0 B10R1.15 BrCC(Br)C1=CC=CC=C1 HL1223 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.15 C#CC(O)C1=CC=CC=C1 HL2705 [0,0,0,0,0,0|0,0,2]=2 2 B10R1.15 C1=CC=C(C(=O)OC)C=C1 LQ3514 [0,0,0,0,0,0|1,0,2]=3 3 B10R1.15 C1=CC=C(N([O-])N=O)C=C1 LT7153 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.15 CC(C=O)C1=CC=CC=C1 HL1224 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.15 CC(CBr)C1=CC=CC=C1 HL0832 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.15 CCC(=O)C1=CC=CN=C1 JZ4667 [0,0,0,0,0,0|1,0,2]=3 7 B10R1.15 CCC(C)C1=CC=CC=C1 LL0562 [0,0,0,0,0,0|1,0,0]=1 8 B10R1.15 CCC(C)C1=NC=CN=C1 JZ1742 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 HL2472 [0,0,0,0,0,0|1,0,0]=1 10 B10R1.15 CN(C=O)C1=CC=CC=C1 JZ0143 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.15 CNC(=O)C1=CC=CC=C1 HL0175 [0,0,0,0,0,0|1,0,2]=3 12 B10R1.15 CNC(=O)C1=NC=CC=C1 RT3529 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.15 COC(=N)C1=NC=CC=C1 RT4090 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.15 COC(=O)C1=CC=CN=C1 JZ0756 [0,0,0,0,0,0|2,0,2]=4 15 B10R1.15 COC(=O)C1=CC=NC=C1 RT1566 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.15 N#CC(O)C1=CC=CC=C1 LL0935 [0,0,0,0,0,0|1,0,1]=2 17 B10R1.15 NCC(=O)C1=CC=CC=C1 LT5895 [0,0,0,0,0,0|1,0,2]=3 18 B10R1.15 NCC(=O)C1=CC=CN=C1 RT4369 [0,0,0,0,0,0|2,0,2]=4 19 B10R1.15 NNC(=O)C1=CC=CC=C1 LT4155 [0,0,0,0,0,0|2,0,2]=4 20 B10R1.15 N\C(=N/O)C1=CC=CC=C1 HL0174 [0,0,0,0,0,0|3,0,1]=4 21 B10R1.15 O=C(CBr)C1=CC=CC=C1 RT11120 [0,0,0,0,0,0|1,0,2]=3 22 B10R1.15 O=C(CBr)C1=CC=CC=C1 YH43692 [0,0,0,0,0,0|1,0,2]=3 23 B10R1.15 O=C(CBr)C1=CC=NC=C1 XJ2872 [0,0,0,0,0,0|2,0,2]=4 24 B10R1.15 O=C(CBr)C1=NC=CC=C1 LQ4012 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.15 O=C(CCl)C1=CC=CC=C1 LT3832 [0,0,0,0,0,0|1,0,2]=3 26 B10R1.15 O=C(NO)C1=CC=CC=C1 LT6975 [0,0,0,0,0,0|2,0,2]=4 27 B10R1.15 OC(CCl)C1=CC=CC=C1 LQ1871 [0,0,0,0,0,0|1,0,0]=1 28 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 LT6111 [0,0,0,0,0,0|1,0,0]=1 29 B10R1.15 OC[C@H](O)C1=CC=CC=C1 LT6110 [0,0,0,0,0,0|1,0,0]=1 30 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 RT1705 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.6 C=C(C)C1=CC=CC=C1 XJ0257 [1,0,0,0,0,0|1,0,1]=3 32 B9R1.6 CC(=O)C1=CC=CC=C1 RT11112 [1,0,0,0,0,0|0,0,2]=3 33 B9R1.6 CC(=O)C1=CC=NC=C1 HL0648 [1,0,0,0,0,0|1,0,2]=4 34 B9R1.6 CC(=O)C1=CN=CC=C1 LQ0733 [1,0,0,0,0,0|1,0,2]=4 35 B9R1.6 CC(Br)C1=CC=CC=C1 XJ1034 [1,0,0,0,0,0|1,0,0]=2 36 B9R1.6 CC(C)C1=NC=CN=C1 JZ1741 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.6 CC(N)C1=CC=CC=C1 JZ0721 [1,0,0,0,0,0|1,0,0]=2 38 B9R1.6 CC(O)C1=CN=CN=C1 RT9947 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.6 CN(C)C1=CC=NC=C1 LT3039 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.6 CN(C)C1=NC=CC=C1 XJ2942 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.6 CN(N)C1=CC=CC=C1 LQ1214 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.6 CN(N)C1=CC=CC=C1 LX2044 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.6 C[C@@H](N)C1=CC=CC=C1 RT1721 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.6 C[C@@H](N)C1=NC=CC=C1 YH51514 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.6 C[C@@H](O)C1=NC=CC=C1 YH51543 [1,0,0,0,0,0|1,0,0]=2 46 B9R1.6 C[C@H](N)C1=CC=CC=C1 RT1720 [1,0,0,0,0,0|1,0,0]=2 47 B9R1.6 C[Si](=O)C1=CC=CC=C1 XJ3509 [1,0,0,0,0,0|0,1,1]=3 48 B9R1.6 ClC(Cl)C1=CC=CC=C1 LT3671 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.6 ClP(Cl)C1=CC=CC=C1 JZ4097 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 YH96399 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.6 N=C(N)C1=CC=CC=C1 LQ1861 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.6 NC(=O)C1=CC=CC=C1 CJ3392 [1,0,0,0,0,0|1,0,2]=4 53 B9R1.6 NC(=O)C1=CC=CC=C1 LT4036 [1,0,0,0,0,0|1,0,2]=4 54 B9R1.6 NC(=S)C1=CC=CC=C1 XJ2085 [1,0,0,0,0,0|1,1,1]=4 55 B9R1.6 O=C(F)C1=CC=CC=C1 HL1804 [1,0,0,0,0,0|1,0,2]=4 56 B9R1.6 O=C(O)C1=CC=CC=N1 SY0293 [1,0,0,0,0,0|2,0,1]=4 57 B9R1.6 O=C(O)C1=CC=CN=C1 LT7314 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.6 O=C(O)C1=CC=NC=C1 JZ0786 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0026 [1,0,0,0,0,0|1,0,2]=4 60 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0027 [1,0,0,0,0,0|1,0,2]=4 61 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ0044 [1,0,0,0,0,0|1,0,2]=4 62 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ4278 [1,0,0,0,0,0|1,0,2]=4 63 B9R1.6 O=C([O-])C1=CC=CC=C1 LT4848 [1,0,0,0,0,0|1,0,2]=4 64 B9R1.6 O=C([O-])C1=CC=CC=C1 XJ0991 [1,0,0,0,0,0|1,0,2]=4 65 B9R1.6 O=S(O)C1=CC=CC=C1 LQ1215 [1,0,0,0,0,0|2,0,0]=3 66 B9R1.6 O=S([O-])C1=CC=CC=C1 LL1085 [1,0,0,0,0,0|2,0,1]=4 67 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 XJ0263 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.6 O=[P+]([O-])C1=CC=CC=C1 LQ2659 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.6 OB(O)C1=CC=CC=C1 JZ0681 [1,0,0,0,0,0|2,0,0]=3 70 B9R1.6 OB(O)C1=CC=CC=N1 LL2565 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.6 OB(O)C1=CC=CN=C1 LQ1914 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.6 OB(O)C1=CC=NC=C1 CJ2813 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.6 [18O]=C([18OH])C1=CC=CC=C1 RT11444 [1,0,0,0,0,0|1,0,1]=3 74 B9R1.6 [SiH](Cl)(Cl)C1=CC=CC=C1 HL0912 [1,0,0,0,0,0|2,1,0]=4 75 B9R1.8 BrCCC1=CC=CC=C1 LL0334 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.8 BrCCC1=CC=NC=C1 CJ2885 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.8 BrCCC1=NC=CC=C1 LX2681 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.8 BrCCC1=NC=CC=C1 YH16042 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.8 C=CSC1=CC=CC=C1 HL0999 [1,0,0,0,0,0|1,0,2]=4 80 B9R1.8 CCCC1=CC=NC=C1 LT3807 [1,0,0,0,0,0|1,0,0]=2 81 B9R1.8 CCOC1=NC=CC=C1 LT1993 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.8 CCSC1=CC=CC=C1 JZ4001 [1,0,0,0,0,0|1,0,0]=2 83 B9R1.8 CNCC1=CC=CC=C1 RT3204 [1,0,0,0,0,0|1,0,0]=2 84 B9R1.8 CNCC1=CC=CN=C1 LQ4200 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.8 COCC1=CC=CN=C1 LQ5401 [1,0,0,0,0,0|2,0,0]=3 86 B9R1.8 COCC1=NC=CN=C1 LT2349 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.8 CSSC1=CC=CC=C1 JZ4887 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.8 C\C=C\C1=CC=CC=C1 RT6350 [1,0,0,0,0,0|0,0,2]=3 89 B9R1.8 C\C=C\C1=CC=CC=C1 RT6415 [1,0,0,0,0,0|0,0,2]=3 90 B9R1.8 ClCCC1=CC=CC=C1 JZ3996 [1,0,0,0,0,0|1,0,0]=2 91 B9R1.8 ClCCC1=CC=CC=C1 JZ4528 [1,0,0,0,0,0|1,0,0]=2 92 B9R1.8 ClCCC1=CC=NC=C1 CJ2857 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.8 N#CCC1=CC=CN=C1 LT6846 [1,0,0,0,0,0|2,0,1]=4 94 B9R1.8 N#CCC1=NC=CC=C1 LT2169 [1,0,0,0,0,0|2,0,1]=4 95 B9R1.8 N#COC1=CC=CC=C1 RT6011 [1,0,0,0,0,0|2,0,1]=4 96 B9R1.8 NCCC1=CC=CN=C1 LQ4201 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.8 NCCC1=CC=NC=C1 YH11719 [1,0,0,0,0,0|2,0,0]=3 98 B9R1.8 NNCC1=CC=CC=C1 LQ1000 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.8 NNCC1=CC=CC=C1 LX3048 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.8 NOCC1=CC=CC=C1 LT5864 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.8 O=C=NC1=CC=CC=C1 LL0339 [1,0,0,0,0,0|2,0,1]=4 102 B9R1.8 O=CCC1=CC=CC=C1 XJ0479 [1,0,0,0,0,0|1,0,1]=3 103 B9R1.8 O=CCC1=CC=CN=C1 RT9275 [1,0,0,0,0,0|2,0,1]=4 104 B9R1.8 O=COC1=CC=CC=C1 HL2038 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.8 OCCC1=CC=CC=C1 YH43593 [1,0,0,0,0,0|1,0,0]=2 106 B9R1.8 OCCC1=CC=NC=C1 XJ2857 [1,0,0,0,0,0|2,0,0]=3 107 B9R1.8 O\N=C\C1=CC=CC=C1 RT6343 [1,0,0,0,0,0|2,0,1]=4 108 B9R1.8 SCCC1=CC=NC=C1 RT10479 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.8 SCCC1=NC=CC=C1 RT10478 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.8 [2H]\C=C\C1=CC=CC=C1 RT11345 [1,0,0,0,0,0|1,0,2]=4 111 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 SY0100 [0,1,0,0,0,0|2,0,1]=4 112 B11R1.7 CC(N)(CO)C1=CC=CC=C1 YH66378 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.7 CC(O)(CO)C1=CC=CC=C1 HL2733 [0,1,0,0,0,0|1,0,0]=2 114 B11R1.7 CCC(C)(O)C1=CC=CC=C1 JZ4655 [0,1,0,0,0,0|0,0,0]=1 115 B11R1.7 CCS(=O)(=O)C1=CC=CC=C1 LQ1163 [0,1,0,0,0,0|1,0,1]=3 116 B11R1.7 COP(C)(=O)C1=CC=CC=C1 JZ2962 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.7 CO[Si](C)(C)C1=CC=CC=C1 JZ5229 [0,1,0,0,0,0|2,1,0]=4 118 B11R1.12 CCC(CC)C1=NC=CC=C1 LT3246 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.12 CCN(CC)C1=NC=CC=C1 LT3355 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.12 CC[C@@H](CCl)C1=CC=CC=C1 RT17488 [0,1,0,0,0,0|1,0,0]=2 121 B11R1.12 COC(OC)C1=CC=CC=C1 HL0685 [0,1,0,0,0,0|1,0,0]=2 122 B11R1.12 COP(OC)C1=CC=CC=C1 JZ2190 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.12 N#CC(C#N)C1=CC=CC=C1 YH53125 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.12 NCC(CO)C1=CC=CC=C1 RT3247 [0,1,0,0,0,0|1,0,0]=2 125 B11R1.12 OCP(CO)C1=CC=CC=C1 LQ2400 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.16 CCCC(C)C1=CC=CC=C1 XJ2276 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.16 CCC[C@H](N)C1=CC=CC=C1 HL2642 [0,1,0,0,0,0|1,0,0]=2 128 B11R1.16 CCNC(C)C1=CC=CN=C1 RT2509 [0,1,0,0,0,0|2,0,0]=3 129 B11R1.16 CCOC(=N)C1=CC=CC=C1 XJ2841 [0,1,0,0,0,0|1,0,1]=3 130 B11R1.16 CCOC(=O)C1=CC=CC=C1 HL1235 [0,1,0,0,0,0|0,0,2]=3 131 B11R1.16 CCOC(=O)C1=CC=CC=C1 XJ5129 [0,1,0,0,0,0|0,0,2]=3 132 B11R1.16 CCOC(=O)C1=CC=NC=C1 JZ0760 [0,1,0,0,0,0|1,0,2]=4 133 B11R1.16 CCOC(=O)C1=CN=CC=C1 JZ0757 [0,1,0,0,0,0|1,0,2]=4 134 B11R1.16 CN(CCO)C1=NC=CC=C1 YH28946 [0,1,0,0,0,0|3,0,0]=4 135 B11R1.16 CNCC(C)C1=CC=CC=C1 RT3521 [0,1,0,0,0,0|1,0,0]=2 136 B11R1.16 COCC(=O)C1=CC=CC=C1 XJ2596 [0,1,0,0,0,0|0,0,2]=3 137 B11R1.16 N#CCC(=O)C1=CC=CC=C1 LT6989 [0,1,0,0,0,0|0,0,3]=4 138 B11R1.16 N#CCC(O)C1=CC=CC=C1 RT6095 [0,1,0,0,0,0|0,0,1]=2 139 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 LT6112 [0,1,0,0,0,0|1,0,0]=2 140 B11R1.16 O=C(CCBr)C1=CC=CC=C1 YH65517 [0,1,0,0,0,0|0,0,2]=3 141 B11R1.16 O=C(CCCl)C1=CC=CC=C1 YH58599 [0,1,0,0,0,0|0,0,2]=3 142 B11R1.16 OCC[C@@H](O)C1=CC=CC=C1 LL1784 [0,1,0,0,0,0|0,0,0]=1 143 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 RT6757 [0,1,0,0,0,0|0,0,0]=1 144 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 LX3302 [0,1,0,0,0,0|0,0,0]=1 145 B11R1.22 C(=O)C(C)C1=CC=C(Cl)C=C1 YH58118 [0,1,0,0,0,0|2,0,1]=4 146 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 YH65417 [0,1,0,0,0,0|1,0,2]=4 147 B11R1.22 CC1=CC=C(C(C)C=O)C=C1 HL1295 [0,1,0,0,0,0|2,0,1]=4 148 B11R1.22 CC1=CC=C(C(O)CN)C=C1 RT1609 [0,1,0,0,0,0|1,0,0]=2 149 B11R1.22 CCC(=O)C1=CC=C(N)C=C1 YH14959 [0,1,0,0,0,0|0,0,2]=3 150 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 RT11202 [0,1,0,0,0,0|0,0,2]=3 151 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 LT4307 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 JZ3934 [0,1,0,0,0,0|1,0,2]=4 153 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 HL0691 [0,1,0,0,0,0|1,0,2]=4 154 B11R1.22 COC(=O)C1=CC=C(F)C=C1 JZ1260 [0,1,0,0,0,0|1,0,2]=4 155 B11R1.22 COC(=O)C1=CC=C(I)C=C1 JZ3935 [0,1,0,0,0,0|1,0,2]=4 156 B11R1.22 COC(=O)C1=CC=C(N)C=C1 JZ3936 [0,1,0,0,0,0|1,0,2]=4 157 B11R1.22 COC(=O)C1=CC=C(O)C=C1 LT7452 [0,1,0,0,0,0|1,0,2]=4 158 B11R1.22 COC(=O)C1=CC=C([O-])C=C1 YH03826 [0,1,0,0,0,0|1,0,2]=4 159 B11R1.22 FC1=CC=C(C(Br)CBr)C=C1 YH56190 [0,1,0,0,0,0|2,0,0]=3 160 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 RT1562 [0,1,0,0,0,0|1,0,2]=4 161 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 LQ2917 [0,1,0,0,0,0|1,0,2]=4 162 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 RT2897 [0,1,0,0,0,0|1,0,2]=4 163 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 YH17779 [0,1,0,0,0,0|1,0,2]=4 164 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 YH17778 [0,1,0,0,0,0|1,0,2]=4 165 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 HL1815 [0,1,0,0,0,0|1,0,2]=4 166 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 LX2710 [0,1,0,0,0,0|1,0,2]=4 167 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 YH43755 [0,1,0,0,0,0|1,0,2]=4 168 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 HL1296 [0,1,0,0,0,0|1,0,2]=4 169 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 LT2785 [0,1,0,0,0,0|1,0,2]=4 170 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 RT10679 [0,1,0,0,0,0|1,0,2]=4 171 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 HL1817 [0,1,0,0,0,0|1,0,2]=4 172 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 YH11049 [0,1,0,0,0,0|1,0,2]=4 173 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 RT12028 [0,1,0,0,0,0|0,0,2]=3 174 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 YH65453 [0,1,0,0,0,0|0,0,2]=3 175 B11R1.23 CCC(=O)C1=CC=CC(O)=C1 LQ3598 [0,1,0,0,0,0|0,0,2]=3 176 B11R1.23 COC(=O)C1=CC(O)=CC=C1 XJ4508 [0,1,0,0,0,0|1,0,2]=4 177 B11R1.23 COC(=O)C1=CC=CC(C)=C1 XJ0280 [0,1,0,0,0,0|1,0,2]=4 178 B11R1.23 COC(=O)C1=CC=CC(N)=C1 HL2757 [0,1,0,0,0,0|1,0,2]=4 179 B11R1.23 N#CC(O)C1=CC=CC(O)=C1 RT6293 [0,1,0,0,0,0|1,0,1]=3 180 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 YH05716 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.23 NCC(O)C1=CC(O)=CC=C1 RT2781 [0,1,0,0,0,0|1,0,0]=2 182 B11R1.23 O=C(CCl)C1=CC=CC(Cl)=C1 LQ4318 [0,1,0,0,0,0|1,0,2]=4 183 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 JZ3849 [0,1,0,0,0,0|0,0,3]=4 184 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 HL0407 [0,1,0,0,0,0|1,0,1]=3 185 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 YH58730 [0,1,0,0,0,0|1,0,1]=3 186 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 JZ3850 [0,1,0,0,0,0|2,0,1]=4 187 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 LQ2063 [0,1,0,0,0,0|0,0,2]=3 188 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 XJ1123 [0,1,0,0,0,0|0,0,2]=3 189 B11R1.36 CC(C)C(O)C1=CC=CC=C1 XJ1122 [0,1,0,0,0,0|0,0,0]=1 190 B11R1.36 CC(C1=CC=CC=C1)N(C)C XJ2195 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 RT10540 [0,1,0,0,0,0|0,0,2]=3 192 B11R1.36 C[C@@H](N)[C@H](O)C1=CC=CC=C1 RT3084 [0,1,0,0,0,0|0,0,0]=1 193 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 JZ0182 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 JZ0158 [0,1,0,0,0,0|2,0,1]=4 195 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 LT4728 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 YH52440 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.36 O=C(C1=CC=CC=C1)C(Cl)Cl JZ2121 [0,1,0,0,0,0|1,0,2]=4 198 B11R1.36 O=C(C1=CC=CC=C1)C(F)F HL1767 [0,1,0,0,0,0|1,0,2]=4 199 B11R1.36 O=C(C1=CC=CC=C1)C(O)O JZ4378 [0,1,0,0,0,0|1,0,2]=4 200 B11R1.36 O=C(Cl)C(Cl)C1=CC=CC=C1 LT6908 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 XJ2766 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 YH66089 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 JZ1417 [0,1,0,0,0,0|1,0,1]=3 204 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 LX2232 [0,1,0,0,0,0|1,0,1]=3 205 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 XJ0179 [0,1,0,0,0,0|1,0,1]=3 206 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 XJ4358 [0,1,0,0,0,0|1,0,1]=3 207 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 LT4732 [0,1,0,0,0,0|1,0,1]=3 208 B11R1.36 O=[PH]([O-])C(O)C1=CC=CC=C1 RT12947 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.36 [C@H](C)(C(=O)O)C1=CC=CC=C1 JZ0854 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.222 CCC(=O)C1=CC=CC=C1F XJ0760 [0,1,0,0,0,0|0,0,2]=3 211 B11R1.222 CCC(C)C1=C(O)C=CC=C1 LL0208 [0,1,0,0,0,0|1,0,0]=2 212 B11R1.222 CNC(=O)C1=CC=CC=C1N HL2654 [0,1,0,0,0,0|1,0,2]=4 213 B11R1.222 COC(=O)C1=C(C)C=CC=C1 LT7460 [0,1,0,0,0,0|1,0,2]=4 214 B11R1.222 COC(=O)C1=C(I)C=CC=C1 LT1761 [0,1,0,0,0,0|1,0,2]=4 215 B11R1.222 COC(=O)C1=CC=CC=C1O JZ3307 [0,1,0,0,0,0|1,0,2]=4 216 B11R1.222 NCC(=O)C1=C(Br)C=CC=C1 YH08544 [0,1,0,0,0,0|1,0,2]=4 217 B11R1.222 NCC(=O)C1=C(Cl)C=CC=C1 HL4533 [0,1,0,0,0,0|1,0,2]=4 218 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 YH16342 [0,1,0,0,0,0|1,0,2]=4 219 B11R1.222 NCC(O)C1=CC=CC=C1F JZ2275 [0,1,0,0,0,0|1,0,0]=2 220 B11R1.222 O=C(CBr)C1=CC=CC=C1Cl HL2832 [0,1,0,0,0,0|1,0,2]=4 221 B11R1.222 O=C(CCl)C1=CC=CC=C1F RT11088 [0,1,0,0,0,0|1,0,2]=4 222 B11R2.1 CC1=CCC2=C1C=CC=C2 YH66128 [0,0,0,1,0,0|1,0,2]=4 223 B11R2.1 CC1C=CC2=CC=CC=C21 YH65581 [0,0,0,1,0,0|1,0,2]=4 224 B11R2.1 CC1CCC2=NC=CN=C21 LT3758 [0,0,0,1,0,0|3,0,0]=4 225 B11R2.1 CC1CNC2=CC=CC=C21 YH01636 [0,0,0,1,0,0|2,0,0]=3 226 B11R2.1 CN1CCC2=C1C=CC=C2 LQ1487 [0,0,0,1,0,0|2,0,0]=3 227 B11R2.1 NC1CCC2=C1C=CC=C2 JZ0372 [0,0,0,1,0,0|1,0,0]=2 228 B11R2.1 NC1CCC2=C1C=CC=C2 LL1225 [0,0,0,1,0,0|1,0,0]=2 229 B11R2.1 N[C@H]1CCC2=CC=CC=C21 RT1824 [0,0,0,1,0,0|1,0,0]=2 230 B11R2.1 N[C@H]1CCC2=CC=CN=C21 YH03814 [0,0,0,1,0,0|2,0,0]=3 231 B11R2.1 O=C1CCC2=CC=CC=C12 RT11144 [0,0,0,1,0,0|0,0,2]=3 232 B11R2.1 O=C1CCC2=CC=CN=C12 YH53701 [0,0,0,1,0,0|1,0,2]=4 233 B11R2.1 O=C1COC2=CC=CC=C12 LT6773 [0,0,0,1,0,0|1,0,2]=4 234 B11R2.1 O=C1NCC2=CC=CC=C12 YH03035 [0,0,0,1,0,0|1,0,2]=4 235 B11R2.1 OC1=CNC2=C1C=CC=C2 RT14410 [0,0,0,1,0,0|1,0,2]=4 236 B11R2.1 ON1N=NC2=CC=CC=C21 LT7863 [0,0,0,1,0,0|3,0,0]=4 237 B11R2.1 ON1N=NC2=CC=CC=C21 RT15166 [0,0,0,1,0,0|3,0,0]=4 238 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 RT2823 [0,0,0,1,0,0|2,0,0]=3 239 B11R2.40 NC1(C2=CC=CC=C2)CC1 YH00383 [0,0,0,1,0,0|1,0,0]=2 240 B11R2.40 NC1(C2=CC=CC=C2)CC1 YH16483 [0,0,0,1,0,0|1,0,0]=2 241 B11R2.239 C1=CC=C(C2CNC2)C=C1 RT7923 [0,0,0,1,0,0|2,0,0]=3 242 B9R1.11 CCC(=O)C1=CC=CN1 JZ4355 [0,0,0,0,1,0|1,0,2]=4 243 B9R1.11 CCC(=O)C1=CC=CO1 JZ2245 [0,0,0,0,1,0|1,0,2]=4 244 B9R1.11 CCC(=O)C1=CC=CS1 JZ4817 [0,0,0,0,1,0|1,0,2]=4 245 B9R1.11 CCC(=O)C1=CC=CS1 LT0591 [0,0,0,0,1,0|1,0,2]=4 246 B9R1.11 CCC(C)C1=NC=CS1 XJ4408 [0,0,0,0,1,0|3,0,0]=4 247 B9R1.11 CNC(C)C1=CC=CS1 HL3673 [0,0,0,0,1,0|3,0,0]=4 248 B11R1.40 CNC(C)CC1=CC=CN=C1 RT1972 [0,0,0,0,0,1|3,0,0]=4 249 B11R1.40 C\C(=C/C1=CC=CC=C1)CO YH66093 [0,0,0,0,0,1|2,0,1]=4 250 B11R1.40 N#CC(O)CC1=CC=CC=C1 CJ2908 [0,0,0,0,0,1|1,0,1]=3 251 B11R1.40 NCC(=O)CC1=CC=CC=C1 RT12543 [0,0,0,0,0,1|1,0,2]=4 252 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 RT1726 [0,0,0,0,0,1|2,0,0]=3 253 B11R1.40 NC[C@H](N)CC1=CC=CC=C1 RT1725 [0,0,0,0,0,1|2,0,0]=3 254 B11R1.40 O=C(CBr)CC1=CC=CC=C1 RT10869 [0,0,0,0,0,1|1,0,2]=4 255 B11R1.40 O=C(CBr)OC1=CC=CC=C1 JZ3957 [0,0,0,0,0,1|1,0,2]=4 256 B11R1.40 O=C(CCl)NC1=CC=CC=C1 YH08620 [0,0,0,0,0,1|1,0,2]=4 257 B11R1.40 O=C(CO)CC1=CC=CC=C1 RT6783 [0,0,0,0,0,1|1,0,2]=4 258 B8R0.4 CCC\C=C\C=C\C=O LT5073 [1,0,1,0,0,0|1,0,0]=3 259 B8R1.2 BrCC1=CC=CC=C1 JZ1264 [2,0,0,0,0,0|1,0,0]=3 260 B8R1.2 BrCC1=CC=CN=C1 YH03265 [2,0,0,0,0,0|2,0,0]=4 261 B8R1.2 BrCC1=CC=CN=C1 YH65568 [2,0,0,0,0,0|2,0,0]=4 262 B8R1.2 BrCC1=NC=CC=C1 LQ4674 [2,0,0,0,0,0|2,0,0]=4 263 B8R1.2 Br[Mg]C1=CC=CC=C1 HL1276 [2,0,0,0,0,0|2,0,0]=4 264 B8R1.2 C=CC1=CC=CC=C1 XJ3473 [2,0,0,0,0,0|0,0,2]=4 265 B8R1.2 CCC1=CC=CN=C1 JZ1084 [2,0,0,0,0,0|1,0,0]=3 266 B8R1.2 CCC1=CC=NC=C1 LL0974 [2,0,0,0,0,0|1,0,0]=3 267 B8R1.2 CNC1=CC=CN=C1 LT2493 [2,0,0,0,0,0|2,0,0]=4 268 B8R1.2 CNC1=CC=NC=C1 LT6892 [2,0,0,0,0,0|2,0,0]=4 269 B8R1.2 COC1=CC=CN=C1 LT6817 [2,0,0,0,0,0|2,0,0]=4 270 B8R1.2 COC1=NC=CC=C1 LT2109 [2,0,0,0,0,0|2,0,0]=4 271 B8R1.2 CSC1=NC=CC=C1 LT2167 [2,0,0,0,0,0|2,0,0]=4 272 B8R1.2 ClCC1=CC=CC=C1 HL1268 [2,0,0,0,0,0|1,0,0]=3 273 B8R1.2 ClCC1=CC=CC=N1 JZ2503 [2,0,0,0,0,0|2,0,0]=4 274 B8R1.2 ClCC1=CC=CN=C1 JZ0781 [2,0,0,0,0,0|2,0,0]=4 275 B8R1.2 ClCC1=CC=CN=C1 YH53620 [2,0,0,0,0,0|2,0,0]=4 276 B8R1.2 ClCC1=NC=CC=C1 JZ0742 [2,0,0,0,0,0|2,0,0]=4 277 B8R1.2 ClCC1=NC=CC=C1 LT2316 [2,0,0,0,0,0|2,0,0]=4 278 B8R1.2 N#CC1=CC=CC=C1 JZ4954 [2,0,0,0,0,0|1,0,1]=4 279 B8R1.2 N#CC1=CC=CC=C1 XJ4015 [2,0,0,0,0,0|1,0,1]=4 280 B8R1.2 NCC1=CC=CC=C1 LQ1371 [2,0,0,0,0,0|1,0,0]=3 281 B8R1.2 NCC1=CC=CN=C1 RT2311 [2,0,0,0,0,0|2,0,0]=4 282 B8R1.2 NCC1=CC=NC=C1 LL1070 [2,0,0,0,0,0|2,0,0]=4 283 B8R1.2 NCC1=CC=NC=C1 RT10176 [2,0,0,0,0,0|2,0,0]=4 284 B8R1.2 NCC1=NC=CC=C1 HL2591 [2,0,0,0,0,0|2,0,0]=4 285 B8R1.2 NNC1=CC=CC=C1 HL1279 [2,0,0,0,0,0|2,0,0]=4 286 B8R1.2 NNC1=CC=CC=C1 JZ5772 [2,0,0,0,0,0|2,0,0]=4 287 B8R1.2 O=NC1=CC=CC=C1 YH08587 [2,0,0,0,0,0|1,0,1]=4 288 B8R1.2 O=[As]C1=CC=CC=C1 JZ4036 [2,0,0,0,0,0|1,0,1]=4 289 B8R1.2 OCC1=CC=CC=C1 HL1271 [2,0,0,0,0,0|0,0,0]=2 290 B8R1.2 OCC1=CC=CC=N1 LT2170 [2,0,0,0,0,0|1,0,0]=3 291 B8R1.2 OCC1=CN=CC=C1 HL1274 [2,0,0,0,0,0|1,0,0]=3 292 B8R1.2 OCC1=CN=CN=C1 LX3222 [2,0,0,0,0,0|2,0,0]=4 293 B8R1.2 OCC1=NC=CN=C1 YH13049 [2,0,0,0,0,0|2,0,0]=4 294 B8R1.2 OCC1=NC=NC=C1 YH55246 [2,0,0,0,0,0|2,0,0]=4 295 B8R1.2 O[Hg]C1=CC=CC=C1 LQ3360 [2,0,0,0,0,0|1,0,0]=3 296 B8R1.2 SCC1=CC=CC=C1 HL1273 [2,0,0,0,0,0|0,1,0]=3 297 B8R1.2 [C-]#CC1=CC=CC=C1 JZ3648 [2,0,0,0,0,0|0,0,2]=4 298 B8R1.2 [C-]#[N+]C1=CC=CC=C1 YH65599 [2,0,0,0,0,0|1,0,1]=4 299 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HL1303 [1,1,0,0,0,0|0,0,2]=4 300 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 JZ1119 [1,1,0,0,0,0|0,0,2]=4 301 B10R1.13 CC(=O)C1=CC=C(F)C=C1 JZ1124 [1,1,0,0,0,0|0,0,2]=4 302 B10R1.13 CC(=O)C1=CC=C(N)C=C1 LT6854 [1,1,0,0,0,0|0,0,2]=4 303 B10R1.13 CC(=O)C1=CC=C(O)C=C1 RT11987 [1,1,0,0,0,0|0,0,2]=4 304 B10R1.13 CC(C)C1=CC=C(Br)C=C1 XJ1042 [1,1,0,0,0,0|1,0,0]=3 305 B10R1.13 CC(C)C1=CC=C(N)C=N1 YH00023 [1,1,0,0,0,0|2,0,0]=4 306 B10R1.13 CC(N)C1=CC=C(Br)C=C1 YH48936 [1,1,0,0,0,0|1,0,0]=3 307 B10R1.13 CC(N)C1=NC=C(F)C=C1 SY0015 [1,1,0,0,0,0|2,0,0]=4 308 B10R1.13 CC(O)C1=CC=C(F)C=C1 LQ0797 [1,1,0,0,0,0|0,0,0]=2 309 B10R1.13 CC1=CC=C(B(O)O)C=C1 SY0255 [1,1,0,0,0,0|2,0,0]=4 310 B10R1.13 CC1=CC=C(C(=O)O)C=C1 JZ0130 [1,1,0,0,0,0|1,0,1]=4 311 B10R1.13 CC1=CC=C(C(C)C)C=C1 XJ5623 [1,1,0,0,0,0|1,0,0]=3 312 B10R1.13 CC1=CC=C(C(C)N)C=C1 JZ0723 [1,1,0,0,0,0|1,0,0]=3 313 B10R1.13 CC1=CC=C(C(C)O)C=C1 LL0968 [1,1,0,0,0,0|0,0,0]=2 314 B10R1.13 CC1=CC=C(C(C)O)C=N1 RT2394 [1,1,0,0,0,0|1,0,0]=3 315 B10R1.13 CC1=CC=C(N(C)C)C=C1 YH99046 [1,1,0,0,0,0|2,0,0]=4 316 B10R1.13 CC1=CC=C(S(=O)O)C=C1 LL0969 [1,1,0,0,0,0|2,0,0]=4 317 B10R1.13 CN(C)C1=CC=C(Br)C=C1 LT2750 [1,1,0,0,0,0|2,0,0]=4 318 B10R1.13 CN(C)C1=CC=C(N)C=C1 HL1305 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.13 CN(C)C1=CC=C(N)C=C1 LL0967 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.13 CN(C)C1=CC=C(N)C=C1 LQ4413 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.13 CN(C)C1=CC=C(N)C=C1 XJ3077 [1,1,0,0,0,0|2,0,0]=4 322 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 LQ5152 [1,1,0,0,0,0|1,0,0]=3 323 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 YH17516 [1,1,0,0,0,0|1,0,0]=3 324 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 XJ4897 [1,1,0,0,0,0|1,0,0]=3 325 B10R1.13 ClC1=CC=C(C(Cl)Cl)C=C1 LT3445 [1,1,0,0,0,0|2,0,0]=4 326 B10R1.13 NC1=CC=C(B(O)O)C=C1 SY0280 [1,1,0,0,0,0|2,0,0]=4 327 B10R1.13 NC1=CC=C(C(=O)O)C=C1 RT3381 [1,1,0,0,0,0|1,0,1]=4 328 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 XJ1044 [1,1,0,0,0,0|1,0,1]=4 329 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 JZ0383 [1,1,0,0,0,0|1,0,1]=4 330 B10R1.13 O=C(O)C1=CC=C(F)C=C1 JZ1125 [1,1,0,0,0,0|1,0,1]=4 331 B10R1.13 O=C(O)C1=CC=C(I)C=C1 JZ3940 [1,1,0,0,0,0|1,0,1]=4 332 B10R1.13 O=C(O)C1=CC=C(O)C=C1 JZ0015 [1,1,0,0,0,0|1,0,1]=4 333 B10R1.13 OB(O)C1=CC=C(Br)C=C1 CJ2455 [1,1,0,0,0,0|2,0,0]=4 334 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 LQ1888 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.13 OB(O)C1=CC=C(F)C=C1 XJ1901 [1,1,0,0,0,0|2,0,0]=4 336 B10R1.13 OB(O)C1=CC=C(O)C=C1 XJ6238 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.28 CC(C)(C)C1=CC=CC=C1 XJ0222 [1,1,0,0,0,0|1,0,0]=3 338 B10R1.28 CC(C)(N)C1=CC=CC=C1 XJ1030 [1,1,0,0,0,0|1,0,0]=3 339 B10R1.28 CC(C)(N)C1=CN=CC=C1 YH99047 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.28 CC(C)(O)C1=CC=CC=C1 LQ1212 [1,1,0,0,0,0|0,0,0]=2 341 B10R1.28 CC(C)(S)C1=CC=CC=C1 YH38274 [1,1,0,0,0,0|0,1,0]=3 342 B10R1.28 CP(=O)(Cl)C1=CC=CC=C1 XJ2994 [1,1,0,0,0,0|1,0,1]=4 343 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 LQ2383 [1,1,0,0,0,0|1,0,1]=4 344 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 HL2720 [1,1,0,0,0,0|2,0,0]=4 345 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 HL0392 [1,1,0,0,0,0|1,1,0]=4 346 B10R1.28 C[Si](C)(O)C1=CC=CC=C1 JZ2662 [1,1,0,0,0,0|0,1,0]=3 347 B10R1.28 C[Si](C)([O-])C1=CC=CC=C1 LQ3287 [1,1,0,0,0,0|0,1,1]=4 348 B10R1.28 FC(F)(F)C1=CC=CC=C1 YH98647 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 RT13210 [1,1,0,0,0,0|2,0,0]=4 350 B10R1.28 O=[As](O)(O)C1=CC=CC=C1 XJ0221 [1,1,0,0,0,0|2,0,0]=4 351 B10R1.61 C=C(C)C1=CC=CC=C1C LQ4513 [1,1,0,0,0,0|1,0,1]=4 352 B10R1.61 CC(=O)C1=C(C)C=CC=C1 JZ3832 [1,1,0,0,0,0|0,0,2]=4 353 B10R1.61 CC(=O)C1=C(F)C=CC=C1 LT6542 [1,1,0,0,0,0|0,0,2]=4 354 B10R1.61 CC(=O)C1=CC=CC=C1Br LQ2085 [1,1,0,0,0,0|0,0,2]=4 355 B10R1.61 CC(=O)C1=CC=CC=C1Cl RT11894 [1,1,0,0,0,0|0,0,2]=4 356 B10R1.61 CC(C)C1=C(Br)C=CC=C1 XJ3244 [1,1,0,0,0,0|1,0,0]=3 357 B10R1.61 CC(C)C1=C(N)C=CC=C1 JZ4085 [1,1,0,0,0,0|1,0,0]=3 358 B10R1.61 CC(C)C1=C(O)C=CC=C1 LL0172 [1,1,0,0,0,0|1,0,0]=3 359 B10R1.61 CC(N)C1=CC=CC=C1O YH66634 [1,1,0,0,0,0|1,0,0]=3 360 B10R1.61 CC(N)C1=NC=CC=C1N RT2322 [1,1,0,0,0,0|2,0,0]=4 361 B10R1.61 CC(O)C1=CC=CC=C1Cl LQ3656 [1,1,0,0,0,0|0,0,0]=2 362 B10R1.61 CC1=C(C(=O)O)C=CC=C1 LQ0494 [1,1,0,0,0,0|1,0,1]=4 363 B10R1.61 CC1=C(C(Cl)Cl)C=CC=C1 LT3220 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.61 CC1=CC=CC=C1B(O)O LT6617 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.61 CC1=CC=CC=C1N(C)C XJ1085 [1,1,0,0,0,0|2,0,0]=4 366 B10R1.61 CN(C)C1=CC=CC=C1Cl LQ1380 [1,1,0,0,0,0|2,0,0]=4 367 B10R1.61 C[C@@H](N)C1=CC=CC=C1O YH29387 [1,1,0,0,0,0|1,0,0]=3 368 B10R1.61 C[C@@H](N)C1=NC=CC=C1F RT1757 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.61 C[C@H](N)C1=NC=CC=C1F RT1756 [1,1,0,0,0,0|2,0,0]=4 370 B10R1.61 NC1=C(C(=O)O)C=CC=C1 LT0272 [1,1,0,0,0,0|1,0,1]=4 371 B10R1.61 NC1=CC=CC=C1B(O)O LT0279 [1,1,0,0,0,0|2,0,0]=4 372 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 LQ0495 [1,1,0,0,0,0|1,0,1]=4 373 B10R1.61 O=C(O)C1=C(I)C=CC=C1 LT6566 [1,1,0,0,0,0|1,0,1]=4 374 B10R1.61 O=C(O)C1=C(O)C=CC=C1 RT10607 [1,1,0,0,0,0|1,0,1]=4 375 B10R1.61 O=C(O)C1=CC=CC=C1Br LL0169 [1,1,0,0,0,0|1,0,1]=4 376 B10R1.61 O=C(O)C1=CC=CC=C1S LQ3223 [1,1,0,0,0,0|1,0,1]=4 377 B10R1.61 O=C(O)C1=CC=CC=C1[O-] LQ0966 [1,1,0,0,0,0|1,0,1]=4 378 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 LT1715 [1,1,0,0,0,0|2,0,0]=4 379 B10R1.61 OB(O)C1=C(F)C=CC=C1 XJ1970 [1,1,0,0,0,0|2,0,0]=4 380 B10R1.113 C=C(C)C1=CC(C)=CC=C1 HL0676 [1,1,0,0,0,0|1,0,1]=4 381 B10R1.113 CC(=O)C1=CC(F)=CC=C1 LT6788 [1,1,0,0,0,0|0,0,2]=4 382 B10R1.113 CC(=O)C1=CC(N)=CC=C1 LT6621 [1,1,0,0,0,0|0,0,2]=4 383 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 LQ2084 [1,1,0,0,0,0|0,0,2]=4 384 B10R1.113 CC(=O)C1=CC=CC(O)=C1 LT6622 [1,1,0,0,0,0|0,0,2]=4 385 B10R1.113 CC(C)C1=CC(Br)=CC=C1 HL2984 [1,1,0,0,0,0|1,0,0]=3 386 B10R1.113 CC(C)C1=CC(O)=CC=C1 RT10578 [1,1,0,0,0,0|1,0,0]=3 387 B10R1.113 CC(C)C1=CC=CC(N)=C1 XJ2891 [1,1,0,0,0,0|1,0,0]=3 388 B10R1.113 CC(C)C1=CC=CC(N)=N1 YH18705 [1,1,0,0,0,0|2,0,0]=4 389 B10R1.113 CC(C)C1=NC(Cl)=CC=C1 YH27840 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 RT2925 [1,1,0,0,0,0|1,0,0]=3 391 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 JZ3057 [1,1,0,0,0,0|0,0,0]=2 392 B10R1.113 CC(O)C1=CC=CC(N)=C1 XJ2202 [1,1,0,0,0,0|0,0,0]=2 393 B10R1.113 CC1=CC(N(C)C)=CC=C1 LL0511 [1,1,0,0,0,0|2,0,0]=4 394 B10R1.113 CC1=CC=CC(B(O)O)=C1 LT6827 [1,1,0,0,0,0|2,0,0]=4 395 B10R1.113 CC1=CC=CC(C(=O)O)=C1 XJ0266 [1,1,0,0,0,0|1,0,1]=4 396 B10R1.113 CC1=CC=CC(C(Cl)Cl)=C1 LT3221 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.113 NC1=CC=CC(B(O)O)=C1 LT2552 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 LT3007 [1,1,0,0,0,0|1,0,1]=4 399 B10R1.113 O=C(O)C1=CC(F)=CC=C1 JZ1086 [1,1,0,0,0,0|1,0,1]=4 400 B10R1.113 O=C(O)C1=CC(I)=CC=C1 LQ1220 [1,1,0,0,0,0|1,0,1]=4 401 B10R1.113 O=C(O)C1=CC(O)=CC=C1 RT13217 [1,1,0,0,0,0|1,0,1]=4 402 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 LT2935 [1,1,0,0,0,0|1,0,1]=4 403 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 JZ4304 [1,1,0,0,0,0|1,0,1]=4 404 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 SY0269 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.113 OB(O)C1=CC(F)=CC=C1 LT2898 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.1 CC1=CC=C(CC#N)C=C1 JZ2192 [1,1,0,0,0,0|1,0,1]=4 407 B10R1.1 CC1=CC=C(CCN)C=C1 XJ2410 [1,1,0,0,0,0|1,0,0]=3 408 B10R1.1 CC1=CN=C(CCN)C=C1 YH88428 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.1 CCCC1=CC=C(N)C=C1 XJ2253 [1,1,0,0,0,0|0,0,0]=2 410 B10R1.1 CCNC1=CC=C(C)C=C1 JZ4006 [1,1,0,0,0,0|1,0,0]=3 411 B10R1.1 CCNC1=CC=C(Cl)C=C1 YH66088 [1,1,0,0,0,0|1,0,0]=3 412 B10R1.1 CCOC1=CC=C(Br)C=N1 LQ5337 [1,1,0,0,0,0|2,0,0]=4 413 B10R1.1 CCOC1=CC=C(I)C=C1 LQ1391 [1,1,0,0,0,0|1,0,0]=3 414 B10R1.1 CCOC1=CC=C(N)C=C1 RT3081 [1,1,0,0,0,0|1,0,0]=3 415 B10R1.1 CCOC1=CC=C(O)C=C1 JZ4008 [1,1,0,0,0,0|1,0,0]=3 416 B10R1.1 CCOC1=CN=C(Cl)C=C1 LX1903 [1,1,0,0,0,0|2,0,0]=4 417 B10R1.1 CCOC1=NC=C(N)C=C1 YH04966 [1,1,0,0,0,0|2,0,0]=4 418 B10R1.1 CNCC1=CC=C(Cl)N=C1 RT2410 [1,1,0,0,0,0|2,0,0]=4 419 B10R1.1 COCC1=CC=C(O)C=C1 YH05854 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.1 ClC1=CC=C(CCBr)C=C1 XJ3158 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.1 FC1=CC=C(CCBr)C=C1 RT12501 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.1 N#CCC1=CC=C(Br)C=C1 LT6208 [1,1,0,0,0,0|1,0,1]=4 423 B10R1.1 N#CCC1=CC=C(Cl)C=C1 JZ0810 [1,1,0,0,0,0|1,0,1]=4 424 B10R1.1 N#CCC1=CC=C(F)C=C1 HL1841 [1,1,0,0,0,0|1,0,1]=4 425 B10R1.1 N#CCC1=CC=C(I)C=C1 LQ5219 [1,1,0,0,0,0|1,0,1]=4 426 B10R1.1 N#CCC1=CC=C(N)C=C1 LT1657 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.1 NCCC1=CC=C(Br)C=C1 LL1320 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.1 NCCC1=CC=C(Cl)C=C1 LQ0644 [1,1,0,0,0,0|1,0,0]=3 429 B10R1.1 NCCC1=CC=C(F)C=C1 LT3075 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.1 NCCC1=CC=C(N)C=C1 LT0213 [1,1,0,0,0,0|1,0,0]=3 431 B10R1.1 NCCC1=CC=C(O)C=C1 RT6525 [1,1,0,0,0,0|1,0,0]=3 432 B10R1.1 NCCC1=CC=C(O)C=C1 YH09355 [1,1,0,0,0,0|1,0,0]=3 433 B10R1.1 O=CCC1=CC=C(F)C=C1 YH40007 [1,1,0,0,0,0|1,0,1]=4 434 B10R1.1 O=CCC1=CC=C(O)C=C1 RT6375 [1,1,0,0,0,0|1,0,1]=4 435 B10R1.1 OCCC1=CC=C(Br)C=C1 LQ2719 [1,1,0,0,0,0|1,0,0]=3 436 B10R1.1 OCCC1=CC=C(F)C=C1 LT2419 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.1 OCCC1=CC=C(O)C=C1 RT12563 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.4 CC1=CC=CC=C1CC#N LT5660 [1,1,0,0,0,0|1,0,1]=4 439 B10R1.4 CC1=NC=CC=C1CCO RT8739 [1,1,0,0,0,0|2,0,0]=4 440 B10R1.4 CCCC1=CC=CC=C1O JZ4091 [1,1,0,0,0,0|0,0,0]=2 441 B10R1.4 CCOC1=C(Br)C=CC=C1 XJ1001 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.4 CCOC1=C(Cl)C=CC=C1 HL0191 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.4 CCOC1=C(F)C=CC=C1 LT6548 [1,1,0,0,0,0|1,0,0]=3 444 B10R1.4 CCOC1=C(O)C=CC=C1 LQ0245 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.4 CCOC1=CC=CN=C1Br YH94023 [1,1,0,0,0,0|2,0,0]=4 446 B10R1.4 CCOC1=CC=CN=C1N YH20158 [1,1,0,0,0,0|2,0,0]=4 447 B10R1.4 CCOC1=NC=CC=C1I LT3940 [1,1,0,0,0,0|2,0,0]=4 448 B10R1.4 N#CCC1=C(Br)C=CC=C1 XJ4518 [1,1,0,0,0,0|1,0,1]=4 449 B10R1.4 N#CCC1=C(F)C=CC=C1 HL1631 [1,1,0,0,0,0|1,0,1]=4 450 B10R1.4 N#CCC1=C(I)C=CC=C1 LQ5028 [1,1,0,0,0,0|1,0,1]=4 451 B10R1.4 N#CCC1=CC=CC=C1Br LT2296 [1,1,0,0,0,0|1,0,1]=4 452 B10R1.4 N#CCC1=CC=CC=C1N RT1593 [1,1,0,0,0,0|1,0,1]=4 453 B10R1.4 NC1=CC=CC=C1CCO YH05747 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.4 NCCC1=CC=CC=C1Br XJ6027 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.4 NCCC1=CC=CC=C1O RT6527 [1,1,0,0,0,0|1,0,0]=3 456 B10R1.4 NCCN1C=CC=CC1=O YH56675 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.4 O=CCC1=C(Cl)C=CC=C1 LQ2618 [1,1,0,0,0,0|1,0,1]=4 458 B10R1.4 O=CCC1=CC=CC=C1F XJ6347 [1,1,0,0,0,0|1,0,1]=4 459 B10R1.4 OCCC1=CC=CC=C1Br JZ4362 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.4 ONCC1=CC=CC=C1Cl JZ2761 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.10 CC1=CC=CC(CC#N)=C1 LT2624 [1,1,0,0,0,0|1,0,1]=4 462 B10R1.10 CC1=CC=CC(CCO)=N1 CJ3011 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.10 CCCC1=CC(N)=CC=C1 YH65505 [1,1,0,0,0,0|0,0,0]=2 464 B10R1.10 CCCC1=CC(N)=NC=C1 HL4171 [1,1,0,0,0,0|1,0,0]=3 465 B10R1.10 CCOC1=CC(Br)=CC=C1 XJ2220 [1,1,0,0,0,0|1,0,0]=3 466 B10R1.10 CCOC1=CC(Br)=CN=C1 YH39559 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.10 CCOC1=CC(F)=CC=C1 HL1827 [1,1,0,0,0,0|1,0,0]=3 468 B10R1.10 CCOC1=CC(F)=NC=C1 LX3150 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.10 CCOC1=CC=CC(O)=C1 JZ3968 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.10 CCOC1=CC=NC(N)=C1 XJ5598 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.10 CCOC1=CN=CC(N)=C1 LX2438 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.10 CNCC1=CC(Br)=CC=C1 HL4336 [1,1,0,0,0,0|1,0,0]=3 473 B10R1.10 N#CCC1=CC(I)=CC=C1 HL3403 [1,1,0,0,0,0|1,0,1]=4 474 B10R1.10 N#CCC1=CC=CC(Br)=C1 LT6740 [1,1,0,0,0,0|1,0,1]=4 475 B10R1.10 N#CCC1=CC=CC(Cl)=C1 LT2337 [1,1,0,0,0,0|1,0,1]=4 476 B10R1.10 N#CCC1=CC=CC(F)=C1 LQ3386 [1,1,0,0,0,0|1,0,1]=4 477 B10R1.10 NC1=CC(CCO)=CC=C1 XJ5592 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.10 NCCC1=CC(F)=CC=C1 YH59765 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.10 NCCC1=CC=CC(Br)=C1 YH08740 [1,1,0,0,0,0|1,0,0]=3 480 B10R1.10 NCCC1=CC=CC(O)=C1 YH55865 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.10 O=CCC1=CC(F)=CC=C1 YH17193 [1,1,0,0,0,0|1,0,1]=4 482 B10R1.10 OCCC1=CC(Br)=CC=C1 YH51734 [1,1,0,0,0,0|1,0,0]=3 483 B10R1.10 OCCC1=CC=CC(O)=C1 YH66577 [1,1,0,0,0,0|1,0,0]=3 484 B10R1.10 OCCC1=NC=CC(Cl)=C1 RT9226 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.17 BrCCCC1=CC=CN=C1 RT14570 [1,1,0,0,0,0|1,0,0]=3 486 B10R1.17 BrCCOC1=CC=CC=C1 HL0054 [1,1,0,0,0,0|1,0,0]=3 487 B10R1.17 BrC\C=C\C1=CC=CC=C1 LT4566 [1,1,0,0,0,0|0,0,2]=4 488 B10R1.17 C(=O)CCC1=CC=CC=C1 LL0373 [1,1,0,0,0,0|0,0,1]=3 489 B10R1.17 C(=O)OCC1=CC=CC=C1 LL0376 [1,1,0,0,0,0|1,0,1]=4 490 B10R1.17 C=CCCC1=CC=CC=C1 YH17996 [1,1,0,0,0,0|0,0,1]=3 491 B10R1.17 CCC#CC1=CC=CC=C1 JZ4010 [1,1,0,0,0,0|0,0,1]=3 492 B10R1.17 CCCCC1=CC=CN=C1 XJ0908 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.17 CCCCC1=NC=CC=C1 HL2877 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.17 CCCC[N+]1=CC=CC=C1 HL0679 [1,1,0,0,0,0|1,0,0]=3 495 B10R1.17 CCCNC1=CC=CC=C1 XJ1126 [1,1,0,0,0,0|0,0,0]=2 496 B10R1.17 CCCOC1=CC=CC=C1 XJ1127 [1,1,0,0,0,0|0,0,0]=2 497 B10R1.17 CCNCC1=CC=CN=C1 XJ2344 [1,1,0,0,0,0|1,0,0]=3 498 B10R1.17 CCNCC1=CC=NC=C1 YH55114 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.17 CNCCC1=CC=NC=C1 YH66483 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.17 CNCCC1=NC=CC=C1 RT4594 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.17 CNCCC1=NC=CC=C1 RT4605 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.17 COCCC1=NC=CC=C1 LT3761 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.17 ClCCCC1=CC=CC=C1 LL0372 [1,1,0,0,0,0|0,0,0]=2 504 B10R1.17 ClCOCC1=CC=CC=C1 JZ2365 [1,1,0,0,0,0|1,0,0]=3 505 B10R1.17 ClCSCC1=CC=CC=C1 JZ2415 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.17 N#CCNC1=CC=CC=C1 XJ2362 [1,1,0,0,0,0|1,0,1]=4 507 B10R1.17 N#CCOC1=CC=CC=C1 JZ2377 [1,1,0,0,0,0|1,0,1]=4 508 B10R1.17 NCC#CC1=CC=CC=C1 YH18704 [1,1,0,0,0,0|0,0,2]=4 509 B10R1.17 NCCNC1=NC=CC=C1 RT11017 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.17 O=C=NCC1=CC=CC=C1 LT4166 [1,1,0,0,0,0|1,0,1]=4 511 B10R1.17 O=CNCC1=CC=CC=C1 JZ2897 [1,1,0,0,0,0|1,0,1]=4 512 B10R1.17 OCC#CC1=CC=CC=C1 LQ1789 [1,1,0,0,0,0|0,0,2]=4 513 B10R1.17 OCCCC1=CC=NC=C1 LT3397 [1,1,0,0,0,0|1,0,0]=3 514 B10R1.17 OCCCC1=CN=CC=C1 LQ2303 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.17 OCCCC1=NC=CC=C1 LT1600 [1,1,0,0,0,0|1,0,0]=3 516 B10R1.17 OCCNC1=CC=CC=C1 XJ0488 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.17 OCCOC1=CC=CC=C1 XJ0489 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 JZ4012 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.18 CC(=O)CC1=CC=CC=C1 YH22297 [1,1,0,0,0,0|0,0,1]=3 520 B10R1.18 CC(=O)CC1=CC=NC=C1 LQ3035 [1,1,0,0,0,0|1,0,1]=4 521 B10R1.18 CC(=S)NC1=CC=CC=C1 JZ4043 [1,1,0,0,0,0|1,0,1]=4 522 B10R1.18 CC(C)CC1=CC=CN=C1 LT3805 [1,1,0,0,0,0|1,0,0]=3 523 B10R1.18 CC(C)CC1=NC=CN=C1 JZ1743 [1,1,0,0,0,0|2,0,0]=4 524 B10R1.18 CC(C)NC1=CC=CC=C1 HL0393 [1,1,0,0,0,0|1,0,0]=3 525 B10R1.18 CN(C)CC1=CC=CC=C1 YH22302 [1,1,0,0,0,0|1,0,0]=3 526 B10R1.18 CS(=O)CC1=CC=CC=C1 RT13178 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.18 C[C@@H](N)CC1=CC=CC=C1 YH66589 [1,1,0,0,0,0|0,0,0]=2 528 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 RT11145 [1,1,0,0,0,0|0,0,0]=2 529 B10R1.18 FC(F)OC1=CC=CC=C1 HL1835 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.18 NC(=O)CC1=CC=CC=C1 LL0344 [1,1,0,0,0,0|1,0,1]=4 531 B10R1.18 NC(=S)CC1=CC=CC=C1 XJ1206 [1,1,0,0,0,0|1,0,1]=4 532 B10R1.18 O=C(Cl)CC1=CC=CC=C1 LL0343 [1,1,0,0,0,0|1,0,1]=4 533 B10R1.18 O=C(O)CC1=CC=CC=C1 LL0345 [1,1,0,0,0,0|1,0,1]=4 534 B10R1.11 OC(CCCl)C1=CC=CS1 YH65507 [0,1,0,0,1,0|1,0,0]=3 535 B12R1.32 CCCC(=O)CC1=CC=CC=C1 RT12903 [0,1,0,0,0,1|0,0,2]=4 536 B12R1.32 CCOC(=O)NC1=CC=CC=C1 LQ0343 [0,1,0,0,0,1|0,0,2]=4 537 B12R1.32 CN(CCO)CC1=CC=CC=C1 RT11841 [0,1,0,0,0,1|2,0,0]=4 538 B12R1.34 C(C)(NC)[C@H](O)C1=CC=CC=C1 LT5056 [0,1,0,0,0,1|2,0,0]=4 539 B12R1.34 CCC(Br)C(=O)C1=CC=CC=C1 RT12924 [0,1,0,0,0,1|1,0,0]=3 540 B12R1.34 CN[C@@H](C)[C@H](O)C1=CC=CC=C1 LT4944 [0,1,0,0,0,1|2,0,0]=4 541 B12R1.34 N[C@@H](CO)[C@@H](O)C1=CC=CC=C1 RT1894 [0,1,0,0,0,1|2,0,0]=4 542 B12R1.34 N[C@H](CO)[C@H](O)C1=CC=CC=C1 YH02322 [0,1,0,0,0,1|2,0,0]=4 543 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 JZ4215 [0,1,0,0,0,1|1,0,1]=4 544 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 LQ3258 [0,1,0,0,0,1|1,0,1]=4 545 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 RT15818 [0,1,0,0,0,1|0,0,2]=4 546 B12R1.49 N[C@@H](CO)CC1=CC=C(O)C=C1 LT7646 [0,1,0,0,0,1|2,0,0]=4 547 B12R1.118 CCN(CC)CC1=CC=CC=C1 HL0428 [0,1,0,0,0,1|2,0,0]=4 548 B12R1.194 CC(C)(CO)CC1=CC=CC=C1 XJ3854 [0,1,0,0,0,1|2,0,0]=4 549 B12R1.194 CNC(C)(C)CC1=CC=CC=C1 RT3481 [0,1,0,0,0,1|2,0,0]=4 550 B12R1.9 CCC(C)(C)C1=CC=C(O)C=C1 XJ0119 [0,2,0,0,0,0|1,0,0]=3 551 B12R1.9 CCS(=O)(=O)C1=CC=C(Cl)C=C1 LT3073 [0,2,0,0,0,0|1,0,1]=4 552 B12R1.10 CC[N+](C)(C)C1=CC=CC(O)=C1 RT16205 [0,2,0,0,0,0|2,0,0]=4 553 B12R1.10 CC[N+](C)(C)C1=CC=CC(O)=C1 YH65077 [0,2,0,0,0,0|2,0,0]=4 554 B12R1.39 CCOS(=O)(=O)C1=CC=CC=C1 RT12173 [0,2,0,0,0,0|1,0,1]=4 555 B12R1.475 CCC(O)(CC)C1=CC=CC=C1 JZ4653 [0,2,0,0,0,0|0,0,0]=2 556 B12R1.475 CO[Si](C)(OC)C1=CC=CC=C1 XJ2384 [0,2,0,0,0,0|1,1,0]=4 557 B12R1.3 CCN(CCCl)C1=CC=CC=C1 HL1185 [0,2,0,0,0,0|2,0,0]=4 558 B12R1.3 CNC(CCO)C1=CC=CC=C1 RT3227 [0,2,0,0,0,0|1,0,0]=3 559 B12R1.12 CCN(CC)C1=CC=C(C)C=C1 HL0164 [0,2,0,0,0,0|2,0,0]=4 560 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 HL1211 [0,2,0,0,0,0|2,0,0]=4 561 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 JZ1929 [0,2,0,0,0,0|2,0,0]=4 562 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 LT5591 [0,2,0,0,0,0|2,0,0]=4 563 B12R1.12 CCN(CC)C1=CC=C(N)C=C1 XJ5961 [0,2,0,0,0,0|2,0,0]=4 564 B12R1.13 CCN(CC)C1=CC=CC(O)=C1 LT6779 [0,2,0,0,0,0|2,0,0]=4 565 B12R1.13 COC(OC)C1=CN=CC(Cl)=C1 LT3951 [0,2,0,0,0,0|2,0,0]=4 566 B12R1.243 CCN(CC)C1=CC=CC=C1C JZ3917 [0,2,0,0,0,0|2,0,0]=4 567 B12R1.243 O=C1C=CC=C\C1=C(/CBr)NO RT6426 [0,2,0,0,0,0|1,0,1]=4 568 B12R1.478 CC(=O)C(C#N)C1=CC=CC=C1 XJ2725 [0,2,0,0,0,0|1,0,1]=4 569 B12R1.478 CC(C)C(CN)C1=CC=CC=C1 RT1838 [0,2,0,0,0,0|1,0,0]=3 570 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 JZ0156 [0,2,0,0,0,0|0,0,0]=2 571 B12R1.478 CCC(C(N)=O)C1=CC=CC=C1 XJ0168 [0,2,0,0,0,0|0,0,1]=3 572 B12R1.478 CCN(C(=S)[S-])C1=CC=CC=C1 LQ3795 [0,2,0,0,0,0|1,1,0]=4 573 B12R1.478 CN(C)C(C#N)C1=CC=CC=C1 JZ4208 [0,2,0,0,0,0|2,0,0]=4 574 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 HL0018 [0,2,0,0,0,0|1,0,0]=3 575 B12R1.16 CCCC(=O)C1=CC=C(C)C=C1 RT11080 [0,2,0,0,0,0|0,0,2]=4 576 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 XJ0996 [0,2,0,0,0,0|0,0,2]=4 577 B12R1.16 CCCC(C)C1=CC=C(O)C=C1 RT17651 [0,2,0,0,0,0|1,0,0]=3 578 B12R1.16 CCOC(=N)C1=CC=C(Cl)C=C1 RT12541 [0,2,0,0,0,0|1,0,1]=4 579 B12R1.16 CCOC(=O)C1=CC=C(Br)C=C1 HL3014 [0,2,0,0,0,0|0,0,2]=4 580 B12R1.16 CCOC(=O)C1=CC=C(Cl)C=C1 LQ3269 [0,2,0,0,0,0|0,0,2]=4 581 B12R1.16 CCOC(=O)C1=CC=C(I)C=C1 CJ2917 [0,2,0,0,0,0|0,0,2]=4 582 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 SY0289 [0,2,0,0,0,0|0,0,2]=4 583 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 YH48180 [0,2,0,0,0,0|0,0,2]=4 584 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 JZ3824 [0,2,0,0,0,0|0,0,0]=2 585 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 LT4056 [0,2,0,0,0,0|0,0,0]=2 586 B12R1.16 CNCC(O)C1=CC=C(O)C=C1 RT4716 [0,2,0,0,0,0|0,0,0]=2 587 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 LX2785 [0,2,0,0,0,0|1,0,0]=3 588 B12R1.16 N[C@H](CCO)C1=CC=C(F)C=C1 YH47867 [0,2,0,0,0,0|1,0,0]=3 589 B12R1.16 O=C(CCCl)C1=CC=C(Cl)C=C1 LT4187 [0,2,0,0,0,0|0,0,2]=4 590 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 LQ0709 [0,2,0,0,0,0|0,0,2]=4 591 B12R1.16 O=C(CCCl)C1=CC=C(O)C=C1 RT10798 [0,2,0,0,0,0|0,0,2]=4 592 B12R1.17 CCOC(=O)C1=CC(C)=CC=C1 LL0469 [0,2,0,0,0,0|0,0,2]=4 593 B12R1.17 CCOC(=O)C1=CC(Cl)=CC=C1 HL0704 [0,2,0,0,0,0|0,0,2]=4 594 B12R1.17 CCOC(=O)C1=CC(F)=CC=C1 XJ0783 [0,2,0,0,0,0|0,0,2]=4 595 B12R1.17 CCOC(=O)C1=CC(N)=CC=C1 XJ0992 [0,2,0,0,0,0|0,0,2]=4 596 B12R1.17 CCOC(=O)C1=CC(O)=CC=C1 XJ3351 [0,2,0,0,0,0|0,0,2]=4 597 B12R1.17 CNCC(=O)C1=CC(O)=CC=C1 RT2728 [0,2,0,0,0,0|0,0,2]=4 598 B12R1.17 CNCC(O)C1=CC=CC(O)=C1 RT0358 [0,2,0,0,0,0|0,0,0]=2 599 B12R1.17 CNC[C@H](O)C1=CC=CC(O)=C1 XJ0007 [0,2,0,0,0,0|0,0,0]=2 600 B12R1.17 NC(CCO)C1=CC=CC(Cl)=C1 YH13662 [0,2,0,0,0,0|1,0,0]=3 601 B12R1.17 N[C@H](CCO)C1=CC=CC(Br)=C1 YH66650 [0,2,0,0,0,0|1,0,0]=3 602 B12R1.17 N[C@H](CCO)C1=CC=CC(Br)=C1 YH66666 [0,2,0,0,0,0|1,0,0]=3 603 B12R1.30 CCCCC(=O)C1=CC=CC=C1 HL0607 [0,2,0,0,0,0|0,0,2]=4 604 B12R1.30 CCCOC(=O)C1=CC=CC=C1 HL2226 [0,2,0,0,0,0|0,0,2]=4 605 B12R1.30 CNCCC(O)C1=CC=CC=C1 LT3055 [0,2,0,0,0,0|0,0,0]=2 606 B12R1.30 CNCC[C@@H](O)C1=CC=CC=C1 HL3244 [0,2,0,0,0,0|0,0,0]=2 607 B12R1.30 O=C(OCCO)C1=CC=CC=C1 RT0571 [0,2,0,0,0,0|0,0,2]=4 608 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 HL1237 [0,2,0,0,0,0|0,0,2]=4 609 B12R1.107 CC(=O)N[C@H](C)C1=CC=CC=C1 RT7260 [0,2,0,0,0,0|1,0,1]=4 610 B12R1.107 CC(=O)OC(C)C1=CC=CC=C1 HL1238 [0,2,0,0,0,0|1,0,1]=4 611 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 LT6844 [0,2,0,0,0,0|1,0,1]=4 612 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 JZ0890 [0,2,0,0,0,0|1,0,1]=4 613 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 RT12059 [0,2,0,0,0,0|1,0,1]=4 614 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 LQ3693 [0,2,0,0,0,0|1,0,1]=4 615 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 LQ2496 [0,2,0,0,0,0|0,0,1]=3 616 B12R1.308 CC1=CC=CC=C1C(N)CCO RT12768 [0,2,0,0,0,0|1,0,0]=3 617 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 LQ0202 [0,2,0,0,0,0|0,0,2]=4 618 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=C1 LQ3267 [0,2,0,0,0,0|0,0,2]=4 619 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 LL0830 [0,2,0,0,0,0|0,0,2]=4 620 B12R1.308 CCOC(=O)C1=C(I)C=CC=C1 HL2008 [0,2,0,0,0,0|0,0,2]=4 621 B12R1.5 CCC(=O)C1=CC=C(OC)C=C1 LL0515 [0,2,0,0,0,0|0,0,2]=4 622 B12R1.20 CC(C)C(=O)C1=CC=C(Cl)C=C1 YH65724 [0,2,0,0,0,0|0,0,2]=4 623 B12R1.20 CC(N)C(O)C1=CC=C(Cl)C=C1 LT5084 [0,2,0,0,0,0|0,0,0]=2 624 B12R1.20 CC1=CC=C(C(=O)C(C)Cl)C=C1 YH47530 [0,2,0,0,0,0|0,0,2]=4 625 B12R1.20 CC1=CC=C(C(O)C(=O)O)C=C1 LQ4697 [0,2,0,0,0,0|1,0,1]=4 626 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 JZ3059 [0,2,0,0,0,0|1,0,1]=4 627 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 LL0881 [0,2,0,0,0,0|1,0,1]=4 628 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 HL1770 [0,2,0,0,0,0|1,0,1]=4 629 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 JZ4498 [0,2,0,0,0,0|1,0,1]=4 630 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 RT11186 [0,2,0,0,0,0|1,0,1]=4 631 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 YH54312 [0,2,0,0,0,0|1,0,1]=4 632 B12R1.367 NCC(O)C1=CC(O)=C(O)C=C1 LT7649 [0,2,0,0,0,0|1,0,0]=3 633 B12R1.367 NCC(O)C1=CC(O)=C(O)C=C1 YH04566 [0,2,0,0,0,0|1,0,0]=3 634 B12R1.367 NCC(O)C1=CC=C(O)C(O)=C1 HL3185 [0,2,0,0,0,0|1,0,0]=3 635 B12R1.367 NCC(O)C1=CC=C(O)C(O)=C1 YH55551 [0,2,0,0,0,0|1,0,0]=3 636 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 LX2603 [0,2,0,0,0,0|1,0,0]=3 637 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 LX2787 [0,2,0,0,0,0|1,0,0]=3 638 B12R1.1703 CCC(=O)C1=C(O)C=C(O)C=C1 HL3011 [0,2,0,0,0,0|0,0,2]=4 639 B12R1.1703 N[C@@H](CO)C1=CC=C(F)C=C1O RT12086 [0,2,0,0,0,0|2,0,0]=4 640 B12R1.1703 O[C@@H](CCl)C1=CC=C(Cl)C=C1Cl YH30362 [0,2,0,0,0,0|1,0,0]=3 641 B12R1.1703 O[C@H](CCl)C1=CC=C(Cl)C=C1Cl YH66335 [0,2,0,0,0,0|1,0,0]=3 642 B12R1.225 CC(=O)C(O)C1=CC=CC(Cl)=C1 RT11240 [0,2,0,0,0,0|0,0,1]=3 643 B12R1.225 CC(Br)C(=O)C1=CC(Cl)=CC=C1 RT6232 [0,2,0,0,0,0|0,0,2]=4 644 B12R1.225 CC(C1=CC=CC(O)=C1)N(C)C RT3091 [0,2,0,0,0,0|2,0,0]=4 645 B12R1.225 CC(O)C(=O)C1=CC=CC(Cl)=C1 RT10521 [0,2,0,0,0,0|0,0,2]=4 646 B12R1.225 C[C@@H](C1=CC(O)=CC=C1)N(C)C YH65470 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.225 C[C@@H](O)C(=O)C1=CC=CC(Cl)=C1 RT10950 [0,2,0,0,0,0|0,0,2]=4 648 B12R1.225 C[C@H](O)C(=O)C1=CC=CC(Cl)=C1 RT10949 [0,2,0,0,0,0|0,0,2]=4 649 B12R1.225 O=C(O)C(O)C1=CC=CC(F)=C1 HL1768 [0,2,0,0,0,0|1,0,1]=4 650 B12R1.225 O=C(O)C(O)C1=CC=CC(O)=C1 RT6094 [0,2,0,0,0,0|1,0,1]=4 651 B12R1.354 CCC(=O)C1=CC(O)=CC=C1N LT5986 [0,2,0,0,0,0|0,0,2]=4 652 B12R1.354 CCC(=O)C1=CC(O)=CC=C1O JZ4313 [0,2,0,0,0,0|0,0,2]=4 653 B12R1.124 CC(=O)C(Br)C1=CC=CC=C1F RT10535 [0,2,0,0,0,0|1,0,1]=4 654 B12R1.124 O=C(O)C(O)C1=C(Cl)C=CC=C1 LQ3409 [0,2,0,0,0,0|1,0,1]=4 655 B12R1.564 CC(C)(O)C(=O)C1=CC=CC=C1 LT1748 [0,2,0,0,0,0|0,0,2]=4 656 B12R1.564 CC(C)(O)[C@@H](N)C1=CC=CC=C1 YH66511 [0,2,0,0,0,0|1,0,0]=3 657 B12R1.564 CC(C)(O)[C@@H](N)C1=CC=CC=C1 YH66648 [0,2,0,0,0,0|1,0,0]=3 658 B12R1.3453 CC[C@@H](O)C1(N)(Cl)C=CC=CC1 LL2743 [0,2,0,0,0,0|0,0,2]=4 659 B10R2.6 C1=CC=C(C2CN2)C=C1 RT8683 [1,0,0,1,0,0|1,0,0]=3 660 B10R2.6 C1=CC=C(C2CO2)C=C1 XJ4585 [1,0,0,1,0,0|0,0,0]=2 661 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 XJ4586 [1,0,0,1,0,0|0,0,0]=2 662 B10R2.320 O=C1CC2=CC=CC=C12 YH55957 [1,0,0,1,0,0|0,0,2]=4 663 B10R2.7 C1=CC2=C(C=C1)CNC2 LL0906 [1,0,0,1,0,0|1,0,0]=3 664 B10R2.7 C1=CC2=C(C=C1)CNC2 LX2633 [1,0,0,1,0,0|1,0,0]=3 665 B10R2.7 C1=CC2=C(CNC2)N=C1 YH35533 [1,0,0,1,0,0|2,0,0]=4 666 B10R2.7 C1=CC2=NCCN2C=C1 RT2480 [1,0,0,1,0,0|2,0,0]=4 667 B10R2.7 C1=CC=C2CC=CC2=C1 LQ0257 [1,0,0,1,0,0|0,0,2]=4 668 B10R2.7 C1=CC=C2NCCC2=C1 JZ1571 [1,0,0,1,0,0|1,0,0]=3 669 B10R2.7 C1=CC=C2OCCC2=C1 YH03385 [1,0,0,1,0,0|1,0,0]=3 670 B10R2.7 C1=CN=C2CCCC2=C1 SY0245 [1,0,0,1,0,0|1,0,0]=3 671 B10R2.7 C1=CN=C2CCCC2=C1 XJ1002 [1,0,0,1,0,0|1,0,0]=3 672 B10R2.7 C1=CN=C2CNCC2=C1 YH35531 [1,0,0,1,0,0|2,0,0]=4 673 B10R2.7 C1=CN=C2CNCC2=C1 YH44941 [1,0,0,1,0,0|2,0,0]=4 674 B10R2.7 C1=NC=C2CNCC2=C1 YH03382 [1,0,0,1,0,0|2,0,0]=4 675 B12R2.18 CC1=NC2=CC=CC=C2C1C LT0091 [0,0,0,1,0,1|1,0,1]=4 676 B12R2.18 CC1C(=O)NC2=CC=CC=C21 LQ1788 [0,0,0,1,0,1|0,0,2]=4 677 B12R2.18 N[C@@H]1C2=C(C=CC=C2)C[C@@H]1O JZ4790 [0,0,0,1,0,1|1,0,0]=3 678 B12R2.18 N[C@@H]1C2=CC=CC=C2C[C@@H]1O YH32938 [0,0,0,1,0,1|1,0,0]=3 679 B12R2.18 N[C@H]1C2=CC=CC=C2C[C@H]1O LT4572 [0,0,0,1,0,1|1,0,0]=3 680 B12R2.18 OC1C2=C(C=CC=C2)CC1Br HL2931 [0,0,0,1,0,1|2,0,0]=4 681 B12R2.24 CC1CCC2=CC=CC=C2N1 XJ1928 [0,0,0,1,0,1|1,0,0]=3 682 B12R2.24 C[C@@H]1CNC2=C(C=CC=C2)N1 LT1109 [0,0,0,1,0,1|2,0,0]=4 683 B12R2.24 C[C@H]1CNC2=C(C=CC=C2)N1 LT1108 [0,0,0,1,0,1|2,0,0]=4 684 B12R2.24 NC1CCC2=C(C=CC=C2)C1 YH65482 [0,0,0,1,0,1|1,0,0]=3 685 B12R2.24 NC1CCC2=CC=CC=C2C1 JZ2198 [0,0,0,1,0,1|1,0,0]=3 686 B12R2.24 N[C@@H]1CCC2=CC=CC=C2C1 JZ5475 [0,0,0,1,0,1|1,0,0]=3 687 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 LQ4317 [0,0,0,1,0,1|1,0,0]=3 688 B12R2.32 CCC1=CC2=C(C=CC=C2)C1 XJ4312 [0,0,0,1,0,1|1,0,1]=4 689 B12R2.32 CCC1=CC2=C(C=CC=C2)N1 LQ2500 [0,0,0,1,0,1|1,0,1]=4 690 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 YH42114 [0,0,0,1,0,1|1,0,1]=4 691 B12R2.32 ICC1CC2=CC=CC=C2O1 RT9864 [0,0,0,1,0,1|1,0,0]=3 692 B12R2.32 O=CC1CC2=CC=CC=C2O1 LQ2632 [0,0,0,1,0,1|1,0,1]=4 693 B12R2.116 CC1(C2=CC=CC=C2)CNC1 RT9865 [0,1,0,1,0,0|1,0,0]=3 694 B12R2.1 BrCC1=NOC2=CC=CC=C21 LT5834 [0,1,0,1,0,0|1,0,1]=4 695 B12R2.1 CCN1C=CC2=CC=CC=C21 JZ3474 [0,1,0,1,0,0|2,0,0]=4 696 B12R2.1 OCC1=NOC2=CC=CC=C21 YH66546 [0,1,0,1,0,0|1,0,1]=4 697 B12R2.2 C1=CC(C2CCCN2)=CC=N1 RT7690 [0,1,0,1,0,0|2,0,0]=4 698 B12R2.2 C1=CC=C(C2CCCN2)C=C1 HL0594 [0,1,0,1,0,0|1,0,0]=3 699 B12R2.2 C1=CC=C(C2CCCO2)C=C1 YH37915 [0,1,0,1,0,0|0,0,0]=2 700 B12R2.2 C1=CC=C(C2CCNC2)C=C1 YH65152 [0,1,0,1,0,0|1,0,0]=3 701 B12R2.2 C1=CC=C(C2CCNC2)C=C1 YH96657 [0,1,0,1,0,0|1,0,0]=3 702 B12R2.2 C1=CC=C(N2CCCC2)C=C1 XJ2611 [0,1,0,1,0,0|2,0,0]=4 703 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 YH65558 [0,1,0,1,0,0|1,0,0]=3 704 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 YH07424 [0,1,0,1,0,0|1,0,0]=3 705 B12R2.2 C1=CC=C([C@H]2CCNC2)C=C1 YH89689 [0,1,0,1,0,0|1,0,0]=3 706 B12R2.2 C1=CN=C(C2CCNC2)C=C1 LT3794 [0,1,0,1,0,0|2,0,0]=4 707 B12R2.2 C1=CN=CC(C2=NCCO2)=C1 RT2485 [0,1,0,1,0,0|1,0,1]=4 708 B12R2.2 C1=CN=CC(C2CCC=N2)=C1 RT14595 [0,1,0,1,0,0|2,0,0]=4 709 B12R2.2 C1=CN=CC(C2CCCN2)=C1 XJ2984 [0,1,0,1,0,0|2,0,0]=4 710 B12R2.2 C1=CN=CC([C@@H]2CCCN2)=C1 RT14833 [0,1,0,1,0,0|2,0,0]=4 711 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 YH05386 [0,1,0,1,0,0|1,0,1]=4 712 B12R2.1081 CC1CCNC2=C1C=CC=C2 JZ5356 [0,1,0,1,0,0|1,0,0]=3 713 B12R2.1081 CC1NCCC2=C1C=CC=C2 XJ2816 [0,1,0,1,0,0|1,0,0]=3 714 B12R2.1081 NC1CCNC2=CC=CC=C21 YH65897 [0,1,0,1,0,0|1,0,0]=3 715 B12R2.1081 NN1CCCC2=CC=CC=C21 LT5813 [0,1,0,1,0,0|2,0,0]=4 716 B12R2.1081 N[C@@H]1CCCC2=CC=CC=C21 JZ5559 [0,1,0,1,0,0|1,0,0]=3 717 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 XJ5138 [0,1,0,1,0,0|1,0,0]=3 718 B12R2.1081 N[C@H]1CCCC2=CC=CC=C21 JZ5560 [0,1,0,1,0,0|1,0,0]=3 719 B12R2.1081 N[C@H]1CCCC2=CC=CN=C21 YH57498 [0,1,0,1,0,0|2,0,0]=4 720 B12R2.1081 O=C1CCCC2=C1C=CC=C2 RT11341 [0,1,0,1,0,0|0,0,2]=4 721 B12R2.1081 O=C1CCOC2=CC=CC=C12 LL0873 [0,1,0,1,0,0|0,0,2]=4 722 B12R2.1081 O=C1NCCC2=CC=CC=C12 JZ4485 [0,1,0,1,0,0|0,0,2]=4 723 B12R2.1081 O=C1OCCC2=CC=CC=C12 LQ2745 [0,1,0,1,0,0|0,0,2]=4 724 B12R2.1081 OC1CCCC2=C1C=CC=N2 YH65731 [0,1,0,1,0,0|1,0,0]=3 725 B12R2.1081 OC1CCCC2=CC=CN=C21 YH35264 [0,1,0,1,0,0|1,0,0]=3 726 B12R2.1081 OC1CCNC2=C1C=CC=C2 YH48820 [0,1,0,1,0,0|0,0,0]=2 727 B12R2.1081 OC1CNCC2=C1C=CC=C2 RT7798 [0,1,0,1,0,0|0,0,0]=2 728 B12R2.2028 CC1=CC(C)C2=C1C=CC=C2 YH66162 [0,1,0,1,0,0|1,0,1]=4 729 B12R2.2075 O=C(C1=CC=CC=C1)C2CC2 LQ2435 [0,1,0,1,0,0|0,0,2]=4 730 B12R2.79 NC1CC1C2=CC=C(F)C=C2 RT3576 [0,1,0,1,0,0|2,0,0]=4 731 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 RT3436 [0,1,0,1,0,0|2,0,0]=4 732 B12R2.612 CC1=CC2=C(C=N1)C(N)CC2 YH66299 [0,1,0,1,0,0|2,0,0]=4 733 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 HL2805 [0,1,0,1,0,0|0,0,2]=4 734 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 LQ2490 [0,1,0,1,0,0|0,0,2]=4 735 B12R2.612 NC1CCC2=CC(Br)=CC=C21 YH97266 [0,1,0,1,0,0|1,0,0]=3 736 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 LQ2487 [0,1,0,1,0,0|0,0,2]=4 737 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 XJ5153 [0,1,0,1,0,0|0,0,2]=4 738 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 YH01019 [0,1,0,1,0,0|0,0,2]=4 739 B12R2.612 O=C1CCC2=CC(F)=CC=C12 JZ4104 [0,1,0,1,0,0|0,0,2]=4 740 B12R2.2302 BrC1=CC=C(C2CNC2)C=C1 RT9917 [0,1,0,1,0,0|2,0,0]=4 741 B12R2.2302 ClC1=CC=C(C2CNC2)C=C1 RT9918 [0,1,0,1,0,0|2,0,0]=4 742 B12R2.2302 FC1=CC=C(C2CNC2)C=C1 RT9556 [0,1,0,1,0,0|2,0,0]=4 743 B12R2.80 NC1CC1C2=CC=CC(Cl)=C2 LX3278 [0,1,0,1,0,0|2,0,0]=4 744 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 LQ4410 [0,1,0,1,0,0|0,0,2]=4 745 B12R2.132 NC1CCC2=CC=C(Br)C=C21 YH94710 [0,1,0,1,0,0|1,0,0]=3 746 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 RT1823 [0,1,0,1,0,0|1,0,0]=3 747 B12R2.132 N[C@@H]1CCC2=CC=C(F)C=C21 YH19003 [0,1,0,1,0,0|1,0,0]=3 748 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 LQ3761 [0,1,0,1,0,0|0,0,2]=4 749 B12R2.132 O=C1CCC2=CC=C(F)C=C12 HL0875 [0,1,0,1,0,0|0,0,2]=4 750 B12R2.132 O=C1CCC2=CC=C(O)C=C12 XJ5989 [0,1,0,1,0,0|0,0,2]=4 751 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 LQ4415 [0,1,0,1,0,0|0,0,2]=4 752 B12R2.196 NC1CCC2=C1C=CC=C2F YH35733 [0,1,0,1,0,0|1,0,0]=3 753 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 CJ2785 [0,1,0,1,0,0|0,0,2]=4 754 B12R2.196 O=C1CCC2=C1C=CC=C2Cl XJ4153 [0,1,0,1,0,0|0,0,2]=4 755 B12R2.196 O=C1CCC2=C1C=CC=C2O LQ5074 [0,1,0,1,0,0|0,0,2]=4 756 B12R2.1282 NC1(C2=CC=CC(F)=C2)CC1 RT3545 [0,1,0,1,0,0|1,0,0]=3 757 B12R2.2313 ClC1=CC(C2CNC2)=CC=C1 RT9560 [0,1,0,1,0,0|2,0,0]=4 758 B12R2.2313 FC1=CC(C2CNC2)=CC=C1 RT9559 [0,1,0,1,0,0|2,0,0]=4 759 B12R2.92 CC1(C)CC1C2=CC=CC=C2 LQ3308 [0,1,0,1,0,0|1,0,0]=3 760 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 LX2203 [0,1,0,1,0,0|0,0,2]=4 761 B12R2.203 O=C1CCC2=C1C(Br)=CC=C2 YH29451 [0,1,0,1,0,0|0,0,2]=4 762 B12R2.203 O=C1CCC2=C1C(Br)=CC=C2 YH29819 [0,1,0,1,0,0|0,0,2]=4 763 B12R2.203 O=C1CCC2=C1C(Cl)=CC=C2 YH56099 [0,1,0,1,0,0|0,0,2]=4 764 B12R2.203 O=C1CCC2=C1C(F)=CC=C2 YH66130 [0,1,0,1,0,0|0,0,2]=4 765 B12R2.203 O=C1CCC2=C1C(O)=CC=C2 XJ3186 [0,1,0,1,0,0|0,0,2]=4 766 B12R3.12 C1=CC=C2C(=C1)CC3OC23 YH17985 [0,0,0,2,0,0|0,0,0]=2 767 B8R1.7 CC(C)C1=CC=CO1 JZ3469 [1,0,0,0,1,0|2,0,0]=4 768 B8R1.7 C[C@@H](N)C1=CC=CO1 RT3868 [1,0,0,0,1,0|2,0,0]=4 769 B8R1.8 CSCC1=CC=CO1 LT5048 [1,0,0,0,1,0|2,0,0]=4 770 B8R1.8 OCCC1=CC=CS1 LT0210 [1,0,0,0,1,0|2,0,0]=4 771 B12R1.27 CCC(=O)OCC1=CC=CC=C1 LT4168 [0,0,0,0,0,2|0,0,2]=4 772 B12R1.27 OCC(O)COC1=CC=CC=C1 LT3080 [0,0,0,0,0,2|1,0,0]=3