0 B12R1.77 CNC(=O)C1=C(CO)C=CC=C1 BB57-5079 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.77 COC(=O)C1=C(SC)C=CC=C1 BB57-5352 [0,0,0,0,0,0|0,1,0]=1 2 B12R1.77 COC1=C(C(=O)NN)C=CC=C1 BB01-6504 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.77 NNC(=O)C1=CC=CC=C1CO BB57-6670 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.41 CNCC1=C(OC)C=CC=C1 BB58-0562 [1,0,0,0,0,0|1,0,1]=3 5 B11R1.41 COC1=C(CC#N)C=CC=C1 BB57-4962 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.41 COC1=C(CNN)C=CC=C1 BB57-2293 [1,0,0,0,0,0|2,0,1]=4 7 B11R1.41 COC1=CC=CC=C1N=C=O BB01-4427 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.53 CCC1=CC=CC=C1B(O)O BB55-6183 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.53 CNC1=C(C(=O)O)C=CC=C1 BB17-0631 [1,0,0,0,0,0|1,0,0]=2 10 B11R1.53 CSC1=C(C(=O)O)C=CC=N1 BB01-5972 [1,0,0,0,0,0|1,1,0]=3 11 B11R1.53 CSC1=CC=CC=C1C(=O)O BB57-4640 [1,0,0,0,0,0|0,1,0]=2 12 B11R1.222 CC1=C(C(=O)NN)C=CC=C1 BB01-6079 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.222 CNC(=O)C1=C(Br)C=CC=C1 BB57-2486 [1,0,0,0,0,0|2,0,0]=3 14 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 BB57-5866 [1,0,0,0,0,0|1,0,0]=2 15 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 BB17-2141 [1,0,0,0,0,0|1,0,0]=2 16 B11R1.222 COC(=O)C1=C(F)C=CC=C1 BB01-6088 [1,0,0,0,0,0|1,0,0]=2 17 B11R1.222 COC(=O)C1=CC=CN=C1N BB01-7871 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.222 COC(=O)C1=CC=CNC1=O BB20-6587 [1,0,0,0,0,0|1,0,1]=3 19 B11R1.222 COC(=O)C1=NC=CN=C1N BB01-8312 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.222 NNC(=O)C1=C(Cl)C=CC=C1 BB01-3413 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.222 NNC(=O)C1=C(N)C=CC=C1 BB01-6317 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.222 NNC(=O)C1=CC=CC=C1Br BB01-8008 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.222 NNC(=O)C1=CC=CC=C1F BB01-6365 [1,0,0,0,0,0|3,0,0]=4 24 B11R1.222 NNC(=O)C1=CC=CC=C1I BB55-0726 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.222 NNC(=O)C1=CC=CC=C1O BB01-6316 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 BB01-6556 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 BB01-5022 [1,0,0,0,0,0|3,0,0]=4 28 B13R1.382 COC(=O)C1=CC=CC=C1N=C=O BB01-6271 [0,1,0,0,0,0|1,0,1]=3 29 B13R1.382 COC(=O)C1=CC=CC=C1N=C=S BB01-7819 [0,1,0,0,0,0|1,0,1]=3 30 B13R1.464 COC1=CC=CC=C1C(=O)CC#N BB58-0854 [0,1,0,0,0,0|1,0,1]=3 31 B13R1.547 COC(=O)C1=C(C(=O)O)C=CC=C1 BB57-5980 [0,1,0,0,0,0|2,0,0]=3 32 B13R1.547 COC(=O)C1=NC=CC=C1C(=O)O BB01-3752 [0,1,0,0,0,0|3,0,0]=4 33 B13R1.2357 COC(=O)C1=C(O)C=CC=C1OC BB58-5085 [0,1,0,0,0,0|0,0,0]=1 34 B13R2.32 O=C1C2=CC=CC=C2CCC1Br BB01-4417 [0,0,0,1,0,0|3,0,0]=4 35 B13R2.5252 O=C1NCCOC2=CC=CC=C12 BB01-2505 [0,0,0,1,0,0|1,0,0]=2 36 B11R1.59 CCN1N=CC=C1C(=O)OC BB05-4850 [0,0,0,0,1,0|3,0,0]=4 37 B13R1.91 CCC1=C(NC(=O)CBr)C=CC=C1 BB55-5008 [0,0,0,0,0,1|3,0,0]=4 38 B13R1.91 CCC1=C(NC(=O)CCl)C=CC=C1 BB01-5149 [0,0,0,0,0,1|3,0,0]=4 39 B13R1.91 COC1=C(NC(=O)CBr)C=CC=C1 BB55-5012 [0,0,0,0,0,1|2,0,0]=3 40 B13R1.91 COC1=CC=CC=C1CC(=O)NN BB01-5049 [0,0,0,0,0,1|2,0,0]=3 41 B13R1.91 COC1=CC=CC=C1NC(=O)CCl BB01-5150 [0,0,0,0,0,1|2,0,0]=3 42 B13R1.91 CSC1=C(NC(=O)CCl)C=CC=C1 BB55-1892 [0,0,0,0,0,1|2,1,0]=4 43 B10R1.4 CNCC1=CC=CC=C1C BB55-7028 [2,0,0,0,0,0|1,0,1]=4 44 B10R1.4 O\N=C\C1=CC=CC=C1O BB01-2228 [2,0,0,0,0,0|2,0,0]=4 45 B10R1.20 CCC1=C(NC)C=CC=C1 BB01-3189 [2,0,0,0,0,0|1,0,1]=4 46 B10R1.20 CNC1=CC=CC=C1NC BB58-4628 [2,0,0,0,0,0|2,0,0]=4 47 B10R1.20 N#CC1=C(C=O)C=CC=C1 BB57-2099 [2,0,0,0,0,0|2,0,0]=4 48 B10R1.61 CC1=C(B(O)O)C=CC=C1 BB01-0929 [2,0,0,0,0,0|1,0,1]=4 49 B10R1.61 CC1=CN=CC=C1C(=O)O BB58-4632 [2,0,0,0,0,0|1,0,0]=3 50 B10R1.61 NC1=CC=CN=C1C(=O)O BB01-8355 [2,0,0,0,0,0|2,0,0]=4 51 B10R1.61 NC1=NC=CC=C1C(=O)O BB17-0064 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.61 O=C(Cl)C1=CC=CC=C1Cl BB01-5906 [2,0,0,0,0,0|2,0,0]=4 53 B10R1.61 O=C(O)C1=CC=CN=C1S BB01-6184 [2,0,0,0,0,0|1,1,0]=4 54 B10R1.15 COC(=O)C1=CC=CC=N1 BB01-7838 [2,0,0,0,0,0|1,0,0]=3 55 B12R1.121 COC1=CC=CC=C1OCCN BB01-4690 [1,1,0,0,0,0|2,0,0]=4 56 B12R1.46 COC1=C(B(O)O)C=C(F)C=C1 BB01-0932 [1,1,0,0,0,0|1,0,1]=4 57 B12R1.46 COC1=C(C(=O)O)C=C(Br)C=C1 BB57-4580 [1,1,0,0,0,0|0,0,0]=2 58 B12R1.46 COC1=C([N+](=O)[O-])C=C(Br)C=C1 BB01-2836 [1,1,0,0,0,0|1,0,1]=4 59 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=C1 BB01-8306 [1,1,0,0,0,0|0,0,0]=2 60 B12R1.261 CC(=O)C1=CC=CC=C1B(O)O BB01-0061 [1,1,0,0,0,0|2,0,0]=4 61 B12R1.261 CC(=O)C1=CC=CC=C1[N+](=O)[O-] BB20-1425 [1,1,0,0,0,0|2,0,0]=4 62 B12R1.261 O=C(O)C1=C(B(O)O)C=CC=C1 BB01-0945 [1,1,0,0,0,0|2,0,0]=4 63 B12R1.24 CC1=C(O)C(C(=O)NN)=CC=C1 BB55-2088 [1,1,0,0,0,0|2,0,0]=4 64 B12R1.24 COC(=O)C1=C(C)C(N)=CC=C1 BB57-4777 [1,1,0,0,0,0|0,0,0]=2 65 B12R1.24 COC(=O)C1=C(O)C(C)=CC=C1 BB57-4501 [1,1,0,0,0,0|0,0,0]=2 66 B12R1.308 CCNC(=O)C1=C(O)C=CC=C1 BB57-4768 [1,1,0,0,0,0|1,0,0]=3 67 B12R1.308 CCOC(=O)C1=C(C)C=CC=C1 BB01-6224 [1,1,0,0,0,0|0,0,0]=2 68 B12R1.308 CCOC(=O)C1=C(Cl)C=CC=C1 BB01-4699 [1,1,0,0,0,0|1,0,0]=3 69 B12R1.308 CCOC(=O)C1=C(F)C=CC=C1 BB01-6355 [1,1,0,0,0,0|1,0,0]=3 70 B12R1.354 CC1=CC(C(=O)CBr)=C(C)C=C1 BB01-4743 [1,1,0,0,0,0|2,0,0]=4 71 B12R1.354 CC1=CC=C(O)C(C(=O)NN)=C1 BB58-5020 [1,1,0,0,0,0|2,0,0]=4 72 B12R1.354 CCC(=O)C1=C(C)C=CC(C)=C1 BB01-4348 [1,1,0,0,0,0|1,0,0]=3 73 B12R1.354 CNC(=O)C1=CC(Br)=CC=C1Cl BB57-1174 [1,1,0,0,0,0|2,0,0]=4 74 B12R1.354 COC(=O)C1=C(N)C=CC(Br)=C1 BB17-0640 [1,1,0,0,0,0|1,0,0]=3 75 B12R1.354 COC(=O)C1=C(N)C=CC(Cl)=C1 BB17-0629 [1,1,0,0,0,0|1,0,0]=3 76 B12R1.354 COC(=O)C1=C(N)C=CC(I)=C1 BB57-5037 [1,1,0,0,0,0|1,0,0]=3 77 B12R1.354 COC(=O)C1=CC(Br)=CC=C1O BB57-3991 [1,1,0,0,0,0|0,0,0]=2 78 B12R1.354 COC(=O)C1=CC(Br)=NC=C1O BB31-1254 [1,1,0,0,0,0|1,0,0]=3 79 B12R1.354 COC(=O)C1=CC(C)=CC=C1O BB58-5019 [1,1,0,0,0,0|0,0,0]=2 80 B12R1.354 NNC(=O)C1=CC(Cl)=CC=C1O BB55-1942 [1,1,0,0,0,0|2,0,0]=4 81 B12R1.354 NNC(=O)C1=CC(O)=CC=C1O BB55-1927 [1,1,0,0,0,0|2,0,0]=4 82 B12R1.354 O=C(CCl)C1=CC(Cl)=CC=C1O BB57-6552 [1,1,0,0,0,0|2,0,0]=4 83 B12R1.1703 CC1=CC(C)=C(C(=O)CBr)C=C1 BB01-4742 [1,1,0,0,0,0|2,0,0]=4 84 B12R1.1703 CCC(=O)C1=C(C)C=C(C)C=C1 BB01-4148 [1,1,0,0,0,0|1,0,0]=3 85 B12R1.1703 COC(=O)C1=C(C)C=C(Br)C=C1 BB58-0777 [1,1,0,0,0,0|0,0,0]=2 86 B12R1.1703 COC(=O)C1=C(O)C=C(Cl)C=C1 BB58-4553 [1,1,0,0,0,0|0,0,0]=2 87 B12R1.1703 COC(=O)C1=CC=C(N)C=C1O BB20-6632 [1,1,0,0,0,0|0,0,0]=2 88 B12R1.1703 NNC(=O)C1=CC=C(Cl)C=C1O BB55-2089 [1,1,0,0,0,0|2,0,0]=4 89 B14R1.483 CCOC1=CC=CC=C1NC(=O)CCl BB01-5169 [0,1,0,0,0,1|2,0,0]=4 90 B14R1.965 CCC1=C(NC(=O)CCCl)C=CC=C1 BB57-1660 [0,1,0,0,0,1|2,0,0]=4 91 B14R1.965 CCC1=CC=CC=C1NC(=O)CNC BB01-4793 [0,1,0,0,0,1|2,0,0]=4 92 B14R1.965 COC1=C(NC(=O)CCCl)C=CC=C1 BB57-1648 [0,1,0,0,0,1|1,0,0]=3 93 B14R1.965 CSC1=CC=CC=C1NC(=O)CCCl BB55-2887 [0,1,0,0,0,1|1,1,0]=4 94 B14R1.3135 CCC1=C(NC(=O)C(C)Br)C=CC=C1 BB01-5537 [0,1,0,0,0,1|2,0,0]=4 95 B14R1.3135 COC1=CC=CC=C1NC(=O)C(C)Br BB58-4928 [0,1,0,0,0,1|1,0,0]=3 96 B14R1.3279 COC1=C(NC(=O)CBr)C=C(Cl)C=C1 BB55-5048 [0,1,0,0,0,1|2,0,0]=4 97 B14R1.3279 COC1=CC=C(C)C=C1NC(=O)CCl BB01-5214 [0,1,0,0,0,1|2,0,0]=4 98 B14R1.3279 COC1=CC=C(Cl)C=C1NC(=O)CCl BB01-5307 [0,1,0,0,0,1|2,0,0]=4 99 B14R1.2171 COC1=C(OC)C(C(=O)NN)=CC=C1 BB55-0719 [0,2,0,0,0,0|2,0,0]=4 100 B14R1.263 CCOC(=O)C1=C(N=C=O)C=CC=C1 BB01-6511 [0,2,0,0,0,0|1,0,1]=4 101 B14R1.263 CCOC(=O)C1=CC=CC=C1OCC BB01-6227 [0,2,0,0,0,0|0,0,0]=2 102 B14R1.746 COC(=O)C1=CC=CN=C1C(=O)OC BB58-4797 [0,2,0,0,0,0|1,0,0]=3 103 B14R1.939 CNC1=C(C(=O)NCCCl)C=CC=C1 BB57-4988 [0,2,0,0,0,0|2,0,0]=4 104 B14R1.745 COC(=O)C1=C(S(=O)(=O)Cl)C=CC=C1 BB01-5035 [0,2,0,0,0,0|1,1,0]=4 105 B14R1.1126 COC(=O)C1=C([N+](=O)[O-])C=C(N)C=C1 BB57-5977 [0,2,0,0,0,0|2,0,0]=4 106 B14R1.2315 COC1=CC(C(=O)CCl)=C(OC)C=C1 BB58-3697 [0,2,0,0,0,0|2,0,0]=4 107 B14R1.2315 COC1=CC=C(OC)C(C(=O)CBr)=C1 BB01-4907 [0,2,0,0,0,0|2,0,0]=4 108 B14R1.2167 COC1=CC=CC(OC)=C1C(=O)NN BB58-2171 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.367 COC(=O)C1=CC(C)=C(N)C=C1 BB57-7075 [0,0,1,1,0,0|2,0,0]=4 110 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 BB57-1374 [0,0,1,1,0,0|2,0,0]=4 111 B14R2.11689 COC1=CC=CC2=C1C(C=O)=CN2 BB20-1281 [0,1,0,1,0,0|2,0,0]=4 112 B14R2.19306 CC1=C(C=O)C2=C(C=CC=C2)N1C BB01-4593 [0,1,0,1,0,0|2,0,0]=4 113 B14R2.10782 COC(=O)C1=C2C=CNC2=CC=C1 BB01-0935 [0,1,0,1,0,0|1,0,1]=4 114 B14R2.10782 COC(=O)C1=CC=CC2=C1C=NN2 BB01-6761 [0,1,0,1,0,0|2,0,0]=4 115 B10R1.149 COC(=O)C1=C(N)C=CS1 BB01-7784 [1,0,0,0,1,0|2,0,0]=4 116 B10R1.149 COC(=O)C1=C(O)C=CS1 BB05-3066 [1,0,0,0,1,0|1,0,0]=3 117 B10R1.149 COC(=O)C1=CC=NN1C BB05-1631 [1,0,0,0,1,0|2,0,0]=4 118 B14R1.863 COC(=O)COC1=CC=CC=C1C#N BB57-6136 [0,0,0,0,0,2|2,0,0]=4 119 B14R1.863 COC(=O)COC1=CC=CC=C1C=O BB17-1622 [0,0,0,0,0,2|2,0,0]=4 120 B14R1.863 COC(=O)\C=C\C1=C(OC)C=CC=C1 BB58-5126 [0,0,0,0,0,2|0,0,0]=2 121 B14R1.863 COC1=C(CCC(=O)NN)C=CC=C1 BB01-5061 [0,0,0,0,0,2|2,0,0]=4 122 B14R1.863 COC1=C(OCC(=O)NN)C=CC=C1 BB01-5698 [0,0,0,0,0,2|2,0,0]=4