0 B10R1.18 BrC(Br)=CC1=CC=CC=C1 YH16676 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.18 CC(=O)CC1=CC=CC=C1 YH22297 [0,0,0,0,0,0|1,0,0]=1 2 B10R1.18 CC(=O)CC1=CC=NC=C1 LQ3035 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.18 CC(=O)NC1=NC=CC=C1 LQ2855 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.18 CC(=O)OC1=CCCCC1 XJ1738 [0,0,0,0,0,0|0,0,4]=4 5 B10R1.18 CC(=O)OC1=CCCCC1 XJ4417 [0,0,0,0,0,0|0,0,4]=4 6 B10R1.18 CC(=O)OC1=NC=CC=C1 RT9785 [0,0,0,0,0,0|1,0,0]=1 7 B10R1.18 CC(=S)NC1=CC=CC=C1 JZ4043 [0,0,0,0,0,0|1,1,0]=2 8 B10R1.18 CC(C)CC1=CC=CN=C1 LT3805 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.18 CC(C)NC1=CC=CC=C1 HL0393 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.18 CN(C)CC1=CC=CC=C1 YH22302 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.18 CS(=O)CC1=CC=CC=C1 RT13178 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.18 C[C@@H](N)CC1=CC=CC=C1 YH66589 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 RT11145 [0,0,0,0,0,0|1,0,2]=3 14 B10R1.18 FC(F)OC1=CC=CC=C1 HL1835 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.18 N=C(N)NC1=CC=CC=C1 LQ3733 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.18 N=C(N)NC1=CC=CC=C1 YH65018 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.18 NC(=O)CC1=CC=CC=C1 LL0344 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.18 NC(=O)CC1=CC=CN=C1 HL2586 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.18 NC(=O)NC1=CC=CC=C1 XJ0031 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.18 NC(=O)OC1=CC=CC=C1 JZ4003 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.18 NC(=S)CC1=CC=CC=C1 XJ1206 [0,0,0,0,0,0|2,1,0]=3 22 B10R1.18 O=C(Cl)CC1=CC=CC=C1 LL0343 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.18 O=C(Cl)OC1=CC=CC=C1 LQ1974 [0,0,0,0,0,0|1,0,0]=1 24 B10R1.18 O=C(O)CC1=CC=CC=C1 LL0345 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.18 O=C(O)CC1=CC=CN=C1 LT2642 [0,0,0,0,0,0|3,0,0]=3 26 B10R1.18 O=C(O)CC1=CC=CN=C1 XJ0855 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.18 O=C(O)CC1=CC=NC=C1 JZ0762 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.18 O=C(O)CC1=CC=NC=C1 LT3467 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.18 O=C(O)CC1=CN=CN=C1 YH05329 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.18 O=C(O)CC1=NC=CC=C1 JZ0740 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.18 O=C(O)CC1=NC=CC=C1 YH65464 [0,0,0,0,0,0|3,0,0]=3 32 B10R1.18 S=C(Cl)CC1=CC=NC=C1 LT3199 [0,0,0,0,0,0|3,1,0]=4 33 B10R1.18 S=C(Cl)OC1=CC=CC=C1 HL0590 [0,0,0,0,0,0|1,1,0]=2 34 B9R1.8 BrCCC1=CC=CC=C1 LL0334 [1,0,0,0,0,0|2,0,1]=4 35 B9R1.8 C=CSC1=CC=CC=C1 HL0999 [1,0,0,0,0,0|0,1,1]=3 36 B9R1.8 CCCC1=CC=NC=C1 LT3807 [1,0,0,0,0,0|2,0,1]=4 37 B9R1.8 CCOC1=NC=CC=C1 LT1993 [1,0,0,0,0,0|1,0,1]=3 38 B9R1.8 CCSC1=CC=CC=C1 JZ4001 [1,0,0,0,0,0|0,1,1]=3 39 B9R1.8 CNCC1=CC=CC=C1 RT3204 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.8 CNCC1=CC=CN=C1 LQ4200 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.8 COCC1=CC=CN=C1 LQ5401 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.8 CSSC1=CC=CC=C1 JZ4887 [1,0,0,0,0,0|1,1,0]=3 43 B9R1.8 C\C=C\C1=CC=CC=C1 RT6350 [1,0,0,0,0,0|1,0,0]=2 44 B9R1.8 C\C=C\C1=CC=CC=C1 RT6415 [1,0,0,0,0,0|1,0,0]=2 45 B9R1.8 ClCCC1=CC=CC=C1 JZ3996 [1,0,0,0,0,0|2,0,1]=4 46 B9R1.8 ClCCC1=CC=CC=C1 JZ4528 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.8 N#COC1=CC=CC=C1 RT6011 [1,0,0,0,0,0|1,0,1]=3 48 B9R1.8 NNCC1=CC=CC=C1 LQ1000 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.8 NNCC1=CC=CC=C1 LX3048 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.8 NOCC1=CC=CC=C1 LT5864 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.8 O=C=NC1=CC=CC=C1 LL0339 [1,0,0,0,0,0|1,0,1]=3 52 B9R1.8 O=C=NC1=NC=CC=C1 RT8706 [1,0,0,0,0,0|2,0,1]=4 53 B9R1.8 O=CCC1=CC=CC=C1 XJ0479 [1,0,0,0,0,0|1,0,0]=2 54 B9R1.8 O=CCC1=CC=CN=C1 RT9275 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.8 O=COC1=CC=CC=C1 HL2038 [1,0,0,0,0,0|0,0,0]=1 56 B9R1.8 O=N\C=C1\C=CC=CN1 RT8508 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.8 OCCC1=CC=CC=C1 YH43593 [1,0,0,0,0,0|1,0,2]=4 58 B9R1.8 O\N=C\C1=CC=CC=C1 RT6343 [1,0,0,0,0,0|2,0,1]=4 59 B9R1.8 [2H]\C=C\C1=CC=CC=C1 RT11345 [1,0,0,0,0,0|2,0,0]=3 60 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 JZ2786 [0,1,0,0,0,0|1,0,0]=2 61 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 HL1838 [0,1,0,0,0,0|1,0,0]=2 62 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 YH18094 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 LL0348 [0,1,0,0,0,0|1,0,0]=2 64 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 XJ0481 [0,1,0,0,0,0|1,0,0]=2 65 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 RT12770 [0,1,0,0,0,0|1,0,0]=2 66 B11R1.20 CC(=O)NC1=CC=C(S)C=C1 HL0695 [0,1,0,0,0,0|1,0,0]=2 67 B11R1.20 CC(=O)NC1=NC=C(I)C=C1 LT3770 [0,1,0,0,0,0|2,0,0]=3 68 B11R1.20 CC(=O)NC1=NC=C(N)C=C1 XJ5030 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 XJ0551 [0,1,0,0,0,0|0,0,0]=1 70 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 YH54366 [0,1,0,0,0,0|0,0,0]=1 71 B11R1.20 CC(=O)OC1C=CC(=O)CO1 RT15430 [0,1,0,0,0,0|1,0,2]=4 72 B11R1.20 CC(=O)SC1=CC=C(I)C=C1 YH14509 [0,1,0,0,0,0|0,1,0]=2 73 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 LX2745 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 HL0415 [0,1,0,0,0,0|2,0,1]=4 75 B11R1.20 CC(C)OC1=CC=C(N)C=C1 LQ3314 [0,1,0,0,0,0|1,0,1]=3 76 B11R1.20 CC(N)CC1=CC=C(F)C=C1 HL1836 [0,1,0,0,0,0|2,0,1]=4 77 B11R1.20 CC(N)CC1=CC=C(F)C=C1 LL1086 [0,1,0,0,0,0|2,0,1]=4 78 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 JZ4004 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.20 CC1=CC=C(OC(=S)Cl)C=C1 JZ4309 [0,1,0,0,0,0|1,1,0]=3 80 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 RT3249 [0,1,0,0,0,0|3,0,0]=4 81 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 XJ4357 [0,1,0,0,0,0|2,0,0]=3 82 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 XJ0550 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.20 NC(=O)NC1=CC=C(F)C=C1 XJ1279 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.20 NC(=S)CC1=CC=C(Cl)C=C1 LQ3999 [0,1,0,0,0,0|2,1,0]=4 85 B11R1.20 NC(=S)NC1=CC=C(Cl)C=C1 XJ2569 [0,1,0,0,0,0|2,1,0]=4 86 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 LT3063 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.20 NC1=CC=C(OC(F)F)C=C1 XJ4644 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.20 O=C(Cl)CC1=CC=C(F)C=C1 HL1839 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 LQ3329 [0,1,0,0,0,0|1,0,0]=2 90 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 LQ1955 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 LT3076 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 RT12785 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.20 O=C(O)CC1=CN=C(Cl)C=C1 YH59203 [0,1,0,0,0,0|3,0,0]=4 94 B11R1.20 S=C(Cl)OC1=CC=C(Cl)C=C1 JZ4310 [0,1,0,0,0,0|1,1,0]=3 95 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 LL0879 [0,1,0,0,0,0|2,0,0]=3 96 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 JZ3849 [0,1,0,0,0,0|1,0,0]=2 97 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 HL0407 [0,1,0,0,0,0|1,0,0]=2 98 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 YH58730 [0,1,0,0,0,0|1,0,0]=2 99 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 JZ3850 [0,1,0,0,0,0|1,0,0]=2 100 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 LQ2063 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 XJ1123 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.36 CC(C)C(O)C1=CC=CC=C1 XJ1122 [0,1,0,0,0,0|2,0,1]=4 103 B11R1.36 CC(C1=CC=CC=C1)N(C)C XJ2195 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.36 CC(Cl)C(=O)C1=CC=CC=C1 RT10540 [0,1,0,0,0,0|2,0,1]=4 105 B11R1.36 CN(C(=O)Cl)C1=CC=CC=C1 LQ2649 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.36 C[C@@H](N)[C@H](O)C1=CC=CC=C1 RT3084 [0,1,0,0,0,0|2,0,1]=4 107 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 JZ0182 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 JZ0158 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 LT4728 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 YH52440 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.36 O=C(Cl)C(Cl)C1=CC=CC=C1 LT6908 [0,1,0,0,0,0|2,0,0]=3 112 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 XJ1125 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 XJ2766 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 YH66089 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 JZ1417 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 LX2232 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 XJ0179 [0,1,0,0,0,0|2,0,0]=3 118 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 XJ4358 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 LT4732 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.36 O=[PH]([O-])C(O)C1=CC=CC=C1 RT12947 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.36 [C@H](C)(C(=O)O)C1=CC=CC=C1 JZ0854 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.40 C\C(=C/C1=CC=CC=C1)CO YH66093 [0,1,0,0,0,0|1,0,1]=3 123 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 LQ0316 [0,1,0,0,0,0|1,0,0]=2 124 B11R1.40 NCC(=O)CC1=CC=CC=C1 RT12543 [0,1,0,0,0,0|1,0,0]=2 125 B11R1.40 NC[C@@H](N)CC1=CC=CC=C1 RT1726 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.40 NC[C@H](N)CC1=CC=CC=C1 RT1725 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.40 NNC(=O)CC1=CC=CC=C1 JZ4307 [0,1,0,0,0,0|2,0,0]=3 128 B11R1.40 NNC(=O)CC1=CC=CN=C1 YH43733 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 RT9532 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.40 NNC(=O)OC1=CC=CC=C1 LT4161 [0,1,0,0,0,0|1,0,0]=2 131 B11R1.40 O=C(CBr)CC1=CC=CC=C1 RT10869 [0,1,0,0,0,0|1,0,0]=2 132 B11R1.40 O=C(CBr)OC1=CC=CC=C1 JZ3957 [0,1,0,0,0,0|0,0,0]=1 133 B11R1.40 O=C(CCl)NC1=CC=CC=C1 YH08620 [0,1,0,0,0,0|1,0,0]=2 134 B11R1.40 O=C(CCl)NC1=NC=CC=C1 RT2329 [0,1,0,0,0,0|2,0,0]=3 135 B11R1.40 O=C(CO)CC1=CC=CC=C1 RT6783 [0,1,0,0,0,0|1,0,0]=2 136 B11R1.40 O=C\C(Cl)=C\C1=CC=CC=C1 XJ4438 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.86 CC(=O)CC1=CC=CC=C1Br RT11899 [0,1,0,0,0,0|1,0,0]=2 138 B11R1.86 CC(=O)NC1=CC=CC=C1Cl LL0941 [0,1,0,0,0,0|1,0,0]=2 139 B11R1.86 CC(=O)OC1=CC=CC=C1Br RT11882 [0,1,0,0,0,0|0,0,0]=1 140 B11R1.86 CC(=O)OC1CCC=CC1=O YH06918 [0,1,0,0,0,0|0,0,3]=4 141 B11R1.86 CC(C)OC1=C(O)C=CC=C1 JZ2617 [0,1,0,0,0,0|1,0,1]=3 142 B11R1.86 CC(C)OC1=CC=CC=C1Br JZ4107 [0,1,0,0,0,0|1,0,1]=3 143 B11R1.86 CC(N)CC1=CC=CC=C1F JZ4703 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 LT2142 [0,1,0,0,0,0|2,0,0]=3 145 B11R1.86 CC1=CC=CC=C1NC(N)=O HL0193 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.86 NC(=O)NC1=CC=CC=C1F XJ1260 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.86 NC(=S)NC1=CC=CC=C1Cl XJ2860 [0,1,0,0,0,0|2,1,0]=4 148 B11R1.86 NC(=S)NC1=CC=CC=C1O LQ1826 [0,1,0,0,0,0|2,1,0]=4 149 B11R1.86 NC1=CC=CC=C1OC(F)F XJ4641 [0,1,0,0,0,0|2,0,1]=4 150 B11R1.86 O=C(Cl)CC1=C(F)C=CC=C1 XJ0788 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.86 O=C(Cl)OC1=CC=CC=C1Cl XJ4468 [0,1,0,0,0,0|1,0,0]=2 152 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 LT6517 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 LT6567 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.86 O=C(O)CC1=CC=CC=C1Br LT6480 [0,1,0,0,0,0|2,0,0]=3 155 B11R1.86 O=C(O)CC1=CC=CC=C1S RT19094 [0,1,0,0,0,0|2,0,0]=3 156 B11R1.86 O=C(O)CC1=CC=CN=C1Cl YH66545 [0,1,0,0,0,0|3,0,0]=4 157 B11R1.86 O=C([O-])CC1=CC=CC=C1O JZ0260 [0,1,0,0,0,0|2,0,0]=3 158 B11R1.157 CC(=O)CC1=CC=CC(C)=C1 LQ4107 [0,1,0,0,0,0|1,0,0]=2 159 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 LL0985 [0,1,0,0,0,0|1,0,0]=2 160 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 HL0043 [0,1,0,0,0,0|1,0,0]=2 161 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 LQ0740 [0,1,0,0,0,0|1,0,0]=2 162 B11R1.157 CC(=O)NC1=NC(=O)NC=C1 LT7371 [0,1,0,0,0,0|3,0,0]=4 163 B11R1.157 CC(C)OC1=CC=CC(Br)=C1 HL3436 [0,1,0,0,0,0|1,0,1]=3 164 B11R1.157 CC1=CC(CC(=O)O)=CC=C1 JZ3970 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 RT1647 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 YH66558 [0,1,0,0,0,0|2,0,0]=3 167 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 XJ4094 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.157 NC1=CC(OC(F)F)=CC=C1 XJ4643 [0,1,0,0,0,0|2,0,1]=4 169 B11R1.157 NC1=NC=CC(CC(=O)O)=C1 HL4831 [0,1,0,0,0,0|3,0,0]=4 170 B11R1.157 O=C(O)CC1=CC(Br)=CN=C1 YH59202 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 LT3102 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 LQ1956 [0,1,0,0,0,0|2,0,0]=3 173 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 LQ1954 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 LT6766 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 LT3028 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.157 O=C(O)CC1=CC=CC(S)=C1 RT19096 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.509 CC(C)(O)CC1=CC=CC=C1 LQ0299 [0,1,0,0,0,0|1,0,2]=4 178 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 LT5528 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.509 CS(=O)(=O)SC1=CC=CC=C1 RT17788 [0,1,0,0,0,0|1,1,0]=3 180 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 LL1922 [0,1,0,0,0,0|3,0,0]=4 181 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 LT4179 [0,1,0,0,0,0|3,0,0]=4 182 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 LT6993 [0,1,0,0,0,0|3,0,0]=4 183 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 XJ3090 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.509 ClC(Cl)(Cl)OC1=CC=CC=C1 YH56080 [0,1,0,0,0,0|2,0,1]=4 185 B11R1.509 O=P(Cl)(Cl)OC1=CC=CC=C1 HL0412 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.509 O=P([O-])([O-])OC1=CC=CC=C1 XJ2431 [0,1,0,0,0,0|2,0,0]=3 187 B9R0.2 C\C=C\C=C\COC(C)=O LQ1809 [0,0,1,0,0,0|0,0,2]=3 188 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 RT2823 [0,0,0,1,0,0|2,0,1]=4 189 B11R2.10 BrC1=NC2=CC=CC=C2S1 HL2307 [0,0,0,1,0,0|2,1,0]=4 190 B11R2.10 CC1=CC2=CC=CC=C2N1 LQ0261 [0,0,0,1,0,0|2,0,0]=3 191 B11R2.10 CC1=CC2=CC=CC=C2O1 LQ2633 [0,0,0,1,0,0|1,0,0]=2 192 B11R2.10 CC1=CC2=NC=CC=C2N1 RT4195 [0,0,0,1,0,0|3,0,0]=4 193 B11R2.10 CC1=NC2=CC=CC=C2O1 LT6591 [0,0,0,1,0,0|1,0,0]=2 194 B11R2.10 CC1=NC2=CC=CC=C2S1 LL0486 [0,0,0,1,0,0|1,1,0]=3 195 B11R2.10 CC1=NC2=CC=CC=C2[Se]1 LT1791 [0,0,0,1,0,0|1,1,0]=3 196 B11R2.10 C[C@@H]1CC2=C(C=CC=C2)N1 LT1106 [0,0,0,1,0,0|2,0,1]=4 197 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 LT1107 [0,0,0,1,0,0|2,0,1]=4 198 B11R2.10 ClC1=NC2=CC=CC=C2S1 LT2131 [0,0,0,1,0,0|2,1,0]=4 199 B11R2.10 ClC1=NC2=CC=CN=C2O1 CJ3027 [0,0,0,1,0,0|3,0,0]=4 200 B11R2.10 NC1=CC2=C(C=CC=C2)N1 RT15983 [0,0,0,1,0,0|2,0,1]=4 201 B11R2.10 NC1=NC2=C(C=CC=C2)N1 LT6425 [0,0,0,1,0,0|3,0,0]=4 202 B11R2.10 NC1=NC2=C(C=CC=C2)S1 LL0576 [0,0,0,1,0,0|2,1,0]=4 203 B11R2.10 NC1CC2=C(C=CC=C2)C1 HL2236 [0,0,0,1,0,0|2,0,1]=4 204 B11R2.10 NC1CC2=CC=CC=C2C1 XJ2313 [0,0,0,1,0,0|2,0,1]=4 205 B11R2.10 O=C1C=C2C=COC=C2O1 RT14175 [0,0,0,1,0,0|1,0,1]=3 206 B11R2.10 O=C1CC2=C(C=CC=C2)N1 JZ1726 [0,0,0,1,0,0|1,0,0]=2 207 B11R2.10 O=C1CC2=CC=CC=C2C1 JZ0697 [0,0,0,1,0,0|1,0,0]=2 208 B11R2.10 O=C1CC2=CC=CC=C2S1 RT9248 [0,0,0,1,0,0|0,1,0]=2 209 B11R2.10 O=C1CC2=NC=CC=C2N1 XJ5078 [0,0,0,1,0,0|2,0,0]=3 210 B11R2.10 O=C1N=C2C=CC=CC2=N1 YH01415 [0,0,0,1,0,0|2,0,0]=3 211 B11R2.10 O=C1NC2=CC=CC=C2O1 LT0282 [0,0,0,1,0,0|1,0,0]=2 212 B11R2.10 O=C1NC2=NC=CC=C2O1 RT7818 [0,0,0,1,0,0|2,0,0]=3 213 B11R2.10 OC1=NC2=C(C=CC=C2)S1 JZ4289 [0,0,0,1,0,0|1,1,1]=4 214 B11R2.10 OC1CC2=CC=CC=C2C1 JZ0698 [0,0,0,1,0,0|1,0,2]=4 215 B11R2.10 SC1=NC2=C(C=CC=C2)O1 LT2020 [0,0,0,1,0,0|1,1,0]=3 216 B11R2.10 SC1=NC2=CC=CC=C2N1 RT9298 [0,0,0,1,0,0|2,1,0]=4 217 B11R2.10 SC1=NC2=CC=CC=C2S1 HL1623 [0,0,0,1,0,0|1,2,0]=4 218 B11R2.10 [S-]C1=NC2=CC=CC=C2N1 XJ2390 [0,0,0,1,0,0|2,1,0]=4 219 B11R2.238 C1=CC=C(SC2CC2)C=C1 LQ3793 [0,0,0,1,0,0|1,1,1]=4 220 B9R1.6 C=C(C)C1=CC=CC=C1 XJ0257 [0,0,0,0,1,0|1,0,0]=2 221 B9R1.6 CC(=O)C1=CC=CC=C1 RT11112 [0,0,0,0,1,0|0,0,0]=1 222 B9R1.6 CC(=O)C1=CC=NC=C1 HL0648 [0,0,0,0,1,0|1,0,0]=2 223 B9R1.6 CC(=O)C1=CN=CC=C1 LQ0733 [0,0,0,0,1,0|1,0,0]=2 224 B9R1.6 CC(=O)C1=CN=CN=C1 RT1973 [0,0,0,0,1,0|2,0,0]=3 225 B9R1.6 CC(=O)C1=NC=CC=N1 YH05694 [0,0,0,0,1,0|2,0,0]=3 226 B9R1.6 CC(Br)C1=CC=CC=C1 XJ1034 [0,0,0,0,1,0|1,0,1]=3 227 B9R1.6 CC(N)C1=CC=CC=C1 JZ0721 [0,0,0,0,1,0|1,0,1]=3 228 B9R1.6 CN(C)C1=CC=NC=C1 LT3039 [0,0,0,0,1,0|3,0,0]=4 229 B9R1.6 CN(C)C1=NC=CC=C1 XJ2942 [0,0,0,0,1,0|3,0,0]=4 230 B9R1.6 CN(N)C1=CC=CC=C1 LQ1214 [0,0,0,0,1,0|2,0,0]=3 231 B9R1.6 CN(N)C1=CC=CC=C1 LX2044 [0,0,0,0,1,0|2,0,0]=3 232 B9R1.6 C[C@@H](N)C1=CC=CC=C1 RT1721 [0,0,0,0,1,0|1,0,1]=3 233 B9R1.6 C[C@@H](N)C1=NC=CC=C1 YH51514 [0,0,0,0,1,0|2,0,1]=4 234 B9R1.6 C[C@@H](O)C1=NC=CC=C1 YH51543 [0,0,0,0,1,0|1,0,2]=4 235 B9R1.6 C[C@H](N)C1=CC=CC=C1 RT1720 [0,0,0,0,1,0|1,0,1]=3 236 B9R1.6 C[Si](=O)C1=CC=CC=C1 XJ3509 [0,0,0,0,1,0|0,1,0]=2 237 B9R1.6 ClC(Cl)C1=CC=CC=C1 LT3671 [0,0,0,0,1,0|2,0,1]=4 238 B9R1.6 ClP(Cl)C1=CC=CC=C1 JZ4097 [0,0,0,0,1,0|3,0,0]=4 239 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 YH96399 [0,0,0,0,1,0|3,0,0]=4 240 B9R1.6 N=C(N)C1=CC=CC=C1 LQ1861 [0,0,0,0,1,0|2,0,0]=3 241 B9R1.6 N=C(N)C1=CC=NC=C1 JZ2903 [0,0,0,0,1,0|3,0,0]=4 242 B9R1.6 N=C(N)C1=CC=NC=C1 YH55019 [0,0,0,0,1,0|3,0,0]=4 243 B9R1.6 NC(=O)C1=CC=CC=C1 CJ3392 [0,0,0,0,1,0|1,0,0]=2 244 B9R1.6 NC(=O)C1=CC=CC=C1 LT4036 [0,0,0,0,1,0|1,0,0]=2 245 B9R1.6 NC(=O)C1=CC=CN=C1 XJ0261 [0,0,0,0,1,0|2,0,0]=3 246 B9R1.6 NC(=O)C1=CC=NC=C1 XJ1788 [0,0,0,0,1,0|2,0,0]=3 247 B9R1.6 NC(=S)C1=CC=CC=C1 XJ2085 [0,0,0,0,1,0|1,1,0]=3 248 B9R1.6 O=C(Cl)C1=CC=CN=C1 JZ0788 [0,0,0,0,1,0|2,0,0]=3 249 B9R1.6 O=C(Cl)C1=CC=CN=C1 LT7313 [0,0,0,0,1,0|2,0,0]=3 250 B9R1.6 O=C(Cl)C1=CN=CC=N1 YH43954 [0,0,0,0,1,0|3,0,0]=4 251 B9R1.6 O=C(Cl)C1=NC=CC=C1 LT5112 [0,0,0,0,1,0|2,0,0]=3 252 B9R1.6 O=C(F)C1=CC=CC=C1 HL1804 [0,0,0,0,1,0|1,0,0]=2 253 B9R1.6 O=C(O)C1=CC=CC=N1 SY0293 [0,0,0,0,1,0|2,0,0]=3 254 B9R1.6 O=C(O)C1=CC=CN=C1 LT7314 [0,0,0,0,1,0|2,0,0]=3 255 B9R1.6 O=C(O)C1=CC=NC=C1 JZ0786 [0,0,0,0,1,0|2,0,0]=3 256 B9R1.6 O=C(O)C1=CN=CN=C1 JZ0399 [0,0,0,0,1,0|3,0,0]=4 257 B9R1.6 O=C(O)C1=CN=NC=C1 XJ5546 [0,0,0,0,1,0|3,0,0]=4 258 B9R1.6 O=C(O)C1=NC=CC=N1 YH53937 [0,0,0,0,1,0|3,0,0]=4 259 B9R1.6 O=C(O)C1=NC=CN=C1 LT6615 [0,0,0,0,1,0|3,0,0]=4 260 B9R1.6 O=C(O)C1=NC=NC=C1 LQ4720 [0,0,0,0,1,0|3,0,0]=4 261 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0026 [0,0,0,0,1,0|1,0,0]=2 262 B9R1.6 O=C([O-])C1=CC=CC=C1 HL0027 [0,0,0,0,1,0|1,0,0]=2 263 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ0044 [0,0,0,0,1,0|1,0,0]=2 264 B9R1.6 O=C([O-])C1=CC=CC=C1 JZ4278 [0,0,0,0,1,0|1,0,0]=2 265 B9R1.6 O=C([O-])C1=CC=CC=C1 LT4848 [0,0,0,0,1,0|1,0,0]=2 266 B9R1.6 O=C([O-])C1=CC=CC=C1 XJ0991 [0,0,0,0,1,0|1,0,0]=2 267 B9R1.6 O=C([O-])C1=CN=CC=C1 LL1069 [0,0,0,0,1,0|2,0,0]=3 268 B9R1.6 O=C([O-])C1=CN=CC=C1 LQ0027 [0,0,0,0,1,0|2,0,0]=3 269 B9R1.6 O=C([O-])C1=NC=CC=C1 JZ5244 [0,0,0,0,1,0|2,0,0]=3 270 B9R1.6 O=C([O-])C1=NC=CC=C1 LQ3798 [0,0,0,0,1,0|2,0,0]=3 271 B9R1.6 O=S(O)C1=CC=CC=C1 LQ1215 [0,0,0,0,1,0|2,0,0]=3 272 B9R1.6 O=S([O-])C1=CC=CC=C1 LL1085 [0,0,0,0,1,0|2,0,0]=3 273 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 XJ0263 [0,0,0,0,1,0|2,0,0]=3 274 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 LQ2210 [0,0,0,0,1,0|3,0,0]=4 275 B9R1.6 O=[P+]([O-])C1=CC=CC=C1 LQ2659 [0,0,0,0,1,0|2,0,0]=3 276 B9R1.6 OB(O)C1=CC=CC=C1 JZ0681 [0,0,0,0,1,0|2,0,1]=4 277 B9R1.6 [18O]=C([18OH])C1=CC=CC=C1 RT11444 [0,0,0,0,1,0|1,0,0]=2 278 B9R1.6 [SiH](Cl)(Cl)C1=CC=CC=C1 HL0912 [0,0,0,0,1,0|2,1,0]=4 279 B9R1.13 CC(=O)CC1=CC=CN1 RT14091 [0,0,0,0,1,0|2,0,0]=3 280 B9R1.13 NC(=O)CC1=CC=CS1 XJ2712 [0,0,0,0,1,0|3,0,0]=4 281 B9R1.13 O=C(Cl)CC1=CC=CS1 LT0592 [0,0,0,0,1,0|3,0,0]=4 282 B9R1.13 O=C(Cl)CC1=CC=CS1 LT5114 [0,0,0,0,1,0|3,0,0]=4 283 B9R1.13 O=C(O)CC1=CC=CS1 LT6659 [0,0,0,0,1,0|3,0,0]=4 284 B9R1.13 O=C(O)CC1=CNC=C1 YH90782 [0,0,0,0,1,0|3,0,0]=4 285 B9R1.13 O=C(O)CC1=CSC=C1 LT3139 [0,0,0,0,1,0|3,0,0]=4 286 B9R1.13 O=C(O)CC1=CSC=C1 XJ3177 [0,0,0,0,1,0|3,0,0]=4 287 B11R1.91 C=C(C)COC1=CC=CC=C1 HL3035 [0,0,0,0,0,1|1,0,0]=2 288 B11R1.91 CC(=O)C#CC1=CC=CC=C1 XJ1968 [0,0,0,0,0,1|1,0,0]=2 289 B11R1.91 CC(=O)CCC1=CC=CC=C1 LQ2231 [0,0,0,0,0,1|1,0,0]=2 290 B11R1.91 CC(=O)NNC1=CC=CC=C1 HL1438 [0,0,0,0,0,1|1,0,0]=2 291 B11R1.91 CC(N)CCC1=CC=CC=C1 XJ4684 [0,0,0,0,0,1|2,0,1]=4 292 B11R1.91 CC(O)COC1=CC=CC=C1 HL0414 [0,0,0,0,0,1|0,0,2]=3 293 B11R1.91 CC(O)COC1=CC=CC=C1 HL3407 [0,0,0,0,0,1|0,0,2]=3 294 B11R1.91 ClP(Cl)OCC1=CC=CC=C1 RT12951 [0,0,0,0,0,1|3,0,0]=4 295 B11R1.91 N=C(N)SCC1=CC=CC=C1 XJ0890 [0,0,0,0,0,1|2,1,0]=4 296 B11R1.91 NC(=O)COC1=CC=CC=C1 JZ3987 [0,0,0,0,0,1|1,0,0]=2 297 B11R1.91 NC(=O)NNC1=CC=CC=C1 LL0305 [0,0,0,0,0,1|2,0,0]=3 298 B11R1.91 NC(=O)OCC1=CC=CC=C1 JZ3985 [0,0,0,0,0,1|1,0,0]=2 299 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 LT4562 [0,0,0,0,0,1|2,0,0]=3 300 B11R1.91 NC(=S)NCC1=CC=CC=C1 JZ3984 [0,0,0,0,0,1|2,1,0]=4 301 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 RT11201 [0,0,0,0,0,1|2,0,0]=3 302 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 LL0303 [0,0,0,0,0,1|2,0,0]=3 303 B11R1.91 O=C(Cl)\C=C\C1=CC=CN=C1 YH25200 [0,0,0,0,0,1|3,0,0]=4 304 B11R1.91 O=C(O)C#CC1=CC=CC=C1 JZ4042 [0,0,0,0,0,1|2,0,0]=3 305 B11R1.91 O=C(O)COC1=CC=CC=N1 YH08506 [0,0,0,0,0,1|2,0,0]=3 306 B11R1.91 O=C(O)COC1=CC=CN=C1 LL1584 [0,0,0,0,0,1|2,0,0]=3 307 B11R1.91 O=C(O)CSC1=CC=CC=C1 LL0306 [0,0,0,0,0,1|1,1,0]=3 308 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 LT4563 [0,0,0,0,0,1|2,0,0]=3 309 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 RT12003 [0,0,0,0,0,1|2,0,0]=3 310 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 HL0692 [0,0,0,0,0,1|3,0,0]=4 311 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 JZ5354 [0,0,0,0,0,1|3,0,0]=4 312 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 XJ2849 [0,0,0,0,0,1|3,0,0]=4 313 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 LQ3273 [0,0,0,0,0,1|3,0,0]=4 314 B11R1.91 O=C([O-])CNC1=CC=CC=C1 LT5790 [0,0,0,0,0,1|2,0,0]=3 315 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 HL0048 [0,0,0,0,0,1|2,0,0]=3 316 B11R1.91 O=C([O-])\C=C\C1=CC=CC=C1 XJ4235 [0,0,0,0,0,1|2,0,0]=3 317 B11R1.91 O=[N+]([O-])\C=C\C1=CC=CC=C1 LQ2816 [0,0,0,0,0,1|3,0,0]=4 318 B8R0.4 C\C=C\C=C/C=C/C=O RT17881 [1,0,1,0,0,0|1,0,1]=4 319 B8R1.2 BrCC1=CC=CC=C1 JZ1264 [2,0,0,0,0,0|1,0,1]=4 320 B8R1.2 Br[Mg]C1=CC=CC=C1 HL1276 [2,0,0,0,0,0|2,0,0]=4 321 B8R1.2 C=CC1=CC=CC=C1 XJ3473 [2,0,0,0,0,0|0,0,1]=3 322 B8R1.2 C=CC1=CC=CN=C1 RT7678 [2,0,0,0,0,0|1,0,1]=4 323 B8R1.2 CCC1=CC=CN=C1 JZ1084 [2,0,0,0,0,0|1,0,1]=4 324 B8R1.2 CCC1=CC=NC=C1 LL0974 [2,0,0,0,0,0|1,0,1]=4 325 B8R1.2 CNC1=CC=CN=C1 LT2493 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.2 CNC1=CC=NC=C1 LT6892 [2,0,0,0,0,0|2,0,0]=4 327 B8R1.2 COC1=CC=CCC1 JZ1877 [2,0,0,0,0,0|0,0,2]=4 328 B8R1.2 COC1=CC=CN=C1 LT6817 [2,0,0,0,0,0|1,0,0]=3 329 B8R1.2 COC1=NC=CC=C1 LT2109 [2,0,0,0,0,0|1,0,0]=3 330 B8R1.2 COC1=NC=CN=C1 LT2105 [2,0,0,0,0,0|2,0,0]=4 331 B8R1.2 CSC1=NC=CC=C1 LT2167 [2,0,0,0,0,0|1,1,0]=4 332 B8R1.2 ClCC1=CC=CC=C1 HL1268 [2,0,0,0,0,0|1,0,1]=4 333 B8R1.2 N#CC1=CC=CC=C1 JZ4954 [2,0,0,0,0,0|1,0,1]=4 334 B8R1.2 N#CC1=CC=CC=C1 XJ4015 [2,0,0,0,0,0|1,0,1]=4 335 B8R1.2 NCC1=CC=CC=C1 LQ1371 [2,0,0,0,0,0|1,0,1]=4 336 B8R1.2 NNC1=CC=CC=C1 HL1279 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.2 NNC1=CC=CC=C1 JZ5772 [2,0,0,0,0,0|2,0,0]=4 338 B8R1.2 O=CC1=CC=CC=N1 JZ0732 [2,0,0,0,0,0|1,0,0]=3 339 B8R1.2 O=CC1=CC=CN=C1 RT10183 [2,0,0,0,0,0|1,0,0]=3 340 B8R1.2 O=CC1=CN=CN=C1 LX3173 [2,0,0,0,0,0|2,0,0]=4 341 B8R1.2 O=CC1=NC=CC=N1 YH51306 [2,0,0,0,0,0|2,0,0]=4 342 B8R1.2 O=CC1=NC=CN=C1 HL3002 [2,0,0,0,0,0|2,0,0]=4 343 B8R1.2 O=CC1=NC=NC=C1 YH48930 [2,0,0,0,0,0|2,0,0]=4 344 B8R1.2 O=CC1=NN=CC=C1 XJ5876 [2,0,0,0,0,0|2,0,0]=4 345 B8R1.2 O=NC1=CC=CC=C1 YH08587 [2,0,0,0,0,0|1,0,0]=3 346 B8R1.2 O=[As]C1=CC=CC=C1 JZ4036 [2,0,0,0,0,0|1,0,0]=3 347 B8R1.2 OCC1=CC=CC=C1 HL1271 [2,0,0,0,0,0|0,0,2]=4 348 B8R1.2 O[Hg]C1=CC=CC=C1 LQ3360 [2,0,0,0,0,0|1,0,1]=4 349 B8R1.2 SCC1=CC=CC=C1 HL1273 [2,0,0,0,0,0|0,1,1]=4 350 B8R1.2 [C-]#CC1=CC=CC=C1 JZ3648 [2,0,0,0,0,0|0,0,2]=4 351 B8R1.2 [C-]#[N+]C1=CC=CC=C1 YH65599 [2,0,0,0,0,0|1,0,1]=4 352 B10R1.1 Br\C=C\C1=CC=C(Br)C=C1 RT6387 [1,1,0,0,0,0|2,0,0]=4 353 B10R1.1 CC1=CC=C(N=C=O)C=C1 LT3140 [1,1,0,0,0,0|1,0,1]=4 354 B10R1.1 CCCC1=CC=C(N)C=C1 XJ2253 [1,1,0,0,0,0|1,0,1]=4 355 B10R1.1 CCNC1=CC=C(C)C=C1 JZ4006 [1,1,0,0,0,0|1,0,1]=4 356 B10R1.1 CCNC1=CC=C(Cl)C=C1 YH66088 [1,1,0,0,0,0|1,0,1]=4 357 B10R1.1 CCOC1=CC=C(Br)C=N1 LQ5337 [1,1,0,0,0,0|1,0,1]=4 358 B10R1.1 CCOC1=CC=C(I)C=C1 LQ1391 [1,1,0,0,0,0|0,0,1]=3 359 B10R1.1 CCOC1=CC=C(N)C=C1 RT3081 [1,1,0,0,0,0|0,0,1]=3 360 B10R1.1 CCOC1=CC=C(O)C=C1 JZ4008 [1,1,0,0,0,0|0,0,1]=3 361 B10R1.1 CCOC1=CN=C(Cl)C=C1 LX1903 [1,1,0,0,0,0|1,0,1]=4 362 B10R1.1 CCOC1=NC=C(N)C=C1 YH04966 [1,1,0,0,0,0|1,0,1]=4 363 B10R1.1 COCC1=CC=C(O)C=C1 YH05854 [1,1,0,0,0,0|2,0,0]=4 364 B10R1.1 ClC1=CC=C(\C=C\Br)C=C1 RT6043 [1,1,0,0,0,0|2,0,0]=4 365 B10R1.1 O=C=NC1=CC=C(F)C=C1 JZ4482 [1,1,0,0,0,0|1,0,1]=4 366 B10R1.1 O=CCC1=CC=C(F)C=C1 YH40007 [1,1,0,0,0,0|1,0,0]=3 367 B10R1.1 O=CCC1=CC=C(O)C=C1 RT6375 [1,1,0,0,0,0|1,0,0]=3 368 B10R1.4 Br\C=C\C1=CC=CC=C1Br RT6046 [1,1,0,0,0,0|2,0,0]=4 369 B10R1.4 CC1=CC=CC=C1N=C=O HL0189 [1,1,0,0,0,0|1,0,1]=4 370 B10R1.4 CCCC1=CC=CC=C1O JZ4091 [1,1,0,0,0,0|1,0,1]=4 371 B10R1.4 CCOC1=C(Br)C=CC=C1 XJ1001 [1,1,0,0,0,0|0,0,1]=3 372 B10R1.4 CCOC1=C(Cl)C=CC=C1 HL0191 [1,1,0,0,0,0|0,0,1]=3 373 B10R1.4 CCOC1=C(F)C=CC=C1 LT6548 [1,1,0,0,0,0|0,0,1]=3 374 B10R1.4 CCOC1=C(O)C=CC=C1 LQ0245 [1,1,0,0,0,0|0,0,1]=3 375 B10R1.4 CCOC1=CC=CN=C1Br YH94023 [1,1,0,0,0,0|1,0,1]=4 376 B10R1.4 CCOC1=CC=CN=C1N YH20158 [1,1,0,0,0,0|1,0,1]=4 377 B10R1.4 CCOC1=NC=CC=C1I LT3940 [1,1,0,0,0,0|1,0,1]=4 378 B10R1.4 O=C=NC1=C(Cl)C=CC=C1 XJ2468 [1,1,0,0,0,0|1,0,1]=4 379 B10R1.4 O=C=NC1=C(F)C=CC=C1 LQ3980 [1,1,0,0,0,0|1,0,1]=4 380 B10R1.4 O=CCC1=C(Cl)C=CC=C1 LQ2618 [1,1,0,0,0,0|1,0,0]=3 381 B10R1.4 O=CCC1=CC=CC=C1F XJ6347 [1,1,0,0,0,0|1,0,0]=3 382 B10R1.10 CC1=CC(NC=O)=CC=C1 HL2478 [1,1,0,0,0,0|1,0,0]=3 383 B10R1.10 CCCC1=CC(N)=CC=C1 YH65505 [1,1,0,0,0,0|1,0,1]=4 384 B10R1.10 CCOC1=CC(Br)=CC=C1 XJ2220 [1,1,0,0,0,0|0,0,1]=3 385 B10R1.10 CCOC1=CC(Br)=CN=C1 YH39559 [1,1,0,0,0,0|1,0,1]=4 386 B10R1.10 CCOC1=CC(F)=CC=C1 HL1827 [1,1,0,0,0,0|0,0,1]=3 387 B10R1.10 CCOC1=CC(F)=NC=C1 LX3150 [1,1,0,0,0,0|1,0,1]=4 388 B10R1.10 CCOC1=CC=CC(O)=C1 JZ3968 [1,1,0,0,0,0|0,0,1]=3 389 B10R1.10 CCOC1=CC=NC(N)=C1 XJ5598 [1,1,0,0,0,0|1,0,1]=4 390 B10R1.10 CCOC1=CN=CC(N)=C1 LX2438 [1,1,0,0,0,0|1,0,1]=4 391 B10R1.10 CNCC1=CC(Br)=CC=C1 HL4336 [1,1,0,0,0,0|2,0,0]=4 392 B10R1.10 O=C=NC1=CC(Br)=CC=C1 LQ4373 [1,1,0,0,0,0|1,0,1]=4 393 B10R1.10 O=C=NC1=CC(F)=CC=C1 LQ0799 [1,1,0,0,0,0|1,0,1]=4 394 B10R1.10 O=C=NC1=CC(I)=CC=C1 LQ4374 [1,1,0,0,0,0|1,0,1]=4 395 B10R1.10 O=C=NC1=CC=CC(Cl)=C1 LT2914 [1,1,0,0,0,0|1,0,1]=4 396 B10R1.10 O=CCC1=CC(F)=CC=C1 YH17193 [1,1,0,0,0,0|1,0,0]=3 397 B10R1.15 C1=CC=C(C(=O)OC)C=C1 LQ3514 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.15 C1=CC=C(N([O-])N=O)C=C1 LT7153 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.15 CC(C=O)C1=CC=CC=C1 HL1224 [1,1,0,0,0,0|1,0,0]=3 400 B10R1.15 CCC(C)C1=CC=CC=C1 LL0562 [1,1,0,0,0,0|1,0,1]=4 401 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 HL2472 [1,1,0,0,0,0|1,0,1]=4 402 B10R1.15 CN(C=O)C1=CC=CC=C1 JZ0143 [1,1,0,0,0,0|1,0,0]=3 403 B10R1.15 CNC(=O)C1=CC=CC=C1 HL0175 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.17 BrCCOC1=CC=CC=C1 HL0054 [1,1,0,0,0,0|0,0,1]=3 405 B10R1.17 BrC\C=C\C1=CC=CC=C1 LT4566 [1,1,0,0,0,0|1,0,0]=3 406 B10R1.17 C(=O)CCC1=CC=CC=C1 LL0373 [1,1,0,0,0,0|1,0,0]=3 407 B10R1.17 C(=O)OCC1=CC=CC=C1 LL0376 [1,1,0,0,0,0|0,0,0]=2 408 B10R1.17 C=CCCC1=CC=CC=C1 YH17996 [1,1,0,0,0,0|1,0,1]=4 409 B10R1.17 CCC#CC1=CC=CC=C1 JZ4010 [1,1,0,0,0,0|1,0,1]=4 410 B10R1.17 CCCNC1=CC=CC=C1 XJ1126 [1,1,0,0,0,0|1,0,1]=4 411 B10R1.17 CCCOC1=CC=CC=C1 XJ1127 [1,1,0,0,0,0|0,0,1]=3 412 B10R1.17 ClCCCC1=CC=CC=C1 LL0372 [1,1,0,0,0,0|1,0,1]=4 413 B10R1.17 ClCOCC1=CC=CC=C1 JZ2365 [1,1,0,0,0,0|1,0,1]=4 414 B10R1.17 ClCSCC1=CC=CC=C1 JZ2415 [1,1,0,0,0,0|2,0,0]=4 415 B10R1.17 N#CCOC1=CC=CC=C1 JZ2377 [1,1,0,0,0,0|0,0,2]=4 416 B10R1.17 N#C\C=C\C1=CC=CC=C1 JZ2494 [1,1,0,0,0,0|1,0,1]=4 417 B10R1.17 NCC#CC1=CC=CC=C1 YH18704 [1,1,0,0,0,0|1,0,1]=4 418 B10R1.17 O=C=NCC1=CC=CC=C1 LT4166 [1,1,0,0,0,0|1,0,1]=4 419 B10R1.17 O=CC#CC1=CC=CC=C1 LQ2262 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.17 O=CNCC1=CC=CC=C1 JZ2897 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.17 O=C\C=C\C1=CC=CC=C1 LT4560 [1,1,0,0,0,0|1,0,0]=3 422 B10R1.17 O=C\C=C\C1=CC=CN=C1 RT18185 [1,1,0,0,0,0|2,0,0]=4 423 B10R1.17 O=C\C=C\C1=CC=CN=C1 XJ5146 [1,1,0,0,0,0|2,0,0]=4 424 B10R1.17 OCC#CC1=CC=CC=C1 LQ1789 [1,1,0,0,0,0|1,0,1]=4 425 B10R1.17 OCCNC1=CC=CC=C1 XJ0488 [1,1,0,0,0,0|1,0,1]=4 426 B10R1.17 OCCOC1=CC=CC=C1 XJ0489 [1,1,0,0,0,0|0,0,1]=3 427 B10R1.17 OC\C=C\C1=CC=CN=C1 RT7938 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HL1303 [0,1,0,0,1,0|0,0,0]=2 429 B10R1.13 CC(=O)C1=CC=C(C)N=C1 RT18075 [0,1,0,0,1,0|1,0,0]=3 430 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 JZ1119 [0,1,0,0,1,0|0,0,0]=2 431 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 YH07034 [0,1,0,0,1,0|1,0,0]=3 432 B10R1.13 CC(=O)C1=CC=C(F)C=C1 JZ1124 [0,1,0,0,1,0|0,0,0]=2 433 B10R1.13 CC(=O)C1=CC=C(N)C=C1 LT6854 [0,1,0,0,1,0|0,0,0]=2 434 B10R1.13 CC(=O)C1=CC=C(O)C=C1 RT11987 [0,1,0,0,1,0|0,0,0]=2 435 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 HL3496 [0,1,0,0,1,0|1,0,0]=3 436 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CJ2729 [0,1,0,0,1,0|1,0,0]=3 437 B10R1.13 CC(C)C1=CC=C(Br)C=C1 XJ1042 [0,1,0,0,1,0|1,0,1]=4 438 B10R1.13 CC(N)C1=CC=C(Br)C=C1 YH48936 [0,1,0,0,1,0|1,0,1]=4 439 B10R1.13 CC(O)C1=CC=C(F)C=C1 LQ0797 [0,1,0,0,1,0|0,0,2]=4 440 B10R1.13 CC1=CC=C(C(=O)O)C=C1 JZ0130 [0,1,0,0,1,0|1,0,0]=3 441 B10R1.13 CC1=CC=C(C(=O)O)C=N1 JZ2268 [0,1,0,0,1,0|2,0,0]=4 442 B10R1.13 CC1=CC=C(C(C)C)C=C1 XJ5623 [0,1,0,0,1,0|1,0,1]=4 443 B10R1.13 CC1=CC=C(C(C)N)C=C1 JZ0723 [0,1,0,0,1,0|1,0,1]=4 444 B10R1.13 CC1=CC=C(C(C)O)C=C1 LL0968 [0,1,0,0,1,0|0,0,2]=4 445 B10R1.13 CC1=CC=C(C(N)=O)C=C1 JZ3937 [0,1,0,0,1,0|1,0,0]=3 446 B10R1.13 CC1=CC=C(N(C)C)C=C1 YH99046 [0,1,0,0,1,0|2,0,0]=4 447 B10R1.13 CC1=CC=C(S(=O)O)C=C1 LL0969 [0,1,0,0,1,0|2,0,0]=4 448 B10R1.13 CC1=CC=C(S(N)=O)C=C1 YH66632 [0,1,0,0,1,0|2,0,0]=4 449 B10R1.13 CC1=CN=C(C(=O)O)C=C1 YH01820 [0,1,0,0,1,0|2,0,0]=4 450 B10R1.13 CN(C)C1=CC=C(Br)C=C1 LT2750 [0,1,0,0,1,0|2,0,0]=4 451 B10R1.13 CN(C)C1=CC=C(N)C=C1 HL1305 [0,1,0,0,1,0|2,0,0]=4 452 B10R1.13 CN(C)C1=CC=C(N)C=C1 LL0967 [0,1,0,0,1,0|2,0,0]=4 453 B10R1.13 CN(C)C1=CC=C(N)C=C1 LQ4413 [0,1,0,0,1,0|2,0,0]=4 454 B10R1.13 CN(C)C1=CC=C(N)C=C1 XJ3077 [0,1,0,0,1,0|2,0,0]=4 455 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 LQ5152 [0,1,0,0,1,0|1,0,1]=4 456 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 YH17516 [0,1,0,0,1,0|1,0,1]=4 457 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 XJ4897 [0,1,0,0,1,0|1,0,1]=4 458 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 HL3245 [0,1,0,0,1,0|2,0,0]=4 459 B10R1.13 N=C(N)C1=CC=C(N)C=C1 HL2287 [0,1,0,0,1,0|2,0,0]=4 460 B10R1.13 N=C(N)C1=CC=C(N)C=C1 JZ3229 [0,1,0,0,1,0|2,0,0]=4 461 B10R1.13 N=C(N)C1=CC=C(O)C=C1 LT2008 [0,1,0,0,1,0|2,0,0]=4 462 B10R1.13 N=C(N)C1=CC=C(O)C=C1 YH36971 [0,1,0,0,1,0|2,0,0]=4 463 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 LQ1385 [0,1,0,0,1,0|1,0,0]=3 464 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 JZ3938 [0,1,0,0,1,0|1,0,0]=3 465 B10R1.13 NC(=O)C1=CC=C(F)C=C1 JZ4190 [0,1,0,0,1,0|1,0,0]=3 466 B10R1.13 NC(=O)C1=CC=C(I)C=C1 YH59026 [0,1,0,0,1,0|1,0,0]=3 467 B10R1.13 NC(=O)C1=CC=C(O)C=C1 JZ3939 [0,1,0,0,1,0|1,0,0]=3 468 B10R1.13 NC(=O)C1=NC=C(N)C=C1 YH35056 [0,1,0,0,1,0|2,0,0]=4 469 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 YH49579 [0,1,0,0,1,0|1,1,0]=4 470 B10R1.13 NC1=CC=C(C(=O)O)C=C1 RT3381 [0,1,0,0,1,0|1,0,0]=3 471 B10R1.13 NC1=CC=C(C(=O)O)C=N1 LT3585 [0,1,0,0,1,0|2,0,0]=4 472 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 LT3105 [0,1,0,0,1,0|1,0,0]=3 473 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 JZ0055 [0,1,0,0,1,0|2,0,0]=4 474 B10R1.13 NC1=CN=C(C(=O)O)C=C1 JZ1163 [0,1,0,0,1,0|2,0,0]=4 475 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 XJ0449 [0,1,0,0,1,0|1,0,0]=3 476 B10R1.13 O=C(Cl)C1=CC=C(Cl)N=C1 JZ0749 [0,1,0,0,1,0|2,0,0]=4 477 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 JZ1126 [0,1,0,0,1,0|1,0,0]=3 478 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 JZ4692 [0,1,0,0,1,0|1,0,0]=3 479 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 XJ1044 [0,1,0,0,1,0|1,0,0]=3 480 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 JZ0785 [0,1,0,0,1,0|2,0,0]=4 481 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 JZ1200 [0,1,0,0,1,0|2,0,0]=4 482 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 JZ0383 [0,1,0,0,1,0|1,0,0]=3 483 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 LT3592 [0,1,0,0,1,0|2,0,0]=4 484 B10R1.13 O=C(O)C1=CC=C(F)C=C1 JZ1125 [0,1,0,0,1,0|1,0,0]=3 485 B10R1.13 O=C(O)C1=CC=C(I)C=C1 JZ3940 [0,1,0,0,1,0|1,0,0]=3 486 B10R1.13 O=C(O)C1=CC=C(O)C=C1 JZ0015 [0,1,0,0,1,0|1,0,0]=3 487 B10R1.13 O=C(O)C1=CC=C(O)C=N1 XJ4141 [0,1,0,0,1,0|2,0,0]=4 488 B10R1.13 O=C(O)C1=CC=C(O)N=C1 RT9389 [0,1,0,0,1,0|2,0,0]=4 489 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CJ2890 [0,1,0,0,1,0|2,0,0]=4 490 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 LL1597 [0,1,0,0,1,0|2,0,0]=4 491 B10R1.13 O=C(O)C1=NC=C(F)C=C1 YH23879 [0,1,0,0,1,0|2,0,0]=4 492 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 HL1435 [0,1,0,0,1,0|1,0,0]=3 493 B10R1.13 O=S([O-])C1=CC=C(F)C=C1 JZ4192 [0,1,0,0,1,0|2,0,0]=4 494 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 RT13188 [0,1,0,0,1,0|2,0,0]=4 495 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 LT0072 [0,1,0,0,1,0|2,0,0]=4 496 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 RT11294 [0,1,0,0,1,0|2,0,0]=4 497 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 LT3458 [0,1,0,0,1,0|2,0,0]=4 498 B10R1.13 O=[N+]([O-])C1=CC=C(S)C=C1 RT12985 [0,1,0,0,1,0|2,0,0]=4 499 B10R1.28 CC(C)(C)C1=CC=CC=C1 XJ0222 [0,1,0,0,1,0|1,0,1]=4 500 B10R1.28 CC(C)(N)C1=CC=CC=C1 XJ1030 [0,1,0,0,1,0|1,0,1]=4 501 B10R1.28 CC(C)(O)C1=CC=CC=C1 LQ1212 [0,1,0,0,1,0|0,0,2]=4 502 B10R1.28 CC(C)(S)C1=CC=CC=C1 YH38274 [0,1,0,0,1,0|0,1,1]=4 503 B10R1.28 CP(=O)(Cl)C1=CC=CC=C1 XJ2994 [0,1,0,0,1,0|1,0,0]=3 504 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 LQ2383 [0,1,0,0,1,0|1,0,0]=3 505 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 HL2720 [0,1,0,0,1,0|2,0,0]=4 506 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 HL0392 [0,1,0,0,1,0|1,1,0]=4 507 B10R1.28 C[Si](C)(O)C1=CC=CC=C1 JZ2662 [0,1,0,0,1,0|0,1,1]=4 508 B10R1.28 C[Si](C)([O-])C1=CC=CC=C1 LQ3287 [0,1,0,0,1,0|0,1,1]=4 509 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 XJ0224 [0,1,0,0,1,0|2,0,0]=4 510 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 RT13210 [0,1,0,0,1,0|2,0,0]=4 511 B10R1.28 O=S(=O)([Na])C1=CC=CC=C1 LT4044 [0,1,0,0,1,0|2,0,0]=4 512 B10R1.28 O=S(=O)([Zn])C1=CC=CC=C1 LT4045 [0,1,0,0,1,0|2,0,0]=4 513 B10R1.28 O=[As](O)(O)C1=CC=CC=C1 XJ0221 [0,1,0,0,1,0|2,0,0]=4 514 B10R1.61 C=C(C)C1=CC=CC=C1C LQ4513 [0,1,0,0,1,0|1,0,0]=3 515 B10R1.61 CC(=O)C1=C(C)C=CC=C1 JZ3832 [0,1,0,0,1,0|0,0,0]=2 516 B10R1.61 CC(=O)C1=C(F)C=CC=C1 LT6542 [0,1,0,0,1,0|0,0,0]=2 517 B10R1.61 CC(=O)C1=CC=CC=C1Br LQ2085 [0,1,0,0,1,0|0,0,0]=2 518 B10R1.61 CC(=O)C1=CC=CC=C1Cl RT11894 [0,1,0,0,1,0|0,0,0]=2 519 B10R1.61 CC(=O)C1=CC=CN=C1C YH39691 [0,1,0,0,1,0|1,0,0]=3 520 B10R1.61 CC(=O)C1=CC=CN=C1Cl YH07033 [0,1,0,0,1,0|1,0,0]=3 521 B10R1.61 CC(=O)C1=CC=CN=C1N YH12193 [0,1,0,0,1,0|1,0,0]=3 522 B10R1.61 CC(=O)C1=NC=CC=C1F YH65591 [0,1,0,0,1,0|1,0,0]=3 523 B10R1.61 CC(=O)C1=NC=CN=C1C XJ4743 [0,1,0,0,1,0|2,0,0]=4 524 B10R1.61 CC(C)C1=C(Br)C=CC=C1 XJ3244 [0,1,0,0,1,0|1,0,1]=4 525 B10R1.61 CC(C)C1=C(N)C=CC=C1 JZ4085 [0,1,0,0,1,0|1,0,1]=4 526 B10R1.61 CC(C)C1=C(O)C=CC=C1 LL0172 [0,1,0,0,1,0|1,0,1]=4 527 B10R1.61 CC(N)C1=CC=CC=C1O YH66634 [0,1,0,0,1,0|1,0,1]=4 528 B10R1.61 CC(O)C1=CC=CC=C1Cl LQ3656 [0,1,0,0,1,0|0,0,2]=4 529 B10R1.61 CC1=C(C(=O)O)C=CC=C1 LQ0494 [0,1,0,0,1,0|1,0,0]=3 530 B10R1.61 CC1=C(C(=O)O)C=CN=C1 RT9406 [0,1,0,0,1,0|2,0,0]=4 531 B10R1.61 CC1=CC=CC=C1C(=O)Cl JZ4285 [0,1,0,0,1,0|1,0,0]=3 532 B10R1.61 CC1=CC=CC=C1N(C)C XJ1085 [0,1,0,0,1,0|2,0,0]=4 533 B10R1.61 CC1=CC=CN=C1C(=O)O LT5691 [0,1,0,0,1,0|2,0,0]=4 534 B10R1.61 CC1=NC=CC=C1C(=O)O JZ2271 [0,1,0,0,1,0|2,0,0]=4 535 B10R1.61 CN(C)C1=CC=CC=C1Cl LQ1380 [0,1,0,0,1,0|2,0,0]=4 536 B10R1.61 C[C@@H](N)C1=CC=CC=C1O YH29387 [0,1,0,0,1,0|1,0,1]=4 537 B10R1.61 C[N+]1=CC=CC=C1C(=O)[O-] RT7788 [0,1,0,0,1,0|2,0,0]=4 538 B10R1.61 N=C(N)C1=C(O)C=CC=C1 YH65820 [0,1,0,0,1,0|2,0,0]=4 539 B10R1.61 NC(=O)C1=C(N)C=CN=C1 YH16594 [0,1,0,0,1,0|2,0,0]=4 540 B10R1.61 NC(=O)C1=CC=CC=C1N LL0171 [0,1,0,0,1,0|1,0,0]=3 541 B10R1.61 NC(=O)C1=NC=CC=C1N XJ5526 [0,1,0,0,1,0|2,0,0]=4 542 B10R1.61 NC1=C(C(=O)O)C=CC=C1 LT0272 [0,1,0,0,1,0|1,0,0]=3 543 B10R1.61 NC1=C(C(=O)O)C=CN=C1 YH17177 [0,1,0,0,1,0|2,0,0]=4 544 B10R1.61 NC1=C(C(=O)O)C=NC=C1 JZ3131 [0,1,0,0,1,0|2,0,0]=4 545 B10R1.61 NC1=CC=CN=C1C(=O)O HL0849 [0,1,0,0,1,0|2,0,0]=4 546 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 RT7792 [0,1,0,0,1,0|2,0,0]=4 547 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 JZ1033 [0,1,0,0,1,0|1,0,0]=3 548 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 XJ1083 [0,1,0,0,1,0|1,0,0]=3 549 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl LT2133 [0,1,0,0,1,0|1,0,0]=3 550 B10R1.61 O=C(O)C1=C(Cl)C=CC=C1 LQ0495 [0,1,0,0,1,0|1,0,0]=3 551 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 XJ3548 [0,1,0,0,1,0|2,0,0]=4 552 B10R1.61 O=C(O)C1=C(F)C=CN=C1 LX2749 [0,1,0,0,1,0|2,0,0]=4 553 B10R1.61 O=C(O)C1=C(F)C=NC=C1 HL1748 [0,1,0,0,1,0|2,0,0]=4 554 B10R1.61 O=C(O)C1=C(I)C=CC=C1 LT6566 [0,1,0,0,1,0|1,0,0]=3 555 B10R1.61 O=C(O)C1=C(O)C=CC=C1 RT10607 [0,1,0,0,1,0|1,0,0]=3 556 B10R1.61 O=C(O)C1=C(O)C=CN=C1 XJ1084 [0,1,0,0,1,0|2,0,0]=4 557 B10R1.61 O=C(O)C1=CC=CC=C1Br LL0169 [0,1,0,0,1,0|1,0,0]=3 558 B10R1.61 O=C(O)C1=CC=CC=C1S LQ3223 [0,1,0,0,1,0|1,0,0]=3 559 B10R1.61 O=C(O)C1=CC=CC=C1[O-] LQ0966 [0,1,0,0,1,0|1,0,0]=3 560 B10R1.61 O=C(O)C1=CC=CN=C1Cl LT6516 [0,1,0,0,1,0|2,0,0]=4 561 B10R1.61 O=C(O)C1=CC=CN=C1F HL1749 [0,1,0,0,1,0|2,0,0]=4 562 B10R1.61 O=C(O)C1=CN=CC=C1Br YH36635 [0,1,0,0,1,0|2,0,0]=4 563 B10R1.61 O=C(O)C1=NC=CC=C1Br RT15189 [0,1,0,0,1,0|2,0,0]=4 564 B10R1.61 O=C(O)C1=NC=CC=C1Cl XJ5804 [0,1,0,0,1,0|2,0,0]=4 565 B10R1.61 O=C(O)C1=NC=CC=C1F YH36326 [0,1,0,0,1,0|2,0,0]=4 566 B10R1.61 O=C(O)C1=NC=CC=C1O XJ1437 [0,1,0,0,1,0|2,0,0]=4 567 B10R1.61 O=C(O)C1=NC=CC=C1S RT16346 [0,1,0,0,1,0|2,0,0]=4 568 B10R1.61 O=C([O-])C1=CC=CC=C1O HL0014 [0,1,0,0,1,0|1,0,0]=3 569 B10R1.61 O=C([O-])C1=CC=CC=C1O JZ3839 [0,1,0,0,1,0|1,0,0]=3 570 B10R1.61 O=C([O-])C1=CC=CC=C1O JZ5006 [0,1,0,0,1,0|1,0,0]=3 571 B10R1.61 O=C([O-])C1=CC=CC=C1O LQ0967 [0,1,0,0,1,0|1,0,0]=3 572 B10R1.61 O=C([O-])C1=CC=CC=C1O LQ4134 [0,1,0,0,1,0|1,0,0]=3 573 B10R1.61 O=C([O-])C1=CC=CC=C1[O-] LL1063 [0,1,0,0,1,0|1,0,0]=3 574 B10R1.61 O=C([O-])C1=NC=CC=C1Br RT16520 [0,1,0,0,1,0|2,0,0]=4 575 B10R1.61 O=N(=O)C1=CC=CC=C1O LL0174 [0,1,0,0,1,0|2,0,0]=4 576 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 JZ3833 [0,1,0,0,1,0|2,0,0]=4 577 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 LL0173 [0,1,0,0,1,0|2,0,0]=4 578 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 RT12368 [0,1,0,0,1,0|2,0,0]=4 579 B10R1.61 O=[N+]([O-])C1=C(I)C=CC=C1 XJ1086 [0,1,0,0,1,0|2,0,0]=4 580 B10R1.61 O=[N+]([O-])C1=C(S)C=CC=C1 YH03191 [0,1,0,0,1,0|2,0,0]=4 581 B10R1.61 O=[N+]([O-])C1=CC=CC=C1[O-] LQ1488 [0,1,0,0,1,0|2,0,0]=4 582 B10R1.113 C=C(C)C1=CC(C)=CC=C1 HL0676 [0,1,0,0,1,0|1,0,0]=3 583 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 LX2618 [0,1,0,0,1,0|1,0,0]=3 584 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 RT15363 [0,1,0,0,1,0|1,0,0]=3 585 B10R1.113 CC(=O)C1=CC(F)=CC=C1 LT6788 [0,1,0,0,1,0|0,0,0]=2 586 B10R1.113 CC(=O)C1=CC(N)=CC=C1 LT6621 [0,1,0,0,1,0|0,0,0]=2 587 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 LQ2084 [0,1,0,0,1,0|0,0,0]=2 588 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 LX2619 [0,1,0,0,1,0|1,0,0]=3 589 B10R1.113 CC(=O)C1=CC=CC(O)=C1 LT6622 [0,1,0,0,1,0|0,0,0]=2 590 B10R1.113 CC(=O)C1=NC=CC(C)=C1 CJ2939 [0,1,0,0,1,0|1,0,0]=3 591 B10R1.113 CC(C)C1=CC(Br)=CC=C1 HL2984 [0,1,0,0,1,0|1,0,1]=4 592 B10R1.113 CC(C)C1=CC(O)=CC=C1 RT10578 [0,1,0,0,1,0|1,0,1]=4 593 B10R1.113 CC(C)C1=CC=CC(N)=C1 XJ2891 [0,1,0,0,1,0|1,0,1]=4 594 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 RT2925 [0,1,0,0,1,0|1,0,1]=4 595 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 JZ3057 [0,1,0,0,1,0|0,0,2]=4 596 B10R1.113 CC(O)C1=CC=CC(N)=C1 XJ2202 [0,1,0,0,1,0|0,0,2]=4 597 B10R1.113 CC1=CC(C(N)=O)=CC=C1 LQ1217 [0,1,0,0,1,0|1,0,0]=3 598 B10R1.113 CC1=CC(N(C)C)=CC=C1 LL0511 [0,1,0,0,1,0|2,0,0]=4 599 B10R1.113 CC1=CC=CC(C(=O)O)=C1 XJ0266 [0,1,0,0,1,0|1,0,0]=3 600 B10R1.113 CC1=CC=CC(C(=O)O)=N1 JZ4291 [0,1,0,0,1,0|2,0,0]=4 601 B10R1.113 CC1=CN=CC(C(=O)O)=C1 LT6022 [0,1,0,0,1,0|2,0,0]=4 602 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 YH65966 [0,1,0,0,1,0|2,0,0]=4 603 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 XJ3010 [0,1,0,0,1,0|2,0,0]=4 604 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 RT4413 [0,1,0,0,1,0|2,0,0]=4 605 B10R1.113 N=C(N)C1=CC=CC(F)=C1 XJ6333 [0,1,0,0,1,0|2,0,0]=4 606 B10R1.113 N=C(N)C1=CC=CC(N)=C1 LT2228 [0,1,0,0,1,0|2,0,0]=4 607 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 LQ4630 [0,1,0,0,1,0|2,0,0]=4 608 B10R1.113 NC(=O)C1=CC(F)=CC=C1 HL1806 [0,1,0,0,1,0|1,0,0]=3 609 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 LQ1218 [0,1,0,0,1,0|1,0,0]=3 610 B10R1.113 NC(=O)C1=C[N+]([O-])=CC=C1 JZ1859 [0,1,0,0,1,0|2,0,0]=4 611 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 XJ6709 [0,1,0,0,1,0|2,0,0]=4 612 B10R1.113 NC1=CC(C(=O)O)=CN=C1 YH48838 [0,1,0,0,1,0|2,0,0]=4 613 B10R1.113 NC1=CC(C(=O)O)=NC=C1 RT5964 [0,1,0,0,1,0|2,0,0]=4 614 B10R1.113 NC1=CC=CC(C(=O)O)=N1 JZ5606 [0,1,0,0,1,0|2,0,0]=4 615 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 XJ0269 [0,1,0,0,1,0|2,0,0]=4 616 B10R1.113 NC1=NC=CC(C(=O)O)=C1 YH32218 [0,1,0,0,1,0|2,0,0]=4 617 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 JZ4695 [0,1,0,0,1,0|1,0,0]=3 618 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 LQ1216 [0,1,0,0,1,0|1,0,0]=3 619 B10R1.113 O=C(Cl)C1=CC(Cl)=NC=C1 LT3937 [0,1,0,0,1,0|2,0,0]=4 620 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 LT3027 [0,1,0,0,1,0|1,0,0]=3 621 B10R1.113 O=C(Cl)C1=CC(I)=CC=C1 JZ4696 [0,1,0,0,1,0|1,0,0]=3 622 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 JZ0792 [0,1,0,0,1,0|2,0,0]=4 623 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 LT3007 [0,1,0,0,1,0|1,0,0]=3 624 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 LT6515 [0,1,0,0,1,0|2,0,0]=4 625 B10R1.113 O=C(O)C1=CC(F)=CC=C1 JZ1086 [0,1,0,0,1,0|1,0,0]=3 626 B10R1.113 O=C(O)C1=CC(F)=CN=C1 LQ0786 [0,1,0,0,1,0|2,0,0]=4 627 B10R1.113 O=C(O)C1=CC(I)=CC=C1 LQ1220 [0,1,0,0,1,0|1,0,0]=3 628 B10R1.113 O=C(O)C1=CC(O)=CC=C1 RT13217 [0,1,0,0,1,0|1,0,0]=3 629 B10R1.113 O=C(O)C1=CC(S)=NC=C1 YH42361 [0,1,0,0,1,0|2,0,0]=4 630 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 LT2935 [0,1,0,0,1,0|1,0,0]=3 631 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 JZ4304 [0,1,0,0,1,0|1,0,0]=3 632 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 LQ2733 [0,1,0,0,1,0|2,0,0]=4 633 B10R1.113 O=C(O)C1=CC=CC(F)=N1 LQ0787 [0,1,0,0,1,0|2,0,0]=4 634 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 LT3524 [0,1,0,0,1,0|2,0,0]=4 635 B10R1.113 O=C(O)C1=CN=CC(O)=C1 JZ0794 [0,1,0,0,1,0|2,0,0]=4 636 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 JZ0754 [0,1,0,0,1,0|2,0,0]=4 637 B10R1.113 O=C(O)C1=NC(O)=CC=C1 JZ0755 [0,1,0,0,1,0|2,0,0]=4 638 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 LX2083 [0,1,0,0,1,0|2,0,0]=4 639 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 LQ2927 [0,1,0,0,1,0|2,0,0]=4 640 B10R1.113 O=[N+]([O-])C1=CC(Cl)=CC=C1 LL0512 [0,1,0,0,1,0|2,0,0]=4 641 B10R1.113 O=[N+]([O-])C1=CC(I)=CC=C1 JZ4098 [0,1,0,0,1,0|2,0,0]=4 642 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 LT1873 [0,1,0,0,1,0|2,0,0]=4 643 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 LQ0982 [0,1,0,0,1,0|2,0,0]=4 644 B10R1.64 CC(=O)SC1=C(C)OC=C1 LT2075 [0,1,0,0,1,0|1,1,0]=4 645 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 JZ4325 [0,1,0,0,0,1|1,0,0]=3 646 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 JZ2437 [0,1,0,0,0,1|1,1,0]=4 647 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 JZ1980 [0,1,0,0,0,1|2,0,0]=4 648 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 HL0948 [0,1,0,0,0,1|2,0,0]=4 649 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 RT6283 [0,1,0,0,0,1|2,0,0]=4 650 B12R1.21 O=C(O)CCC1=CC=C(S)C=C1 RT16522 [0,1,0,0,0,1|2,0,0]=4 651 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 LT7384 [0,1,0,0,0,1|2,0,0]=4 652 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 LQ1962 [0,1,0,0,0,1|1,0,0]=3 653 B12R1.21 O=C(O)\C=C/C1=CC=C(O)C=C1 RT11084 [0,1,0,0,0,1|2,0,0]=4 654 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 XJ1623 [0,1,0,0,0,1|2,0,0]=4 655 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 RT6457 [0,1,0,0,0,1|2,0,0]=4 656 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 LT2333 [0,1,0,0,0,1|2,0,0]=4 657 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 XJ0856 [0,1,0,0,0,1|2,0,0]=4 658 B12R1.21 O=C(O)\C=C\C1=CC=C(S)C=C1 RT13144 [0,1,0,0,0,1|2,0,0]=4 659 B12R1.27 C=C(C=O)OCC1=CC=CC=C1 YH10507 [0,1,0,0,0,1|0,0,1]=3 660 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 JZ3727 [0,1,0,0,0,1|1,0,1]=4 661 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 HL2281 [0,1,0,0,0,1|0,0,1]=3 662 B12R1.27 CCC(=O)OCC1=CC=CC=C1 LT4168 [0,1,0,0,0,1|0,0,0]=2 663 B12R1.27 COC(=O)CCC1=CC=CN=C1 XJ6488 [0,1,0,0,0,1|2,0,0]=4 664 B12R1.27 COC(=O)OCC1=CC=CC=C1 RT11038 [0,1,0,0,0,1|0,0,0]=2 665 B12R1.27 NCC(=O)OCC1=CC=CC=C1 JZ4757 [0,1,0,0,0,1|0,0,0]=2 666 B12R1.27 NCC(=O)OCC1=CC=CC=C1 RT5531 [0,1,0,0,0,1|0,0,0]=2 667 B12R1.27 O=C(C#CC1=CC=CC=C1)CCl RT12399 [0,1,0,0,0,1|1,0,0]=3 668 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 YH49901 [0,1,0,0,0,1|1,0,0]=3 669 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 XJ0546 [0,1,0,0,0,1|0,0,0]=2 670 B12R1.27 O=C(CO)OCC1=CC=CC=C1 RT12484 [0,1,0,0,0,1|0,0,0]=2 671 B12R1.27 O=C(COC1=CC=CC=C1)O[Na] JZ0339 [0,1,0,0,0,1|1,0,0]=3 672 B12R1.27 OCC(O)COC1=CC=CC=C1 LT3080 [0,1,0,0,0,1|0,0,2]=4 673 B12R1.43 C=C(C)C(=O)OC1=CC=CC=C1 JZ1904 [0,1,0,0,0,1|1,0,0]=3 674 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O JZ1061 [0,1,0,0,0,1|2,0,0]=4 675 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O XJ2931 [0,1,0,0,0,1|2,0,0]=4 676 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O HL0609 [0,1,0,0,0,1|2,0,0]=4 677 B12R1.43 CC(OC1=CC=CC=C1)C(=O)Cl XJ0460 [0,1,0,0,0,1|1,0,0]=3 678 B12R1.43 C[C@@H](OC1=CC=CC=C1)C(=O)O YH66331 [0,1,0,0,0,1|1,0,0]=3 679 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 JZ2645 [0,1,0,0,0,1|2,0,0]=4 680 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 RT6536 [0,1,0,0,0,1|2,0,0]=4 681 B12R1.43 NC(CC1=CC=CC=C1)C(=O)[O-] YH66172 [0,1,0,0,0,1|2,0,0]=4 682 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O LT4754 [0,1,0,0,0,1|2,0,0]=4 683 B12R1.43 N\C(=C/C1=CC=CC=C1)C(=O)O RT5134 [0,1,0,0,0,1|2,0,0]=4 684 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 YH38554 [0,1,0,0,0,1|2,0,0]=4 685 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 JZ4215 [0,1,0,0,0,1|2,0,0]=4 686 B12R1.43 O=C(O)[C@@H](Cl)CC1=CC=CC=C1 YH65812 [0,1,0,0,0,1|2,0,0]=4 687 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 LQ3258 [0,1,0,0,0,1|2,0,0]=4 688 B12R1.43 O=C(O)\C(F)=C\C1=CC=CC=C1 LQ0738 [0,1,0,0,0,1|2,0,0]=4 689 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 HL1237 [0,1,0,0,0,1|1,0,0]=3 690 B12R1.107 CC(=O)N[C@H](C)C1=CC=CC=C1 RT7260 [0,1,0,0,0,1|1,0,0]=3 691 B12R1.107 CC(=O)OC(C)C1=CC=CC=C1 HL1238 [0,1,0,0,0,1|0,0,0]=2 692 B12R1.107 CC(=O)\C=C(/N)C1=CC=CC=C1 CJ3357 [0,1,0,0,0,1|1,0,0]=3 693 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 LT6844 [0,1,0,0,0,1|2,0,0]=4 694 B12R1.107 C\C(=C/C(=O)O)C1=CC=CC=C1 JZ4501 [0,1,0,0,0,1|2,0,0]=4 695 B12R1.107 NC(=O)CC(=O)C1=CC=CC=C1 LQ2460 [0,1,0,0,0,1|2,0,0]=4 696 B12R1.107 NC(=O)NC(=O)C1=CC=CC=C1 HL0179 [0,1,0,0,0,1|2,0,0]=4 697 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 JZ0890 [0,1,0,0,0,1|2,0,0]=4 698 B12R1.107 N[C@@H](CC(=O)O)C1=CC=CC=C1 RT12059 [0,1,0,0,0,1|2,0,0]=4 699 B12R1.107 N[C@H](CC(=O)O)C1=CC=CC=C1 LQ3693 [0,1,0,0,0,1|2,0,0]=4 700 B12R1.107 O=C(O)CC(O)C1=CC=CC=C1 LQ2496 [0,1,0,0,0,1|2,0,0]=4 701 B12R1.125 CC(=O)CSC1=CC=CC=C1Cl RT13133 [0,1,0,0,0,1|0,1,0]=3 702 B12R1.125 CC1=C(CCC(=O)O)C=CC=C1 YH47112 [0,1,0,0,0,1|2,0,0]=4 703 B12R1.125 O=C(O)CCC1=CC=CC=C1Br XJ4152 [0,1,0,0,0,1|2,0,0]=4 704 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl HL0947 [0,1,0,0,0,1|2,0,0]=4 705 B12R1.125 O=C(O)COC1=CC=CC=C1O LQ3078 [0,1,0,0,0,1|1,0,0]=3 706 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br RT6378 [0,1,0,0,0,1|2,0,0]=4 707 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O HL0187 [0,1,0,0,0,1|2,0,0]=4 708 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O XJ1000 [0,1,0,0,0,1|2,0,0]=4 709 B12R1.226 CC(=O)\C=C\C1=CC=CC(O)=C1 RT12436 [0,1,0,0,0,1|1,0,0]=3 710 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 HL0979 [0,1,0,0,0,1|2,0,0]=4 711 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 JZ3977 [0,1,0,0,0,1|2,0,0]=4 712 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 CJ2730 [0,1,0,0,0,1|2,0,0]=4 713 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 HL1832 [0,1,0,0,0,1|2,0,0]=4 714 B12R1.226 O=C(O)\C=C\C1=CC(Br)=CC=C1 XJ5126 [0,1,0,0,0,1|2,0,0]=4 715 B12R1.226 O=C(O)\C=C\C1=CC(F)=CC=C1 HL1833 [0,1,0,0,0,1|2,0,0]=4 716 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 JZ5420 [0,1,0,0,0,1|2,0,0]=4 717 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 YH35497 [0,1,0,0,0,1|2,0,0]=4 718 B12R1.891 CS(=O)(=S)OCC1=CC=CC=C1 RT12102 [0,1,0,0,0,1|1,0,0]=3 719 B12R1.4 C=CC1=CC=C(OC(C)=O)C=C1 JZ2093 [0,2,0,0,0,0|0,0,0]=2 720 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 LT3061 [0,2,0,0,0,0|1,0,0]=3 721 B12R1.4 CC(=O)OC1=CC=C(CBr)C=C1 CJ3037 [0,2,0,0,0,0|0,0,0]=2 722 B12R1.4 CC(C)OC1=CC=C(C=O)C=C1 LQ4143 [0,2,0,0,0,0|1,0,1]=4 723 B12R1.4 CCC1=CC=C(CC(=O)O)C=C1 LT2917 [0,2,0,0,0,0|2,0,0]=4 724 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 LL0352 [0,2,0,0,0,0|2,0,0]=4 725 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 LT2838 [0,2,0,0,0,0|1,0,0]=3 726 B12R1.4 COC1=CC=C(NC(C)=O)C=C1 RT11360 [0,2,0,0,0,0|1,0,0]=3 727 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 XJ4261 [0,2,0,0,0,0|2,0,0]=4 728 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 LQ2904 [0,2,0,0,0,0|2,0,0]=4 729 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 YH27802 [0,2,0,0,0,0|2,0,0]=4 730 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 XJ3973 [0,2,0,0,0,0|2,0,0]=4 731 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 HL4494 [0,2,0,0,0,0|2,0,0]=4 732 B12R1.19 CC(=O)CC1=CC=C(O)C(O)=C1 RT16870 [0,2,0,0,0,0|1,0,0]=3 733 B12R1.19 NC1=CC(CC(=O)O)=CC=C1O RT0058 [0,2,0,0,0,0|2,0,0]=4 734 B12R1.19 O=C(Cl)CC1=CC=C(Cl)C(Cl)=C1 XJ2380 [0,2,0,0,0,0|2,0,0]=4 735 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 YH14884 [0,2,0,0,0,0|2,0,0]=4 736 B12R1.19 O=C(O)CC1=CC(F)=C(F)C=C1 XJ1277 [0,2,0,0,0,0|2,0,0]=4 737 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 HL1829 [0,2,0,0,0,0|2,0,0]=4 738 B12R1.19 O=C(O)CC1=CC=C(Cl)C(Cl)=C1 YH08292 [0,2,0,0,0,0|2,0,0]=4 739 B12R1.19 O=C(O)CC1=CC=C(O)C(Cl)=C1 LQ4793 [0,2,0,0,0,0|2,0,0]=4 740 B12R1.20 CC(=O)C(=O)C1=CC=C(Cl)C=C1 LQ3474 [0,2,0,0,0,0|1,0,0]=3 741 B12R1.20 CC(=O)N(C)C1=CC=C(N)C=C1 LQ0515 [0,2,0,0,0,0|1,0,0]=3 742 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 JZ4316 [0,2,0,0,0,0|2,0,0]=4 743 B12R1.20 CC(C(=O)O)C1=CC=C(O)C=C1 JZ4317 [0,2,0,0,0,0|2,0,0]=4 744 B12R1.20 CC1=CC=C(C(N)C(=O)O)C=C1 LX2120 [0,2,0,0,0,0|2,0,0]=4 745 B12R1.20 CC1=CC=C(C(O)C(=O)O)C=C1 LQ4697 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.20 NC(C(=O)O)C1=CC=C(F)C=C1 LQ3229 [0,2,0,0,0,0|2,0,0]=4 747 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 JZ0195 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Cl)C=C1 YH13184 [0,2,0,0,0,0|2,0,0]=4 749 B12R1.20 N[C@H](C(=O)O)C1=CC=C(F)C=C1 RT5099 [0,2,0,0,0,0|2,0,0]=4 750 B12R1.20 N[C@H](C(=O)O)C1=CC=C(O)C=C1 YH15246 [0,2,0,0,0,0|2,0,0]=4 751 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 YH66539 [0,2,0,0,0,0|2,0,0]=4 752 B12R1.20 O=C(O)C(O)C1=CC=C(Br)C=C1 JZ3059 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 LL0881 [0,2,0,0,0,0|2,0,0]=4 754 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 HL1770 [0,2,0,0,0,0|2,0,0]=4 755 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 JZ4498 [0,2,0,0,0,0|2,0,0]=4 756 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 RT11186 [0,2,0,0,0,0|2,0,0]=4 757 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 YH54312 [0,2,0,0,0,0|2,0,0]=4 758 B12R1.20 [C@@H](N)(C(=O)O)C1=CC=C(O)C=C1 YH54440 [0,2,0,0,0,0|2,0,0]=4 759 B12R1.49 CC1=CC=C(CC(C)C=O)C=C1 XJ5434 [0,2,0,0,0,0|1,0,1]=4 760 B12R1.49 CCC(=O)NC1=CC=C(O)C=C1 RT15818 [0,2,0,0,0,0|1,0,0]=3 761 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 XJ5486 [0,2,0,0,0,0|1,0,0]=3 762 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 YH05226 [0,2,0,0,0,0|1,0,0]=3 763 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 JZ4903 [0,2,0,0,0,0|1,0,0]=3 764 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 YH55824 [0,2,0,0,0,0|2,0,0]=4 765 B12R1.106 CC(C)(C)OC1=CC=C(Cl)C=C1 LQ4159 [0,2,0,0,0,0|1,0,1]=4 766 B12R1.106 CC1=CC=C(OS(=O)(=O)[O-])C=C1 RT13024 [0,2,0,0,0,0|2,0,0]=4 767 B12R1.106 O=P(Cl)(Cl)OC1=CC=C(Cl)C=C1 HL0430 [0,2,0,0,0,0|2,0,0]=4 768 B12R1.233 CC(=O)NC1=C(C)C=C(N)N=C1 YH65720 [0,2,0,0,0,0|2,0,0]=4 769 B12R1.233 CC(=O)NC1=CC=C(Br)C=C1C XJ4799 [0,2,0,0,0,0|1,0,0]=3 770 B12R1.233 CC(=O)NC1=CC=C(C)C=C1Br HL0195 [0,2,0,0,0,0|1,0,0]=3 771 B12R1.233 CC(=O)OC1=CC=C(Br)C=C1Br RT11919 [0,2,0,0,0,0|0,0,0]=2 772 B12R1.233 CC1=C(CC(=O)O)C=CC(F)=C1 YH00198 [0,2,0,0,0,0|2,0,0]=4 773 B12R1.233 NC1=CC=C(CC(=O)O)C(F)=C1 LX3277 [0,2,0,0,0,0|2,0,0]=4 774 B12R1.233 O=C(O)CC1=C(Br)C=C(Cl)C=C1 YH05432 [0,2,0,0,0,0|2,0,0]=4 775 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 YH09917 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.233 O=C(O)CC1=C(F)C=C(Br)C=C1 CJ2121 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.233 O=C(O)CC1=C(F)C=C(Cl)C=C1 LL2528 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.233 O=C(O)CC1=C(F)C=C(O)C=C1 YH65418 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1Cl YH43718 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.233 O=C(O)CC1=CC=C(F)C=C1F LT0123 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.34 C=C(C(=O)OC)C1=CC=CC=C1 YH42419 [0,2,0,0,0,0|1,0,0]=3 782 B12R1.34 COC(=O)C(=O)C1=CC=CC=C1 LT5550 [0,2,0,0,0,0|1,0,0]=3 783 B12R1.34 COC(=O)C(Br)C1=CC=CC=C1 HL2426 [0,2,0,0,0,0|1,0,0]=3 784 B12R1.34 COC(=O)C(Cl)C1=CC=CC=C1 LT6303 [0,2,0,0,0,0|1,0,0]=3 785 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 RT6453 [0,2,0,0,0,0|1,0,0]=3 786 B12R1.34 NNC(=O)C(O)C1=CC=CC=C1 XJ2183 [0,2,0,0,0,0|2,0,0]=4 787 B12R1.34 [C@@H](N)(C(=O)OC)C1=CC=CC=C1 JZ1254 [0,2,0,0,0,0|1,0,0]=3 788 B12R1.124 CC(=O)C(Br)C1=CC=CC=C1F RT10535 [0,2,0,0,0,0|1,0,0]=3 789 B12R1.124 NC(C(=O)O)C1=C(Cl)C=CC=C1 JZ1546 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.124 O=C(O)C(=O)C1=C(Cl)C=CC=C1 YH50289 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.124 O=C(O)C(Br)C1=C(Cl)C=CC=C1 LT3674 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.124 O=C(O)C(O)C1=C(Cl)C=CC=C1 LQ3409 [0,2,0,0,0,0|2,0,0]=4 793 B12R1.225 CC(=O)C(=O)C1=CC=CC(Cl)=C1 RT11574 [0,2,0,0,0,0|1,0,0]=3 794 B12R1.225 CC(=O)C(O)C1=CC=CC(Cl)=C1 RT11240 [0,2,0,0,0,0|1,0,0]=3 795 B12R1.225 NC(C(=O)O)C1=CC=CC(Cl)=C1 YH16021 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.225 O=C(O)C(O)C1=CC=CC(F)=C1 HL1768 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.225 O=C(O)C(O)C1=CC=CC(O)=C1 RT6094 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.253 CC(C)(C(=O)O)C1=CC=CC=C1 JZ4199 [0,2,0,0,0,0|2,0,0]=4 799 B12R1.253 C[C@@](N)(C(=O)O)C1=CC=CC=C1 YH66305 [0,2,0,0,0,0|2,0,0]=4 800 B12R1.253 C[C@](N)(C(=O)O)C1=CC=CC=C1 YH50860 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.478 CC(=O)C(C#N)C1=CC=CC=C1 XJ2725 [0,2,0,0,0,0|1,0,0]=3 802 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 JZ0156 [0,2,0,0,0,0|2,0,0]=4 803 B12R1.478 CCC(C(N)=O)C1=CC=CC=C1 XJ0168 [0,2,0,0,0,0|2,0,0]=4 804 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 HL0018 [0,2,0,0,0,0|2,0,0]=4 805 B12R1.32 CCCC(=O)CC1=CC=CC=C1 RT12903 [0,2,0,0,0,0|1,0,0]=3 806 B12R1.32 CCOC(=O)CC1=CC=NC=C1 RT14075 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.32 CCOC(=O)CC1=NC=CC=C1 XJ2291 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.32 CCOC(=O)NC1=CC=CC=C1 LQ0343 [0,2,0,0,0,0|1,0,0]=3 809 B12R1.50 CNC(=O)OC1=CC(C)=CC=C1 HL0709 [0,2,0,0,0,0|0,0,0]=2 810 B12R1.50 COC(=O)CC1=CC=CC(N)=C1 LL2312 [0,2,0,0,0,0|1,0,0]=3 811 B12R1.50 COC(=O)CC1=NC(C)=CC=C1 CJ2938 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.371 C=CC(=O)NC1=CC=CC=C1[Hg+] RT3262 [0,2,0,0,0,0|1,0,1]=4 813 B12R1.371 CC1=CC=CC=C1NC(=O)CCl YH66095 [0,2,0,0,0,0|1,0,0]=3 814 B12R1.371 COC(=O)NC1=C(C)C=CN=C1 YH66211 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.75 COC1=C(CC(C)=O)C=CC=C1 YH05030 [0,2,0,0,0,0|1,0,0]=3 816 B12R1.75 COC1=CC=CC=C1CC(=O)O HL1217 [0,2,0,0,0,0|2,0,0]=4 817 B12R1.75 COC1=CC=CC=C1NC(C)=O HL1218 [0,2,0,0,0,0|1,0,0]=3 818 B12R1.75 N#CC1=CC=CC=C1CC(=O)O YH42495 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.75 NCC1=CC=CC=C1CC(=O)O YH00265 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.75 O=C(O)CC1=CC=CC=C1CCl YH97821 [0,2,0,0,0,0|2,0,0]=4 821 B12R1.127 CC(=O)NC1=C(F)C=CC(Br)=C1 YH92113 [0,2,0,0,0,0|1,0,0]=3 822 B12R1.127 CC(C)OC1=CC(Cl)=CC=C1N YH98863 [0,2,0,0,0,0|1,0,1]=4 823 B12R1.127 CC1=CC(CC(=O)O)=C(C)C=C1 JZ3784 [0,2,0,0,0,0|2,0,0]=4 824 B12R1.127 O=C(O)CC1=C(F)C=CC(Br)=C1 YH92150 [0,2,0,0,0,0|2,0,0]=4 825 B12R1.127 O=C(O)CC1=C(F)C=CC(F)=C1 LT0151 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.127 O=C(O)CC1=CC(O)=CC=C1O RT10981 [0,2,0,0,0,0|2,0,0]=4 827 B12R1.224 CC(=O)CC1=CC=CC(Cl)=C1Cl HL3097 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.224 CC1=C(C)C(CC(=O)O)=CC=C1 RT11914 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.224 O=C(O)CC1=C(F)C(Cl)=CC=C1 LL2701 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.224 O=C(O)CC1=C(F)C(F)=CC=C1 LT0081 [0,2,0,0,0,0|2,0,0]=4 831 B12R1.224 O=C(O)CC1=CC=CC(O)=C1O RT11747 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.1009 CC(=O)OC1=C(Br)C=CC=C1Br RT11908 [0,2,0,0,0,0|0,0,0]=2 833 B12R1.1009 CC(=O)OC1=C(C)OC=CC1=O LT4122 [0,2,0,0,0,0|1,0,0]=3 834 B12R1.1009 CC1=CC=CC(C)=C1OC(=O)O YH18931 [0,2,0,0,0,0|1,0,0]=3 835 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1F LT5975 [0,2,0,0,0,0|2,0,0]=4 836 B12R1.1009 O=C(O)CC1=C(F)C=CC=C1F LT0187 [0,2,0,0,0,0|2,0,0]=4 837 B12R1.101 O=C(O)CC1=CC(Br)=CC(Br)=C1 HL3770 [0,2,0,0,0,0|2,0,0]=4 838 B12R1.101 O=C(O)CC1=CC(Cl)=CC(Cl)=C1 YH04740 [0,2,0,0,0,0|2,0,0]=4 839 B12R1.101 O=C(O)CC1=CC(F)=CC(Cl)=C1 YH44494 [0,2,0,0,0,0|2,0,0]=4 840 B12R1.101 O=C(O)CC1=CC(O)=CC(O)=C1 YH02500 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.119 CS(=O)(=O)NC1=CC=CC(N)=C1 XJ5258 [0,2,0,0,0,0|2,0,0]=4 842 B12R1.438 COC1=CC(CC(=O)O)=CC=C1 XJ1952 [0,2,0,0,0,0|2,0,0]=4 843 B12R1.438 CSC1=CC(NC(C)=O)=CC=C1 LQ2202 [0,2,0,0,0,0|1,0,0]=3 844 B10R1.66 CC(=O)OCC1=CC=CO1 LT5083 [0,0,1,1,0,0|1,0,1]=4 845 B10R1.66 CC(=O)\C=C/C1=CC=CO1 HL3203 [0,0,1,1,0,0|2,0,0]=4 846 B10R1.66 CC(=O)\C=C\C1=CC=CS1 XJ1445 [0,0,1,1,0,0|2,0,0]=4 847 B10R2.6 C1=CC=C(C2CN2)C=C1 RT8683 [1,0,0,1,0,0|2,0,0]=4 848 B10R2.6 C1=CC=C(C2CO2)C=C1 XJ4585 [1,0,0,1,0,0|2,0,0]=4 849 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 XJ4586 [1,0,0,1,0,0|2,0,0]=4 850 B10R2.7 B1OC2=C(C=CC=C2)O1 LL0610 [1,0,0,1,0,0|1,0,1]=4 851 B10R2.7 C1=CC2=C(C=C1)CNC2 LL0906 [1,0,0,1,0,0|2,0,0]=4 852 B10R2.7 C1=CC2=C(C=C1)CNC2 LX2633 [1,0,0,1,0,0|2,0,0]=4 853 B10R2.7 C1=CC2=C(C=C1)NC=C2 SY0038 [1,0,0,1,0,0|1,0,1]=4 854 B10R2.7 C1=CC2=C(C=C1)SC=C2 LT0724 [1,0,0,1,0,0|0,1,1]=4 855 B10R2.7 C1=CC2=C(C=N1)OC=C2 XJ4535 [1,0,0,1,0,0|1,0,1]=4 856 B10R2.7 C1=CC=C2CC=CC2=C1 LQ0257 [1,0,0,1,0,0|1,0,0]=3 857 B10R2.7 C1=CC=C2NCCC2=C1 JZ1571 [1,0,0,1,0,0|1,0,1]=4 858 B10R2.7 C1=CC=C2OC=NC2=C1 LL0609 [1,0,0,1,0,0|1,0,0]=3 859 B10R2.7 C1=CC=C2OCCC2=C1 YH03385 [1,0,0,1,0,0|0,0,1]=3 860 B10R2.7 C1=CC=C2SC=CC2=C1 JZ3503 [1,0,0,1,0,0|0,1,1]=4 861 B10R2.320 O=C1CC2=CC=CC=C12 YH55957 [1,0,0,1,0,0|1,0,0]=3 862 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 YH05386 [0,0,0,1,0,1|1,0,0]=3 863 B12R2.24 CC1=CC2=CC=CC=C2C=C1 LT6594 [0,0,0,1,0,1|2,0,0]=4 864 B12R2.24 CC1=CC2=CC=CC=C2C=N1 HL0684 [0,0,0,1,0,1|2,0,0]=4 865 B12R2.24 CC1=CC2=CC=CC=C2N=C1 HL0146 [0,0,0,1,0,1|2,0,0]=4 866 B12R2.24 CC1=NC2=CC=CC=C2N=N1 YH11008 [0,0,0,1,0,1|2,0,0]=4 867 B12R2.24 O=C1C=CC2=C(C=CC=C2)N1 JZ0091 [0,0,0,1,0,1|2,0,0]=4 868 B12R2.24 O=C1C=CC2=CC=CC=C2O1 JZ0028 [0,0,0,1,0,1|2,0,0]=4 869 B12R2.24 O=C1C=NC2=CC=CC=C2N1 LT2094 [0,0,0,1,0,1|2,0,0]=4 870 B12R2.24 O=C1CCC2=CC=CN=C2C1 YH18355 [0,0,0,1,0,1|2,0,0]=4 871 B12R2.24 O=C1CCC2=CC=NC=C2C1 YH47858 [0,0,0,1,0,1|2,0,0]=4 872 B12R2.24 O=C1CCC2=NC=CC=C2C1 YH51321 [0,0,0,1,0,1|2,0,0]=4 873 B12R2.24 O=C1N=CC2=CC=CC=C2O1 RT8742 [0,0,0,1,0,1|2,0,0]=4 874 B12R2.2057 C1=CC=C(OC[C@@H]2CO2)C=C1 LT4982 [0,0,0,1,0,1|0,0,2]=4 875 B12R2.3190 O=C(O)C1CC2=CC=CC=C21 YH34665 [0,0,0,1,0,1|2,0,0]=4 876 B12R2.606 CC1=CC2=C(C=C1)NC(C)=C2 JZ4489 [0,1,0,1,0,0|2,0,0]=4 877 B12R2.606 CC1=CC2=C(C=CC(Br)=C2)N1 JZ4380 [0,1,0,1,0,0|2,0,0]=4 878 B12R2.606 CC1=CC2=C(C=CC(F)=C2)N1 LQ0751 [0,1,0,1,0,0|2,0,0]=4 879 B12R2.606 CC1=CC2=C(C=CC(O)=C2)N1 JZ3731 [0,1,0,1,0,0|2,0,0]=4 880 B12R2.606 CC1=CC2=CC(N)=CC=C2N1 LT5845 [0,1,0,1,0,0|2,0,0]=4 881 B12R2.606 CC1=CC=C2OC(C)=NC2=C1 LT0158 [0,1,0,1,0,0|1,0,0]=3 882 B12R2.606 CC1=CC=C2SC(C)=NC2=C1 LQ0265 [0,1,0,1,0,0|1,1,0]=4 883 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 LT3538 [0,1,0,1,0,0|1,0,0]=3 884 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)S1 LT3537 [0,1,0,1,0,0|1,1,0]=4 885 B12R2.606 CC1=NC2=CC=C(I)C=C2N1 YH66367 [0,1,0,1,0,0|2,0,0]=4 886 B12R2.606 ClC1=CC=C2N=C(Cl)OC2=C1 YH57053 [0,1,0,1,0,0|2,0,0]=4 887 B12R2.606 ClC1=CC=C2OC(Cl)=NC2=C1 XJ2501 [0,1,0,1,0,0|2,0,0]=4 888 B12R2.606 NC1=CC=C2CC(=O)NC2=C1 LX2743 [0,1,0,1,0,0|1,0,0]=3 889 B12R2.606 NC1=CC=C2NC(=O)CC2=C1 XJ4617 [0,1,0,1,0,0|1,0,0]=3 890 B12R2.606 NC1=NC2=CC(Br)=CC=C2O1 YH65867 [0,1,0,1,0,0|2,0,0]=4 891 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 XJ6692 [0,1,0,1,0,0|1,0,0]=3 892 B12R2.606 O=C1CC2=C(C=C(F)C=C2)N1 LQ5396 [0,1,0,1,0,0|1,0,0]=3 893 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 CJ2887 [0,1,0,1,0,0|1,0,0]=3 894 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 JZ1167 [0,1,0,1,0,0|1,0,0]=3 895 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 LT3275 [0,1,0,1,0,0|1,0,0]=3 896 B12R2.606 O=C1CC2=CC(Br)=CN=C2N1 LX2841 [0,1,0,1,0,0|2,0,0]=4 897 B12R2.606 O=C1CC2=CC(Cl)=CN=C2N1 YH27372 [0,1,0,1,0,0|2,0,0]=4 898 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 LT6085 [0,1,0,1,0,0|1,0,0]=3 899 B12R2.606 O=C1CC2=CC(O)=CC=C2O1 RT7759 [0,1,0,1,0,0|0,0,0]=2 900 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 LT3654 [0,1,0,1,0,0|1,0,0]=3 901 B12R2.606 O=C1CC2=CC=C(O)C=C2N1 JZ3003 [0,1,0,1,0,0|1,0,0]=3 902 B12R2.606 O=C1CC2=NC=C(F)C=C2N1 YH33240 [0,1,0,1,0,0|2,0,0]=4 903 B12R2.606 O=C1NC2=CC(Cl)=CC=C2S1 LT3533 [0,1,0,1,0,0|1,1,0]=4 904 B12R2.606 O=C1NC2=CC=C(F)C=C2S1 YH11468 [0,1,0,1,0,0|1,1,0]=4 905 B12R2.606 SC1=NC2=CC(Cl)=CC=C2O1 YH47895 [0,1,0,1,0,0|1,1,0]=4 906 B12R2.606 SC1=NC2=CC=C(Cl)C=C2O1 YH47896 [0,1,0,1,0,0|1,1,0]=4 907 B12R2.18 CC1=C2C=COC=C2OC1=O RT14174 [0,1,0,1,0,0|1,0,0]=3 908 B12R2.18 CC1=NC2=CC=CC=C2C1C LT0091 [0,1,0,1,0,0|2,0,0]=4 909 B12R2.18 CC1=[N+](C)C2=CC=CC=C2S1 RT9295 [0,1,0,1,0,0|1,1,0]=4 910 B12R2.18 CC1C(=O)NC2=C1C=CC=N2 RT15552 [0,1,0,1,0,0|2,0,0]=4 911 B12R2.18 CC1C(=O)NC2=CC=CC=C21 LQ1788 [0,1,0,1,0,0|1,0,0]=3 912 B12R2.18 CC1CC2=CC=CC=C2C1=O LQ3991 [0,1,0,1,0,0|1,0,1]=4 913 B12R2.18 CN1C(=O)CC2=CC=CC=C21 YH10239 [0,1,0,1,0,0|1,0,0]=3 914 B12R2.18 O=C1NC2=CC=CC=C2C1=O JZ1575 [0,1,0,1,0,0|1,0,1]=4 915 B12R2.32 BrCC1=NC2=CC=CC=C2S1 YH23298 [0,1,0,1,0,0|1,1,0]=4 916 B12R2.32 CCC1=CC2=C(C=CC=C2)C1 XJ4312 [0,1,0,1,0,0|2,0,0]=4 917 B12R2.32 CCC1=CC2=C(C=CC=C2)N1 LQ2500 [0,1,0,1,0,0|2,0,0]=4 918 B12R2.32 CCC1=NC2=C(C=CC=C2)N1 YH42114 [0,1,0,1,0,0|2,0,0]=4 919 B12R2.32 ICC1CC2=CC=CC=C2O1 RT9864 [0,1,0,1,0,0|1,0,1]=4 920 B12R2.32 NCC1=NC2=CC=CC=C2N1 LQ3005 [0,1,0,1,0,0|2,0,0]=4 921 B12R2.32 O=CC1=CC2=CC=CC=C2S1 JZ2317 [0,1,0,1,0,0|0,1,1]=4 922 B12R2.32 O=CC1CC2=CC=CC=C2O1 LQ2632 [0,1,0,1,0,0|0,0,1]=3 923 B12R2.32 OCC1=CC2=CC=CC=C2N1 YH49153 [0,1,0,1,0,0|2,0,0]=4 924 B12R2.32 ON=C1CC2=CC=CC=C2C1 HL2501 [0,1,0,1,0,0|1,0,1]=4 925 B12R2.202 CC1=CC2=C(C1)C(Br)=CC=C2 CJ2666 [0,1,0,1,0,0|2,0,0]=4 926 B12R2.202 CC1=CC2=C(C=CC=C2Br)C1 CJ2381 [0,1,0,1,0,0|2,0,0]=4 927 B12R2.202 CC1=CC2=C(C=CC=C2C)C1 YH65403 [0,1,0,1,0,0|2,0,0]=4 928 B12R2.202 CC1=CC2=C(C=CC=C2Cl)C1 LX2144 [0,1,0,1,0,0|2,0,0]=4 929 B12R2.202 CC1=CC2=C(C=CC=C2O)N1 LT5867 [0,1,0,1,0,0|2,0,0]=4 930 B12R2.202 CC1=CC2=CC=CC(Br)=C2S1 LT1461 [0,1,0,1,0,0|1,1,0]=4 931 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 RT2017 [0,1,0,1,0,0|1,0,0]=3 932 B12R2.202 O=C1CC2=C(Br)C=CC=C2N1 XJ6693 [0,1,0,1,0,0|1,0,0]=3 933 B12R2.202 O=C1CC2=C(C=CC=C2I)N1 YH65719 [0,1,0,1,0,0|1,0,0]=3 934 B12R2.202 O=C1CC2=C(Cl)C=CC=C2N1 XJ4615 [0,1,0,1,0,0|1,0,0]=3 935 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 HL4002 [0,1,0,1,0,0|1,0,0]=3 936 B12R2.202 O=C1CC2=CC=CC(Cl)=C2N1 JZ5699 [0,1,0,1,0,0|1,0,0]=3 937 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 XJ6214 [0,1,0,1,0,0|1,0,0]=3 938 B8R1.7 CC(=O)C1=CC=CS1 LT4058 [0,0,0,0,2,0|1,0,0]=3 939 B8R1.7 CC(=O)C1=CNC=C1 JZ4350 [0,0,0,0,2,0|1,0,0]=3 940 B8R1.7 CC(=O)C1=CNC=N1 YH10387 [0,0,0,0,2,0|2,0,0]=4 941 B8R1.7 CC(=O)C1=CSC=C1 LT2539 [0,0,0,0,2,0|1,0,0]=3 942 B8R1.7 CC(=O)N1C=CN=C1 YH49188 [0,0,0,0,2,0|2,0,0]=4 943 B8R1.7 O=C(Cl)C1=CC=CO1 LQ0957 [0,0,0,0,2,0|2,0,0]=4 944 B8R1.7 O=C(Cl)C1=CC=CS1 RT9297 [0,0,0,0,2,0|2,0,0]=4 945 B8R1.7 O=C(Cl)C1=COC=C1 YH50424 [0,0,0,0,2,0|2,0,0]=4 946 B8R1.7 O=C(Cl)C1=CSC=C1 YH00609 [0,0,0,0,2,0|2,0,0]=4 947 B8R1.7 O=C(O)C1=CC=CN1 LQ1319 [0,0,0,0,2,0|2,0,0]=4 948 B8R1.7 O=C(O)C1=CC=CO1 LQ4516 [0,0,0,0,2,0|2,0,0]=4 949 B8R1.7 O=C(O)C1=CC=CO1 LT6552 [0,0,0,0,2,0|2,0,0]=4 950 B8R1.7 O=C(O)C1=CSC=C1 LT6654 [0,0,0,0,2,0|2,0,0]=4 951 B8R1.7 O=C(O)C1C=CC=C1 LT5432 [0,0,0,0,2,0|1,0,1]=4 952 B12R1.252 CC(=O)OCCC1=CC=CC=C1 LL0321 [0,0,0,0,0,2|0,0,0]=2 953 B12R1.252 CC(=O)SCCC1=NC=CC=C1 RT10486 [0,0,0,0,0,2|1,1,0]=4 954 B12R1.252 CC(O)COCC1=CC=CC=C1 RT12344 [0,0,0,0,0,2|0,0,2]=4 955 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 RT12731 [0,0,0,0,0,2|0,0,2]=4 956 B12R1.252 NC(=O)N\N=C\C1=CC=CC=C1 RT12380 [0,0,0,0,0,2|2,0,0]=4 957 B12R1.252 O=C(O)CCCC1=CC=CC=C1 RT12403 [0,0,0,0,0,2|2,0,0]=4 958 B12R1.252 O=C(O)CCOC1=CC=CC=C1 LT6842 [0,0,0,0,0,2|1,0,0]=3 959 B12R1.252 O=C(O)CNCC1=CC=CC=C1 YH18010 [0,0,0,0,0,2|2,0,0]=4 960 B12R1.252 O=C(O)COCC1=CC=CC=C1 YH53105 [0,0,0,0,0,2|1,0,0]=3 961 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 LQ2010 [0,0,0,0,0,2|2,0,0]=4