0 B8R1.1 CC1=CC=C(C=O)S1 BB17-2278 [0,0,0,0,0,0|0,1,0]=1 1 B8R1.1 CC1=CC=C(CN)O1 BB55-3608 [0,0,0,0,0,0|1,0,1]=2 2 B8R1.1 CC1=NC(CCl)=CS1 BB58-0514 [0,0,0,0,0,0|3,0,1]=4 3 B8R1.1 COC1=NC(C)=CS1 BB58-3260 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.1 O=CC1=CC(Br)=CS1 BB17-2286 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.1 O=CC1=CC=C(Br)O1 BB55-3487 [0,0,0,0,0,0|1,0,0]=1 6 B8R1.1 O=CC1=CC=C(Br)S1 BB01-8320 [0,0,0,0,0,0|1,1,0]=2 7 B8R1.1 O=CC1=CC=C(Cl)S1 BB17-2277 [0,0,0,0,0,0|1,1,0]=2 8 B8R1.1 O=CC1=CC=C(I)O1 BB17-1381 [0,0,0,0,0,0|1,0,0]=1 9 B7R1.1 N#CC1=CC=CS1 BB01-2767 [1,0,0,0,0,0|1,1,1]=4 10 B7R1.1 NCC1=CC=CS1 BB01-5532 [1,0,0,0,0,0|1,1,1]=4 11 B7R1.1 O=CC1=CSC=C1 BB01-6172 [1,0,0,0,0,0|2,0,0]=3 12 B7R1.2 CC1=CN=C(N)S1 BB01-6075 [1,0,0,0,0,0|2,1,0]=4 13 B7R1.2 CC1=CNC(C)=N1 BB58-1932 [1,0,0,0,0,0|2,0,1]=4 14 B7R1.2 CC1=COC(N)=N1 BB01-7949 [1,0,0,0,0,0|3,0,0]=4 15 B7R1.2 CC1=CSC(N)=N1 BB01-6255 [1,0,0,0,0,0|3,0,0]=4 16 B7R1.2 CC1=NN(C)C=C1 BB01-5082 [1,0,0,0,0,0|2,0,1]=4 17 B7R1.2 CN1C=CC(N)=N1 BB05-1352 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.7 CC1=CC=C(\C=N/O)O1 BB58-5150 [0,1,0,0,0,0|0,0,1]=2 19 B9R1.7 CNCC1=CC=C(C)S1 BB55-8316 [0,1,0,0,0,0|1,1,1]=4 20 B9R1.21 CCC1=CC=C(C=O)O1 BB01-6282 [0,1,0,0,0,0|0,0,0]=1 21 B9R1.21 CCC1=CC=C(C=O)S1 BB05-0497 [0,1,0,0,0,0|0,1,0]=2 22 B9R1.21 CCN1C=C(C=O)C=N1 BB01-4777 [0,1,0,0,0,0|3,0,0]=4 23 B9R1.21 CCN1C=C(C=O)C=N1 BB05-0136 [0,1,0,0,0,0|3,0,0]=4 24 B9R1.22 CC1=NN(C)C(C=O)=C1 BB57-3046 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.22 CC1=NN(C)C=C1C=O BB01-4724 [0,1,0,0,0,0|3,0,0]=4 26 B9R1.22 O=CC1=C(Cl)N=C(Cl)S1 BB58-0513 [0,1,0,0,0,0|2,1,0]=4 27 B9R1.35 CC(=O)C1=CC=C(Br)S1 BB01-7781 [0,1,0,0,0,0|1,1,0]=3 28 B9R1.35 CC(=O)C1=CC=C(C)O1 BB55-2250 [0,1,0,0,0,0|0,0,0]=1 29 B9R1.35 CC(=O)C1=CC=C(C)S1 BB17-2349 [0,1,0,0,0,0|0,1,0]=2 30 B9R1.35 CC(=O)C1=CC=C(Cl)S1 BB17-2354 [0,1,0,0,0,0|1,1,0]=3 31 B9R1.35 CC1=CC(C(=O)Cl)=NO1 BB55-5177 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.35 CC1=CC(C(=O)O)=NN1 BB01-2577 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.35 CC1=CC(C(=O)O)=NO1 BB01-4962 [0,1,0,0,0,0|3,0,0]=4 34 B9R1.35 CC1=CC(C(=O)O)=NO1 BB05-1141 [0,1,0,0,0,0|3,0,0]=4 35 B9R1.35 CC1=CC=C(B(O)O)O1 BB01-7929 [0,1,0,0,0,0|1,0,1]=3 36 B9R1.35 CC1=CC=C(B(O)O)S1 BB01-7933 [0,1,0,0,0,0|1,1,1]=4 37 B9R1.35 CC1=CC=C(C(=O)Cl)O1 BB58-1944 [0,1,0,0,0,0|0,0,0]=1 38 B9R1.35 CC1=CC=C(C(=O)Cl)S1 BB20-1586 [0,1,0,0,0,0|0,1,0]=2 39 B9R1.35 CC1=CC=C(C(=O)O)O1 BB58-0337 [0,1,0,0,0,0|0,0,0]=1 40 B9R1.35 CC1=CC=C(C(=O)O)S1 BB55-0510 [0,1,0,0,0,0|0,1,0]=2 41 B9R1.35 CC1=NC(C(=N)N)=CS1 BB58-4250 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.35 CC1=NC([N+](=O)[O-])=CN1 BB01-4039 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.35 CC1=NNC(C(=O)O)=C1 BB01-2833 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.35 CN1C=C(C(=O)O)C=N1 BB05-0076 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.35 CN1C=CC(C(=O)O)=N1 BB05-0012 [0,1,0,0,0,0|2,0,0]=3 46 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 BB55-5570 [0,1,0,0,0,0|1,1,0]=3 47 B9R1.35 O=C(O)C1=CC=C(Br)S1 BB55-0508 [0,1,0,0,0,0|1,1,0]=3 48 B9R1.35 O=C(O)C1=CC=C(Cl)S1 BB55-0509 [0,1,0,0,0,0|1,1,0]=3 49 B9R1.132 CC1=CC=C(C#N)N1C BB01-5963 [0,1,0,0,0,0|2,0,1]=4 50 B9R1.1 C=CC1=CC=C(Br)C=C1 BB01-8155 [0,0,0,0,0,1|3,0,0]=4 51 B9R1.1 C=CC1=CC=C(F)C=C1 BB01-8160 [0,0,0,0,0,1|3,0,0]=4 52 B9R1.1 CC1=CC=C(CN)C=C1 BB01-6086 [0,0,0,0,0,1|2,0,1]=4 53 B9R1.1 CC1=CC=C(NN)C=C1 BB17-0837 [0,0,0,0,0,1|3,0,0]=4 54 B9R1.1 CCC1=CC=C(C)N=C1 BB01-6153 [0,0,0,0,0,1|2,0,1]=4 55 B9R1.1 O=CC1=CC=C(Br)N=C1 BB20-1302 [0,0,0,0,0,1|2,0,0]=3 56 B9R1.1 O=CC1=CC=C(I)C=C1 BB17-1814 [0,0,0,0,0,1|2,0,0]=3 57 B9R1.2 CC1=CC(C#N)=CN=C1 BB57-6686 [0,0,0,0,0,1|2,0,1]=4 58 B9R1.2 CC1=CC(NN)=NC=C1 BB58-3618 [0,0,0,0,0,1|3,0,0]=4 59 B9R1.2 CC1=CC=CC(C=O)=N1 BB17-1884 [0,0,0,0,0,1|1,0,0]=2 60 B9R1.2 CC1=CC=CC(CN)=C1 BB57-0207 [0,0,0,0,0,1|2,0,1]=4 61 B9R1.2 CC1=CC=CC(NN)=C1 BB01-7859 [0,0,0,0,0,1|3,0,0]=4 62 B9R1.2 O=CC1=CC(Cl)=CC=C1 BB01-6045 [0,0,0,0,0,1|2,0,0]=3 63 B9R1.2 O=CC1=CC(F)=CC=C1 BB01-6048 [0,0,0,0,0,1|2,0,0]=3 64 B9R1.2 O=CC1=CC(I)=CC=C1 BB17-1813 [0,0,0,0,0,1|2,0,0]=3 65 B6R1.2 CC1=CC=NN1 BB01-4929 [2,0,0,0,0,0|2,0,0]=4 66 B6R1.2 CC1=NC=CN1 BB01-6021 [2,0,0,0,0,0|2,0,0]=4 67 B6R1.2 CN1C=CC=N1 BB01-6294 [2,0,0,0,0,0|2,0,0]=4 68 B8R1.7 CC(=O)C1=CSC=C1 BB57-0215 [1,1,0,0,0,0|2,0,0]=4 69 B8R1.7 CC(N)C1=CC=CO1 BB01-4826 [1,1,0,0,0,0|1,0,1]=4 70 B8R1.7 NC(=O)C1=CC=CS1 BB01-2734 [1,1,0,0,0,0|0,1,0]=3 71 B8R1.7 O=C(O)C1=CNC=N1 BB57-6654 [1,1,0,0,0,0|2,0,0]=4 72 B8R1.7 O=C(O)C1=COC=C1 BB57-0214 [1,1,0,0,0,0|2,0,0]=4 73 B8R1.7 O=C(O)C1=CSC=C1 BB53-1742 [1,1,0,0,0,0|2,0,0]=4 74 B8R1.7 O=C(O)C1=CSC=N1 BB01-8351 [1,1,0,0,0,0|2,0,0]=4 75 B8R1.7 O=C(O)C1=NNC=C1 BB53-1765 [1,1,0,0,0,0|2,0,0]=4 76 B8R1.7 O=[N+]([O-])C1=CC=CS1 BB17-0786 [1,1,0,0,0,0|1,1,0]=4 77 B8R1.8 CNCC1=CC=CO1 BB01-5301 [1,1,0,0,0,0|1,0,1]=4 78 B8R1.8 O\N=C\C1=CC=CS1 BB55-7187 [1,1,0,0,0,0|0,1,1]=4 79 B8R1.11 CC1=C(C=O)SC=C1 BB01-6101 [1,1,0,0,0,0|0,1,0]=3 80 B8R1.11 CC1=C(C=O)SC=N1 BB01-0956 [1,1,0,0,0,0|1,1,0]=4 81 B8R1.11 CN1C=CC=C1C=O BB17-2275 [1,1,0,0,0,0|1,0,0]=3 82 B8R1.11 CN1C=CN=C1C=O BB05-4354 [1,1,0,0,0,0|2,0,0]=4 83 B8R1.11 O=CC1=C(Cl)N=CS1 BB58-0524 [1,1,0,0,0,0|1,1,0]=4 84 B10R1.1 CC1=CC=C(N=S=O)C=C1 BB58-0235 [0,1,0,0,0,1|2,0,0]=4 85 B10R1.3 CSC1=CC=C(C=O)C=C1 BB17-2315 [0,1,0,0,0,1|1,0,0]=3 86 B10R1.3 N#CC1=CC=C(C=O)C=C1 BB01-6198 [0,1,0,0,0,1|1,0,1]=4 87 B10R1.13 CC(=O)C1=CC=C(Br)C=N1 BB01-8350 [0,1,0,0,0,1|2,0,0]=4 88 B10R1.13 CC1=CC=C(C(=O)O)C=N1 BB01-0985 [0,1,0,0,0,1|1,0,0]=3 89 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 BB58-0474 [0,1,0,0,0,1|2,0,0]=4 90 B10R1.13 CC1=CN=C(C(=O)O)C=N1 BB01-8333 [0,1,0,0,0,1|2,0,0]=4 91 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 BB01-2753 [0,1,0,0,0,1|2,0,0]=4 92 B10R1.13 NC(=O)C1=CC=C(Cl)N=C1 BB57-5130 [0,1,0,0,0,1|2,0,0]=4 93 B10R1.13 NC(=O)C1=CC=C(F)C=C1 BB20-1199 [0,1,0,0,0,1|2,0,0]=4 94 B10R1.13 NC1=CN=C(C(=O)O)C=C1 BB20-3104 [0,1,0,0,0,1|2,0,0]=4 95 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 BB01-6056 [0,1,0,0,0,1|2,0,0]=4 96 B10R1.13 O=C(O)C1=CN=C(O)C=C1 BB01-5933 [0,1,0,0,0,1|2,0,0]=4 97 B10R1.25 CC1=CC(O)=C(C=O)C=C1 BB17-2248 [0,1,0,0,0,1|1,0,0]=3 98 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 BB01-6103 [0,1,0,0,0,1|2,0,0]=4 99 B10R1.176 O=CC1=CC(Br)=C(F)C=C1 BB01-6038 [0,1,0,0,0,1|2,0,0]=4 100 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 BB17-1104 [0,1,0,0,0,1|2,0,0]=4 101 B10R1.176 O=CC1=CC(Cl)=C(O)C=C1 BB17-1495 [0,1,0,0,0,1|2,0,0]=4 102 B10R1.176 O=CC1=CC(F)=C(F)C=C1 BB01-6074 [0,1,0,0,0,1|2,0,0]=4 103 B10R1.176 O=CC1=CC(F)=C(O)C=C1 BB01-7858 [0,1,0,0,0,1|2,0,0]=4 104 B10R1.176 O=CC1=CC=C(Cl)C(F)=C1 BB01-6104 [0,1,0,0,0,1|2,0,0]=4 105 B10R1.2 CC1=CC=CC(C=O)=C1O BB17-1049 [0,1,0,0,0,1|1,0,0]=3 106 B10R1.2 O=CC1=C(F)C(Cl)=CC=C1 BB01-6092 [0,1,0,0,0,1|2,0,0]=4 107 B10R1.2 O=CC1=C(F)C(F)=CC=C1 BB01-8362 [0,1,0,0,0,1|2,0,0]=4 108 B10R1.8 O=CC1=CC(Br)=CC(F)=C1 BB01-6300 [0,1,0,0,0,1|2,0,0]=4 109 B10R1.10 CC1=CC(N=C=O)=CC=C1 BB01-4433 [0,1,0,0,0,1|1,0,1]=4 110 B10R1.10 CC1=CC(N=S=O)=CC=C1 BB58-0233 [0,1,0,0,0,1|2,0,0]=4 111 B10R1.30 CC1=CC(C=O)=C(O)C=C1 BB17-2229 [0,1,0,0,0,1|1,0,0]=3 112 B10R1.30 O=CC1=C(F)C=CC(Cl)=C1 BB01-7853 [0,1,0,0,0,1|2,0,0]=4 113 B10R1.30 O=CC1=C(F)C=CC(F)=C1 BB01-8296 [0,1,0,0,0,1|2,0,0]=4 114 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 BB17-1583 [0,1,0,0,0,1|2,0,0]=4 115 B10R1.30 O=CC1=CC(O)=CC=C1Br BB17-2301 [0,1,0,0,0,1|2,0,0]=4 116 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 BB57-1536 [0,1,0,0,0,1|2,0,0]=4 117 B10R1.113 NC(=O)C1=CC(F)=CC=C1 BB17-0563 [0,1,0,0,0,1|2,0,0]=4 118 B10R1.113 NC(=O)C1=CN=CC(Br)=C1 BB17-0501 [0,1,0,0,0,1|2,0,0]=4 119 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 BB57-3761 [0,1,0,0,0,1|2,0,0]=4 120 B10R1.113 NC1=CC(C(=O)O)=CN=C1 BB17-0500 [0,1,0,0,0,1|2,0,0]=4 121 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=C1 BB58-1947 [0,1,0,0,0,1|2,0,0]=4 122 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 BB01-8309 [0,1,0,0,0,1|2,0,0]=4 123 B10R1.113 O=C(O)C1=CC(O)=NC=C1 BB01-7894 [0,1,0,0,0,1|2,0,0]=4 124 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 BB01-8307 [0,1,0,0,0,1|2,0,0]=4 125 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 BB57-3857 [0,1,0,0,0,1|2,0,0]=4 126 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 BB57-2098 [0,1,0,0,0,1|2,0,0]=4 127 B10R1.172 COC1=CC=CC(C=O)=N1 BB01-8348 [0,1,0,0,0,1|1,0,0]=3 128 B10R1.172 N#CC1=CC=CC(C=O)=C1 BB57-2100 [0,1,0,0,0,1|1,0,1]=4 129 B10R1.14 CCC(=O)C1=CC=C(Br)S1 BB55-2283 [0,2,0,0,0,0|1,1,0]=4 130 B10R1.14 CCC(=O)C1=CC=C(Cl)S1 BB55-2282 [0,2,0,0,0,0|1,1,0]=4 131 B10R1.14 COC(=O)C1=CC=C(Br)O1 BB58-0015 [0,2,0,0,0,0|1,0,0]=3 132 B10R1.14 COC(=O)C1=CC=C(C)O1 BB58-0346 [0,2,0,0,0,0|0,0,0]=2 133 B10R1.14 COC(=O)C1=CC=C(C)S1 BB57-2096 [0,2,0,0,0,0|0,1,0]=3 134 B10R1.14 NNC(=O)C1=CC=C(Br)O1 BB55-1918 [0,2,0,0,0,0|1,0,0]=3 135 B10R1.14 O=C(CBr)C1=CC=C(Cl)S1 BB20-0488 [0,2,0,0,0,0|1,1,0]=4 136 B10R1.16 CC1=CC=C(CCC=O)O1 BB01-8332 [0,2,0,0,0,0|0,0,0]=2 137 B10R1.16 CCNCC1=CC=C(C)O1 BB55-8393 [0,2,0,0,0,0|1,0,1]=4 138 B10R1.54 CC1=NC(CC(=O)O)=CS1 BB01-3647 [0,2,0,0,0,0|2,0,0]=4 139 B10R1.54 CC1=NN(CC(=O)O)C=C1 BB05-0867 [0,2,0,0,0,0|2,0,0]=4 140 B10R1.31 CCN1C=CC(C(=O)O)=N1 BB05-0010 [0,2,0,0,0,0|2,0,0]=4 141 B10R1.31 CN(C)C1=CC=C(C=O)S1 BB01-4753 [0,2,0,0,0,0|0,1,0]=3 142 B10R1.31 O=CC1=CC=C([N+](=O)[O-])O1 BB01-8279 [0,2,0,0,0,0|1,0,0]=3 143 B10R1.31 O=CC1=CC=C([N+](=O)[O-])S1 BB17-2237 [0,2,0,0,0,0|1,1,0]=4 144 B10R1.59 CC(=O)C1=C(C)N=C(C)S1 BB58-4768 [0,2,0,0,0,0|1,1,0]=4 145 B10R1.59 CC1=CC(C(=O)Cl)=C(C)O1 BB55-5574 [0,2,0,0,0,0|2,0,0]=4 146 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 BB01-3751 [0,2,0,0,0,0|2,0,0]=4 147 B10R1.59 CC1=CC(C(N)=O)=C(N)S1 BB17-1094 [0,2,0,0,0,0|2,0,0]=4 148 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 BB58-5434 [0,2,0,0,0,0|1,0,0]=3 149 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 BB01-3661 [0,2,0,0,0,0|1,1,0]=4 150 B10R1.59 CN1C=C(Br)C(C(=O)O)=N1 BB05-0017 [0,2,0,0,0,0|2,0,0]=4 151 B10R1.59 CN1C=C(Cl)C(C(=O)O)=N1 BB05-0018 [0,2,0,0,0,0|2,0,0]=4 152 B10R1.58 CC1=CC(C(=O)Cl)=NN1C BB58-4409 [0,2,0,0,0,0|2,0,0]=4 153 B10R1.58 CC1=CC(C(=O)O)=NN1C BB01-4961 [0,2,0,0,0,0|2,0,0]=4 154 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 BB05-1235 [0,2,0,0,0,0|1,1,0]=4 155 B8R1.3 CC1=CC=C(O)N=N1 BB55-6305 [0,0,1,1,0,0|2,0,0]=4 156 B8R1.5 NC1=C(O)C=CC=N1 BB01-4519 [0,0,1,1,0,0|2,0,0]=4