01277 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 CJ2289 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.74 O=C(O)C1=CC(Br)=CC(I)=C1 HL3778 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.74 O=C(O)C1=CC(Cl)=CC(I)=C1 YH52145 [0,2,0,0,0,0|2,0,0]=4 1274 B11R1.74 O=C(O)C1=CC(F)=CC(Cl)=C1 LQ4478 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 HL1807 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 JZ5291 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.74 O=C(O)C1=CC(O)=CC(Br)=C1 CJ3026 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 LT6675 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.266 C(=O)C1=CC(C(=O)O)=CC=C1 LQ1237 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.266 CC(=O)C1=CC(CCl)=CC=C1 YH00769 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.266 CCC1=CC(C(N)=O)=CC=N1 RT3109 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.266 COC1=CC(C(=O)O)=CC=C1 LT2613 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.266 COC1=CC=CC(C(C)=O)=C1 YH08564 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.266 CSC1=CC(C(=O)O)=CC=C1 JZ4197 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.266 N#CC1=CC(C(=O)Cl)=CC=C1 JZ4697 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 LQ1949 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.266 N#CC1=CN=CC(C(=O)O)=C1 YH93163 [0,2,0,0,0,0|1,0,0]=3 1288 B11R1.266 NCC1=CC(C(=O)O)=CC=C1 JZ1981 [0,2,0,0,0,0|2,0,0]=4 1289 B11R1.266 O=C(Cl)C1=CC=CC(CCl)=C1 LT2487 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 XJ3151 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.266 O=C(O)C1=CC=CC(CCl)=C1 LT2902 [0,2,0,0,0,0|2,0,0]=4 1292 B11R1.266 O=C(O)C1=CC=CC(CO)=C1 YH51784 [0,2,0,0,0,0|2,0,0]=4 1293 B9R1.13 NC(=O)CC1=CC=CS1 XJ2712 [0,0,1,1,0,0|1,0,1]=4 1294 B11R2.10 BrC1=CC2=CC=CN=C2N1 YH65631 [0,0,0,1,0,1|1,0,0]=3 1295 B11R2.10 CC1=CC2=CC=CC=C2N1 LQ0261 [0,0,0,1,0,1|2,0,0]=4 1296 B11R2.10 CC1=CC2=NC=CC=C2N1 RT4195 [0,0,0,1,0,1|2,0,0]=4 1297 B11R2.10 ClC1=NC2=CC=CN=C2O1 CJ3027 [0,0,0,1,0,1|1,0,1]=4 1298 B11R2.10 ClC1=NC2=NC=CC=C2N1 YH22715 [0,0,0,1,0,1|1,0,1]=4 1299 B11R2.10 NC1=CC2=C(C=CC=C2)N1 RT15983 [0,0,0,1,0,1|2,0,0]=4 1300 B11R2.10 NC1=NC2=C(C=CC=C2)N1 LT6425 [0,0,0,1,0,1|2,0,0]=4 1301 B11R2.10 NC1=NC2=C(C=CC=C2)S1 LL0576 [0,0,0,1,0,1|1,1,0]=4 1302 B11R2.10 O=C1C=C2C=COC=C2O1 RT14175 [0,0,0,1,0,1|2,0,0]=4 1303 B11R2.10 O=C1CC2=C(C=CC=C2)N1 JZ1726 [0,0,0,1,0,1|1,0,0]=3 1304 B11R2.10 O=C1CC2=CC=CC=C2C1 JZ0697 [0,0,0,1,0,1|2,0,0]=4 1305 B11R2.10 O=C1CC2=CC=CC=C2S1 RT9248 [0,0,0,1,0,1|2,0,0]=4 1306 B11R2.10 O=C1CC2=NC=CC=C2N1 XJ5078 [0,0,0,1,0,1|1,0,0]=3 1307 B11R2.10 O=C1N=C2C=CC=CC2=N1 YH01415 [0,0,0,1,0,1|1,0,1]=4 1308 B11R2.10 O=C1NC2=CC=CC=C2O1 LT0282 [0,0,0,1,0,1|1,0,0]=3 1309 B11R2.10 O=C1NC2=NC=CC=C2O1 RT7818 [0,0,0,1,0,1|0,0,0]=2 1310 B11R2.10 SC1=NC2=C(C=CC=N2)N1 LT3222 [0,0,0,1,0,1|0,1,1]=4 1311 B11R2.10 SC1=NC2=CC=CC=C2N1 RT9298 [0,0,0,1,0,1|1,1,0]=4 1312 B11R2.10 [S-]C1=NC2=CC=CC=C2N1 XJ2390 [0,0,0,1,0,1|1,1,0]=4 1313 B11R2.1 BrC1=CNC2=C1C=CC=C2 HL0892 [0,1,0,1,0,0|2,0,0]=4 1314 B11R2.1 BrC1=CNC2=NC=CC=C12 RT16007 [0,1,0,1,0,0|1,0,0]=3 1315 B11R2.1 BrC1=NNC2=CC=CC=C21 LX3057 [0,1,0,1,0,0|2,0,0]=4 1316 B11R2.1 BrC1=NNC2=NC=CC=C12 YH13914 [0,1,0,1,0,0|1,0,0]=3 1317 B11R2.1 ClC1=C2C=CC=NC2=NN1 RT9425 [0,1,0,1,0,0|1,0,0]=3 1318 B11R2.1 ClC1=CNC2=CC=CC=C12 JZ5124 [0,1,0,1,0,0|2,0,0]=4 1319 B11R2.1 IC1=NNC2=CC=CC=C21 YH12813 [0,1,0,1,0,0|2,0,0]=4 1320 B11R2.1 NC1=NSC2=C1C=CC=C2 LQ4347 [0,1,0,1,0,0|1,1,0]=4 1321 B11R2.1 O=C1C=CC2=C1C=CC=C2 YH65542 [0,1,0,1,0,0|2,0,0]=4 1322 B11R2.1 O=C1CCC2=CC=CC=C12 RT11144 [0,1,0,1,0,0|2,0,0]=4 1323 B11R2.1 O=C1COC2=CC=CC=C12 LT6773 [0,1,0,1,0,0|2,0,0]=4 1324 B11R2.1 O=C1NCC2=C1C=NC=C2 YH59390 [0,1,0,1,0,0|0,0,0]=2 1325 B11R2.1 O=C1NCC2=CC=CC=C12 YH03035 [0,1,0,1,0,0|1,0,0]=3 1326 B11R2.1 O=C1NCC2=NC=CC=C12 YH59389 [0,1,0,1,0,0|0,0,0]=2 1327 B11R2.1 O=C1NN=C2C=CC=CN12 XJ3189 [0,1,0,1,0,0|2,0,0]=4 1328 B11R2.1 O=C1NOC2=CC=CC=C12 LQ4291 [0,1,0,1,0,0|1,0,0]=3 1329 B11R2.1 O=C1NSC2=CC=CC=C12 RT10518 [0,1,0,1,0,0|1,0,0]=3 1330 B11R2.1 OC1=CNC2=C1C=CC=C2 RT14410 [0,1,0,1,0,0|1,0,1]=4 1331 B11R2.1 SC1=CNC2=CC=CC=C12 RT16021 [0,1,0,1,0,0|1,1,0]=4 1332 B7R1.1 NCC1=CC=CO1 RT4371 [1,0,0,0,1,0|1,0,1]=4 1333 B7R1.1 NCC1=CC=CS1 LT5820 [1,0,0,0,1,0|1,0,1]=4 1334 B7R1.1 NCC1=CSC=C1 YH51468 [1,0,0,0,1,0|1,0,1]=4 1335 B7R1.1 NCC1=NC=CO1 YH92552 [1,0,0,0,1,0|1,0,1]=4 1336 B7R1.1 O=CC1=CC=CN1 HL3957 [1,0,0,0,1,0|0,0,1]=3 1337 B7R1.1 O=CC1=CC=CN1 RT5965 [1,0,0,0,1,0|0,0,1]=3 1338 B7R1.1 O=CC1=CC=CS1 LT6658 [1,0,0,0,1,0|1,0,0]=3 1339 B7R1.1 O=CC1=CC=NN1 YH58836 [1,0,0,0,1,0|1,0,0]=3 1340 B7R1.1 O=CC1=CC=NS1 YH05211 [1,0,0,0,1,0|1,0,0]=3 1341 B7R1.1 O=CC1=CNC=N1 LX3143 [1,0,0,0,1,0|1,0,0]=3 1342 B7R1.1 O=CC1=CSC=C1 LT0654 [1,0,0,0,1,0|1,0,0]=3 1343 B7R1.1 O=CC1=NC=CN1 RT10129 [1,0,0,0,1,0|1,0,0]=3 1344 B7R1.1 O=CC1=NOC=C1 YH93674 [1,0,0,0,1,0|1,0,0]=3 1345 B7R1.1 O=CN1C=CN=C1 JZ2254 [1,0,0,0,1,0|1,0,0]=3 1346 B11R1.91 CC(=O)C#CC1=CC=CC=C1 XJ1968 [0,0,0,0,0,2|2,0,0]=4 1347 B11R1.91 CC(=O)CCC1=CC=CC=C1 LQ2231 [0,0,0,0,0,2|2,0,0]=4 1348 B11R1.91 CC(=O)NNC1=CC=CC=C1 HL1438 [0,0,0,0,0,2|2,0,0]=4 1349 B11R1.91 N=C(N)SCC1=CC=CC=C1 XJ0890 [0,0,0,0,0,2|2,0,0]=4 1350 B11R1.91 NC(=O)COC1=CC=CC=C1 JZ3987 [0,0,0,0,0,2|1,0,0]=3 1351 B11R1.91 NC(=O)NNC1=CC=CC=C1 LL0305 [0,0,0,0,0,2|1,0,0]=3 1352 B11R1.91 NC(=O)OCC1=CC=CC=C1 JZ3985 [0,0,0,0,0,2|1,0,0]=3 1353 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 LT4562 [0,0,0,0,0,2|1,0,0]=3 1354 B11R1.91 NC(=S)NCC1=CC=CC=C1 JZ3984 [0,0,0,0,0,2|1,1,0]=4 1355 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 RT11201 [0,0,0,0,0,2|2,0,0]=4 1356 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 LL0303 [0,0,0,0,0,2|2,0,0]=4 1357 B11R1.91 O=C(Cl)\C=C\C1=CC=CN=C1 YH25200 [0,0,0,0,0,2|1,0,0]=3 1358 B11R1.91 O=C(O)C#CC1=CC=CC=C1 JZ4042 [0,0,0,0,0,2|2,0,0]=4 1359 B11R1.91 O=C(O)COC1=CC=CN=C1 LL1584 [0,0,0,0,0,2|1,0,0]=3 1360 B11R1.91 O=C(O)CSC1=CC=CC=C1 LL0306 [0,0,0,0,0,2|2,0,0]=4 1361 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 LT4563 [0,0,0,0,0,2|2,0,0]=4 1362 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 RT12003 [0,0,0,0,0,2|2,0,0]=4 1363 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 HL0692 [0,0,0,0,0,2|1,0,0]=3 1364 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 JZ5354 [0,0,0,0,0,2|1,0,0]=3 1365 B11R1.91 O=C([O-])CNC1=CC=CC=C1 LT5790 [0,0,0,0,0,2|2,0,0]=4 1366 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 HL0048 [0,0,0,0,0,2|2,0,0]=4 1367 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 XJ4235 [0,0,0,0,0,2|2,0,0]=4