0 B12R1.6 C=CC1=CC=C(S(=O)(=O)Cl)C=C1 CJ3239 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.6 C=CC1=CC=C(S(=O)(=O)[O-])C=C1 XJ4869 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.6 C=CC1=CC=C(S(N)(=O)=O)C=C1 CJ3240 [0,0,0,0,0,0|1,0,1]=2 3 B12R1.6 C=CC1=CC=C([S-](=O)(=O)=O)C=C1 XJ2250 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.6 CC(C)(C)C1=CC=C(CN)C=C1 LT5866 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.6 CCC1=CC=C(S(=O)(=O)Cl)C=C1 LQ3961 [0,0,0,0,0,0|2,0,0]=2 6 B12R1.6 CS(=O)(=O)C1=CC=C(C=O)C=C1 LT5680 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.6 N#CC1=CC=C(S(=O)(=O)Cl)C=N1 RT10499 [0,0,0,0,0,0|2,0,2]=4 8 B12R1.6 N#[N+]C1=CC=C(S(=O)(=O)O)C=C1 RT11895 [0,0,0,0,0,0|2,0,1]=3 9 B12R1.6 NCC1=CC=C(C(F)(F)F)C=C1 XJ2451 [0,0,0,0,0,0|4,0,0]=4 10 B12R1.6 NCC1=CC=C(S(N)(=O)=O)C=C1 LT1255 [0,0,0,0,0,0|0,0,0]=0 11 B12R1.6 NCC1=CC=C(S(N)(=O)=O)C=C1 YH33631 [0,0,0,0,0,0|0,0,0]=0 12 B12R1.6 NNC1=CC=C(S(=O)(=O)O)C=C1 XJ0253 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.6 NNC1=CC=C(S(N)(=O)=O)C=C1 LT6363 [0,0,0,0,0,0|1,0,0]=1 14 B12R1.6 NNC1=CC=C(S(N)(=O)=O)C=C1 SY0175 [0,0,0,0,0,0|1,0,0]=1 15 B12R1.6 NS(=O)(=O)C1=CC=C(CBr)C=C1 YH00168 [0,0,0,0,0,0|1,0,0]=1 16 B12R1.6 O=CC1=CC=C(S(=O)(=O)[O-])C=C1 XJ3970 [0,0,0,0,0,0|2,0,1]=3 17 B12R1.6 O=S(=O)(Cl)C1=CC=C(CBr)C=C1 YH12602 [0,0,0,0,0,0|2,0,0]=2 18 B11R1.3 C#CC1=CC=C(N(=O)=O)C=C1 RT11033 [1,0,0,0,0,0|2,0,1]=4 19 B11R1.3 C=CC1=CC=C(N(=O)=O)C=C1 HL1249 [1,0,0,0,0,0|2,0,1]=4 20 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 LT3069 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 JZ3941 [1,0,0,0,0,0|2,0,1]=4 22 B11R1.3 COC1=CC=C(C(N)=O)C=C1 HL2560 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 LQ0055 [1,0,0,0,0,0|1,0,1]=3 24 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CJ2943 [1,0,0,0,0,0|2,0,1]=4 25 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 JZ0800 [1,0,0,0,0,0|2,0,1]=4 26 B11R1.3 NNC1=CC=C(C(N)=O)C=C1 YH66572 [1,0,0,0,0,0|2,0,0]=3 27 B11R1.3 NNC1=CC=C([N+](=O)[O-])C=C1 JZ4034 [1,0,0,0,0,0|2,0,1]=4 28 B11R1.3 O=C(Cl)C1=CC=C(CCl)C=C1 HL0470 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 RT10589 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 HL4991 [1,0,0,0,0,0|2,0,1]=4 31 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 XJ2357 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.3 O=[N+]([O-])C1=CC=C(CBr)C=C1 LT2901 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.3 O=[N+]([O-])C1=CC=C(CCl)C=C1 JZ0439 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 LT6151 [1,0,0,0,0,0|2,0,1]=4 35 B11R1.19 CC1=CC=C(S(=O)(=O)Cl)C=C1 LT7261 [1,0,0,0,0,0|1,0,0]=2 36 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 HL2904 [1,0,0,0,0,0|1,0,0]=2 37 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 LL0357 [1,0,0,0,0,0|1,0,0]=2 38 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 RT4375 [1,0,0,0,0,0|1,0,0]=2 39 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 RT8618 [1,0,0,0,0,0|1,0,0]=2 40 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 XJ3061 [1,0,0,0,0,0|1,0,0]=2 41 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 YH22643 [1,0,0,0,0,0|1,0,0]=2 42 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 XJ1294 [1,0,0,0,0,0|1,0,0]=2 43 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 XJ6642 [1,0,0,0,0,0|1,0,0]=2 44 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH08874 [1,0,0,0,0,0|1,0,0]=2 45 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH65358 [1,0,0,0,0,0|1,0,0]=2 46 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 YH65582 [1,0,0,0,0,0|1,0,0]=2 47 B11R1.19 CC1=CC=C(S(=O)([O-])=S)C=C1 LQ4605 [1,0,0,0,0,0|1,0,1]=3 48 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 JZ2240 [1,0,0,0,0,0|1,0,0]=2 49 B11R1.19 CC1=NC=C(S(=O)(=O)Cl)C=C1 YH02892 [1,0,0,0,0,0|2,0,0]=3 50 B11R1.19 CC1=NC=C(S(=O)(=O)O)C=C1 YH03032 [1,0,0,0,0,0|2,0,0]=3 51 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 XJ0246 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 HL1799 [1,0,0,0,0,0|2,0,0]=3 53 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 LQ2928 [1,0,0,0,0,0|1,0,0]=2 54 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 JZ4918 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.19 NC1=CC=C(P(=O)(O)O)C=C1 YH05728 [1,0,0,0,0,0|2,0,1]=4 56 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 JZ0129 [1,0,0,0,0,0|1,0,0]=2 57 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=N1 RT10485 [1,0,0,0,0,0|1,0,0]=2 58 B11R1.19 NC1=CC=C([As](=O)(O)O)C=C1 XJ0242 [1,0,0,0,0,0|2,0,1]=4 59 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)C=C1 LT2781 [1,0,0,0,0,0|1,0,0]=2 60 B11R1.19 NS(=O)(=O)C1=CC=C(Cl)N=C1 LX2170 [1,0,0,0,0,0|2,0,0]=3 61 B11R1.19 O=S(=O)(Cl)C1=CC=C(Br)C=C1 XJ0247 [1,0,0,0,0,0|2,0,0]=3 62 B11R1.19 O=S(=O)(Cl)C1=CC=C(Cl)N=C1 LQ3132 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.19 O=S(=O)(Cl)C1=CC=C(F)C=C1 LQ0730 [1,0,0,0,0,0|2,0,0]=3 64 B11R1.19 O=S(=O)(Cl)C1=CC=C(I)C=C1 XJ0249 [1,0,0,0,0,0|2,0,0]=3 65 B11R1.19 O=S(=O)(Cl)C1=CC=C(O)C=C1 YH59504 [1,0,0,0,0,0|2,0,0]=3 66 B11R1.19 O=S(=O)(Cl)C1=CN=C(Br)C=C1 YH92953 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.19 O=S(=O)(O)C1=CC=C(Cl)C=C1 XJ0251 [1,0,0,0,0,0|2,0,0]=3 68 B11R1.19 O=S(=O)(O)C1=CC=C(O)C=C1 XJ0252 [1,0,0,0,0,0|2,0,0]=3 69 B11R1.19 O=S(=O)([K])C1=CC=C(Br)C=C1 LT2920 [1,0,0,0,0,0|2,0,0]=3 70 B11R1.19 O=S(=O)([K])C1=CC=C(Cl)C=C1 LT2921 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.19 O=S(=O)([K])C1=CC=C(I)C=C1 LT2829 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.19 O=S(=O)([O-])C1=CC=C(O)C=C1 LQ4598 [1,0,0,0,0,0|2,0,0]=3 73 B11R1.19 O=S(=O)([O-])C1=CC=C(O)C=C1 LT3819 [1,0,0,0,0,0|2,0,0]=3 74 B13R1.38 COC1=C(N)C=C(S(=O)(=O)O)C=C1 XJ0239 [0,1,0,0,0,0|3,0,0]=4 75 B13R1.96 N#CC1=CC=C(S(=O)(=O)Cl)C(Cl)=C1 HL3958 [0,1,0,0,0,0|1,0,2]=4 76 B13R1.140 NCCC1=CC=C(S(N)(=O)=O)C=C1 LT6883 [0,1,0,0,0,0|0,0,0]=1 77 B13R1.187 COC1=CC=C(S(=O)(=O)NN)C=C1 JZ1811 [0,1,0,0,0,0|2,0,0]=3 78 B13R1.338 CC(=O)C1=CC=C(S(C)(=O)=O)C=C1 LT0027 [0,1,0,0,0,0|2,0,1]=4 79 B13R1.338 CC(C)C1=CC=C(S(=O)(=O)Cl)C=C1 XJ5734 [0,1,0,0,0,0|2,0,0]=3 80 B13R1.338 CC(C)C1=CC=C(S(=O)(=O)[O-])C=C1 LQ4578 [0,1,0,0,0,0|2,0,0]=3 81 B13R1.338 CN(C)C1=CC=C(S(=O)(=O)O)C=C1 YH28741 [0,1,0,0,0,0|3,0,0]=4 82 B13R1.338 CS(=O)(=O)C1=CC=C(B(O)O)C=C1 RT6594 [0,1,0,0,0,0|3,0,0]=4 83 B13R1.338 CS(=O)(=O)C1=CC=C(C(=O)O)C=C1 XJ2579 [0,1,0,0,0,0|2,0,1]=4 84 B13R1.338 NS(=O)(=O)C1=CC=C(B(O)O)C=C1 YH10068 [0,1,0,0,0,0|2,0,0]=3 85 B13R1.338 O=C(O)C1=CC=C(S(=O)(=O)O)C=C1 JZ4028 [0,1,0,0,0,0|2,0,1]=4 86 B13R1.338 O=C(O)C1=CC=C(S(=O)(=O)[O-])C=C1 HL2928 [0,1,0,0,0,0|2,0,1]=4 87 B13R1.338 O=[N+]([O-])C1=CC=C(S(=O)(=O)Cl)C=C1 LT6190 [0,1,0,0,0,0|3,0,0]=4 88 B13R1.338 O=[N+]([O-])C1=CC=C(S(=O)(=O)F)C=C1 RT13053 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.3 CCC1=CC=C(NN)C=C1 LQ5282 [2,0,0,0,0,0|2,0,0]=4 90 B10R1.3 COC1=CC=C(CN)C=C1 LT3064 [2,0,0,0,0,0|1,1,0]=4 91 B10R1.3 N#CC1=CC=C(CN)C=C1 XJ4200 [2,0,0,0,0,0|1,0,1]=4 92 B10R1.3 NCC1=CC=C(CO)C=C1 YH55734 [2,0,0,0,0,0|1,0,1]=4 93 B10R1.3 O=CC1=CC=C(CO)C=C1 YH04958 [2,0,0,0,0,0|2,0,0]=4 94 B10R1.13 CC(=O)C1=CC=C(N)C=C1 LT6854 [2,0,0,0,0,0|2,0,0]=4 95 B10R1.13 CC1=CC=C(C(=O)O)C=C1 JZ0130 [2,0,0,0,0,0|1,0,1]=4 96 B10R1.13 CC1=CC=C(C(C)N)C=C1 JZ0723 [2,0,0,0,0,0|2,0,0]=4 97 B10R1.13 CC1=CC=C(C(N)=O)C=C1 JZ3937 [2,0,0,0,0,0|1,0,0]=3 98 B10R1.13 CC1=CC=C(S(=O)O)C=C1 LL0969 [2,0,0,0,0,0|0,0,2]=4 99 B10R1.13 CC1=CC=C(S(N)=O)C=C1 YH66632 [2,0,0,0,0,0|0,0,1]=3 100 B10R1.13 N=C(N)C1=CC=C(N)C=C1 HL2287 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.13 N=C(N)C1=CC=C(N)C=C1 JZ3229 [2,0,0,0,0,0|2,0,0]=4 102 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 LQ1385 [2,0,0,0,0,0|2,0,0]=4 103 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 JZ3938 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.13 NC(=O)C1=CC=C(F)C=C1 JZ4190 [2,0,0,0,0,0|2,0,0]=4 105 B10R1.13 NC(=O)C1=CC=C(I)C=C1 YH59026 [2,0,0,0,0,0|2,0,0]=4 106 B10R1.13 NC(=O)C1=CC=C(O)C=C1 JZ3939 [2,0,0,0,0,0|2,0,0]=4 107 B10R1.13 NC(=O)C1=NC=C(N)C=C1 YH35056 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.13 NC1=CC=C(C(=O)O)C=C1 RT3381 [2,0,0,0,0,0|1,0,1]=4 109 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 LT3105 [2,0,0,0,0,0|1,0,1]=4 110 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 JZ0055 [2,0,0,0,0,0|1,0,1]=4 111 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 LQ2383 [2,0,0,0,0,0|1,0,0]=3 112 B10R1.28 O=S(=O)(Cl)C1=CC=CC=C1 XJ0224 [2,0,0,0,0,0|1,0,0]=3 113 B10R1.28 O=S(=O)(Cl)C1=CC=CN=C1 YH01299 [2,0,0,0,0,0|2,0,0]=4 114 B10R1.28 O=S(=O)(Cl)C1=CC=CN=C1 YH37912 [2,0,0,0,0,0|2,0,0]=4 115 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 RT13210 [2,0,0,0,0,0|1,0,0]=3 116 B10R1.28 O=S(=O)(O)C1=CC=CN=C1 JZ4027 [2,0,0,0,0,0|2,0,0]=4 117 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 YH06116 [2,0,0,0,0,0|2,0,0]=4 118 B10R1.28 O=S(=O)(O)C1=NC=CC=C1 LT5888 [2,0,0,0,0,0|2,0,0]=4 119 B10R1.28 O=S(=O)([Na])C1=CC=CC=C1 LT4044 [2,0,0,0,0,0|1,0,0]=3 120 B10R1.28 O=S(=O)([Zn])C1=CC=CC=C1 LT4045 [2,0,0,0,0,0|1,0,0]=3 121 B12R1.113 CCOC1=CC=C(C(N)=O)C=C1 JZ5755 [1,1,0,0,0,0|2,0,0]=4 122 B12R1.113 NCCC1=CC=C([N+](=O)[O-])C=C1 JZ0304 [1,1,0,0,0,0|1,0,1]=4 123 B12R1.113 O=N(=O)C1=CC=C(CCO)C=C1 LT3788 [1,1,0,0,0,0|2,0,0]=4 124 B12R1.256 C[C@@H](N)C1=CC=C([N+](=O)[O-])C=C1 RT1728 [1,1,0,0,0,0|1,0,1]=4 125 B12R1.256 C[C@@H](N)C1=CC=C([N+](=O)[O-])C=C1 XJ5797 [1,1,0,0,0,0|1,0,1]=4 126 B12R1.9 C#CS(=O)(=O)C1=CC=C(C)C=C1 LQ3684 [1,1,0,0,0,0|1,0,0]=3 127 B12R1.9 CC1=CC=C(S(=O)(=O)CI)C=C1 SY0109 [1,1,0,0,0,0|1,0,0]=3 128 B12R1.9 CC1=CC=C(S(=O)(=O)NN)C=C1 LT3065 [1,1,0,0,0,0|0,0,0]=2 129 B12R1.9 CCS(=O)(=O)C1=CC=C(Cl)C=C1 LT3073 [1,1,0,0,0,0|2,0,0]=4 130 B12R1.9 COS(=O)(=O)C1=CC=C(C)C=C1 LQ4642 [1,1,0,0,0,0|1,0,0]=3 131 B12R1.9 NC1=CC=C(S(=O)(=O)O[Na])C=C1 HL1939 [1,1,0,0,0,0|1,0,0]=3 132 B12R1.23 CC1=C(C)C=C(S(=O)(=O)[O-])C=C1 HL0748 [1,1,0,0,0,0|1,0,0]=3 133 B12R1.23 CC1=CC=C(S(=O)(=O)Cl)C=C1F HL4873 [1,1,0,0,0,0|1,0,0]=3 134 B12R1.23 CC1=CC=C(S(C)(=O)=O)C=C1Cl LX3236 [1,1,0,0,0,0|1,0,0]=3 135 B12R1.23 CS(=O)(=O)C1=CC=C(O)C(N)=C1 LT3182 [1,1,0,0,0,0|2,0,0]=4 136 B12R1.23 NC1=C(O)C=CC(S(N)(=O)=O)=C1 LT1656 [1,1,0,0,0,0|1,0,0]=3 137 B12R1.23 NS(=O)(=O)C1=CC=C(Cl)C(Cl)=C1 XJ4749 [1,1,0,0,0,0|1,0,0]=3 138 B12R1.23 O=S(=O)(Cl)C1=CC(Cl)=C(F)C=C1 LL1633 [1,1,0,0,0,0|2,0,0]=4 139 B12R1.23 O=S(=O)(Cl)C1=CC=C(Br)C(F)=C1 LL2835 [1,1,0,0,0,0|2,0,0]=4 140 B12R1.23 O=S(=O)(Cl)C1=CC=C(Cl)C(Cl)=C1 XJ0236 [1,1,0,0,0,0|2,0,0]=4 141 B12R1.23 O=S(=O)([O-])C1=CC=C(O)C(I)=C1 RT13122 [1,1,0,0,0,0|2,0,0]=4 142 B12R1.126 O=S(=O)(Cl)C1=C(Cl)C=C(F)C=C1 HL4800 [1,1,0,0,0,0|2,0,0]=4 143 B12R1.126 O=S(=O)(Cl)C1=C(F)C=C(Br)C=C1 LL2637 [1,1,0,0,0,0|2,0,0]=4 144 B12R1.126 O=S(=O)(Cl)C1=C(F)C=C(F)C=C1 LQ3692 [1,1,0,0,0,0|2,0,0]=4 145 B12R1.126 O=S(=O)(Cl)C1=CC=C(F)C=C1Br LL2830 [1,1,0,0,0,0|2,0,0]=4 146 B14R1.215 CNS(=O)(=O)CC1=CC=C(NN)C=C1 RT3753 [0,1,0,0,0,1|1,0,0]=3 147 B14R1.719 COC(=O)C1=CC=C(S(N)(=O)=O)C=C1 RT13142 [0,2,0,0,0,0|1,0,1]=4 148 B14R1.719 CS(=O)(=O)C1=CC=C(C(=O)CBr)C=C1 XJ5495 [0,2,0,0,0,0|2,0,0]=4 149 B14R1.806 CS(=O)(=O)C1=CC=C(CC(=O)O)C=C1 LT1170 [0,2,0,0,0,0|2,0,0]=4 150 B14R1.806 O=C(O)CC1=CC=C(S(=O)(=O)Cl)C=C1 RT19773 [0,2,0,0,0,0|2,0,0]=4 151 B14R1.806 O=S(=O)(Cl)C1=CC=C(OC(F)F)C=C1 LL2826 [0,2,0,0,0,0|2,0,0]=4 152 B14R1.3332 CC(C)(C)C1=CC=C(S(=O)(=O)Cl)C=C1 LT3469 [0,2,0,0,0,0|2,0,0]=4 153 B14R1.3332 O=S(=O)(Cl)C1=CC=C(C(F)(F)F)C=C1 XJ2334 [0,2,0,0,0,0|2,0,0]=4 154 B14R2.3125 O=S(=O)(Cl)C1=CC=C2N=NNC2=C1 RT8710 [0,1,0,1,0,0|2,0,0]=4 155 B10R1.55 NC1=NC=C(S(N)(=O)=O)S1 YH11457 [1,0,0,0,1,0|2,0,0]=4 156 B10R1.55 NS(=O)(=O)C1=CC=C(Br)S1 LQ5269 [1,0,0,0,1,0|2,0,0]=4 157 B10R1.55 NS(=O)(=O)C1=CC=C(Cl)S1 LQ5270 [1,0,0,0,1,0|2,0,0]=4 158 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 YH27802 [1,0,0,0,0,1|1,0,1]=4 159 B12R1.106 CC1=CC=C(OS(=O)(=O)[O-])C=C1 RT13024 [1,0,0,0,0,1|1,0,0]=3 160 B12R1.106 O=S(=O)(Cl)CC1=CC=C(Br)C=C1 LQ5260 [1,0,0,0,0,1|2,0,0]=4 161 B12R1.106 O=S(=O)(Cl)CC1=CC=C(Cl)C=C1 XJ3180 [1,0,0,0,0,1|2,0,0]=4 162 B12R1.436 NS(=O)(=O)C1=CC=CC(CBr)=C1 YH66575 [0,0,0,0,1,1|1,0,0]=3