0 B9R1.6 C1=CC=C(B(O)O)C=C1 SY257095 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.6 C=C(Br)C1=CC=CC=C1 SY011143 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.6 C=C(C)C1=NC=CC=C1 SY225338 [0,0,0,0,0,0|1,0,0]=1 3 B9R1.6 CC(=O)C1=CC=NC=C1 SY005519 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 CC(=O)C1=CN=CC=N1 SY004986 [0,0,0,0,0,0|1,0,0]=1 5 B9R1.6 CC(=O)C1=CN=CN=C1 SY005489 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 CC(=O)C1=NC=CC=N1 SY004966 [0,0,0,0,0,0|1,0,0]=1 7 B9R1.6 CC(C)C1=CC=CCC1 SY292102 [0,0,0,0,0,0|2,0,2]=4 8 B9R1.6 CC(N)C1=CC=CN=C1 SY005518 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.6 CC(N)C1=CC=NC=C1 SY005514 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.6 CC(N)C1=NC=CC=C1 SY005425 [0,0,0,0,0,0|1,0,1]=2 11 B9R1.6 CC(N)C1=NC=CC=C1 SY023696 [0,0,0,0,0,0|1,0,1]=2 12 B9R1.6 CC(N)C1=NC=CC=N1 SY270479 [0,0,0,0,0,0|2,0,1]=3 13 B9R1.6 CC(N)C1=NC=CN=C1 SY107192 [0,0,0,0,0,0|2,0,1]=3 14 B9R1.6 CC(O)C1=CC=CN=C1 SY006085 [0,0,0,0,0,0|2,0,2]=4 15 B9R1.6 CC(O)C1=CC=NC=C1 SY006084 [0,0,0,0,0,0|2,0,2]=4 16 B9R1.6 CC(O)C1=NC=CC=C1 SY004070 [0,0,0,0,0,0|0,0,2]=2 17 B9R1.6 C[C@@H](N)C1=CC=CN=C1 SY105422 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.6 C[C@@H](N)C1=CC=NC=C1 SY011547 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.6 C[C@@H](N)C1=CC=NC=C1 SY253760 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.6 C[C@@H](N)C1=NC=CC=C1 SY016895 [0,0,0,0,0,0|1,0,1]=2 21 B9R1.6 C[C@@H](N)C1=NC=CC=N1 SY310791 [0,0,0,0,0,0|2,0,1]=3 22 B9R1.6 C[C@@H](O)C1=CC=CC=C1 SY007833 [0,0,0,0,0,0|1,0,2]=3 23 B9R1.6 C[C@@H](O)C1=CN=CC=C1 SY008212 [0,0,0,0,0,0|2,0,2]=4 24 B9R1.6 C[C@@H](O)C1=NC=CC=C1 SY009224 [0,0,0,0,0,0|0,0,2]=2 25 B9R1.6 C[C@H](N)C1=CC=CN=C1 SY033903 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.6 C[C@H](N)C1=CC=NC=C1 SY011546 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.6 C[C@H](N)C1=NC=CC=C1 SY010698 [0,0,0,0,0,0|1,0,1]=2 28 B9R1.6 C[C@H](O)C1=CN=CC=C1 SY008211 [0,0,0,0,0,0|2,0,2]=4 29 B9R1.6 FC(F)C1=CC=CC=C1 SY024386 [0,0,0,0,0,0|3,0,1]=4 30 B9R1.6 FC(F)C1=NC=CN=C1 SY265906 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.6 N=C(N)C1=CC=CC=C1 SY018319 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.6 N=C(N)C1=CC=CC=C1 SY035738 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.6 N=C(N)C1=CC=NC=C1 SY018012 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.6 N=C(N)C1=CN=CC=C1 SY007646 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.6 N=C(N)C1=NC=CC=C1 SY018011 [0,0,0,0,0,0|2,0,0]=2 36 B9R1.6 N=C(N)C1=NC=CC=N1 SY101920 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.6 NC(=O)C1=CC=CC=C1 SY047098 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.6 NC(=O)C1=CC=NC=C1 SY018471 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.6 NC(=O)C1=CN=CC=C1 SY024804 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.6 NC(=O)C1=NC=CC=C1 SY048638 [0,0,0,0,0,0|1,0,0]=1 41 B9R1.6 NC(=O)C1=NC=CN=C1 SY013550 [0,0,0,0,0,0|2,0,0]=2 42 B9R1.6 NC(=O)C1=NN=CC=C1 SY244413 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.6 NC(=S)C1=CC=CN=C1 SY026920 [0,0,0,0,0,0|3,1,0]=4 44 B9R1.6 NC(=S)C1=CC=NC=C1 SY026921 [0,0,0,0,0,0|3,1,0]=4 45 B9R1.6 NC(=S)C1=NC=CC=C1 SY032222 [0,0,0,0,0,0|1,1,0]=2 46 B9R1.6 O=C(O)C1=CC=CC=C1 SY009192 [0,0,0,0,0,0|2,0,0]=2 47 B9R1.6 O=C(O)C1=CC=CN=N1 SY013220 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.6 O=C(O)C1=CC=NC=C1 SY002246 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.6 O=C(O)C1=CC=NN=C1 SY004681 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.6 O=C(O)C1=CN=CC=C1 SY011111 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.6 O=C(O)C1=CN=CN=C1 SY004100 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.6 O=C(O)C1=NC=CC=C1 SY001169 [0,0,0,0,0,0|1,0,0]=1 53 B9R1.6 O=C(O)C1=NC=CC=N1 SY004101 [0,0,0,0,0,0|2,0,0]=2 54 B9R1.6 O=C(O)C1=NC=CN=C1 SY001166 [0,0,0,0,0,0|2,0,0]=2 55 B9R1.6 O=C(O)C1=NC=NC=C1 SY005548 [0,0,0,0,0,0|2,0,0]=2 56 B9R1.6 O=C([O-])C1=CC=CC=C1 SY010134 [0,0,0,0,0,0|2,0,0]=2 57 B9R1.6 O=C([O-])C1=NC=CC=C1 SY037125 [0,0,0,0,0,0|1,0,0]=1 58 B9R1.6 O=S([O-])C1=CC=NC=C1 SY249777 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.6 OB(O)C1=CC=CC=C1 SY001599 [0,0,0,0,0,0|3,0,1]=4 60 B9R1.6 OB(O)C1=NC=CN=C1 SY102176 [0,0,0,0,0,0|3,0,1]=4 61 B8R1.2 BrCC1=NC=CN=C1 SY024662 [1,0,0,0,0,0|2,0,1]=4 62 B8R1.2 BrCC1=NC=NC=C1 SY048121 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.2 BrCC1=NC=NC=C1 SY285072 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.2 C#CC1=CC=CC=N1 SY019272 [1,0,0,0,0,0|0,0,2]=3 65 B8R1.2 C#CC1=NC=CC=N1 SY110651 [1,0,0,0,0,0|1,0,2]=4 66 B8R1.2 CC[N+]1=CC=CC=C1 SY073856 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.2 CNC1=CC=CN=C1 SY019910 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.2 CNC1=CC=NC=C1 SY007759 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.2 CNC1=NC=CC=N1 SY109149 [1,0,0,0,0,0|2,0,0]=3 70 B8R1.2 COC1=CC=CN=C1 SY024150 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.2 COC1=CC=NC=C1 SY003216 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 COC1=NN=CC=C1 SY047082 [1,0,0,0,0,0|2,0,0]=3 73 B8R1.2 CSC1=NC=CC=C1 SY015557 [1,0,0,0,0,0|1,0,0]=2 74 B8R1.2 ClCC1=NC=CC=N1 SY018344 [1,0,0,0,0,0|2,0,1]=4 75 B8R1.2 ClCC1=NC=CN=C1 SY024416 [1,0,0,0,0,0|2,0,1]=4 76 B8R1.2 N#CC1=CC=CC=C1 SY007899 [1,0,0,0,0,0|2,0,1]=4 77 B8R1.2 N#CC1=NC=NC=C1 SY019449 [1,0,0,0,0,0|2,0,1]=4 78 B8R1.2 N#CC1=NN=CC=C1 SY030491 [1,0,0,0,0,0|2,0,1]=4 79 B8R1.2 NCC1=CC=CC=C1 SY020429 [1,0,0,0,0,0|2,0,1]=4 80 B8R1.2 NCC1=NC=CC=N1 SY019710 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.2 NCC1=NC=CC=N1 SY019711 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.2 NCC1=NC=CN=C1 SY006799 [1,0,0,0,0,0|2,0,1]=4 83 B8R1.2 NCC1=NC=CN=C1 SY020278 [1,0,0,0,0,0|2,0,1]=4 84 B8R1.2 NCC1=NC=NC=C1 SY041990 [1,0,0,0,0,0|2,0,1]=4 85 B8R1.2 NNC1=CC=CC=N1 SY013843 [1,0,0,0,0,0|2,0,0]=3 86 B8R1.2 NNC1=NC=NC=C1 SY185630 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.2 NOC1=CC=CC=C1 SY116626 [1,0,0,0,0,0|3,0,0]=4 88 B8R1.2 O=CC1=CC=NN=C1 SY039203 [1,0,0,0,0,0|3,0,0]=4 89 B8R1.2 O=CC1=CN=CN=C1 SY002007 [1,0,0,0,0,0|3,0,0]=4 90 B8R1.2 O=CC1=NC=CN=C1 SY023908 [1,0,0,0,0,0|1,0,0]=2 91 B8R1.2 O=CC1=NC=NC=C1 SY024569 [1,0,0,0,0,0|1,0,0]=2 92 B8R1.2 O=NC1=CC=CC=C1 SY031930 [1,0,0,0,0,0|2,0,0]=3 93 B8R1.2 OCC1=CC=CC=N1 SY005684 [1,0,0,0,0,0|0,0,2]=3 94 B8R1.2 OCC1=CC=CN=N1 SY013184 [1,0,0,0,0,0|1,0,2]=4 95 B8R1.2 OCC1=NC=CC=N1 SY009461 [1,0,0,0,0,0|1,0,2]=4 96 B8R1.2 OCC1=NC=CN=C1 SY004183 [1,0,0,0,0,0|1,0,2]=4 97 B8R1.2 OCC1=NC=NC=C1 SY037570 [1,0,0,0,0,0|1,0,2]=4 98 B8R1.2 [C-]#[N+]C1=CC=CC=C1 SY243548 [1,0,0,0,0,0|2,0,1]=4 99 B10R1.13 C1=CC(Cl)=CC=C1N(C)C SY246299 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.13 C1=CC(F)=CC=C1N(C)C SY246298 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.13 C=C(C)C1=CC=C(Br)C=C1 SY225322 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.13 C=C(C)C1=CC=C(Cl)C=C1 SY048599 [0,1,0,0,0,0|2,0,0]=3 103 B10R1.13 C=C(C)C1=CC=C(F)C=C1 SY048549 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.13 C=C(C)C1=CC=C(I)C=C1 SY225345 [0,1,0,0,0,0|2,0,0]=3 105 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 SY001458 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 SY007796 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.13 CC(=O)C1=CC=C(C)C=N1 SY005233 [0,1,0,0,0,0|0,0,0]=1 108 B10R1.13 CC(=O)C1=CC=C(C)N=C1 SY063969 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 SY017267 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.13 CC(=O)C1=CC=C(F)N=C1 SY022263 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.13 CC(=O)C1=CC=C(I)C=C1 SY011859 [0,1,0,0,0,0|1,0,0]=2 112 B10R1.13 CC(=O)C1=CC=C(N)C=C1 SY011145 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.13 CC(=O)C1=CC=C(O)C=C1 SY009665 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.13 CC(=O)C1=CC=C(O)N=C1 SY022345 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.13 CC(=O)C1=CN=C(C)N=C1 SY020295 [0,1,0,0,0,0|3,0,0]=4 116 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 SY029151 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 SY028282 [0,1,0,0,0,0|0,0,0]=1 118 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 SY022264 [0,1,0,0,0,0|0,0,0]=1 119 B10R1.13 CC(=O)C1=NC=C(F)C=N1 SY029996 [0,1,0,0,0,0|1,0,0]=2 120 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 SY036325 [0,1,0,0,0,0|1,0,0]=2 121 B10R1.13 CC(C)C1=CC=C(Br)C=C1 SY002711 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.13 CC(Cl)C1=CC=C(F)C=C1 SY029740 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.13 CC(N)C1=CC=C(Br)C=C1 SY020147 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.13 CC(N)C1=CC=C(F)C=C1 SY002633 [0,1,0,0,0,0|2,0,1]=4 125 B10R1.13 CC(N)C1=NC=C(Br)C=C1 SY046404 [0,1,0,0,0,0|1,0,1]=3 126 B10R1.13 CC(O)C1=CC=C(Br)C=C1 SY005047 [0,1,0,0,0,0|1,0,2]=4 127 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 SY005059 [0,1,0,0,0,0|1,0,2]=4 128 B10R1.13 CC(O)C1=CC=C(F)C=C1 SY005049 [0,1,0,0,0,0|1,0,2]=4 129 B10R1.13 CC1=CC=C(C(=O)O)C=C1 SY003713 [0,1,0,0,0,0|2,0,0]=3 130 B10R1.13 CC1=CC=C(C(C)N)C=C1 SY002631 [0,1,0,0,0,0|2,0,1]=4 131 B10R1.13 CC1=CC=C(C(C)O)C=C1 SY005050 [0,1,0,0,0,0|1,0,2]=4 132 B10R1.13 CC1=CC=C(C(N)=O)C=N1 SY023122 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.13 CC1=CC=C(S(=O)O)C=C1 SY113268 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 SY013741 [0,1,0,0,0,0|3,0,0]=4 135 B10R1.13 CC1=CC=C(S(N)=O)C=C1 SY261118 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 SY114833 [0,1,0,0,0,0|3,0,0]=4 137 B10R1.13 CC1=CN=C(C(=O)O)C=N1 SY003142 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.13 CC1=CN=C(C(F)F)C=C1 SY265896 [0,1,0,0,0,0|2,0,1]=4 139 B10R1.13 CC1=CN=C([N+](=O)[O-])C=C1 SY030922 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.13 CC1=NC=C(C(=O)O)C=C1 SY001939 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.13 CC1=NN=C(C(=O)O)C=C1 SY007131 [0,1,0,0,0,0|2,0,0]=3 142 B10R1.13 CN(C)C1=CC=C(Br)C=C1 SY013736 [0,1,0,0,0,0|3,0,0]=4 143 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 SY027100 [0,1,0,0,0,0|3,0,0]=4 144 B10R1.13 CN(C)C1=NC=C(Br)C=C1 SY024322 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.13 CN(C)C1=NC=C(Br)C=N1 SY030999 [0,1,0,0,0,0|3,0,0]=4 146 B10R1.13 CN(C)C1=NC=C(I)C=C1 SY096673 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.13 CN(C)C1=NN=C(Cl)C=C1 SY103939 [0,1,0,0,0,0|3,0,0]=4 148 B10R1.13 CS(=O)C1=CC=C(Br)C=C1 SY253160 [0,1,0,0,0,0|2,0,0]=3 149 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 SY009358 [0,1,0,0,0,0|2,0,1]=4 150 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 SY031357 [0,1,0,0,0,0|2,0,1]=4 151 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 SY007454 [0,1,0,0,0,0|2,0,1]=4 152 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 SY024772 [0,1,0,0,0,0|1,0,2]=4 153 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 SY116631 [0,1,0,0,0,0|1,0,2]=4 154 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 SY009324 [0,1,0,0,0,0|1,0,2]=4 155 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 SY009349 [0,1,0,0,0,0|2,0,1]=4 156 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 SY007451 [0,1,0,0,0,0|2,0,1]=4 157 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 SY024771 [0,1,0,0,0,0|1,0,2]=4 158 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 SY009323 [0,1,0,0,0,0|1,0,2]=4 159 B10R1.13 Cc1ccc(C(C)C)cc1 SY010591 [0,1,0,0,0,0|2,0,1]=4 160 B10R1.13 Cc1ccc(C(C)C)cc1 SY010592 [0,1,0,0,0,0|2,0,1]=4 161 B10R1.13 FC(F)C1=NC=C(Br)C=C1 SY029735 [0,1,0,0,0,0|2,0,1]=4 162 B10R1.13 FC(F)C1=NC=C(Cl)C=C1 SY265898 [0,1,0,0,0,0|2,0,1]=4 163 B10R1.13 FC1=CN=C(C(F)F)C=C1 SY265814 [0,1,0,0,0,0|2,0,1]=4 164 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 SY014927 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 SY014928 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.13 N=C(N)C1=CC=C(F)C=C1 SY032215 [0,1,0,0,0,0|3,0,0]=4 167 B10R1.13 N=C(N)C1=CC=C(N)C=C1 SY017964 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.13 N=C(N)C1=CC=C(O)C=C1 SY018812 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 SY020099 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 SY048513 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.13 NC(=O)C1=CC=C(F)C=C1 SY013152 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.13 NC(=O)C1=CC=C(N)C=C1 SY004554 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 SY047606 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 SY004157 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.13 NC(=O)C1=CN=C(N)C=C1 SY038238 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 SY064801 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 SY075316 [0,1,0,0,0,0|1,0,0]=2 178 B10R1.13 NC(=O)C1=NC=C(Cl)N=C1 SY021612 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.13 NC(=O)C1=NC=C(N)C=N1 SY006741 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.13 NC(=O)C1=NN=C(Cl)C=C1 SY038664 [0,1,0,0,0,0|2,0,0]=3 181 B10R1.13 NC(=O)C1=NN=C(O)C=C1 SY016718 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.13 NC(=S)C1=CC=C(O)C=C1 SY030992 [0,1,0,0,0,0|2,1,0]=4 183 B10R1.13 NC1=CC=C(C(=O)O)C=C1 SY003749 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.13 NC1=CC=C(C(F)F)N=C1 SY212057 [0,1,0,0,0,0|2,0,1]=4 185 B10R1.13 NC1=CN=C(C(=O)O)C=C1 SY004398 [0,1,0,0,0,0|1,0,0]=2 186 B10R1.13 NC1=CN=C(C(=O)O)C=N1 SY002809 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.13 NC1=NC=C(C(=O)O)C=C1 SY004091 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.13 NC1=NN=C(C(=O)O)C=C1 SY003537 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 SY001067 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 SY002326 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.13 O=C(O)C1=CC=C(F)C=C1 SY001592 [0,1,0,0,0,0|2,0,0]=3 192 B10R1.13 O=C(O)C1=CC=C(I)C=C1 SY001356 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.13 O=C(O)C1=CC=[N+]([O-])C=C1 SY112139 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 SY002819 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 SY001709 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 SY018611 [0,1,0,0,0,0|2,0,0]=3 197 B10R1.13 O=C(O)C1=CN=C(F)C=C1 SY004391 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.13 O=C(O)C1=CN=C(I)C=C1 SY310699 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.13 O=C(O)C1=CN=C(O)C=C1 SY004348 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 SY002993 [0,1,0,0,0,0|1,0,0]=2 201 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 SY003477 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.13 O=C(O)C1=NC=C(Br)N=C1 SY018532 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 SY007343 [0,1,0,0,0,0|1,0,0]=2 204 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 SY029327 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.13 O=C(O)C1=NC=C(F)C=C1 SY008116 [0,1,0,0,0,0|1,0,0]=2 206 B10R1.13 O=C(O)C1=NC=C(F)N=C1 SY242638 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SY013072 [0,1,0,0,0,0|1,0,0]=2 208 B10R1.13 O=C(O)C1=NC=C(O)C=C1 SY026499 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 SY181701 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 SY003010 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.13 O=C(O)C1=NN=C(O)C=C1 SY006732 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.13 O=C(O)C1=NN=C(O)C=C1 SY007138 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.13 O=S([O-])C1=CC=C(F)C=C1 SY037436 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=N1 SY007835 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=N1 SY114254 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.13 O=[N+]([O-])C1=NC=C(Br)C=C1 SY004047 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.13 O=[N+]([O-])C1=NC=C(Cl)C=C1 SY013411 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.13 O=[N+]([O-])C1=NC=C(F)C=C1 SY026018 [0,1,0,0,0,0|2,0,0]=3 219 B10R1.13 OB(O)C1=NC=C(Br)C=C1 SY047778 [0,1,0,0,0,0|2,0,1]=4 220 B10R1.13 OB(O)C1=NC=C(Cl)C=C1 SY009369 [0,1,0,0,0,0|2,0,1]=4 221 B10R1.15 C#CC(O)C1=NC=CC=C1 SY045240 [0,1,0,0,0,0|0,0,3]=4 222 B10R1.15 CC(C=O)C1=CC=CC=C1 SY049214 [0,1,0,0,0,0|1,0,1]=3 223 B10R1.15 CCC(=O)C1=CC=CC=N1 SY005362 [0,1,0,0,0,0|0,0,0]=1 224 B10R1.15 CCC(N)C1=NC=CC=C1 SY014377 [0,1,0,0,0,0|1,0,1]=3 225 B10R1.15 CCC(O)C1=CC=CC=C1 SY020321 [0,1,0,0,0,0|1,0,2]=4 226 B10R1.15 CCN(C)C1=CC=CC=C1 SY032004 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.15 CN(N=O)C1=CC=CC=C1 SY052228 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.15 CNC(=O)C1=CC=CC=C1 SY037937 [0,1,0,0,0,0|1,0,0]=2 229 B10R1.15 COC(=O)C1=CN=CC=N1 SY006191 [0,1,0,0,0,0|1,0,0]=2 230 B10R1.15 COC(=O)C1=CN=CN=C1 SY096988 [0,1,0,0,0,0|3,0,0]=4 231 B10R1.15 COC(=O)C1=CN=NC=C1 SY004472 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.15 COC(=O)C1=NC=CC=C1 SY005022 [0,1,0,0,0,0|0,0,0]=1 233 B10R1.15 COC(=O)C1=NC=CC=N1 SY006773 [0,1,0,0,0,0|1,0,0]=2 234 B10R1.15 COC(=O)C1=NC=NC=C1 SY019964 [0,1,0,0,0,0|1,0,0]=2 235 B10R1.15 COS(=O)C1=CC=CC=C1 SY050665 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 SY017826 [0,1,0,0,0,0|2,0,1]=4 237 B10R1.15 C[C@H](C=O)C1=CC=CC=C1 SY036236 [0,1,0,0,0,0|1,0,1]=3 238 B10R1.15 C[C@H](CO)C1=CC=CC=C1 SY036226 [0,1,0,0,0,0|1,0,2]=4 239 B10R1.15 C\C(=N\O)C1=CC=CC=C1 SY057978 [0,1,0,0,0,0|1,0,1]=3 240 B10R1.15 N=C(NN)C1=NC=CC=C1 SY114159 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.15 NC(=NO)C1=CC=CC=C1 SY057185 [0,1,0,0,0,0|2,0,1]=4 242 B10R1.15 NC(=NO)C1=NC=CC=C1 SY073648 [0,1,0,0,0,0|1,0,1]=3 243 B10R1.15 NC(CF)C1=CC=CC=C1 SY045869 [0,1,0,0,0,0|2,0,1]=4 244 B10R1.15 NC(CO)C1=CC=CC=C1 SY002083 [0,1,0,0,0,0|2,0,1]=4 245 B10R1.15 NC(CO)C1=CC=CC=N1 SY007452 [0,1,0,0,0,0|1,0,1]=3 246 B10R1.15 NCC(=O)C1=CC=CC=C1 SY007242 [0,1,0,0,0,0|1,0,0]=2 247 B10R1.15 NCC(O)C1=CC=CC=C1 SY042533 [0,1,0,0,0,0|1,0,2]=4 248 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 SY013940 [0,1,0,0,0,0|1,0,2]=4 249 B10R1.15 NC[C@H](O)C1=CC=CC=C1 SY009089 [0,1,0,0,0,0|1,0,2]=4 250 B10R1.15 NNC(=O)C1=CC=NC=C1 SY010614 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.15 NNC(=O)C1=CN=CC=C1 SY033050 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.15 NNC(=O)C1=NC=CC=C1 SY021575 [0,1,0,0,0,0|1,0,0]=2 253 B10R1.15 NNC(=O)C1=NC=CN=C1 SY025964 [0,1,0,0,0,0|2,0,0]=3 254 B10R1.15 NNC(=O)C1=NC=NC=C1 SY110139 [0,1,0,0,0,0|2,0,0]=3 255 B10R1.15 N[C@@H](CF)C1=CC=CC=C1 SY045870 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 SY003526 [0,1,0,0,0,0|2,0,1]=4 257 B10R1.15 N[C@H](CF)C1=CC=CC=C1 SY045868 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.15 N[C@H](CO)C1=CC=CC=C1 SY001952 [0,1,0,0,0,0|2,0,1]=4 259 B10R1.15 O=C(CBr)C1=CC=CN=C1 SY023116 [0,1,0,0,0,0|2,0,0]=3 260 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY007962 [0,1,0,0,0,0|0,0,0]=1 261 B10R1.15 O=C(CBr)C1=NC=CC=C1 SY226653 [0,1,0,0,0,0|0,0,0]=1 262 B10R1.15 O=C(CCl)C1=CC=NC=C1 SY011676 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.15 O=C(CO)C1=CC=CC=C1 SY014756 [0,1,0,0,0,0|1,0,0]=2 264 B10R1.15 O=C(CO)C1=CC=CN=C1 SY131032 [0,1,0,0,0,0|2,0,0]=3 265 B10R1.15 O=C(CO)C1=CC=NC=C1 SY131033 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.15 O=C(CO)C1=NC=CC=C1 SY131031 [0,1,0,0,0,0|0,0,0]=1 267 B10R1.15 O=CC(=O)C1=CC=CC=C1 SY047494 [0,1,0,0,0,0|1,0,1]=3 268 B10R1.15 O=CC(Br)C1=CC=CC=C1 SY277929 [0,1,0,0,0,0|2,0,1]=4 269 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 SY017542 [0,1,0,0,0,0|1,0,2]=4 270 B10R1.15 OC[C@H](O)C1=CC=CC=C1 SY017543 [0,1,0,0,0,0|1,0,2]=4 271 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 SY101214 [0,1,0,0,0,0|1,0,2]=4 272 B10R1.28 C1=CC=C(S(C)(=O)=O)C=C1 SY246294 [0,1,0,0,0,0|2,0,0]=3 273 B10R1.28 CC(C)(N)C1=CC=CC=C1 SY025865 [0,1,0,0,0,0|2,0,1]=4 274 B10R1.28 CC(C)(N)C1=CC=CC=N1 SY010718 [0,1,0,0,0,0|1,0,1]=3 275 B10R1.28 CC(C)(N)C1=CC=CC=N1 SY012360 [0,1,0,0,0,0|1,0,1]=3 276 B10R1.28 CC(C)(O)C1=CC=CC=C1 SY021550 [0,1,0,0,0,0|1,0,2]=4 277 B10R1.28 CC(C)(O)C1=NC=CC=C1 SY064823 [0,1,0,0,0,0|0,0,2]=3 278 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 SY018221 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.28 CS(=O)(=O)C1=NC=CC=N1 SY039389 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.28 FC(F)(F)C1=NC=CC=C1 SY006004 [0,1,0,0,0,0|2,0,1]=4 281 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 SY042357 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 SY301325 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.61 C=C(C)C1=CC=CC=C1F SY154483 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 SY029921 [0,1,0,0,0,0|2,0,0]=3 285 B10R1.61 CC(=O)C1=C(C)C=CC=N1 SY005230 [0,1,0,0,0,0|0,0,0]=1 286 B10R1.61 CC(=O)C1=C(F)C=NC=C1 SY011662 [0,1,0,0,0,0|2,0,0]=3 287 B10R1.61 CC(=O)C1=C(I)C=CC=C1 SY010667 [0,1,0,0,0,0|1,0,0]=2 288 B10R1.61 CC(=O)C1=CC=CC=C1Br SY002108 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.61 CC(=O)C1=CC=CC=C1C SY002283 [0,1,0,0,0,0|1,0,0]=2 290 B10R1.61 CC(=O)C1=CC=CC=C1N SY001368 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.61 CC(=O)C1=CC=CN=C1C SY108212 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.61 CC(=O)C1=CC=CN=C1Cl SY007174 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.61 CC(=O)C1=CC=CN=C1F SY064682 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.61 CC(=O)C1=CC=CN=C1N SY040774 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.61 CC(=O)C1=NC=CC=C1Br SY029920 [0,1,0,0,0,0|0,0,0]=1 296 B10R1.61 CC(=O)C1=NC=CC=C1F SY022346 [0,1,0,0,0,0|0,0,0]=1 297 B10R1.61 CC(=O)C1=NC=CC=C1N SY240339 [0,1,0,0,0,0|0,0,0]=1 298 B10R1.61 CC(=O)C1=NC=CN=C1C SY027476 [0,1,0,0,0,0|1,0,0]=2 299 B10R1.61 CC(C)C1=C(N)C=CC=C1 SY006015 [0,1,0,0,0,0|2,0,1]=4 300 B10R1.61 CC(C)C1=CC=CC=C1Br SY026917 [0,1,0,0,0,0|2,0,1]=4 301 B10R1.61 CC(C)C1=CC=CC=C1I SY048195 [0,1,0,0,0,0|2,0,1]=4 302 B10R1.61 CC(N)C1=CC=CC=C1Cl SY002632 [0,1,0,0,0,0|2,0,1]=4 303 B10R1.61 CC(N)C1=CC=CC=C1F SY002510 [0,1,0,0,0,0|2,0,1]=4 304 B10R1.61 CC(N)C1=CC=CC=C1F SY096571 [0,1,0,0,0,0|2,0,1]=4 305 B10R1.61 CC(N)C1=CC=CC=C1O SY026082 [0,1,0,0,0,0|2,0,1]=4 306 B10R1.61 CC(O)C1=C(Br)C=CC=C1 SY005052 [0,1,0,0,0,0|1,0,2]=4 307 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 SY005057 [0,1,0,0,0,0|1,0,2]=4 308 B10R1.61 CC(O)C1=C(F)C=CC=C1 SY005055 [0,1,0,0,0,0|1,0,2]=4 309 B10R1.61 CC(O)C1=C(N)C=CC=C1 SY005046 [0,1,0,0,0,0|1,0,2]=4 310 B10R1.61 CC(O)C1=NC=CN=C1Cl SY291852 [0,1,0,0,0,0|1,0,2]=4 311 B10R1.61 CC1=C(C(=N)N)C=CC=C1 SY003976 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.61 CC1=C(C(=O)O)C=CC=C1 SY008811 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.61 CC1=C(C(=O)O)C=CN=C1 SY013083 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.61 CC1=C(C(=O)O)C=NC=C1 SY003372 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.61 CC1=C(C(C)N)C=CC=C1 SY006058 [0,1,0,0,0,0|2,0,1]=4 316 B10R1.61 CC1=C(C(C)O)C=CC=C1 SY005056 [0,1,0,0,0,0|1,0,2]=4 317 B10R1.61 CC1=CC=CC=C1C(C)N SY002511 [0,1,0,0,0,0|2,0,1]=4 318 B10R1.61 CC1=CC=CN=C1C(=O)O SY005196 [0,1,0,0,0,0|1,0,0]=2 319 B10R1.61 CC1=CC=CN=C1C(F)F SY265782 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.61 CC1=CN=CN=C1C(=O)O SY114951 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.61 CC1=NC=CC=C1C(=O)O SY007014 [0,1,0,0,0,0|3,0,0]=4 322 B10R1.61 CC1=NC=CN=C1C(=O)O SY006147 [0,1,0,0,0,0|2,0,0]=3 323 B10R1.61 CN(C)C1=CC=CC=C1Br SY024924 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.61 CN(C)C1=CC=CC=C1N SY032003 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.61 C[C@@H](O)C1=CC=CC=C1Br SY024770 [0,1,0,0,0,0|1,0,2]=4 326 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl SY024788 [0,1,0,0,0,0|1,0,2]=4 327 B10R1.61 C[C@@H](O)C1=CC=CC=C1F SY040023 [0,1,0,0,0,0|1,0,2]=4 328 B10R1.61 C[C@H](N)C1=CC=CC=C1F SY008657 [0,1,0,0,0,0|2,0,1]=4 329 B10R1.61 C[C@H](N)C1=CC=CC=C1F SY224243 [0,1,0,0,0,0|2,0,1]=4 330 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl SY024787 [0,1,0,0,0,0|1,0,2]=4 331 B10R1.61 C[C@H](O)C1=NC=CC=C1Br SY289336 [0,1,0,0,0,0|0,0,2]=3 332 B10R1.61 FC(F)C1=NC=CC=C1Cl SY265781 [0,1,0,0,0,0|2,0,1]=4 333 B10R1.61 FC1=CC=CN=C1C(F)F SY265894 [0,1,0,0,0,0|2,0,1]=4 334 B10R1.61 N=C(N)C1=CC=CC=C1Br SY028769 [0,1,0,0,0,0|3,0,0]=4 335 B10R1.61 N=C(N)C1=CC=CC=C1Cl SY003975 [0,1,0,0,0,0|3,0,0]=4 336 B10R1.61 N=C(N)C1=CC=CC=C1F SY109705 [0,1,0,0,0,0|3,0,0]=4 337 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 SY013017 [0,1,0,0,0,0|3,0,0]=4 338 B10R1.61 NC(=O)C1=C(Cl)N=CC=C1 SY006428 [0,1,0,0,0,0|3,0,0]=4 339 B10R1.61 NC(=O)C1=C(I)C=CC=C1 SY013782 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.61 NC(=O)C1=C(N)N=CC=C1 SY007086 [0,1,0,0,0,0|3,0,0]=4 341 B10R1.61 NC(=O)C1=CC=CC=C1Br SY026521 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.61 NC(=O)C1=CC=CC=C1F SY023168 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.61 NC(=O)C1=CC=CC=C1N SY001144 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.61 NC(=O)C1=CC=NC=C1N SY024370 [0,1,0,0,0,0|3,0,0]=4 345 B10R1.61 NC(=O)C1=NC=CN=C1Cl SY021613 [0,1,0,0,0,0|2,0,0]=3 346 B10R1.61 NC(=O)C1=NC=CN=C1O SY017450 [0,1,0,0,0,0|2,0,0]=3 347 B10R1.61 NC1=C(C(=O)O)C=CC=N1 SY001124 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.61 NC1=C(C(=O)O)N=CC=N1 SY005247 [0,1,0,0,0,0|2,0,0]=3 349 B10R1.61 NC1=C(C(=O)O)N=NC=C1 SY008428 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.61 NC1=CC=CN=C1C(=O)O SY005540 [0,1,0,0,0,0|1,0,0]=2 351 B10R1.61 NC1=CC=CN=C1[N+](=O)[O-] SY003847 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.61 NC1=CC=NC=C1C(=O)O SY005556 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.61 NC1=CN=CC=C1C(=O)O SY003330 [0,1,0,0,0,0|3,0,0]=4 354 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl SY001379 [0,1,0,0,0,0|3,0,0]=4 355 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 SY003796 [0,1,0,0,0,0|2,0,0]=3 356 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 SY007802 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 SY007643 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 SY001758 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.61 O=C(O)C1=C(F)C=NC=C1 SY021120 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.61 O=C(O)C1=C(F)N=CC=C1 SY004382 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.61 O=C(O)C1=C(O)C=CC=N1 SY017848 [0,1,0,0,0,0|1,0,0]=2 362 B10R1.61 O=C(O)C1=C(O)C=CN=C1 SY013019 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.61 O=C(O)C1=C(O)N=CC=C1 SY003611 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.61 O=C(O)C1=C(S)C=CC=C1 SY007814 [0,1,0,0,0,0|2,0,0]=3 365 B10R1.61 O=C(O)C1=C(S)N=CC=C1 SY018289 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.61 O=C(O)C1=CC=CC=C1F SY001376 [0,1,0,0,0,0|2,0,0]=3 367 B10R1.61 O=C(O)C1=CC=CC=C1I SY001344 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.61 O=C(O)C1=CC=CN=C1Br SY013308 [0,1,0,0,0,0|3,0,0]=4 369 B10R1.61 O=C(O)C1=CC=NC=C1O SY007397 [0,1,0,0,0,0|3,0,0]=4 370 B10R1.61 O=C(O)C1=CN=CC=C1Cl SY006770 [0,1,0,0,0,0|3,0,0]=4 371 B10R1.61 O=C(O)C1=NC=CC=C1Br SY004667 [0,1,0,0,0,0|1,0,0]=2 372 B10R1.61 O=C(O)C1=NC=CC=C1Cl SY007503 [0,1,0,0,0,0|1,0,0]=2 373 B10R1.61 O=C(O)C1=NC=CC=C1F SY013087 [0,1,0,0,0,0|1,0,0]=2 374 B10R1.61 O=C(O)C1=NC=CC=C1F SY016097 [0,1,0,0,0,0|1,0,0]=2 375 B10R1.61 O=C(O)C1=NC=CN=C1Br SY021901 [0,1,0,0,0,0|2,0,0]=3 376 B10R1.61 O=C(O)C1=NC=CN=C1Cl SY013464 [0,1,0,0,0,0|2,0,0]=3 377 B10R1.61 O=C(O)C1=NC=CN=C1I SY023922 [0,1,0,0,0,0|2,0,0]=3 378 B10R1.61 O=C(O)C1=NC=CN=C1O SY017462 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.61 O=C([O-])C1=CC=CC=C1O SY013574 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.61 O=[N+]([O-])C1=NC=CC=C1Br SY003008 [0,1,0,0,0,0|2,0,0]=3 381 B10R1.61 O=[N+]([O-])C1=NC=CC=C1F SY025327 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.61 O=[N+]([O-])C1=NC=CC=C1I SY031487 [0,1,0,0,0,0|2,0,0]=3 383 B10R1.61 O=[N+]([O-])C1=NC=CC=C1O SY002996 [0,1,0,0,0,0|2,0,0]=3 384 B10R1.113 C=C(C)C1=CC(C)=CC=C1 SY225337 [0,1,0,0,0,0|2,0,0]=3 385 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 SY225323 [0,1,0,0,0,0|2,0,0]=3 386 B10R1.113 C=C(C)C1=CC=CC(Cl)=C1 SY225324 [0,1,0,0,0,0|2,0,0]=3 387 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 SY020986 [0,1,0,0,0,0|2,0,0]=3 388 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 SY117232 [0,1,0,0,0,0|2,0,0]=3 389 B10R1.113 CC(=O)C1=CC(C)=CC=N1 SY005272 [0,1,0,0,0,0|0,0,0]=1 390 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 SY007670 [0,1,0,0,0,0|2,0,0]=3 391 B10R1.113 CC(=O)C1=CC(F)=CN=C1 SY105167 [0,1,0,0,0,0|2,0,0]=3 392 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 SY001472 [0,1,0,0,0,0|1,0,0]=2 393 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 SY005798 [0,1,0,0,0,0|0,0,0]=1 394 B10R1.113 CC(=O)C1=CC=CC(C)=N1 SY015030 [0,1,0,0,0,0|0,0,0]=1 395 B10R1.113 CC(=O)C1=CC=CC(F)=C1 SY007259 [0,1,0,0,0,0|1,0,0]=2 396 B10R1.113 CC(=O)C1=CC=CC(I)=C1 SY109511 [0,1,0,0,0,0|1,0,0]=2 397 B10R1.113 CC(=O)C1=CC=CC(N)=C1 SY001475 [0,1,0,0,0,0|1,0,0]=2 398 B10R1.113 CC(=O)C1=CC=CC(O)=C1 SY004849 [0,1,0,0,0,0|1,0,0]=2 399 B10R1.113 CC(=O)C1=NC(Cl)=NC=C1 SY114455 [0,1,0,0,0,0|1,0,0]=2 400 B10R1.113 CC(=O)C1=NC(N)=NC=C1 SY112748 [0,1,0,0,0,0|1,0,0]=2 401 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 SY043151 [0,1,0,0,0,0|0,0,0]=1 402 B10R1.113 CC(C)C1=CC=CC(Br)=N1 SY006302 [0,1,0,0,0,0|1,0,1]=3 403 B10R1.113 CC(C)C1=CC=CC(N)=C1 SY005822 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.113 CC(C)C1=CC=CC(N)=N1 SY006009 [0,1,0,0,0,0|1,0,1]=3 405 B10R1.113 CC(C)C1=NC(Cl)=NC=C1 SY023339 [0,1,0,0,0,0|2,0,1]=4 406 B10R1.113 CC(N)C1=CC=CC(Br)=C1 SY023019 [0,1,0,0,0,0|2,0,1]=4 407 B10R1.113 CC(N)C1=CC=CC(Br)=C1 SY037546 [0,1,0,0,0,0|2,0,1]=4 408 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 SY027082 [0,1,0,0,0,0|2,0,1]=4 409 B10R1.113 CC(O)C1=CC=CC(Br)=C1 SY005048 [0,1,0,0,0,0|1,0,2]=4 410 B10R1.113 CC(O)C1=CC=CC(Cl)=C1 SY005051 [0,1,0,0,0,0|1,0,2]=4 411 B10R1.113 CC(O)C1=CC=CC(O)=C1 SY005071 [0,1,0,0,0,0|1,0,2]=4 412 B10R1.113 CC(O)C1=NC(Cl)=NC=C1 SY270921 [0,1,0,0,0,0|1,0,2]=4 413 B10R1.113 CC(O)C1=NC=CC(Br)=C1 SY037352 [0,1,0,0,0,0|0,0,2]=3 414 B10R1.113 CC1=CC(C(=O)O)=CN=C1 SY004561 [0,1,0,0,0,0|3,0,0]=4 415 B10R1.113 CC1=CC(C(F)F)=NC=C1 SY265897 [0,1,0,0,0,0|2,0,1]=4 416 B10R1.113 CC1=CC=CC(C(=O)O)=N1 SY004175 [0,1,0,0,0,0|1,0,0]=2 417 B10R1.113 CC1=CC=CC(C(F)F)=N1 SY265779 [0,1,0,0,0,0|2,0,1]=4 418 B10R1.113 CC1=CN=CC(C(=O)O)=N1 SY017452 [0,1,0,0,0,0|2,0,0]=3 419 B10R1.113 CC1=NC=CC(C(=O)O)=C1 SY013049 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.113 CN(C)C1=CC(O)=CC=C1 SY003817 [0,1,0,0,0,0|3,0,0]=4 421 B10R1.113 CN(C)C1=CC=CC(Br)=C1 SY101188 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.113 CN(C)C1=CC=CC(I)=C1 SY290789 [0,1,0,0,0,0|3,0,0]=4 423 B10R1.113 CN(C)C1=CC=CC(N)=C1 SY010751 [0,1,0,0,0,0|3,0,0]=4 424 B10R1.113 CN(C)C1=CC=CC(N)=C1 SY044787 [0,1,0,0,0,0|3,0,0]=4 425 B10R1.113 CN(C)C1=NC(Br)=CN=C1 SY288875 [0,1,0,0,0,0|3,0,0]=4 426 B10R1.113 CN(C)C1=NC=CC(Br)=C1 SY037279 [0,1,0,0,0,0|2,0,0]=3 427 B10R1.113 C[C@@H](N)C1=CC(F)=CC=C1 SY008725 [0,1,0,0,0,0|2,0,1]=4 428 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 SY110609 [0,1,0,0,0,0|2,0,1]=4 429 B10R1.113 C[C@@H](N)C1=CC=CC(Cl)=C1 SY239977 [0,1,0,0,0,0|2,0,1]=4 430 B10R1.113 C[C@@H](O)C1=CC=CC(Br)=C1 SY107032 [0,1,0,0,0,0|1,0,2]=4 431 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 SY029286 [0,1,0,0,0,0|2,0,1]=4 432 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 SY029288 [0,1,0,0,0,0|2,0,1]=4 433 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=C1 SY258403 [0,1,0,0,0,0|2,0,1]=4 434 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 SY028768 [0,1,0,0,0,0|3,0,0]=4 435 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 SY285003 [0,1,0,0,0,0|3,0,0]=4 436 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 SY106891 [0,1,0,0,0,0|3,0,0]=4 437 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 SY001775 [0,1,0,0,0,0|3,0,0]=4 438 B10R1.113 NC(=O)C1=CC(F)=CC=C1 SY016219 [0,1,0,0,0,0|2,0,0]=3 439 B10R1.113 NC(=O)C1=CC(F)=CC=N1 SY007027 [0,1,0,0,0,0|1,0,0]=2 440 B10R1.113 NC(=O)C1=CC(N)=NC=C1 SY017536 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.113 NC(=O)C1=CC(O)=CC=C1 SY004825 [0,1,0,0,0,0|2,0,0]=3 442 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 SY020170 [0,1,0,0,0,0|2,0,0]=3 443 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 SY030316 [0,1,0,0,0,0|2,0,0]=3 444 B10R1.113 NC(=O)C1=CC=CC(I)=C1 SY041741 [0,1,0,0,0,0|2,0,0]=3 445 B10R1.113 NC(=O)C1=CC=CC(N)=C1 SY012693 [0,1,0,0,0,0|2,0,0]=3 446 B10R1.113 NC(=O)C1=CN=CC(F)=C1 SY008440 [0,1,0,0,0,0|3,0,0]=4 447 B10R1.113 NC(=O)C1=CN=CC(N)=C1 SY019492 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.113 NC(=O)C1=NC(Cl)=CN=C1 SY023917 [0,1,0,0,0,0|2,0,0]=3 449 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 SY007414 [0,1,0,0,0,0|1,0,0]=2 450 B10R1.113 NC(=O)C1=NC=CC(N)=C1 SY105172 [0,1,0,0,0,0|1,0,0]=2 451 B10R1.113 NC(=O)C1=NC=NC(O)=C1 SY247994 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.113 NC(=S)C1=CC=CC(Cl)=C1 SY003195 [0,1,0,0,0,0|2,1,0]=4 453 B10R1.113 NC1=CC(C(=O)O)=CC=C1 SY001800 [0,1,0,0,0,0|2,0,0]=3 454 B10R1.113 NC1=CC(C(=O)O)=NC=C1 SY009458 [0,1,0,0,0,0|1,0,0]=2 455 B10R1.113 NC1=CC(C(=O)O)=NC=C1 SY023428 [0,1,0,0,0,0|1,0,0]=2 456 B10R1.113 NC1=CC(C(=O)O)=NC=C1 SY026378 [0,1,0,0,0,0|1,0,0]=2 457 B10R1.113 NC1=CC(C(F)F)=NC=C1 SY263208 [0,1,0,0,0,0|2,0,1]=4 458 B10R1.113 NC1=CC([N+](=O)[O-])=NC=C1 SY026074 [0,1,0,0,0,0|2,0,0]=3 459 B10R1.113 NC1=CC=CC(C(=O)O)=N1 SY005202 [0,1,0,0,0,0|1,0,0]=2 460 B10R1.113 NC1=CN=CC(C(=O)O)=N1 SY017453 [0,1,0,0,0,0|2,0,0]=3 461 B10R1.113 NC1=NC([N+](=O)[O-])=CC=C1 SY047067 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.113 NC1=NC=CC(C(=O)O)=N1 SY021660 [0,1,0,0,0,0|2,0,0]=3 463 B10R1.113 O=C(Cl)C1=CC=CC(F)=C1 SY006091 [0,1,0,0,0,0|2,0,0]=3 464 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 SY017174 [0,1,0,0,0,0|3,0,0]=4 465 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 SY013173 [0,1,0,0,0,0|3,0,0]=4 466 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 SY003272 [0,1,0,0,0,0|3,0,0]=4 467 B10R1.113 O=C(O)C1=CC(F)=CC=N1 SY009049 [0,1,0,0,0,0|1,0,0]=2 468 B10R1.113 O=C(O)C1=CC(F)=NC=C1 SY024079 [0,1,0,0,0,0|3,0,0]=4 469 B10R1.113 O=C(O)C1=CC(I)=NC=C1 SY275245 [0,1,0,0,0,0|3,0,0]=4 470 B10R1.113 O=C(O)C1=CC(O)=NC=C1 SY007554 [0,1,0,0,0,0|3,0,0]=4 471 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 SY001482 [0,1,0,0,0,0|2,0,0]=3 472 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 SY001122 [0,1,0,0,0,0|2,0,0]=3 473 B10R1.113 O=C(O)C1=CC=CC(F)=C1 SY002150 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.113 O=C(O)C1=CC=CC(F)=N1 SY016861 [0,1,0,0,0,0|1,0,0]=2 475 B10R1.113 O=C(O)C1=CC=CC(I)=C1 SY001406 [0,1,0,0,0,0|2,0,0]=3 476 B10R1.113 O=C(O)C1=CC=C[N+]([O-])=C1 SY112140 [0,1,0,0,0,0|3,0,0]=4 477 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 SY001554 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.113 O=C(O)C1=CN=CC(F)=C1 SY005275 [0,1,0,0,0,0|3,0,0]=4 479 B10R1.113 O=C(O)C1=CN=CC(O)=C1 SY003082 [0,1,0,0,0,0|3,0,0]=4 480 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 SY004392 [0,1,0,0,0,0|1,0,0]=2 481 B10R1.113 O=C(O)C1=NC(Br)=CN=C1 SY059121 [0,1,0,0,0,0|2,0,0]=3 482 B10R1.113 O=C(O)C1=NC(Br)=NC=C1 SY121371 [0,1,0,0,0,0|2,0,0]=3 483 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 SY007552 [0,1,0,0,0,0|1,0,0]=2 484 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 SY017455 [0,1,0,0,0,0|2,0,0]=3 485 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 SY009367 [0,1,0,0,0,0|2,0,0]=3 486 B10R1.113 O=C(O)C1=NC(O)=CC=C1 SY003534 [0,1,0,0,0,0|1,0,0]=2 487 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 SY002817 [0,1,0,0,0,0|1,0,0]=2 488 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 SY003269 [0,1,0,0,0,0|1,0,0]=2 489 B10R1.113 O=C(O)C1=NC=CC(I)=C1 SY031004 [0,1,0,0,0,0|1,0,0]=2 490 B10R1.113 O=C(O)C1=NC=CC(O)=C1 SY011044 [0,1,0,0,0,0|1,0,0]=2 491 B10R1.113 O=C(O)C1=NC=CC(O)=C1 SY013177 [0,1,0,0,0,0|1,0,0]=2 492 B10R1.113 O=C(O)C1=NC=NC(O)=C1 SY006725 [0,1,0,0,0,0|2,0,0]=3 493 B10R1.113 O=C1N=C(C(=O)O)C=CN1 SY022754 [0,1,0,0,0,0|2,0,0]=3 494 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=N1 SY074130 [0,1,0,0,0,0|2,0,0]=3 495 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 SY031835 [0,1,0,0,0,0|2,0,0]=3 496 B10R1.113 O=[N+]([O-])C1=NC=CC(Cl)=C1 SY038052 [0,1,0,0,0,0|2,0,0]=3 497 B10R1.113 O=[N+]([O-])C1=NC=CC(F)=C1 SY114387 [0,1,0,0,0,0|2,0,0]=3 498 B10R1.113 O=[N+]([O-])C1=NC=CC(O)=C1 SY007405 [0,1,0,0,0,0|2,0,0]=3 499 B10R1.113 OB(O)C1=NC(Cl)=CC=C1 SY009381 [0,1,0,0,0,0|2,0,1]=4 500 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 SY033347 [0,0,0,1,0,0|1,0,2]=4 501 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 SY032955 [0,0,0,1,0,0|1,0,2]=4 502 B10R2.320 O=C1CC2=CC=CC=C12 SY031738 [0,0,0,1,0,0|1,0,0]=2 503 B8R1.7 C=C(C)C1=CC=CO1 SY225341 [0,0,0,0,1,0|2,0,0]=3 504 B8R1.7 C=C(C)C1=CC=CS1 SY225340 [0,0,0,0,1,0|2,0,0]=3 505 B8R1.7 CC(=O)C1=CC=CN1 SY011279 [0,0,0,0,1,0|0,0,1]=2 506 B8R1.7 CC(=O)C1=CN=CN1 SY042637 [0,0,0,0,1,0|1,0,1]=3 507 B8R1.7 CC(=O)C1=COC=N1 SY310747 [0,0,0,0,1,0|1,0,0]=2 508 B8R1.7 CC(=O)C1=CSC=C1 SY009376 [0,0,0,0,1,0|1,0,0]=2 509 B8R1.7 CC(=O)C1=CSC=N1 SY043032 [0,0,0,0,1,0|1,0,0]=2 510 B8R1.7 CC(=O)C1=NC=CO1 SY148104 [0,0,0,0,1,0|1,0,0]=2 511 B8R1.7 CC(=O)C1=NC=CS1 SY004958 [0,0,0,0,1,0|1,0,0]=2 512 B8R1.7 CC(=O)C1=NNC=C1 SY123629 [0,0,0,0,1,0|1,0,0]=2 513 B8R1.7 CC(=O)C1=NOC=N1 SY291911 [0,0,0,0,1,0|2,0,0]=3 514 B8R1.7 CC(C)C1=CNC=N1 SY037472 [0,0,0,0,1,0|2,0,1]=4 515 B8R1.7 CC(C)C1=NNC=C1 SY025107 [0,0,0,0,1,0|2,0,1]=4 516 B8R1.7 CC(C)N1C=CC=C1 SY300558 [0,0,0,0,1,0|2,0,1]=4 517 B8R1.7 CC(C)N1C=CC=N1 SY024130 [0,0,0,0,1,0|2,0,1]=4 518 B8R1.7 CC(N)C1=NC=CS1 SY006409 [0,0,0,0,1,0|2,0,1]=4 519 B8R1.7 CC(N)C1=NC=CS1 SY020075 [0,0,0,0,1,0|2,0,1]=4 520 B8R1.7 C[C@@H](N)C1=CC=CS1 SY193850 [0,0,0,0,1,0|2,0,1]=4 521 B8R1.7 C[C@@H](N)C1=CNC=N1 SY307692 [0,0,0,0,1,0|2,0,1]=4 522 B8R1.7 C[C@H](N)C1=CNC=N1 SY307691 [0,0,0,0,1,0|2,0,1]=4 523 B8R1.7 N=C(N)C1=NC=CS1 SY013207 [0,0,0,0,1,0|3,0,0]=4 524 B8R1.7 N=C(N)N1C=CC=N1 SY004651 [0,0,0,0,1,0|3,0,0]=4 525 B8R1.7 NC(=O)C1=CNN=C1 SY031430 [0,0,0,0,1,0|3,0,0]=4 526 B8R1.7 NC(=O)C1=COC=N1 SY026763 [0,0,0,0,1,0|2,0,0]=3 527 B8R1.7 NC(=O)C1=NNC=C1 SY033000 [0,0,0,0,1,0|2,0,0]=3 528 B8R1.7 O=C(O)C1=CC=CN1 SY014890 [0,0,0,0,1,0|1,0,1]=3 529 B8R1.7 O=C(O)C1=CC=CS1 SY001476 [0,0,0,0,1,0|2,0,0]=3 530 B8R1.7 O=C(O)C1=CC=NO1 SY018290 [0,0,0,0,1,0|3,0,0]=4 531 B8R1.7 O=C(O)C1=CC=NS1 SY029089 [0,0,0,0,1,0|3,0,0]=4 532 B8R1.7 O=C(O)C1=CN=CO1 SY026644 [0,0,0,0,1,0|3,0,0]=4 533 B8R1.7 O=C(O)C1=CN=CS1 SY006027 [0,0,0,0,1,0|3,0,0]=4 534 B8R1.7 O=C(O)C1=CNC=C1 SY004601 [0,0,0,0,1,0|2,0,0]=3 535 B8R1.7 O=C(O)C1=CNC=N1 SY001178 [0,0,0,0,1,0|2,0,0]=3 536 B8R1.7 O=C(O)C1=CNN=C1 SY018302 [0,0,0,0,1,0|3,0,0]=4 537 B8R1.7 O=C(O)C1=COC=C1 SY003999 [0,0,0,0,1,0|2,0,0]=3 538 B8R1.7 O=C(O)C1=COC=N1 SY003724 [0,0,0,0,1,0|2,0,0]=3 539 B8R1.7 O=C(O)C1=CON=C1 SY029017 [0,0,0,0,1,0|3,0,0]=4 540 B8R1.7 O=C(O)C1=CSC=C1 SY001582 [0,0,0,0,1,0|2,0,0]=3 541 B8R1.7 O=C(O)C1=CSC=N1 SY015498 [0,0,0,0,1,0|2,0,0]=3 542 B8R1.7 O=C(O)C1=CSN=C1 SY022883 [0,0,0,0,1,0|3,0,0]=4 543 B8R1.7 O=C(O)C1=CSN=N1 SY007300 [0,0,0,0,1,0|3,0,0]=4 544 B8R1.7 O=C(O)C1=NC=CN1 SY007870 [0,0,0,0,1,0|2,0,0]=3 545 B8R1.7 O=C(O)C1=NC=NS1 SY129587 [0,0,0,0,1,0|3,0,0]=4 546 B8R1.7 O=C(O)C1=NNC=C1 SY002921 [0,0,0,0,1,0|2,0,0]=3 547 B8R1.7 O=C(O)C1=NNC=N1 SY018482 [0,0,0,0,1,0|3,0,0]=4 548 B8R1.7 O=C(O)C1=NOC=C1 SY031545 [0,0,0,0,1,0|2,0,0]=3 549 B8R1.7 O=C(O)C1=NOC=N1 SY026689 [0,0,0,0,1,0|3,0,0]=4 550 B8R1.7 O=C(O)C1=NSC=C1 SY059468 [0,0,0,0,1,0|2,0,0]=3 551 B8R1.7 O=C(O)C1=NSN=C1 SY123045 [0,0,0,0,1,0|3,0,0]=4 552 B8R1.7 O=[N+]([O-])C1=CNC=C1 SY004596 [0,0,0,0,1,0|3,0,0]=4 553 B8R1.7 O=[N+]([O-])C1=CNC=N1 SY001473 [0,0,0,0,1,0|3,0,0]=4 554 B8R1.7 O=[N+]([O-])C1=NC=CN1 SY019543 [0,0,0,0,1,0|3,0,0]=4 555 B8R1.7 O=[N+]([O-])C1=NNC=C1 SY009101 [0,0,0,0,1,0|3,0,0]=4 556 B8R1.7 O=[N+]([O-])N1C=CC=N1 SY032676 [0,0,0,0,1,0|3,0,0]=4 557 B10R1.18 BrC(Br)=CC1=CC=CC=C1 SY022051 [0,0,0,0,0,1|3,0,0]=4 558 B10R1.18 CC(=O)CC1=CC=NC=C1 SY002437 [0,0,0,0,0,1|2,0,0]=3 559 B10R1.18 CC(=O)CC1=CC=NC=C1 SY005221 [0,0,0,0,0,1|2,0,0]=3 560 B10R1.18 CC(=O)CC1=NC=CC=C1 SY002438 [0,0,0,0,0,1|0,0,0]=1 561 B10R1.18 CC(C)=CC1=CC=CC=C1 SY055240 [0,0,0,0,0,1|2,0,0]=3 562 B10R1.18 CC(O)CC1=CC=CC=C1 SY051093 [0,0,0,0,0,1|1,0,2]=4 563 B10R1.18 N=C(N)NC1=CC=CC=C1 SY059286 [0,0,0,0,0,1|3,0,0]=4 564 B10R1.18 NC(=O)CC1=CC=CC=C1 SY017094 [0,0,0,0,0,1|2,0,0]=3 565 B10R1.18 NC(=O)OC1=CC=CC=C1 SY109407 [0,0,0,0,0,1|2,0,0]=3 566 B10R1.18 NC(=S)NC1=NC=CC=C1 SY050007 [0,0,0,0,0,1|1,1,0]=3 567 B10R1.18 O=C(O)CC1=CC=CN=C1 SY001707 [0,0,0,0,0,1|3,0,0]=4 568 B10R1.18 O=C(O)CC1=CC=NC=C1 SY003595 [0,0,0,0,0,1|3,0,0]=4 569 B10R1.18 O=C(O)CC1=NC=CC=C1 SY003293 [0,0,0,0,0,1|1,0,0]=2 570 B10R1.18 O=C(O)CC1=NC=CC=N1 SY004102 [0,0,0,0,0,1|2,0,0]=3 571 B10R1.18 O=C(O)CC1=NC=CN=C1 SY034525 [0,0,0,0,0,1|2,0,0]=3 572 B7R1.3 BrC1=CC=CN=N1 SY007900 [2,0,0,0,0,0|2,0,0]=4 573 B7R1.3 BrC1=NC=CC=N1 SY004970 [2,0,0,0,0,0|2,0,0]=4 574 B7R1.3 BrC1=NC=CN=C1 SY019862 [2,0,0,0,0,0|2,0,0]=4 575 B7R1.3 BrC1=NC=NC=C1 SY110226 [2,0,0,0,0,0|2,0,0]=4 576 B7R1.3 C1=CC=C(Br)C=C1 SY061516 [2,0,0,0,0,0|2,0,0]=4 577 B7R1.3 CC1=CC=CCC1 SY292105 [2,0,0,0,0,0|1,0,1]=4 578 B7R1.3 CC1=NC=CC=N1 SY008219 [2,0,0,0,0,0|1,0,0]=3 579 B7R1.3 CC1=NC=NC=C1 SY009308 [2,0,0,0,0,0|1,0,0]=3 580 B7R1.3 CC1=NN=CC=C1 SY031534 [2,0,0,0,0,0|1,0,0]=3 581 B7R1.3 ClC1=NN=CC=C1 SY097653 [2,0,0,0,0,0|2,0,0]=4 582 B7R1.3 IC1=CN=CC=N1 SY005099 [2,0,0,0,0,0|2,0,0]=4 583 B7R1.3 IC1=NC=CC=C1 SY013861 [2,0,0,0,0,0|1,0,0]=3 584 B7R1.3 IC1=NC=CC=N1 SY045305 [2,0,0,0,0,0|2,0,0]=4 585 B7R1.3 NC1=CC=NC=N1 SY006845 [2,0,0,0,0,0|2,0,0]=4 586 B7R1.3 NC1=NC=CN=C1 SY001512 [2,0,0,0,0,0|2,0,0]=4 587 B7R1.3 NC1=NN=CC=C1 SY017896 [2,0,0,0,0,0|2,0,0]=4 588 B7R1.3 O=C1C=CC=NN1 SY020182 [2,0,0,0,0,0|1,0,1]=4 589 B7R1.3 O=C1C=CN=CN1 SY002707 [2,0,0,0,0,0|1,0,1]=4 590 B7R1.3 OC1=CN=CC=N1 SY007023 [2,0,0,0,0,0|1,0,1]=4 591 B7R1.3 OC1=NC=CC=N1 SY013551 [2,0,0,0,0,0|1,0,1]=4 592 B7R1.3 OC1=NC=CC=N1 SY020185 [2,0,0,0,0,0|1,0,1]=4 593 B7R1.3 OC1=NC=NC=C1 SY046617 [2,0,0,0,0,0|1,0,1]=4 594 B7R1.3 SC1=CC=CC=N1 SY009099 [2,0,0,0,0,0|0,1,0]=3 595 B7R1.3 SC1=NC=CC=N1 SY048492 [2,0,0,0,0,0|1,1,0]=4 596 B7R1.3 [O-]C1=CC=CC=C1 SY099113 [2,0,0,0,0,0|1,0,1]=4 597 B9R0.55 O=C(O)\C=C/C=C\C(=O)O SY011347 [0,1,1,0,0,0|2,0,0]=4 598 B9R1.1 BrCC1=NC=C(Br)C=C1 SY116614 [1,1,0,0,0,0|1,0,1]=4 599 B9R1.1 C#CC1=NC=C(Br)C=C1 SY024562 [1,1,0,0,0,0|0,0,2]=4 600 B9R1.1 C#CC1=NC=C(Cl)C=C1 SY024561 [1,1,0,0,0,0|0,0,2]=4 601 B9R1.1 C(=O)C1=CC=C(N)C=C1 SY003470 [1,1,0,0,0,0|1,0,0]=3 602 B9R1.1 C(=O)C1=NC=C(C)C=C1 SY022267 [1,1,0,0,0,0|0,0,0]=2 603 B9R1.1 C=CC1=CC=C(Br)C=C1 SY017044 [1,1,0,0,0,0|1,0,1]=4 604 B9R1.1 C=CC1=CC=C(N)C=C1 SY010310 [1,1,0,0,0,0|1,0,1]=4 605 B9R1.1 CC1=CN=C(C#N)C=C1 SY009853 [1,1,0,0,0,0|1,0,1]=4 606 B9R1.1 CC1=CN=C(CBr)C=C1 SY253141 [1,1,0,0,0,0|1,0,1]=4 607 B9R1.1 CC1=CN=C(CN)C=C1 SY032973 [1,1,0,0,0,0|1,0,1]=4 608 B9R1.1 CC1=CN=C(CO)C=C1 SY025498 [1,1,0,0,0,0|0,0,2]=4 609 B9R1.1 CC1=NC=C(C=O)C=C1 SY028284 [1,1,0,0,0,0|2,0,0]=4 610 B9R1.1 CCC1=CC=C(C)C=C1 SY035727 [1,1,0,0,0,0|1,0,1]=4 611 B9R1.1 CCC1=CC=C(I)C=C1 SY101013 [1,1,0,0,0,0|1,0,1]=4 612 B9R1.1 CCC1=CC=C(N)C=C1 SY012867 [1,1,0,0,0,0|1,0,1]=4 613 B9R1.1 CCC1=NC=C(Br)C=C1 SY096806 [1,1,0,0,0,0|0,0,1]=3 614 B9R1.1 CCC1=NNC(=O)C=C1 SY060323 [1,1,0,0,0,0|1,0,1]=4 615 B9R1.1 CNC1=CC=C(Br)C=C1 SY050556 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.1 CNC1=NC=C(Br)C=N1 SY064516 [1,1,0,0,0,0|2,0,0]=4 617 B9R1.1 CNC1=NC=C(C)N=C1 SY028837 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.1 CNC1=NN=C(Cl)C=C1 SY015482 [1,1,0,0,0,0|2,0,0]=4 619 B9R1.1 COC1=CC=C(Cl)C=C1 SY005701 [1,1,0,0,0,0|2,0,0]=4 620 B9R1.1 COC1=CC=C(I)C=C1 SY001036 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.1 COC1=CC=C(O)C=N1 SY022315 [1,1,0,0,0,0|1,0,0]=3 622 B9R1.1 COC1=CN=C(Br)C=N1 SY021384 [1,1,0,0,0,0|2,0,0]=4 623 B9R1.1 COC1=CN=C(N)C=N1 SY017458 [1,1,0,0,0,0|2,0,0]=4 624 B9R1.1 COC1=NC=C(Br)C=C1 SY007569 [1,1,0,0,0,0|1,0,0]=3 625 B9R1.1 COC1=NC=C(Br)C=N1 SY007743 [1,1,0,0,0,0|2,0,0]=4 626 B9R1.1 COC1=NC=C(C)C=C1 SY030140 [1,1,0,0,0,0|1,0,0]=3 627 B9R1.1 COC1=NC=C(F)C=C1 SY013020 [1,1,0,0,0,0|1,0,0]=3 628 B9R1.1 COC1=NC=C(I)C=C1 SY049516 [1,1,0,0,0,0|1,0,0]=3 629 B9R1.1 COC1=NC=C(I)C=N1 SY116069 [1,1,0,0,0,0|2,0,0]=4 630 B9R1.1 COC1=NC=C(N)C=C1 SY005187 [1,1,0,0,0,0|1,0,0]=3 631 B9R1.1 COC1=NC=C(N)C=N1 SY013575 [1,1,0,0,0,0|2,0,0]=4 632 B9R1.1 COC1=NN=C(Br)C=C1 SY104796 [1,1,0,0,0,0|2,0,0]=4 633 B9R1.1 COC1=NN=C(Cl)C=C1 SY025139 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.1 COC1=NN=C(N)C=C1 SY103873 [1,1,0,0,0,0|2,0,0]=4 635 B9R1.1 CSC1=CC=C(Br)C=N1 SY015731 [1,1,0,0,0,0|1,0,0]=3 636 B9R1.1 CSC1=CN=C(Br)C=N1 SY018833 [1,1,0,0,0,0|2,0,0]=4 637 B9R1.1 CSC1=NC=C(Br)C=N1 SY018834 [1,1,0,0,0,0|2,0,0]=4 638 B9R1.1 CSC1=NC=C(N)C=N1 SY024373 [1,1,0,0,0,0|2,0,0]=4 639 B9R1.1 CSC1=NC=C(O)C=N1 SY008714 [1,1,0,0,0,0|2,0,0]=4 640 B9R1.1 ClCC1=NC=C(Br)C=C1 SY060820 [1,1,0,0,0,0|1,0,1]=4 641 B9R1.1 N#CC1=CC=C(N)C=N1 SY020835 [1,1,0,0,0,0|1,0,1]=4 642 B9R1.1 N#CC1=NC=C(Br)C=C1 SY003393 [1,1,0,0,0,0|1,0,1]=4 643 B9R1.1 N#CC1=NC=C(Cl)C=C1 SY007565 [1,1,0,0,0,0|1,0,1]=4 644 B9R1.1 N#CC1=NC=C(F)C=C1 SY009292 [1,1,0,0,0,0|1,0,1]=4 645 B9R1.1 N#CC1=NC=C(O)C=C1 SY031846 [1,1,0,0,0,0|1,0,1]=4 646 B9R1.1 NC1=CN=C(C=O)C=N1 SY263206 [1,1,0,0,0,0|1,0,0]=3 647 B9R1.1 NC1=CN=C(CO)C=C1 SY025459 [1,1,0,0,0,0|0,0,2]=4 648 B9R1.1 NC1=NC=C(C=O)C=C1 SY035532 [1,1,0,0,0,0|2,0,0]=4 649 B9R1.1 NCC1=CC=C(N)C=N1 SY026755 [1,1,0,0,0,0|1,0,1]=4 650 B9R1.1 NCC1=CC=C(O)C=N1 SY067618 [1,1,0,0,0,0|1,0,1]=4 651 B9R1.1 NCC1=NC=C(Br)C=C1 SY009514 [1,1,0,0,0,0|1,0,1]=4 652 B9R1.1 NCC1=NC=C(Br)C=C1 SY025387 [1,1,0,0,0,0|1,0,1]=4 653 B9R1.1 NCC1=NC=C(Cl)C=C1 SY032976 [1,1,0,0,0,0|1,0,1]=4 654 B9R1.1 NCC1=NC=C(F)C=C1 SY028018 [1,1,0,0,0,0|1,0,1]=4 655 B9R1.1 NNC1=NC=C(Br)C=C1 SY007642 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.1 NNC1=NC=C(Cl)C=C1 SY045855 [1,1,0,0,0,0|2,0,0]=4 657 B9R1.1 O=CC1=CC=C(Br)C=C1 SY001094 [1,1,0,0,0,0|1,0,0]=3 658 B9R1.1 O=CC1=CC=C(Cl)N=C1 SY017266 [1,1,0,0,0,0|2,0,0]=4 659 B9R1.1 O=CC1=CC=C(I)C=C1 SY025388 [1,1,0,0,0,0|1,0,0]=3 660 B9R1.1 O=CC1=CC=C(O)C=C1 SY003489 [1,1,0,0,0,0|1,0,0]=3 661 B9R1.1 O=CC1=CN=C(Br)C=C1 SY002969 [1,1,0,0,0,0|2,0,0]=4 662 B9R1.1 O=CC1=CN=C(F)C=C1 SY022307 [1,1,0,0,0,0|2,0,0]=4 663 B9R1.1 O=CC1=CN=C(O)C=C1 SY018144 [1,1,0,0,0,0|2,0,0]=4 664 B9R1.1 O=CC1=NC=C(Br)C=C1 SY002971 [1,1,0,0,0,0|0,0,0]=2 665 B9R1.1 O=CC1=NC=C(Br)C=N1 SY045581 [1,1,0,0,0,0|1,0,0]=3 666 B9R1.1 O=CC1=NC=C(Cl)C=C1 SY022271 [1,1,0,0,0,0|0,0,0]=2 667 B9R1.1 O=CC1=NC=C(Cl)C=N1 SY116380 [1,1,0,0,0,0|1,0,0]=3 668 B9R1.1 O=CC1=NC=C(Cl)N=C1 SY098538 [1,1,0,0,0,0|1,0,0]=3 669 B9R1.1 O=CC1=NC=C(F)C=C1 SY015686 [1,1,0,0,0,0|0,0,0]=2 670 B9R1.1 O=CC1=NC=C(F)C=N1 SY252920 [1,1,0,0,0,0|1,0,0]=3 671 B9R1.1 O=CC1=NC=C(O)C=C1 SY043065 [1,1,0,0,0,0|0,0,0]=2 672 B9R1.1 O=CC1=NN=C(Cl)C=C1 SY039266 [1,1,0,0,0,0|1,0,0]=3 673 B9R1.1 OCC1=NC=C(Br)C=C1 SY002137 [1,1,0,0,0,0|0,0,2]=4 674 B9R1.1 OCC1=NC=C(Cl)C=C1 SY029489 [1,1,0,0,0,0|0,0,2]=4 675 B9R1.1 OCC1=NC=C(F)C=C1 SY097010 [1,1,0,0,0,0|0,0,2]=4 676 B9R1.2 BrCC1=CC=CC(Br)=N1 SY022087 [1,1,0,0,0,0|1,0,1]=4 677 B9R1.2 C#CC1=CC=CC(N)=N1 SY032733 [1,1,0,0,0,0|0,0,2]=4 678 B9R1.2 C#CC1=NC=CC(N)=C1 SY122657 [1,1,0,0,0,0|0,0,2]=4 679 B9R1.2 C(=O)C1=CC(F)=CN=C1 SY022265 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.2 C=CC1=CC=CC(Cl)=C1 SY017095 [1,1,0,0,0,0|1,0,1]=4 681 B9R1.2 CC1=CC(C#N)=NC=C1 SY019192 [1,1,0,0,0,0|1,0,1]=4 682 B9R1.2 CC1=CC(C=O)=CC=C1 SY001146 [1,1,0,0,0,0|1,0,0]=3 683 B9R1.2 CC1=CC(C=O)=CN=C1 SY107463 [1,1,0,0,0,0|2,0,0]=4 684 B9R1.2 CC1=CC(C=O)=NC=C1 SY022270 [1,1,0,0,0,0|0,0,0]=2 685 B9R1.2 CC1=CC(CBr)=NC=C1 SY253139 [1,1,0,0,0,0|1,0,1]=4 686 B9R1.2 CC1=CC(CN)=NC=C1 SY032971 [1,1,0,0,0,0|1,0,1]=4 687 B9R1.2 CC1=CC=CC(C#N)=N1 SY007553 [1,1,0,0,0,0|1,0,1]=4 688 B9R1.2 CC1=CC=CC(C=O)=N1 SY007849 [1,1,0,0,0,0|0,0,0]=2 689 B9R1.2 CC1=CC=CC(CN)=N1 SY035072 [1,1,0,0,0,0|1,0,1]=4 690 B9R1.2 CC1=NC(CO)=CC=C1 SY004267 [1,1,0,0,0,0|0,0,2]=4 691 B9R1.2 CC1=NC=CC(C=O)=C1 SY026484 [1,1,0,0,0,0|2,0,0]=4 692 B9R1.2 CC1=NC=CC(C=O)=N1 SY037571 [1,1,0,0,0,0|1,0,0]=3 693 B9R1.2 CCC1=CC(Br)=CC=C1 SY025138 [1,1,0,0,0,0|1,0,1]=4 694 B9R1.2 CCC1=CC(N)=CC=C1 SY002616 [1,1,0,0,0,0|1,0,1]=4 695 B9R1.2 CCC1=NC(C)=CC=C1 SY046027 [1,1,0,0,0,0|0,0,1]=3 696 B9R1.2 CCC1=NC(Cl)=NC=C1 SY021045 [1,1,0,0,0,0|1,0,1]=4 697 B9R1.2 CCC1=NC=CC(N)=C1 SY026184 [1,1,0,0,0,0|0,0,1]=3 698 B9R1.2 CNC1=CC(Cl)=NC=N1 SY029019 [1,1,0,0,0,0|2,0,0]=4 699 B9R1.2 CNC1=CC=CC(Br)=C1 SY104448 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.2 CNC1=CC=CC(Cl)=C1 SY048376 [1,1,0,0,0,0|2,0,0]=4 701 B9R1.2 CNC1=NC(Br)=CC=C1 SY152462 [1,1,0,0,0,0|1,0,0]=3 702 B9R1.2 CNC1=NC(C)=CC=C1 SY187746 [1,1,0,0,0,0|1,0,0]=3 703 B9R1.2 CNC1=NC=CC(Br)=C1 SY037276 [1,1,0,0,0,0|1,0,0]=3 704 B9R1.2 CNC1=NC=CC(Cl)=N1 SY066187 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.2 COC1=CC(Cl)=CC=C1 SY009231 [1,1,0,0,0,0|2,0,0]=4 706 B9R1.2 COC1=CC(Cl)=NC=N1 SY017908 [1,1,0,0,0,0|2,0,0]=4 707 B9R1.2 COC1=CC(I)=NC=N1 SY031628 [1,1,0,0,0,0|2,0,0]=4 708 B9R1.2 COC1=CC=CC(Br)=C1 SY002244 [1,1,0,0,0,0|2,0,0]=4 709 B9R1.2 COC1=CC=CC(Br)=N1 SY007898 [1,1,0,0,0,0|1,0,0]=3 710 B9R1.2 COC1=CC=CC(Cl)=N1 SY015984 [1,1,0,0,0,0|1,0,0]=3 711 B9R1.2 COC1=CC=CC(F)=N1 SY032408 [1,1,0,0,0,0|1,0,0]=3 712 B9R1.2 COC1=CC=CC(I)=C1 SY027986 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.2 COC1=CC=CC(I)=N1 SY041538 [1,1,0,0,0,0|1,0,0]=3 714 B9R1.2 COC1=CC=NC(N)=N1 SY015052 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.2 COC1=CN=CC(Cl)=N1 SY031631 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.2 COC1=NC(Br)=NC=C1 SY036611 [1,1,0,0,0,0|2,0,0]=4 717 B9R1.2 COC1=NC(Cl)=NC=C1 SY015694 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.2 COC1=NC(I)=NC=C1 SY109839 [1,1,0,0,0,0|2,0,0]=4 719 B9R1.2 COC1=NC(N)=CC=C1 SY003761 [1,1,0,0,0,0|1,0,0]=3 720 B9R1.2 COC1=NC(N)=CN=C1 SY010731 [1,1,0,0,0,0|2,0,0]=4 721 B9R1.2 COC1=NC=CC(Br)=C1 SY008980 [1,1,0,0,0,0|1,0,0]=3 722 B9R1.2 COC1=NC=CC(Br)=N1 SY033688 [1,1,0,0,0,0|2,0,0]=4 723 B9R1.2 COC1=NC=CC(C)=C1 SY047060 [1,1,0,0,0,0|1,0,0]=3 724 B9R1.2 COC1=NC=CC(C)=N1 SY108263 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.2 COC1=NC=CC(Cl)=C1 SY022137 [1,1,0,0,0,0|1,0,0]=3 726 B9R1.2 COC1=NC=CC(I)=C1 SY047228 [1,1,0,0,0,0|1,0,0]=3 727 B9R1.2 COC1=NC=CC(N)=C1 SY005153 [1,1,0,0,0,0|1,0,0]=3 728 B9R1.2 COC1=NC=CC(N)=N1 SY029964 [1,1,0,0,0,0|2,0,0]=4 729 B9R1.2 COC1=NC=CC(O)=C1 SY035360 [1,1,0,0,0,0|1,0,0]=3 730 B9R1.2 COC1=NN=CC(Cl)=C1 SY257765 [1,1,0,0,0,0|2,0,0]=4 731 B9R1.2 COC1=NN=CC(N)=C1 SY251452 [1,1,0,0,0,0|2,0,0]=4 732 B9R1.2 CSC1=CC(Cl)=NC=N1 SY034811 [1,1,0,0,0,0|2,0,0]=4 733 B9R1.2 CSC1=CC(I)=NC=N1 SY291879 [1,1,0,0,0,0|2,0,0]=4 734 B9R1.2 CSC1=CC(N)=CC=C1 SY001852 [1,1,0,0,0,0|2,0,0]=4 735 B9R1.2 CSC1=NC(Cl)=NC=C1 SY024250 [1,1,0,0,0,0|2,0,0]=4 736 B9R1.2 CSC1=NC=CC(=O)N1 SY021276 [1,1,0,0,0,0|2,0,0]=4 737 B9R1.2 CSC1=NC=CC(Br)=N1 SY031193 [1,1,0,0,0,0|2,0,0]=4 738 B9R1.2 CSC1=NC=CC(C)=N1 SY064952 [1,1,0,0,0,0|2,0,0]=4 739 B9R1.2 CSC1=NC=CC(I)=N1 SY060380 [1,1,0,0,0,0|2,0,0]=4 740 B9R1.2 ClCC1=CC=CC(Br)=N1 SY024882 [1,1,0,0,0,0|1,0,1]=4 741 B9R1.2 ClCC1=NC=CC(Cl)=C1 SY111657 [1,1,0,0,0,0|1,0,1]=4 742 B9R1.2 FC1=CC(CBr)=NC=C1 SY253136 [1,1,0,0,0,0|1,0,1]=4 743 B9R1.2 FC1=CC(CBr)=NC=C1 SY253884 [1,1,0,0,0,0|1,0,1]=4 744 B9R1.2 FC1=CC(CBr)=NC=C1 SY254085 [1,1,0,0,0,0|1,0,1]=4 745 B9R1.2 FC1=NC(CBr)=CC=C1 SY046741 [1,1,0,0,0,0|1,0,1]=4 746 B9R1.2 N#CC1=CC=CC(Br)=N1 SY032579 [1,1,0,0,0,0|1,0,1]=4 747 B9R1.2 N#CC1=CC=CC(Cl)=N1 SY012070 [1,1,0,0,0,0|1,0,1]=4 748 B9R1.2 N#CC1=NC(F)=CC=C1 SY040540 [1,1,0,0,0,0|1,0,1]=4 749 B9R1.2 N#CC1=NC(N)=CC=C1 SY013225 [1,1,0,0,0,0|1,0,1]=4 750 B9R1.2 N#CC1=NC=CC(Br)=C1 SY015416 [1,1,0,0,0,0|1,0,1]=4 751 B9R1.2 N#CC1=NC=CC(Cl)=C1 SY002926 [1,1,0,0,0,0|1,0,1]=4 752 B9R1.2 N#CC1=NC=CC(F)=C1 SY035898 [1,1,0,0,0,0|1,0,1]=4 753 B9R1.2 N#CC1=NC=CC(N)=C1 SY042048 [1,1,0,0,0,0|1,0,1]=4 754 B9R1.2 NC1=CC(CO)=NC=C1 SY026008 [1,1,0,0,0,0|0,0,2]=4 755 B9R1.2 NC1=CC=CC(CO)=N1 SY017265 [1,1,0,0,0,0|0,0,2]=4 756 B9R1.2 NC1=NC(CBr)=CC=C1 SY159857 [1,1,0,0,0,0|1,0,1]=4 757 B9R1.2 NCC1=CC=CC(N)=N1 SY035074 [1,1,0,0,0,0|1,0,1]=4 758 B9R1.2 NCC1=NC(F)=CC=C1 SY028019 [1,1,0,0,0,0|1,0,1]=4 759 B9R1.2 NCC1=NC=CC(Br)=C1 SY021750 [1,1,0,0,0,0|1,0,1]=4 760 B9R1.2 NCC1=NC=CC(Cl)=C1 SY031877 [1,1,0,0,0,0|1,0,1]=4 761 B9R1.2 NCC1=NC=CC(F)=C1 SY032986 [1,1,0,0,0,0|1,0,1]=4 762 B9R1.2 NNC1=CC=CC(Cl)=N1 SY007568 [1,1,0,0,0,0|2,0,0]=4 763 B9R1.2 NNC1=NC(Br)=CC=C1 SY007439 [1,1,0,0,0,0|2,0,0]=4 764 B9R1.2 O=CC1=CC(Br)=CN=C1 SY003415 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.2 O=CC1=CC(Cl)=NC=C1 SY025970 [1,1,0,0,0,0|2,0,0]=4 766 B9R1.2 O=CC1=CC(O)=CN=C1 SY025951 [1,1,0,0,0,0|2,0,0]=4 767 B9R1.2 O=CC1=CC=CC(=O)N1 SY027987 [1,1,0,0,0,0|0,0,1]=3 768 B9R1.2 O=CC1=CC=CC(Br)=C1 SY001442 [1,1,0,0,0,0|1,0,0]=3 769 B9R1.2 O=CC1=CC=CC(Cl)=N1 SY014102 [1,1,0,0,0,0|0,0,0]=2 770 B9R1.2 O=CC1=CC=CC(F)=N1 SY014043 [1,1,0,0,0,0|0,0,0]=2 771 B9R1.2 O=CC1=CC=CC(I)=C1 SY011761 [1,1,0,0,0,0|1,0,0]=3 772 B9R1.2 O=CC1=CC=CC(O)=C1 SY001091 [1,1,0,0,0,0|1,0,0]=3 773 B9R1.2 O=CC1=NC(Br)=CC=C1 SY005343 [1,1,0,0,0,0|0,0,0]=2 774 B9R1.2 O=CC1=NC(F)=CN=C1 SY277878 [1,1,0,0,0,0|1,0,0]=3 775 B9R1.2 O=CC1=NC=CC(Br)=C1 SY013125 [1,1,0,0,0,0|0,0,0]=2 776 B9R1.2 O=CC1=NC=CC(Cl)=C1 SY024151 [1,1,0,0,0,0|0,0,0]=2 777 B9R1.2 OCC1=CC=CC(Cl)=N1 SY007573 [1,1,0,0,0,0|0,0,2]=4 778 B9R1.2 OCC1=NC(Br)=CC=C1 SY009306 [1,1,0,0,0,0|0,0,2]=4 779 B9R1.2 OCC1=NC(Cl)=CC=C1 SY007659 [1,1,0,0,0,0|0,0,2]=4 780 B9R1.2 OCC1=NC(F)=CC=C1 SY015411 [1,1,0,0,0,0|0,0,2]=4 781 B9R1.2 OCC1=NC=CC(Br)=C1 SY021911 [1,1,0,0,0,0|0,0,2]=4 782 B9R1.2 OCC1=NC=CC(Cl)=C1 SY003339 [1,1,0,0,0,0|0,0,2]=4 783 B9R1.8 BrCCC1=NC=CC=C1 SY004999 [1,1,0,0,0,0|0,0,1]=3 784 B9R1.8 CC#CC1=CC=CC=C1 SY048557 [1,1,0,0,0,0|1,0,1]=4 785 B9R1.8 CCCC1=NC=CC=C1 SY035538 [1,1,0,0,0,0|0,0,1]=3 786 B9R1.8 CNCC1=NC=CC=C1 SY003781 [1,1,0,0,0,0|0,0,1]=3 787 B9R1.8 COCC1=CC=CC=C1 SY049310 [1,1,0,0,0,0|1,0,1]=4 788 B9R1.8 NNCC1=NC=CC=C1 SY042125 [1,1,0,0,0,0|1,0,1]=4 789 B9R1.8 NOCC1=NC=CC=C1 SY281576 [1,1,0,0,0,0|0,0,2]=4 790 B9R1.8 NOCC1=NC=CC=C1 SY281577 [1,1,0,0,0,0|0,0,2]=4 791 B9R1.8 O=C=NC1=NC=CC=C1 SY128122 [1,1,0,0,0,0|0,0,1]=3 792 B9R1.8 O=CNC1=CC=CC=C1 SY011224 [1,1,0,0,0,0|1,0,0]=3 793 B9R1.8 O=COC1=CC=CC=C1 SY106351 [1,1,0,0,0,0|1,0,0]=3 794 B9R1.8 OCCC1=NC=CN=C1 SY025413 [1,1,0,0,0,0|1,0,1]=4 795 B9R1.8 O\N=C\C1=CC=CC=C1 SY112944 [1,1,0,0,0,0|1,0,1]=4 796 B9R1.8 O\N=C\C1=CC=CC=N1 SY016016 [1,1,0,0,0,0|0,0,1]=3 797 B9R1.8 SCCC1=CC=CC=C1 SY039368 [1,1,0,0,0,0|1,0,1]=4 798 B9R1.15 BrCC1=NC=CC=C1Br SY223889 [1,1,0,0,0,0|1,0,1]=4 799 B9R1.15 C(=O)C1=CC=CN=C1Cl SY005203 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.15 C(=O)C1=CC=CN=C1F SY014361 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.15 C(=O)C1=NC=CC=C1O SY019646 [1,1,0,0,0,0|0,0,0]=2 802 B9R1.15 C=CC1=C(Br)C=CC=C1 SY017137 [1,1,0,0,0,0|1,0,1]=4 803 B9R1.15 CC1=C(C=O)C=NC=C1 SY042040 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.15 CC1=C(C=O)N=CC=C1 SY008466 [1,1,0,0,0,0|0,0,0]=2 805 B9R1.15 CC1=CC=CC=C1C=O SY001303 [1,1,0,0,0,0|1,0,0]=3 806 B9R1.15 CC1=CC=NN=C1C=O SY279280 [1,1,0,0,0,0|1,0,0]=3 807 B9R1.15 CC1=NC=CC=C1C=O SY042068 [1,1,0,0,0,0|2,0,0]=4 808 B9R1.15 CCC1=CC=CC=C1O SY012952 [1,1,0,0,0,0|1,0,1]=4 809 B9R1.15 CCC1=NC=CC=C1Br SY029944 [1,1,0,0,0,0|0,0,1]=3 810 B9R1.15 CCC1=NC=NC=C1Br SY271974 [1,1,0,0,0,0|1,0,1]=4 811 B9R1.15 CCC1=NC=NC=C1F SY099089 [1,1,0,0,0,0|1,0,1]=4 812 B9R1.15 CNC1=CC=CC=C1Br SY246165 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.15 CNC1=CC=CC=C1Cl SY048562 [1,1,0,0,0,0|2,0,0]=4 814 B9R1.15 CNC1=CC=CC=C1F SY018442 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.15 CNC1=CC=CC=C1N SY045512 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.15 COC1=C(Br)C=NC=N1 SY007901 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.15 COC1=C(I)C=CC=C1 SY017939 [1,1,0,0,0,0|2,0,0]=4 818 B9R1.15 COC1=CC=CC=C1Cl SY026857 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.15 COC1=CC=CC=C1N SY277586 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.15 COC1=CC=CC=C1O SY048708 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.15 COC1=NC=CC=C1Br SY007904 [1,1,0,0,0,0|1,0,0]=3 822 B9R1.15 COC1=NC=CC=C1Cl SY022136 [1,1,0,0,0,0|1,0,0]=3 823 B9R1.15 COC1=NC=CC=C1I SY022129 [1,1,0,0,0,0|1,0,0]=3 824 B9R1.15 COC1=NC=CC=C1N SY009589 [1,1,0,0,0,0|1,0,0]=3 825 B9R1.15 COC1=NC=CC=C1O SY068872 [1,1,0,0,0,0|1,0,0]=3 826 B9R1.15 COC1=NC=CN=C1Br SY114135 [1,1,0,0,0,0|2,0,0]=4 827 B9R1.15 COC1=NC=CN=C1N SY021285 [1,1,0,0,0,0|2,0,0]=4 828 B9R1.15 CSC1=C(O)C=CC=C1 SY008439 [1,1,0,0,0,0|2,0,0]=4 829 B9R1.15 CSC1=NC=CC=C1N SY283974 [1,1,0,0,0,0|1,0,0]=3 830 B9R1.15 CSC1=NC=CN=C1C SY015340 [1,1,0,0,0,0|2,0,0]=4 831 B9R1.15 CSC1=NC=CN=C1N SY281646 [1,1,0,0,0,0|2,0,0]=4 832 B9R1.15 ClCC1=NC=CC=C1Br SY014101 [1,1,0,0,0,0|1,0,1]=4 833 B9R1.15 ClCC1=NC=CC=C1Cl SY121216 [1,1,0,0,0,0|1,0,1]=4 834 B9R1.15 FC1=CC=CN=C1CCl SY013902 [1,1,0,0,0,0|1,0,1]=4 835 B9R1.15 FC1=CC=CN=C1CCl SY014099 [1,1,0,0,0,0|1,0,1]=4 836 B9R1.15 N#CC1=C(Cl)C=CC=N1 SY004407 [1,1,0,0,0,0|1,0,1]=4 837 B9R1.15 N#CC1=C(F)C=CC=N1 SY014411 [1,1,0,0,0,0|1,0,1]=4 838 B9R1.15 N#CC1=NC=CC=C1Br SY003790 [1,1,0,0,0,0|1,0,1]=4 839 B9R1.15 N#CC1=NC=CC=C1N SY012209 [1,1,0,0,0,0|1,0,1]=4 840 B9R1.15 N#CC1=NC=CC=C1O SY031451 [1,1,0,0,0,0|1,0,1]=4 841 B9R1.15 NC1=C(C=O)C=CC=C1 SY024955 [1,1,0,0,0,0|1,0,0]=3 842 B9R1.15 NC1=CC=CN=C1C=O SY258410 [1,1,0,0,0,0|0,0,0]=2 843 B9R1.15 NC1=CC=CN=C1CO SY025458 [1,1,0,0,0,0|0,0,2]=4 844 B9R1.15 NC1=CC=NC=C1C=O SY022278 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.15 NC1=CN=CN=C1C=O SY265274 [1,1,0,0,0,0|1,0,0]=3 846 B9R1.15 NC1=NC=CC=C1C=O SY005392 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.15 NCC1=NC=CC=C1F SY035457 [1,1,0,0,0,0|1,0,1]=4 848 B9R1.15 NCC1=NC=CC=C1F SY042134 [1,1,0,0,0,0|1,0,1]=4 849 B9R1.15 NCC1=NC=CC=C1F SY047766 [1,1,0,0,0,0|1,0,1]=4 850 B9R1.15 NCC1=NC=CC=C1N SY035169 [1,1,0,0,0,0|1,0,1]=4 851 B9R1.15 NNC1=NC=CC=C1Cl SY011483 [1,1,0,0,0,0|2,0,0]=4 852 B9R1.15 O=CC1=C(Br)C=CN=C1 SY007122 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.15 O=CC1=C(Br)C=NC=C1 SY005098 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.15 O=CC1=C(Cl)C=CC=N1 SY008181 [1,1,0,0,0,0|0,0,0]=2 855 B9R1.15 O=CC1=C(Cl)C=CN=C1 SY004413 [1,1,0,0,0,0|2,0,0]=4 856 B9R1.15 O=CC1=C(F)C=NC=C1 SY031229 [1,1,0,0,0,0|2,0,0]=4 857 B9R1.15 O=CC1=C(O)C=NC=C1 SY014482 [1,1,0,0,0,0|2,0,0]=4 858 B9R1.15 O=CC1=CC=CC=C1Br SY001671 [1,1,0,0,0,0|1,0,0]=3 859 B9R1.15 O=CC1=CC=CC=C1I SY025787 [1,1,0,0,0,0|1,0,0]=3 860 B9R1.15 O=CC1=CC=CN=C1Br SY004096 [1,1,0,0,0,0|2,0,0]=4 861 B9R1.15 O=CC1=NC=CC=C1Br SY005024 [1,1,0,0,0,0|0,0,0]=2 862 B9R1.15 O=CC1=NC=CC=C1F SY022254 [1,1,0,0,0,0|0,0,0]=2 863 B9R1.15 O=CC1=NC=CN=C1Cl SY023956 [1,1,0,0,0,0|1,0,0]=3 864 B9R1.15 OCC1=NC=CC=C1Br SY014320 [1,1,0,0,0,0|0,0,2]=4 865 B9R1.15 OCC1=NC=CC=C1Cl SY102632 [1,1,0,0,0,0|0,0,2]=4 866 B9R1.15 OCC1=NC=CC=C1F SY037894 [1,1,0,0,0,0|0,0,2]=4 867 B9R1.11 CCC(=O)C1=CC=CS1 SY031388 [0,1,0,0,1,0|1,0,0]=3 868 B9R1.11 CNC(=O)C1=CNN=C1 SY025808 [0,1,0,0,1,0|2,0,0]=4 869 B9R1.11 CNC(=O)N1C=CN=C1 SY027183 [0,1,0,0,1,0|2,0,0]=4 870 B9R1.11 COC(=O)C1=CC=CN1 SY001201 [0,1,0,0,1,0|0,0,1]=3 871 B9R1.11 COC(=O)C1=CC=CS1 SY048432 [0,1,0,0,1,0|1,0,0]=3 872 B9R1.11 COC(=O)C1=CC=NO1 SY078826 [0,1,0,0,1,0|2,0,0]=4 873 B9R1.11 COC(=O)C1=CNC=C1 SY005883 [0,1,0,0,1,0|1,0,0]=3 874 B9R1.11 COC(=O)C1=CNC=N1 SY019856 [0,1,0,0,1,0|1,0,0]=3 875 B9R1.11 COC(=O)C1=CNN=C1 SY011914 [0,1,0,0,1,0|2,0,0]=4 876 B9R1.11 COC(=O)C1=CNN=N1 SY008373 [0,1,0,0,1,0|2,0,0]=4 877 B9R1.11 COC(=O)C1=CSC=C1 SY019965 [0,1,0,0,1,0|1,0,0]=3 878 B9R1.11 COC(=O)C1=CSC=N1 SY007519 [0,1,0,0,1,0|1,0,0]=3 879 B9R1.11 COC(=O)C1=NC=CN1 SY026818 [0,1,0,0,1,0|1,0,0]=3 880 B9R1.11 COC(=O)C1=NC=CS1 SY013211 [0,1,0,0,1,0|1,0,0]=3 881 B9R1.11 COC(=O)C1=NNC=C1 SY013591 [0,1,0,0,1,0|1,0,0]=3 882 B9R1.11 COC(=O)C1=NNC=N1 SY015262 [0,1,0,0,1,0|2,0,0]=4 883 B9R1.11 NCC(=O)C1=CSC=C1 SY269123 [0,1,0,0,1,0|1,0,0]=3 884 B9R1.11 NNC(=O)C1=CC=CO1 SY048471 [0,1,0,0,1,0|2,0,0]=4 885 B9R1.11 NNC(=O)C1=CC=CS1 SY048333 [0,1,0,0,1,0|2,0,0]=4 886 B9R1.11 O=C(CBr)C1=CC=CO1 SY040209 [0,1,0,0,1,0|1,0,0]=3 887 B9R1.11 O=C(CBr)C1=NC=CS1 SY029755 [0,1,0,0,1,0|1,0,0]=3 888 B9R1.11 O=C(CO)C1=CC=CO1 SY131034 [0,1,0,0,1,0|1,0,0]=3 889 B9R1.11 O=C(CO)C1=CC=CS1 SY131036 [0,1,0,0,1,0|1,0,0]=3 890 B9R1.19 CS(=O)(=O)C1=CNC=C1 SY251276 [0,1,0,0,1,0|2,0,0]=4 891 B9R1.19 CS(=O)(=O)C1=NC=CN1 SY034187 [0,1,0,0,1,0|2,0,0]=4 892 B9R1.19 CS(=O)(=O)C1=NNC=C1 SY289486 [0,1,0,0,1,0|2,0,0]=4 893 B9R1.35 CC(=O)C1=CC(Br)=CS1 SY031823 [0,1,0,0,1,0|1,0,0]=3 894 B9R1.35 CC(=O)C1=CC(Cl)=CS1 SY101316 [0,1,0,0,1,0|1,0,0]=3 895 B9R1.35 CC(=O)C1=CC=C(Br)S1 SY017856 [0,1,0,0,1,0|1,0,0]=3 896 B9R1.35 CC(=O)C1=CC=C(C)O1 SY013987 [0,1,0,0,1,0|1,0,0]=3 897 B9R1.35 CC(=O)C1=CC=C(C)S1 SY016983 [0,1,0,0,1,0|1,0,0]=3 898 B9R1.35 CC(=O)C1=CN(C)N=C1 SY064140 [0,1,0,0,1,0|2,0,0]=4 899 B9R1.35 CC(=O)C1=CNC(Br)=C1 SY263216 [0,1,0,0,1,0|1,0,0]=3 900 B9R1.35 CC(=O)C1=NN(C)C=C1 SY045892 [0,1,0,0,1,0|1,0,0]=3 901 B9R1.35 CC(=O)C1=NN(C)C=N1 SY291912 [0,1,0,0,1,0|2,0,0]=4 902 B9R1.35 CC1=CC(C(=O)O)=CS1 SY014238 [0,1,0,0,1,0|2,0,0]=4 903 B9R1.35 CC1=CC(C(=O)O)=NO1 SY010127 [0,1,0,0,1,0|2,0,0]=4 904 B9R1.35 CC1=CC=C(C(=O)O)O1 SY033736 [0,1,0,0,1,0|2,0,0]=4 905 B9R1.35 CC1=CC=C(C(=O)O)S1 SY001770 [0,1,0,0,1,0|2,0,0]=4 906 B9R1.35 CC1=CN=C(C(=O)O)S1 SY023408 [0,1,0,0,1,0|2,0,0]=4 907 B9R1.35 CC1=COC(C(=O)O)=N1 SY273851 [0,1,0,0,1,0|2,0,0]=4 908 B9R1.35 CC1=CSC(C(=O)O)=C1 SY012042 [0,1,0,0,1,0|2,0,0]=4 909 B9R1.35 CC1=CSC(C(=O)O)=N1 SY015483 [0,1,0,0,1,0|2,0,0]=4 910 B9R1.35 CC1=NC(C(=O)O)=CN1 SY015260 [0,1,0,0,1,0|2,0,0]=4 911 B9R1.35 CC1=NC(C(=O)O)=CO1 SY015418 [0,1,0,0,1,0|2,0,0]=4 912 B9R1.35 CC1=NC(C(=O)O)=CS1 SY005875 [0,1,0,0,1,0|2,0,0]=4 913 B9R1.35 CC1=NC(C(N)=O)=CS1 SY096630 [0,1,0,0,1,0|2,0,0]=4 914 B9R1.35 CN1C=CC(C(=O)O)=C1 SY023300 [0,1,0,0,1,0|2,0,0]=4 915 B9R1.35 CN1C=CC(C(=O)O)=N1 SY005921 [0,1,0,0,1,0|2,0,0]=4 916 B9R1.35 CN1C=NC(C(=O)O)=C1 SY003723 [0,1,0,0,1,0|2,0,0]=4 917 B9R1.35 NC(=O)C1=NNC(N)=C1 SY018555 [0,1,0,0,1,0|2,0,0]=4 918 B9R1.35 NC1=CN=C(C(=O)[O-])S1 SY309695 [0,1,0,0,1,0|2,0,0]=4 919 B9R1.35 NC1=CSC(C(=O)O)=C1 SY026146 [0,1,0,0,1,0|2,0,0]=4 920 B9R1.35 NC1=NC(C(=O)O)=CN1 SY027829 [0,1,0,0,1,0|2,0,0]=4 921 B9R1.35 O=C(O)C1=CC(Br)=CN1 SY110044 [0,1,0,0,1,0|1,0,1]=4 922 B9R1.35 O=C(O)C1=CC(Br)=CS1 SY002033 [0,1,0,0,1,0|2,0,0]=4 923 B9R1.35 O=C(O)C1=CC(Cl)=CS1 SY046793 [0,1,0,0,1,0|2,0,0]=4 924 B9R1.35 O=C(O)C1=CC=C(Br)O1 SY023401 [0,1,0,0,1,0|2,0,0]=4 925 B9R1.35 O=C(O)C1=CC=C(Br)S1 SY003028 [0,1,0,0,1,0|2,0,0]=4 926 B9R1.35 O=C(O)C1=CC=C(Cl)O1 SY104264 [0,1,0,0,1,0|2,0,0]=4 927 B9R1.35 O=C(O)C1=CC=C(Cl)S1 SY001039 [0,1,0,0,1,0|2,0,0]=4 928 B9R1.35 O=C(O)C1=CC=C(F)S1 SY042026 [0,1,0,0,1,0|2,0,0]=4 929 B9R1.35 O=C(O)C1=CNC(Cl)=N1 SY264613 [0,1,0,0,1,0|2,0,0]=4 930 B9R1.35 O=C(O)C1=COC(Br)=C1 SY021737 [0,1,0,0,1,0|2,0,0]=4 931 B9R1.35 O=C(O)C1=COC(Cl)=N1 SY027681 [0,1,0,0,1,0|2,0,0]=4 932 B9R1.35 O=C(O)C1=CSC(Br)=C1 SY022842 [0,1,0,0,1,0|2,0,0]=4 933 B9R1.35 O=C(O)C1=CSC(Br)=N1 SY004497 [0,1,0,0,1,0|2,0,0]=4 934 B9R1.35 O=C(O)C1=CSC(Cl)=C1 SY019665 [0,1,0,0,1,0|2,0,0]=4 935 B9R1.35 O=C(O)C1=CSC(Cl)=N1 SY065475 [0,1,0,0,1,0|2,0,0]=4 936 B9R1.35 O=C(O)C1=CSC(I)=N1 SY205366 [0,1,0,0,1,0|2,0,0]=4 937 B9R1.35 O=C(O)C1=NC(Br)=CS1 SY033628 [0,1,0,0,1,0|2,0,0]=4 938 B9R1.35 O=C(O)C1=NC=C(Br)S1 SY006142 [0,1,0,0,1,0|2,0,0]=4 939 B9R1.35 O=C(O)C1=NNC(Br)=C1 SY036625 [0,1,0,0,1,0|2,0,0]=4 940 B9R1.35 O=C(O)C1=NNC(Cl)=C1 SY029998 [0,1,0,0,1,0|2,0,0]=4 941 B9R1.41 CC(=O)C1=C(Br)C=CS1 SY062236 [0,1,0,0,1,0|1,0,0]=3 942 B9R1.41 CC(=O)C1=C(N)SC=C1 SY198401 [0,1,0,0,1,0|1,0,0]=3 943 B9R1.41 CC(=O)C1=CC=CN1C SY005755 [0,1,0,0,1,0|0,0,1]=3 944 B9R1.41 CC(=O)C1=CC=NN1C SY005764 [0,1,0,0,1,0|1,0,1]=4 945 B9R1.41 CC1=C(C(=O)O)C=CS1 SY023486 [0,1,0,0,1,0|2,0,0]=4 946 B9R1.41 CC1=C(C(=O)O)N=CN1 SY022377 [0,1,0,0,1,0|2,0,0]=4 947 B9R1.41 CC1=C(C(=O)O)N=CO1 SY015419 [0,1,0,0,1,0|2,0,0]=4 948 B9R1.41 CC1=C(C(=O)O)NC=C1 SY007678 [0,1,0,0,1,0|1,0,1]=4 949 B9R1.41 CC1=C(C(=O)O)OC=C1 SY027534 [0,1,0,0,1,0|2,0,0]=4 950 B9R1.41 CC1=C(C(=O)O)SC=C1 SY001797 [0,1,0,0,1,0|2,0,0]=4 951 B9R1.41 CC1=CNN=C1C(=O)O SY008321 [0,1,0,0,1,0|2,0,0]=4 952 B9R1.41 CC1=CON=C1C(=O)O SY102755 [0,1,0,0,1,0|2,0,0]=4 953 B9R1.41 CC1=CSC=C1C(=O)O SY097125 [0,1,0,0,1,0|2,0,0]=4 954 B9R1.41 CN1C=CC=C1C(=O)O SY021564 [0,1,0,0,1,0|1,0,1]=4 955 B9R1.41 CN1C=CN=C1C(=O)O SY003797 [0,1,0,0,1,0|2,0,0]=4 956 B9R1.41 NC(=O)C1=C(Br)C=CS1 SY023659 [0,1,0,0,1,0|2,0,0]=4 957 B9R1.41 NC(=O)C1=C(N)C=CO1 SY046339 [0,1,0,0,1,0|2,0,0]=4 958 B9R1.41 NC(=O)C1=C(N)C=CO1 SY296076 [0,1,0,0,1,0|2,0,0]=4 959 B9R1.41 NC(=O)C1=C(N)NC=N1 SY009547 [0,1,0,0,1,0|2,0,0]=4 960 B9R1.41 NC(=O)C1=C(N)NC=N1 SY018912 [0,1,0,0,1,0|2,0,0]=4 961 B9R1.41 NC(=O)C1=C(N)SC=C1 SY015489 [0,1,0,0,1,0|2,0,0]=4 962 B9R1.41 NC(=O)C1=C(N)SC=N1 SY009597 [0,1,0,0,1,0|2,0,0]=4 963 B9R1.41 NC(=O)C1=CC=CN1N SY007857 [0,1,0,0,1,0|1,0,1]=4 964 B9R1.41 NC1=C(C(=O)O)SC=C1 SY006053 [0,1,0,0,1,0|2,0,0]=4 965 B9R1.41 NC1=CNN=C1C(=O)O SY002456 [0,1,0,0,1,0|2,0,0]=4 966 B9R1.41 O=C(O)C1=C(Br)C=CO1 SY042666 [0,1,0,0,1,0|2,0,0]=4 967 B9R1.41 O=C(O)C1=C(Br)C=CS1 SY017647 [0,1,0,0,1,0|2,0,0]=4 968 B9R1.41 O=C(O)C1=C(Br)SC=C1 SY016339 [0,1,0,0,1,0|2,0,0]=4 969 B9R1.41 O=C(O)C1=C(Br)SC=N1 SY006172 [0,1,0,0,1,0|2,0,0]=4 970 B9R1.41 O=C(O)C1=C(Cl)C=CS1 SY007125 [0,1,0,0,1,0|2,0,0]=4 971 B9R1.41 O=C(O)C1=C(Cl)SC=C1 SY021357 [0,1,0,0,1,0|2,0,0]=4 972 B9R1.41 O=C(O)C1=C(F)C=CS1 SY019425 [0,1,0,0,1,0|2,0,0]=4 973 B9R1.41 O=C(O)C1=CSC=C1Br SY023658 [0,1,0,0,1,0|2,0,0]=4 974 B9R1.41 O=C(O)C1=NNC=C1Br SY002455 [0,1,0,0,1,0|2,0,0]=4 975 B9R1.41 O=C(O)C1=NNC=C1Cl SY014072 [0,1,0,0,1,0|2,0,0]=4 976 B9R1.41 O=C(O)C1=NNC=C1F SY197291 [0,1,0,0,1,0|2,0,0]=4 977 B9R1.41 O=C(O)C1=NNC=C1I SY062855 [0,1,0,0,1,0|2,0,0]=4 978 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 SY045434 [0,1,0,0,0,1|1,0,0]=3 979 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 SY042746 [0,1,0,0,0,1|1,0,0]=3 980 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 SY017113 [0,1,0,0,0,1|1,0,0]=3 981 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 SY017054 [0,1,0,0,0,1|1,0,0]=3 982 B11R1.20 CC(=O)NC1=CC=C(Br)C=C1 SY049651 [0,1,0,0,0,1|1,0,0]=3 983 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 SY035719 [0,1,0,0,0,1|1,0,0]=3 984 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 SY001162 [0,1,0,0,0,1|1,0,0]=3 985 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 SY022132 [0,1,0,0,0,1|0,0,0]=2 986 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 SY016072 [0,1,0,0,0,1|1,0,0]=3 987 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 SY233693 [0,1,0,0,0,1|1,0,0]=3 988 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 SY110382 [0,1,0,0,0,1|1,0,1]=4 989 B11R1.20 CC1=CC=C(CC(=O)Cl)C=C1 SY246635 [0,1,0,0,0,1|2,0,0]=4 990 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 SY013543 [0,1,0,0,0,1|2,0,0]=4 991 B11R1.20 NC(=O)CC1=CC=C(Br)C=C1 SY132432 [0,1,0,0,0,1|2,0,0]=4 992 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 SY001683 [0,1,0,0,0,1|2,0,0]=4 993 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 SY001637 [0,1,0,0,0,1|2,0,0]=4 994 B11R1.20 O=C(Cl)OC1=CC=C(Br)C=C1 SY113865 [0,1,0,0,0,1|2,0,0]=4 995 B11R1.20 O=C(Cl)OC1=CC=C(I)C=C1 SY296872 [0,1,0,0,0,1|2,0,0]=4 996 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 SY001685 [0,1,0,0,0,1|2,0,0]=4 997 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 SY001347 [0,1,0,0,0,1|2,0,0]=4 998 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 SY016997 [0,1,0,0,0,1|2,0,0]=4 999 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 SY004128 [0,1,0,0,0,1|2,0,0]=4 1000 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 SY097003 [0,1,0,0,0,1|1,0,0]=3 1001 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 SY039154 [0,1,0,0,0,1|1,0,0]=3 1002 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 SY051220 [0,1,0,0,0,1|2,0,0]=4 1003 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 SY036428 [0,1,0,0,0,1|1,0,0]=3 1004 B11R1.36 CC(=O)C(O)C1=CC=CC=C1 SY028287 [0,1,0,0,0,1|1,0,0]=3 1005 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 SY053096 [0,1,0,0,0,1|1,0,0]=3 1006 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 SY004963 [0,1,0,0,0,1|2,0,0]=4 1007 B11R1.36 CC(C)C(=O)C1=NC=CC=C1 SY004992 [0,1,0,0,0,1|1,0,1]=4 1008 B11R1.36 CC(C)C(N)C1=NC=CC=C1 SY014379 [0,1,0,0,0,1|1,0,1]=4 1009 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 SY020842 [0,1,0,0,0,1|2,0,0]=4 1010 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 SY021075 [0,1,0,0,0,1|2,0,0]=4 1011 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 SY009237 [0,1,0,0,0,1|2,0,0]=4 1012 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 SY006358 [0,1,0,0,0,1|2,0,0]=4 1013 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 SY022365 [0,1,0,0,0,1|1,0,0]=3 1014 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 SY032366 [0,1,0,0,0,1|1,0,0]=3 1015 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 SY006196 [0,1,0,0,0,1|2,0,0]=4 1016 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 SY005672 [0,1,0,0,0,1|2,0,0]=4 1017 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 SY004129 [0,1,0,0,0,1|2,0,0]=4 1018 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 SY110356 [0,1,0,0,0,1|2,0,0]=4 1019 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SY001670 [0,1,0,0,0,1|2,0,0]=4 1020 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 SY289327 [0,1,0,0,0,1|2,0,0]=4 1021 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 SY001645 [0,1,0,0,0,1|2,0,0]=4 1022 B11R1.40 C=CC(=O)NC1=CC=CC=C1 SY052499 [0,1,0,0,0,1|1,0,1]=4 1023 B11R1.40 C=CC(=O)OC1=CC=CC=C1 SY050025 [0,1,0,0,0,1|1,0,1]=4 1024 B11R1.40 COC(=O)CC1=CC=CN=C1 SY014800 [0,1,0,0,0,1|2,0,0]=4 1025 B11R1.40 COC(=O)CC1=CC=CN=C1 SY033634 [0,1,0,0,0,1|2,0,0]=4 1026 B11R1.40 COC(=O)CC1=CC=NC=C1 SY003565 [0,1,0,0,0,1|2,0,0]=4 1027 B11R1.40 COC(=O)CC1=CC=NC=C1 SY007994 [0,1,0,0,0,1|2,0,0]=4 1028 B11R1.40 COC(=O)CC1=NC=CC=C1 SY030291 [0,1,0,0,0,1|0,0,0]=2 1029 B11R1.40 COC(=O)CC1=NC=CC=N1 SY005830 [0,1,0,0,0,1|1,0,0]=3 1030 B11R1.40 COC(=O)C[N+]1=NC=CC=C1 SY286050 [0,1,0,0,0,1|1,0,0]=3 1031 B11R1.40 N#CC(=O)CC1=CC=CC=C1 SY235509 [0,1,0,0,0,1|1,0,1]=4 1032 B11R1.40 NNC(=O)CC1=CC=CC=C1 SY032275 [0,1,0,0,0,1|2,0,0]=4 1033 B11R1.40 NNC(=O)OC1=CC=CC=C1 SY262826 [0,1,0,0,0,1|2,0,0]=4 1034 B11R1.40 O=C(CBr)OC1=CC=CC=C1 SY036432 [0,1,0,0,0,1|1,0,0]=3 1035 B11R1.40 O=C(CCl)NC1=CC=NC=C1 SY022530 [0,1,0,0,0,1|2,0,0]=4 1036 B11R1.40 O=C(CCl)NC1=NC=CC=C1 SY022508 [0,1,0,0,0,1|0,0,0]=2 1037 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 SY048553 [0,1,0,0,0,1|2,0,0]=4 1038 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 SY011510 [0,1,0,0,0,1|1,0,0]=3 1039 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 SY037165 [0,1,0,0,0,1|1,0,0]=3 1040 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 SY034454 [0,1,0,0,0,1|1,0,0]=3 1041 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 SY004721 [0,1,0,0,0,1|1,0,0]=3 1042 B11R1.86 CC(=O)NC1=CC=CC=C1Cl SY048591 [0,1,0,0,0,1|1,0,0]=3 1043 B11R1.86 CC(=O)NC1=CC=CC=C1N SY050887 [0,1,0,0,0,1|1,0,0]=3 1044 B11R1.86 CC(=O)NC1=NC=CC=C1O SY084890 [0,1,0,0,0,1|0,0,0]=2 1045 B11R1.86 CC(=O)NC1=NN=CC=C1C SY014812 [0,1,0,0,0,1|1,0,0]=3 1046 B11R1.86 CC(=O)OC1=CC=CC=C1Br SY265515 [0,1,0,0,0,1|1,0,0]=3 1047 B11R1.86 CC(=O)OC1=CC=CC=C1C SY052277 [0,1,0,0,0,1|1,0,0]=3 1048 B11R1.86 CC(=O)OC1=CC=CC=C1F SY224313 [0,1,0,0,0,1|1,0,0]=3 1049 B11R1.86 CC(C)OC1=NC=CC=C1Br SY077021 [0,1,0,0,0,1|1,0,1]=4 1050 B11R1.86 CC1=C(OC(=O)Cl)C=CC=C1 SY296811 [0,1,0,0,0,1|2,0,0]=4 1051 B11R1.86 CC1=CC=CC=C1CC(=O)O SY003130 [0,1,0,0,0,1|2,0,0]=4 1052 B11R1.86 NC(=O)CC1=CC=CC=C1Cl SY016301 [0,1,0,0,0,1|2,0,0]=4 1053 B11R1.86 NC1=CC=CC=C1CC(=O)O SY101243 [0,1,0,0,0,1|2,0,0]=4 1054 B11R1.86 O=C(Cl)OC1=CC=CC=C1Br SY296808 [0,1,0,0,0,1|2,0,0]=4 1055 B11R1.86 O=C(Cl)OC1=CC=CC=C1F SY202667 [0,1,0,0,0,1|2,0,0]=4 1056 B11R1.86 O=C(Cl)OC1=CC=CC=C1I SY296904 [0,1,0,0,0,1|2,0,0]=4 1057 B11R1.86 O=C(O)CC1=CC=CC=C1Br SY003588 [0,1,0,0,0,1|2,0,0]=4 1058 B11R1.86 O=C(O)CC1=CC=CC=C1F SY003125 [0,1,0,0,0,1|2,0,0]=4 1059 B11R1.86 O=C(O)CC1=CC=CC=C1I SY035508 [0,1,0,0,0,1|2,0,0]=4 1060 B11R1.86 O=C(O)CC1=NC=CC=C1F SY058130 [0,1,0,0,0,1|1,0,0]=3 1061 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 SY050661 [0,1,0,0,0,1|1,0,0]=3 1062 B11R1.157 CC(=O)CC1=NC=CC(Br)=C1 SY249484 [0,1,0,0,0,1|0,0,0]=2 1063 B11R1.157 CC(=O)NC1=CC(Br)=CN=C1 SY128013 [0,1,0,0,0,1|2,0,0]=4 1064 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 SY064864 [0,1,0,0,0,1|2,0,0]=4 1065 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 SY040632 [0,1,0,0,0,1|1,0,0]=3 1066 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 SY006038 [0,1,0,0,0,1|1,0,0]=3 1067 B11R1.157 CC(=O)NC1=NC(=O)NC=C1 SY069214 [0,1,0,0,0,1|1,0,0]=3 1068 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 SY025653 [0,1,0,0,0,1|0,0,0]=2 1069 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 SY116307 [0,1,0,0,0,1|0,0,0]=2 1070 B11R1.157 CC(=O)NC1=NC=CC(Cl)=N1 SY248395 [0,1,0,0,0,1|1,0,0]=3 1071 B11R1.157 CC(=O)NC1=NN=CC(C)=C1 SY014813 [0,1,0,0,0,1|1,0,0]=3 1072 B11R1.157 CC(=O)OC1=CC=CC(Cl)=C1 SY224191 [0,1,0,0,0,1|1,0,0]=3 1073 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 SY042571 [0,1,0,0,0,1|1,0,0]=3 1074 B11R1.157 CC(C)OC1=NC=CC(Br)=C1 SY111491 [0,1,0,0,0,1|1,0,1]=4 1075 B11R1.157 CC(O)CC1=NC=CC(Br)=C1 SY247891 [0,1,0,0,0,1|0,0,2]=4 1076 B11R1.157 CC1=CC(CC(=O)O)=CC=C1 SY048780 [0,1,0,0,0,1|2,0,0]=4 1077 B11R1.157 CC1=CC(NC(N)=S)=NC=C1 SY293176 [0,1,0,0,0,1|1,1,0]=4 1078 B11R1.157 CC1=CC(OC(=O)Cl)=CC=C1 SY203736 [0,1,0,0,0,1|2,0,0]=4 1079 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 SY249639 [0,1,0,0,0,1|1,0,0]=3 1080 B11R1.157 NC(=O)CC1=CC=CC(Br)=C1 SY274676 [0,1,0,0,0,1|2,0,0]=4 1081 B11R1.157 O=C(Cl)OC1=CC=CC(Br)=C1 SY296957 [0,1,0,0,0,1|2,0,0]=4 1082 B11R1.157 O=C(Cl)OC1=CC=CC(Cl)=C1 SY293019 [0,1,0,0,0,1|2,0,0]=4 1083 B11R1.157 O=C(Cl)OC1=CC=CC(F)=C1 SY293018 [0,1,0,0,0,1|2,0,0]=4 1084 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 SY004367 [0,1,0,0,0,1|2,0,0]=4 1085 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 SY004837 [0,1,0,0,0,1|2,0,0]=4 1086 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 SY001712 [0,1,0,0,0,1|2,0,0]=4 1087 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 SY032267 [0,1,0,0,0,1|2,0,0]=4 1088 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 SY013505 [0,1,0,0,0,1|2,0,0]=4 1089 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 SY058123 [0,1,0,0,0,1|1,0,0]=3 1090 B11R1.509 CS(=O)(=O)OC1=CC=CC=C1 SY050523 [0,1,0,0,0,1|2,0,0]=4 1091 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 SY024129 [0,2,0,0,0,0|2,0,0]=4 1092 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 SY067507 [0,2,0,0,0,0|1,0,0]=3 1093 B11R1.3 C#CC1=CN=C(N(C)C)C=C1 SY060588 [0,2,0,0,0,0|2,0,0]=4 1094 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 SY204715 [0,2,0,0,0,0|2,0,0]=4 1095 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 SY011290 [0,2,0,0,0,0|2,0,0]=4 1096 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 SY012989 [0,2,0,0,0,0|1,0,0]=3 1097 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 SY039033 [0,2,0,0,0,0|1,0,0]=3 1098 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 SY002548 [0,2,0,0,0,0|2,0,0]=4 1099 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 SY049093 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 SY011239 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.3 CNC1=NN=C(C(=O)O)C=C1 SY028789 [0,2,0,0,0,0|2,0,0]=4 1102 B11R1.3 COC1=CC=C(C(=O)O)C=C1 SY001719 [0,2,0,0,0,0|2,0,0]=4 1103 B11R1.3 COC1=CC=C(C(N)=O)C=C1 SY040631 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.3 COC1=CN=C(C(=O)O)C=C1 SY013190 [0,2,0,0,0,0|1,0,0]=3 1105 B11R1.3 COC1=CN=C(C(=O)O)C=N1 SY019412 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.3 COC1=CN=C(C(C)=O)C=C1 SY283549 [0,2,0,0,0,0|0,0,0]=2 1107 B11R1.3 COC1=CN=C(C(C)=O)N=C1 SY266262 [0,2,0,0,0,0|1,0,0]=3 1108 B11R1.3 COC1=NC=C(C(C)=O)C=C1 SY017260 [0,2,0,0,0,0|2,0,0]=4 1109 B11R1.3 COC1=NN=C(C(=O)O)C=C1 SY064814 [0,2,0,0,0,0|2,0,0]=4 1110 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 SY032223 [0,2,0,0,0,0|1,0,0]=3 1111 B11R1.3 N#CC1=CN=C(C(=O)O)C=N1 SY120715 [0,2,0,0,0,0|2,0,0]=4 1112 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 SY106686 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 SY002868 [0,2,0,0,0,0|2,0,0]=4 1114 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 SY018304 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 SY022152 [0,2,0,0,0,0|2,0,0]=4 1116 B11R1.3 NNC1=NN=C(C(N)=O)C=C1 SY037384 [0,2,0,0,0,0|2,0,0]=4 1117 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 SY003712 [0,2,0,0,0,0|2,0,0]=4 1118 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 SY001684 [0,2,0,0,0,0|2,0,0]=4 1119 B11R1.19 CC(C)(C)C1=NC=C(Br)C=C1 SY128727 [0,2,0,0,0,0|1,0,1]=4 1120 B11R1.19 CC(C)(F)C1=NC=C(Br)C=C1 SY128735 [0,2,0,0,0,0|1,0,1]=4 1121 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 SY037447 [0,2,0,0,0,0|0,0,2]=4 1122 B11R1.19 CC(F)(F)C1=NC=C(Br)C=C1 SY128734 [0,2,0,0,0,0|1,0,1]=4 1123 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 SY002922 [0,2,0,0,0,0|2,0,0]=4 1124 B11R1.19 CC1=CC=C(S(C)(=O)=O)C=C1 SY009681 [0,2,0,0,0,0|2,0,0]=4 1125 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 SY026610 [0,2,0,0,0,0|2,0,0]=4 1126 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 SY008978 [0,2,0,0,0,0|2,0,0]=4 1127 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 SY013818 [0,2,0,0,0,0|2,0,0]=4 1128 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 SY011688 [0,2,0,0,0,0|2,0,0]=4 1129 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 SY007820 [0,2,0,0,0,0|2,0,0]=4 1130 B11R1.19 CS(=O)(=O)C1=NC=C(Cl)C=N1 SY021541 [0,2,0,0,0,0|2,0,0]=4 1131 B11R1.19 NC1=CN=C(S(N)(=O)=O)C=C1 SY215990 [0,2,0,0,0,0|2,0,0]=4 1132 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 SY008859 [0,2,0,0,0,0|1,0,0]=3 1133 B11R1.21 CC(=O)C1=CC=C(Br)C(C)=C1 SY104680 [0,2,0,0,0,0|1,0,0]=3 1134 B11R1.21 CC(=O)C1=CC=C(Br)C(F)=C1 SY008735 [0,2,0,0,0,0|1,0,0]=3 1135 B11R1.21 CC(=O)C1=CC=C(C)C(C)=C1 SY061591 [0,2,0,0,0,0|1,0,0]=3 1136 B11R1.21 CC(=O)C1=CC=C(C)C(N)=C1 SY024093 [0,2,0,0,0,0|1,0,0]=3 1137 B11R1.21 CC(=O)C1=CC=C(Cl)C(C)=C1 SY062023 [0,2,0,0,0,0|1,0,0]=3 1138 B11R1.21 CC(=O)C1=CC=C(Cl)C(Cl)=C1 SY003529 [0,2,0,0,0,0|1,0,0]=3 1139 B11R1.21 CC(=O)C1=CC=C(F)C(Br)=C1 SY003533 [0,2,0,0,0,0|1,0,0]=3 1140 B11R1.21 CC(=O)C1=CC=C(F)C(C)=C1 SY030422 [0,2,0,0,0,0|1,0,0]=3 1141 B11R1.21 CC(=O)C1=CC=C(F)C(Cl)=C1 SY023313 [0,2,0,0,0,0|1,0,0]=3 1142 B11R1.21 CC(=O)C1=CC=C(F)C(N)=C1 SY011608 [0,2,0,0,0,0|1,0,0]=3 1143 B11R1.21 CC(=O)C1=CC=C(F)C(O)=C1 SY035220 [0,2,0,0,0,0|1,0,0]=3 1144 B11R1.21 CC(=O)C1=CC=C(N)C(Cl)=C1 SY237270 [0,2,0,0,0,0|1,0,0]=3 1145 B11R1.21 CC(=O)C1=CC=C(N)C(F)=C1 SY029029 [0,2,0,0,0,0|1,0,0]=3 1146 B11R1.21 CC(=O)C1=CC=C(N)C(I)=C1 SY237308 [0,2,0,0,0,0|1,0,0]=3 1147 B11R1.21 CC(=O)C1=CC=C(O)C(Br)=C1 SY212901 [0,2,0,0,0,0|1,0,0]=3 1148 B11R1.21 CC(=O)C1=CC=C(O)C(C)=C1 SY018355 [0,2,0,0,0,0|1,0,0]=3 1149 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 SY038279 [0,2,0,0,0,0|1,0,0]=3 1150 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 SY014466 [0,2,0,0,0,0|2,0,0]=4 1151 B11R1.21 CC1=CC(C(=O)O)=CC=C1Br SY005296 [0,2,0,0,0,0|2,0,0]=4 1152 B11R1.21 CC1=CC(C(=O)O)=CC=C1F SY007282 [0,2,0,0,0,0|2,0,0]=4 1153 B11R1.21 CC1=CC(C(=O)O)=CC=C1N SY005389 [0,2,0,0,0,0|2,0,0]=4 1154 B11R1.21 CC1=CC(C(=O)O)=CC=C1O SY002872 [0,2,0,0,0,0|2,0,0]=4 1155 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br SY031506 [0,2,0,0,0,0|1,0,0]=3 1156 B11R1.21 CC1=CC=C(C(=O)O)C=C1C SY001153 [0,2,0,0,0,0|2,0,0]=4 1157 B11R1.21 CC1=CC=C(C(=O)O)C=C1Cl SY003397 [0,2,0,0,0,0|2,0,0]=4 1158 B11R1.21 CC1=CC=C(C(=O)O)C=C1F SY013052 [0,2,0,0,0,0|2,0,0]=4 1159 B11R1.21 CC1=CC=C(C(=O)O)C=C1I SY002748 [0,2,0,0,0,0|2,0,0]=4 1160 B11R1.21 CC1=CC=C(C(=O)O)C=C1N SY001489 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.21 CC1=CC=C(C(=O)O)C=C1O SY003068 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.21 CC1=NC(C(=O)O)=CC=C1Br SY108250 [0,2,0,0,0,0|1,0,0]=3 1163 B11R1.21 CC1=NC([N+](=O)[O-])=CC=C1O SY224094 [0,2,0,0,0,0|2,0,0]=4 1164 B11R1.21 CN1N=C(C(=O)O)C=CC1=O SY065000 [0,2,0,0,0,0|2,0,0]=4 1165 B11R1.21 NC(=O)C1=CC=C(Br)C(O)=C1 SY039306 [0,2,0,0,0,0|2,0,0]=4 1166 B11R1.21 NC(=O)C1=CC=C(Cl)C(N)=C1 SY020313 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 SY009233 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=C1 SY009077 [0,2,0,0,0,0|2,0,0]=4 1169 B11R1.21 NC1=CC(C(=O)O)=CC=C1Cl SY001488 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.21 NC1=CC(C(=O)O)=CC=C1F SY009032 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.21 NC1=CC(C(=O)O)=CC=C1O SY002820 [0,2,0,0,0,0|2,0,0]=4 1172 B11R1.21 NC1=CC(C(=O)O)=CC=C1O SY059883 [0,2,0,0,0,0|2,0,0]=4 1173 B11R1.21 NC1=CC=C(C(=O)O)C=C1Br SY025536 [0,2,0,0,0,0|2,0,0]=4 1174 B11R1.21 NC1=CC=C(C(=O)O)C=C1F SY007349 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.21 NC1=CC=C(C(=O)O)C=C1N SY001595 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.21 NC1=CC=C(C(=O)O)C=C1O SY018797 [0,2,0,0,0,0|2,0,0]=4 1177 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 SY023172 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 SY012255 [0,2,0,0,0,0|2,0,0]=4 1179 B11R1.21 O=C(O)C1=CC=C(Br)C(=O)N1 SY110772 [0,2,0,0,0,0|1,0,1]=4 1180 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 SY034395 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.21 O=C(O)C1=CC=C(Br)C(F)=C1 SY008839 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=C1 SY015480 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.21 O=C(O)C1=CC=C(Cl)C(Cl)=C1 SY001131 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.21 O=C(O)C1=CC=C(Cl)C(F)=C1 SY005008 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.21 O=C(O)C1=CC=C(Cl)C(I)=C1 SY030183 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.21 O=C(O)C1=CC=C(Cl)C(O)=C1 SY021851 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 SY002875 [0,2,0,0,0,0|2,0,0]=4 1188 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 SY005155 [0,2,0,0,0,0|2,0,0]=4 1189 B11R1.21 O=C(O)C1=CC=C(F)C(F)=C1 SY005367 [0,2,0,0,0,0|2,0,0]=4 1190 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 SY003002 [0,2,0,0,0,0|2,0,0]=4 1191 B11R1.21 O=C(O)C1=CC=C(I)C(Br)=C1 SY034738 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 SY041688 [0,2,0,0,0,0|2,0,0]=4 1193 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 SY017183 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 SY014104 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.21 O=C(O)C1=NC(=O)C(F)C=C1 SY117430 [0,2,0,0,0,0|1,0,1]=4 1196 B11R1.21 O=C(O)C1=NC(=O)C(F)C=C1 SY262928 [0,2,0,0,0,0|1,0,1]=4 1197 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 SY033452 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 SY112665 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.21 O=C(O)C1=NC(Cl)=C(F)C=C1 SY038170 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.21 O=C(O)C1=NC(O)=C(O)C=C1 SY119665 [0,2,0,0,0,0|1,0,0]=3 1201 B11R1.22 C=C(CBr)C1=CC=C(F)C=C1 SY274281 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 SY283036 [0,2,0,0,0,0|1,0,1]=4 1203 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 SY022605 [0,2,0,0,0,0|1,0,0]=3 1204 B11R1.22 CC1=CC=C(C(=O)CO)C=C1 SY026844 [0,2,0,0,0,0|1,0,0]=3 1205 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 SY048426 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 SY001608 [0,2,0,0,0,0|1,0,0]=3 1207 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 SY049111 [0,2,0,0,0,0|1,0,0]=3 1208 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 SY002144 [0,2,0,0,0,0|1,0,0]=3 1209 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 SY003666 [0,2,0,0,0,0|1,0,0]=3 1210 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 SY020021 [0,2,0,0,0,0|1,0,0]=3 1211 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 SY005511 [0,2,0,0,0,0|1,0,0]=3 1212 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 SY107933 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.22 CNC(=S)C1=CC=C(Br)C=C1 SY262030 [0,2,0,0,0,0|1,1,0]=4 1214 B11R1.22 COC(=N)C1=CC=C(Br)C=C1 SY028781 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 SY001702 [0,2,0,0,0,0|1,0,0]=3 1216 B11R1.22 COC(=O)C1=CC=C(Br)C=N1 SY009344 [0,2,0,0,0,0|0,0,0]=2 1217 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 SY017140 [0,2,0,0,0,0|1,0,0]=3 1218 B11R1.22 COC(=O)C1=CC=C(Cl)N=N1 SY007129 [0,2,0,0,0,0|1,0,0]=3 1219 B11R1.22 COC(=O)C1=CC=C(F)N=C1 SY022281 [0,2,0,0,0,0|2,0,0]=4 1220 B11R1.22 COC(=O)C1=CC=C(N)N=N1 SY006049 [0,2,0,0,0,0|1,0,0]=3 1221 B11R1.22 COC(=O)C1=CC=C(O)C=C1 SY006626 [0,2,0,0,0,0|1,0,0]=3 1222 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 SY009097 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.22 COC(=O)C1=CN=C(C)C=C1 SY002953 [0,2,0,0,0,0|2,0,0]=4 1224 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 SY006706 [0,2,0,0,0,0|2,0,0]=4 1225 B11R1.22 COC(=O)C1=CN=C(I)C=C1 SY026656 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.22 COC(=O)C1=CN=C(N)C=C1 SY006453 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.22 COC(=O)C1=CN=C(N)C=N1 SY006678 [0,2,0,0,0,0|1,0,0]=3 1228 B11R1.22 COC(=O)C1=CN=C(O)C=C1 SY032672 [0,2,0,0,0,0|2,0,0]=4 1229 B11R1.22 COC(=O)C1=COC(=O)C=C1 SY018974 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 SY006806 [0,2,0,0,0,0|1,0,0]=3 1231 B11R1.22 COC(=O)C1=NC=C(Br)N=C1 SY018538 [0,2,0,0,0,0|1,0,0]=3 1232 B11R1.22 COC(=O)C1=NC=C(C)C=C1 SY046550 [0,2,0,0,0,0|0,0,0]=2 1233 B11R1.22 COC(=O)C1=NC=C(C)C=N1 SY040125 [0,2,0,0,0,0|1,0,0]=3 1234 B11R1.22 COC(=O)C1=NC=C(C)N=C1 SY024382 [0,2,0,0,0,0|1,0,0]=3 1235 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 SY031483 [0,2,0,0,0,0|0,0,0]=2 1236 B11R1.22 COC(=O)C1=NC=C(Cl)C=N1 SY124516 [0,2,0,0,0,0|1,0,0]=3 1237 B11R1.22 COC(=O)C1=NC=C(Cl)N=C1 SY018612 [0,2,0,0,0,0|1,0,0]=3 1238 B11R1.22 COC(=O)C1=NC=C(F)C=C1 SY096916 [0,2,0,0,0,0|0,0,0]=2 1239 B11R1.22 COC(=O)C1=NC=C(F)C=N1 SY036635 [0,2,0,0,0,0|1,0,0]=3 1240 B11R1.22 COC(=O)C1=NC=C(N)C=C1 SY031871 [0,2,0,0,0,0|0,0,0]=2 1241 B11R1.22 COC(=O)C1=NC=C(N)N=C1 SY098745 [0,2,0,0,0,0|1,0,0]=3 1242 B11R1.22 COC(=O)C1=NC=C(O)C=C1 SY021663 [0,2,0,0,0,0|0,0,0]=2 1243 B11R1.22 COC(=O)C1=NC=C(O)C=N1 SY037102 [0,2,0,0,0,0|1,0,0]=3 1244 B11R1.22 COC(=O)C1=NC=C(O)N=C1 SY031016 [0,2,0,0,0,0|1,0,0]=3 1245 B11R1.22 COC(=O)C1=NN=C(Br)C=C1 SY043175 [0,2,0,0,0,0|1,0,0]=3 1246 B11R1.22 COC(=O)C1=NN=C(C)C=C1 SY007132 [0,2,0,0,0,0|1,0,0]=3 1247 B11R1.22 COC(=O)C1=NNC(=O)C=C1 SY008390 [0,2,0,0,0,0|1,0,0]=3 1248 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 SY028321 [0,2,0,0,0,0|1,0,0]=3 1249 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 SY039916 [0,2,0,0,0,0|1,0,0]=3 1250 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 SY020165 [0,2,0,0,0,0|1,0,0]=3 1251 B11R1.22 NNC(=O)C1=CC=C(Br)C=C1 SY001789 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 SY035573 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 SY007335 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 SY036768 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 SY009530 [0,2,0,0,0,0|2,0,0]=4 1256 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 SY041321 [0,2,0,0,0,0|1,0,0]=3 1257 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 SY096724 [0,2,0,0,0,0|1,0,0]=3 1258 B11R1.22 O=C(CCl)C1=NC=C(F)C=C1 SY031219 [0,2,0,0,0,0|0,0,0]=2 1259 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 SY130953 [0,2,0,0,0,0|1,0,0]=3 1260 B11R1.22 O=C(CO)C1=CC=C(Cl)C=C1 SY130959 [0,2,0,0,0,0|1,0,0]=3 1261 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 SY130961 [0,2,0,0,0,0|1,0,0]=3 1262 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 SY003527 [0,2,0,0,0,0|1,0,0]=3 1263 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)N=C1 SY129579 [0,2,0,0,0,0|2,0,0]=4 1264 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 SY011386 [0,2,0,0,0,0|1,0,0]=3 1265 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 SY008954 [0,2,0,0,0,0|1,0,0]=3 1266 B11R1.166 CC(=O)C1=C(N)C=C(Cl)N=C1 SY261630 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 SY004020 [0,2,0,0,0,0|1,0,0]=3 1268 B11R1.166 CC(=O)C1=CC=C(Br)C=C1Br SY034398 [0,2,0,0,0,0|1,0,0]=3 1269 B11R1.166 CC(=O)C1=CC=C(Br)C=C1C SY198423 [0,2,0,0,0,0|1,0,0]=3 1270 B11R1.166 CC(=O)C1=CC=C(Br)C=C1Cl SY046544 [0,2,0,0,0,0|1,0,0]=3 1271 B11R1.166 CC(=O)C1=CC=C(Br)C=C1F SY024301 [0,2,0,0,0,0|1,0,0]=3 1272 B11R1.166 CC(=O)C1=CC=C(Br)C=C1N SY102002 [0,2,0,0,0,0|1,0,0]=3 1273 B11R1.166 CC(=O)C1=CC=C(Br)C=C1O SY026364 [0,2,0,0,0,0|1,0,0]=3 1274 B11R1.166 CC(=O)C1=CC=C(C)C=C1O SY037234 [0,2,0,0,0,0|1,0,0]=3 1275 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br SY057517 [0,2,0,0,0,0|1,0,0]=3 1276 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1O SY018382 [0,2,0,0,0,0|1,0,0]=3 1277 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl SY017378 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.166 CC(=O)C1=CC=C(F)C=C1Cl SY047832 [0,2,0,0,0,0|1,0,0]=3 1279 B11R1.166 CC(=O)C1=CC=C(F)C=C1N SY291138 [0,2,0,0,0,0|1,0,0]=3 1280 B11R1.166 CC(=O)C1=CC=C(F)C=C1O SY048694 [0,2,0,0,0,0|1,0,0]=3 1281 B11R1.166 CC(=O)C1=CC=C(N)C=C1Cl SY038064 [0,2,0,0,0,0|1,0,0]=3 1282 B11R1.166 CC(=O)C1=CC=C(N)C=C1O SY009074 [0,2,0,0,0,0|1,0,0]=3 1283 B11R1.166 CC(=O)C1=CC=C(O)C=C1Cl SY110010 [0,2,0,0,0,0|1,0,0]=3 1284 B11R1.166 CC(=O)C1=CC=C(O)C=C1F SY048930 [0,2,0,0,0,0|1,0,0]=3 1285 B11R1.166 CC(=O)C1=CC=C(O)C=C1I SY265601 [0,2,0,0,0,0|1,0,0]=3 1286 B11R1.166 CC(=O)C1=NC=C(Br)C=C1F SY147940 [0,2,0,0,0,0|0,0,0]=2 1287 B11R1.166 CC(C)C1=C(Br)C=C(N)C=N1 SY289046 [0,2,0,0,0,0|1,0,1]=4 1288 B11R1.166 CC(O)C1=NC=C(Cl)C=C1F SY072446 [0,2,0,0,0,0|0,0,2]=4 1289 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 SY003329 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.166 CC1=CC(Br)=CC=C1C(=O)O SY004437 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.166 CC1=CC(Br)=CN=C1C(=O)Cl SY277823 [0,2,0,0,0,0|1,0,0]=3 1292 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O SY018925 [0,2,0,0,0,0|1,0,0]=3 1293 B11R1.166 CC1=CC(Br)=CN=C1[N+](=O)[O-] SY023387 [0,2,0,0,0,0|2,0,0]=4 1294 B11R1.166 CC1=CC(Cl)=CC=C1C(=O)O SY017097 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.166 CC1=CC(Cl)=CN=C1C(=O)O SY031482 [0,2,0,0,0,0|1,0,0]=3 1296 B11R1.166 CC1=CC(F)=CC=C1C(=O)O SY006136 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.166 CC1=CC(F)=CN=C1C(=O)O SY268386 [0,2,0,0,0,0|1,0,0]=3 1298 B11R1.166 CC1=CC(I)=CC=C1C(=O)O SY020057 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.166 CC1=CC(O)=CC=C1C(=O)O SY014356 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.166 CC1=CC=C(C(=O)O)C(Br)=C1 SY016461 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.166 CC1=CC=C(C(=O)O)C(C)=C1 SY002565 [0,2,0,0,0,0|2,0,0]=4 1302 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=C1 SY026013 [0,2,0,0,0,0|2,0,0]=4 1303 B11R1.166 CC1=CC=C(C(=O)O)C(F)=C1 SY004352 [0,2,0,0,0,0|2,0,0]=4 1304 B11R1.166 CC1=CC=C(C(=O)O)C(I)=C1 SY245079 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.166 CC1=CC=C(C(=O)O)C(N)=C1 SY030949 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 SY001921 [0,2,0,0,0,0|2,0,0]=4 1307 B11R1.166 CC1=CN=C(C(=O)O)C(Br)=C1 SY031478 [0,2,0,0,0,0|1,0,0]=3 1308 B11R1.166 N=C(N)C1=NC=C(F)C=C1F SY240681 [0,2,0,0,0,0|2,0,0]=4 1309 B11R1.166 NC(=O)C1=C(Cl)N=C(Cl)C=N1 SY031594 [0,2,0,0,0,0|2,0,0]=4 1310 B11R1.166 NC(=O)C1=C(F)C=C(F)C=C1 SY023163 [0,2,0,0,0,0|2,0,0]=4 1311 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1N SY025963 [0,2,0,0,0,0|2,0,0]=4 1312 B11R1.166 NC(=O)C1=CC=C(O)C=C1Cl SY027903 [0,2,0,0,0,0|2,0,0]=4 1313 B11R1.166 NC(=O)C1=NC=C(Br)C=C1Cl SY247257 [0,2,0,0,0,0|1,0,0]=3 1314 B11R1.166 NC(=O)C1=NC=C(Br)C=C1N SY009642 [0,2,0,0,0,0|1,0,0]=3 1315 B11R1.166 NC1=CC(Br)=C([N+](=O)[O-])N=C1 SY287829 [0,2,0,0,0,0|2,0,0]=4 1316 B11R1.166 NC1=CC(Br)=CC=C1C(=O)O SY008187 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O SY024163 [0,2,0,0,0,0|1,0,0]=3 1318 B11R1.166 NC1=CC(Cl)=CC=C1C(=O)O SY001306 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 SY008893 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.166 NC1=CC(F)=CC=C1C(=O)O SY001835 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.166 NC1=CC(I)=CC=C1C(=O)O SY027629 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.166 NC1=CC=C(C(=O)O)C(Cl)=C1 SY001299 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 SY001079 [0,2,0,0,0,0|2,0,0]=4 1324 B11R1.166 NC1=CN=C(C(=O)O)C(Br)=C1 SY287830 [0,2,0,0,0,0|1,0,0]=3 1325 B11R1.166 NC1=CN=C(C(=O)O)C(F)=C1 SY264819 [0,2,0,0,0,0|1,0,0]=3 1326 B11R1.166 O=C(Cl)C1=CC=C(F)C=C1Br SY096547 [0,2,0,0,0,0|2,0,0]=4 1327 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 SY013482 [0,2,0,0,0,0|2,0,0]=4 1328 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 SY007062 [0,2,0,0,0,0|2,0,0]=4 1329 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 SY005366 [0,2,0,0,0,0|2,0,0]=4 1330 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 SY005386 [0,2,0,0,0,0|2,0,0]=4 1331 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 SY003827 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 SY016504 [0,2,0,0,0,0|2,0,0]=4 1333 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 SY004396 [0,2,0,0,0,0|2,0,0]=4 1334 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 SY013510 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 SY012802 [0,2,0,0,0,0|2,0,0]=4 1336 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 SY014322 [0,2,0,0,0,0|2,0,0]=4 1337 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Br SY022642 [0,2,0,0,0,0|2,0,0]=4 1338 B11R1.166 O=C(O)C1=CC=C(Br)C=C1F SY001099 [0,2,0,0,0,0|2,0,0]=4 1339 B11R1.166 O=C(O)C1=CC=C(Br)C=C1I SY041365 [0,2,0,0,0,0|2,0,0]=4 1340 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1Br SY016936 [0,2,0,0,0,0|2,0,0]=4 1341 B11R1.166 O=C(O)C1=CC=C(Cl)C=C1I SY034455 [0,2,0,0,0,0|2,0,0]=4 1342 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br SY011499 [0,2,0,0,0,0|2,0,0]=4 1343 B11R1.166 O=C(O)C1=CC=C(F)C=C1I SY047057 [0,2,0,0,0,0|2,0,0]=4 1344 B11R1.166 O=C(O)C1=CC=C(F)C=[N+]1[O-] SY297835 [0,2,0,0,0,0|1,0,1]=4 1345 B11R1.166 O=C(O)C1=CC=C(I)C=C1Br SY034355 [0,2,0,0,0,0|2,0,0]=4 1346 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl SY002123 [0,2,0,0,0,0|2,0,0]=4 1347 B11R1.166 O=C(O)C1=CC=C(O)C=C1Cl SY059550 [0,2,0,0,0,0|2,0,0]=4 1348 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl SY015713 [0,2,0,0,0,0|1,0,0]=3 1349 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F SY042020 [0,2,0,0,0,0|1,0,0]=3 1350 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br SY101711 [0,2,0,0,0,0|1,0,0]=3 1351 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Cl SY015573 [0,2,0,0,0,0|1,0,0]=3 1352 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F SY074079 [0,2,0,0,0,0|1,0,0]=3 1353 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl SY065280 [0,2,0,0,0,0|2,0,0]=4 1354 B11R1.166 O=C(O)C1=NC=C(F)C=C1F SY008959 [0,2,0,0,0,0|1,0,0]=3 1355 B11R1.166 O=C(O)C1=NN=C(Cl)C=C1Cl SY253864 [0,2,0,0,0,0|2,0,0]=4 1356 B11R1.166 O=C(O)C1=NN=C(O)C=C1O SY271720 [0,2,0,0,0,0|2,0,0]=4 1357 B11R1.166 O=C([O-])C1=CC=C(F)C=C1F SY250605 [0,2,0,0,0,0|2,0,0]=4 1358 B11R1.166 O=C([O-])C1=NN=C(Cl)C=C1Cl SY277148 [0,2,0,0,0,0|2,0,0]=4 1359 B11R1.166 O=[N+]([O-])C1=NC=C(Br)C=C1Br SY029364 [0,2,0,0,0,0|2,0,0]=4 1360 B11R1.166 O=[N+]([O-])C1=NC=C(Br)C=C1O SY127411 [0,2,0,0,0,0|2,0,0]=4 1361 B11R1.166 O=[N+]([O-])C1=NC=C(F)C=C1F SY267146 [0,2,0,0,0,0|2,0,0]=4 1362 B11R1.7 COP(C)(=O)C1=CC=CC=C1 SY300619 [0,2,0,0,0,0|2,0,0]=4 1363 B11R1.16 CCCC(=O)C1=CC=CC=N1 SY005363 [0,2,0,0,0,0|0,0,0]=2 1364 B11R1.16 CCCC(N)C1=NC=CC=C1 SY014554 [0,2,0,0,0,0|1,0,1]=4 1365 B11R1.16 CCOC(=N)C1=CC=CC=C1 SY060984 [0,2,0,0,0,0|2,0,0]=4 1366 B11R1.16 CCOC(=O)C1=CC=NC=C1 SY001919 [0,2,0,0,0,0|2,0,0]=4 1367 B11R1.16 CCOC(=O)C1=CC=NC=N1 SY005565 [0,2,0,0,0,0|1,0,0]=3 1368 B11R1.16 CCOC(=O)C1=CN=CC=N1 SY012364 [0,2,0,0,0,0|1,0,0]=3 1369 B11R1.16 CCOC(=O)C1=NC=CC=C1 SY020537 [0,2,0,0,0,0|0,0,0]=2 1370 B11R1.16 CCOC(=O)C1=NC=CC=N1 SY010066 [0,2,0,0,0,0|1,0,0]=3 1371 B11R1.16 CCOC(=O)C1=NC=CN=N1 SY242551 [0,2,0,0,0,0|2,0,0]=4 1372 B11R1.16 CCO[PH](=O)C1=CC=CC=C1 SY257193 [0,2,0,0,0,0|2,0,0]=4 1373 B11R1.16 CNNC(=O)C1=CC=CC=C1 SY294316 [0,2,0,0,0,0|1,0,0]=3 1374 B11R1.16 N#CCC(=O)C1=CC=CC=C1 SY011838 [0,2,0,0,0,0|1,0,0]=3 1375 B11R1.16 N#CCC(=O)C1=CC=CN=C1 SY019571 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.16 N#CCC(=O)C1=CC=NC=C1 SY101520 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.16 N#CCC(=O)C1=NC=CC=N1 SY268591 [0,2,0,0,0,0|1,0,0]=3 1378 B11R1.16 N#CCC(=O)C1=NC=CN=C1 SY268585 [0,2,0,0,0,0|1,0,0]=3 1379 B11R1.16 NCCC(=O)C1=CC=CC=C1 SY263195 [0,2,0,0,0,0|1,0,0]=3 1380 B11R1.16 O=C(CCCl)C1=CC=CC=C1 SY004650 [0,2,0,0,0,0|1,0,0]=3 1381 B11R1.16 O=C(NCO)C1=CN=CC=C1 SY051839 [0,2,0,0,0,0|2,0,0]=4 1382 B11R1.16 O=C(OCI)C1=CC=CC=C1 SY036475 [0,2,0,0,0,0|1,0,0]=3 1383 B11R1.16 O=C(\C=N\O)C1=CC=CC=C1 SY018003 [0,2,0,0,0,0|1,0,1]=4 1384 B11R1.23 CC1=CC(C(=O)CO)=CC=C1 SY130975 [0,2,0,0,0,0|1,0,0]=3 1385 B11R1.23 CCC(=O)C1=CC(Br)=NC=C1 SY301439 [0,2,0,0,0,0|2,0,0]=4 1386 B11R1.23 CCC(=O)C1=CC=CC(C)=C1 SY004012 [0,2,0,0,0,0|1,0,0]=3 1387 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 SY018227 [0,2,0,0,0,0|1,0,0]=3 1388 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 SY016989 [0,2,0,0,0,0|1,0,0]=3 1389 B11R1.23 CCC(=O)C1=CC=CC(O)=C1 SY047086 [0,2,0,0,0,0|1,0,0]=3 1390 B11R1.23 CNC(=O)C1=CC(Cl)=CC=N1 SY007502 [0,2,0,0,0,0|0,0,0]=2 1391 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 SY051152 [0,2,0,0,0,0|1,0,0]=3 1392 B11R1.23 COC(=N)C1=CC=CC(Br)=C1 SY028780 [0,2,0,0,0,0|2,0,0]=4 1393 B11R1.23 COC(=O)C1=CC(=O)NC=C1 SY027263 [0,2,0,0,0,0|2,0,0]=4 1394 B11R1.23 COC(=O)C1=CC(N)=CN=C1 SY013226 [0,2,0,0,0,0|2,0,0]=4 1395 B11R1.23 COC(=O)C1=CC(N)=NC=C1 SY003259 [0,2,0,0,0,0|2,0,0]=4 1396 B11R1.23 COC(=O)C1=CC(O)=CN=C1 SY003383 [0,2,0,0,0,0|2,0,0]=4 1397 B11R1.23 COC(=O)C1=CC(O)=NC=N1 SY016732 [0,2,0,0,0,0|1,0,0]=3 1398 B11R1.23 COC(=O)C1=CC=CC(=O)N1 SY043112 [0,2,0,0,0,0|0,0,1]=3 1399 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 SY002781 [0,2,0,0,0,0|1,0,0]=3 1400 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 SY033868 [0,2,0,0,0,0|1,0,0]=3 1401 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 SY007550 [0,2,0,0,0,0|0,0,0]=2 1402 B11R1.23 COC(=O)C1=CC=CC(N)=C1 SY031535 [0,2,0,0,0,0|1,0,0]=3 1403 B11R1.23 COC(=O)C1=CC=CC(O)=C1 SY001617 [0,2,0,0,0,0|1,0,0]=3 1404 B11R1.23 COC(=O)C1=CC=CC(S)=C1 SY124895 [0,2,0,0,0,0|1,0,0]=3 1405 B11R1.23 COC(=O)C1=CC=NC(Br)=C1 SY016338 [0,2,0,0,0,0|2,0,0]=4 1406 B11R1.23 COC(=O)C1=CC=NC(C)=C1 SY104461 [0,2,0,0,0,0|2,0,0]=4 1407 B11R1.23 COC(=O)C1=CC=NC(Cl)=C1 SY016465 [0,2,0,0,0,0|2,0,0]=4 1408 B11R1.23 COC(=O)C1=CC=NC(F)=C1 SY047621 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.23 COC(=O)C1=CN=CC(Br)=C1 SY005317 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.23 COC(=O)C1=CN=CC(C)=C1 SY004562 [0,2,0,0,0,0|2,0,0]=4 1411 B11R1.23 COC(=O)C1=CN=CC(O)=C1 SY005899 [0,2,0,0,0,0|2,0,0]=4 1412 B11R1.23 COC(=O)C1=C[N+](C)=CC=C1 SY281801 [0,2,0,0,0,0|2,0,0]=4 1413 B11R1.23 COC(=O)C1=NC(Br)=CC=C1 SY009096 [0,2,0,0,0,0|0,0,0]=2 1414 B11R1.23 COC(=O)C1=NC(Br)=CN=C1 SY011898 [0,2,0,0,0,0|1,0,0]=3 1415 B11R1.23 COC(=O)C1=NC(Br)=NC=C1 SY242088 [0,2,0,0,0,0|1,0,0]=3 1416 B11R1.23 COC(=O)C1=NC(C)=CC=C1 SY030535 [0,2,0,0,0,0|0,0,0]=2 1417 B11R1.23 COC(=O)C1=NC(C)=CN=C1 SY023907 [0,2,0,0,0,0|1,0,0]=3 1418 B11R1.23 COC(=O)C1=NC(Cl)=CN=C1 SY014086 [0,2,0,0,0,0|1,0,0]=3 1419 B11R1.23 COC(=O)C1=NC(Cl)=NC=C1 SY019317 [0,2,0,0,0,0|1,0,0]=3 1420 B11R1.23 COC(=O)C1=NC(N)=CC=C1 SY017264 [0,2,0,0,0,0|0,0,0]=2 1421 B11R1.23 COC(=O)C1=NC(N)=CN=C1 SY017454 [0,2,0,0,0,0|1,0,0]=3 1422 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 SY019236 [0,2,0,0,0,0|0,0,0]=2 1423 B11R1.23 COC(=O)C1=NC=CC(C)=C1 SY284479 [0,2,0,0,0,0|0,0,0]=2 1424 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 SY003263 [0,2,0,0,0,0|0,0,0]=2 1425 B11R1.23 COC(=O)C1=NC=CC(F)=C1 SY240688 [0,2,0,0,0,0|0,0,0]=2 1426 B11R1.23 COC(=O)C1=NC=CC(I)=C1 SY027672 [0,2,0,0,0,0|0,0,0]=2 1427 B11R1.23 COC(=O)C1=NC=CC(N)=C1 SY026101 [0,2,0,0,0,0|0,0,0]=2 1428 B11R1.23 COC(=O)C1=NC=CC(O)=C1 SY011047 [0,2,0,0,0,0|0,0,0]=2 1429 B11R1.23 COC(=O)C1=NC=NC(Cl)=C1 SY015373 [0,2,0,0,0,0|1,0,0]=3 1430 B11R1.23 NCC(=O)C1=CC(Br)=CC=C1 SY019239 [0,2,0,0,0,0|1,0,0]=3 1431 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 SY040432 [0,2,0,0,0,0|2,0,0]=4 1432 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 SY078945 [0,2,0,0,0,0|2,0,0]=4 1433 B11R1.23 NNC(=O)C1=NC(N)=CC=C1 SY129373 [0,2,0,0,0,0|1,0,0]=3 1434 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 SY004172 [0,2,0,0,0,0|1,0,0]=3 1435 B11R1.23 O=C(CBr)C1=CC(Cl)=NC=C1 SY008152 [0,2,0,0,0,0|2,0,0]=4 1436 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 SY014721 [0,2,0,0,0,0|1,0,0]=3 1437 B11R1.23 O=C(CBr)C1=CC=CC(F)=C1 SY031402 [0,2,0,0,0,0|1,0,0]=3 1438 B11R1.23 O=C(CBr)C1=NC(Cl)=NC=C1 SY277325 [0,2,0,0,0,0|1,0,0]=3 1439 B11R1.23 O=C(CO)C1=CC=CC(Br)=C1 SY130965 [0,2,0,0,0,0|1,0,0]=3 1440 B11R1.23 O=C(CO)C1=CC=CC(Cl)=C1 SY130969 [0,2,0,0,0,0|1,0,0]=3 1441 B11R1.23 O=C(CO)C1=CC=CC(F)=C1 SY130967 [0,2,0,0,0,0|1,0,0]=3 1442 B11R1.23 O=C(CO)C1=CC=CC(I)=C1 SY130987 [0,2,0,0,0,0|1,0,0]=3 1443 B11R1.222 C=C(CBr)C1=CC=CC=C1F SY278021 [0,2,0,0,0,0|2,0,0]=4 1444 B11R1.222 CC1=CC=CC=C1C(=O)CO SY130976 [0,2,0,0,0,0|1,0,0]=3 1445 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 SY015244 [0,2,0,0,0,0|1,0,0]=3 1446 B11R1.222 CCC(=O)C1=CC=CC=C1Cl SY031881 [0,2,0,0,0,0|1,0,0]=3 1447 B11R1.222 CCC(=O)C1=CC=CC=C1F SY003995 [0,2,0,0,0,0|1,0,0]=3 1448 B11R1.222 CNC(=O)C1=CC=CC=C1Br SY025140 [0,2,0,0,0,0|1,0,0]=3 1449 B11R1.222 CNC(=O)C1=CC=CC=C1N SY005082 [0,2,0,0,0,0|1,0,0]=3 1450 B11R1.222 CNC(=O)C1=CC=CC=C1O SY034205 [0,2,0,0,0,0|1,0,0]=3 1451 B11R1.222 COC(=N)C1=CC=CC=C1Br SY028779 [0,2,0,0,0,0|2,0,0]=4 1452 B11R1.222 COC(=O)C1=C(Br)C=CC=N1 SY005700 [0,2,0,0,0,0|0,0,0]=2 1453 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 SY013223 [0,2,0,0,0,0|2,0,0]=4 1454 B11R1.222 COC(=O)C1=C(C)C=CC=N1 SY005197 [0,2,0,0,0,0|0,0,0]=2 1455 B11R1.222 COC(=O)C1=C(C)C=NC=C1 SY097021 [0,2,0,0,0,0|2,0,0]=4 1456 B11R1.222 COC(=O)C1=C(Cl)C=CC=C1 SY009666 [0,2,0,0,0,0|1,0,0]=3 1457 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 SY043110 [0,2,0,0,0,0|2,0,0]=4 1458 B11R1.222 COC(=O)C1=C(F)C=CC=C1 SY017085 [0,2,0,0,0,0|1,0,0]=3 1459 B11R1.222 COC(=O)C1=C(N)C=CC=N1 SY005552 [0,2,0,0,0,0|0,0,0]=2 1460 B11R1.222 COC(=O)C1=C(N)C=CN=C1 SY007632 [0,2,0,0,0,0|2,0,0]=4 1461 B11R1.222 COC(=O)C1=C(N)C=NC=C1 SY007492 [0,2,0,0,0,0|2,0,0]=4 1462 B11R1.222 COC(=O)C1=C(N)N=CC=C1 SY007227 [0,2,0,0,0,0|2,0,0]=4 1463 B11R1.222 COC(=O)C1=C(N)N=CC=N1 SY005164 [0,2,0,0,0,0|1,0,0]=3 1464 B11R1.222 COC(=O)C1=C(O)C=CC=C1 SY008800 [0,2,0,0,0,0|1,0,0]=3 1465 B11R1.222 COC(=O)C1=C(O)C=NC=C1 SY005796 [0,2,0,0,0,0|2,0,0]=4 1466 B11R1.222 COC(=O)C1=CC=CC=C1Br SY001469 [0,2,0,0,0,0|1,0,0]=3 1467 B11R1.222 COC(=O)C1=CC=CC=C1I SY002220 [0,2,0,0,0,0|1,0,0]=3 1468 B11R1.222 COC(=O)C1=CC=CN=C1C SY014898 [0,2,0,0,0,0|2,0,0]=4 1469 B11R1.222 COC(=O)C1=CC=CN=C1Cl SY018350 [0,2,0,0,0,0|2,0,0]=4 1470 B11R1.222 COC(=O)C1=CC=CN=C1F SY022292 [0,2,0,0,0,0|2,0,0]=4 1471 B11R1.222 COC(=O)C1=CC=CN=C1N SY298758 [0,2,0,0,0,0|2,0,0]=4 1472 B11R1.222 COC(=O)C1=CC=COC1=O SY035712 [0,2,0,0,0,0|2,0,0]=4 1473 B11R1.222 COC(=O)C1=CC=NC=C1F SY035895 [0,2,0,0,0,0|2,0,0]=4 1474 B11R1.222 COC(=O)C1=CC=NC=C1I SY097031 [0,2,0,0,0,0|2,0,0]=4 1475 B11R1.222 COC(=O)C1=CN=CC=C1C SY030816 [0,2,0,0,0,0|2,0,0]=4 1476 B11R1.222 COC(=O)C1=NC=CC=C1F SY014689 [0,2,0,0,0,0|0,0,0]=2 1477 B11R1.222 COC(=O)C1=NC=CC=C1O SY028348 [0,2,0,0,0,0|0,0,0]=2 1478 B11R1.222 COC(=O)C1=NC=CN=C1Br SY021286 [0,2,0,0,0,0|1,0,0]=3 1479 B11R1.222 COC(=O)C1=NC=CN=C1C SY036007 [0,2,0,0,0,0|1,0,0]=3 1480 B11R1.222 COC(=O)C1=NC=CN=C1Cl SY017459 [0,2,0,0,0,0|1,0,0]=3 1481 B11R1.222 COC(=O)C1=NC=CN=C1I SY023923 [0,2,0,0,0,0|1,0,0]=3 1482 B11R1.222 COC(=O)C1=NC=CN=C1O SY020956 [0,2,0,0,0,0|1,0,0]=3 1483 B11R1.222 COC(=O)C1=NC=NC=C1N SY274674 [0,2,0,0,0,0|1,0,0]=3 1484 B11R1.222 NNC(=O)C1=CC=CC=C1N SY040605 [0,2,0,0,0,0|2,0,0]=4 1485 B11R1.222 O=C(CBr)C1=CC=CC=C1Br SY041192 [0,2,0,0,0,0|1,0,0]=3 1486 B11R1.222 O=C(CBr)C1=CC=CC=C1Cl SY004173 [0,2,0,0,0,0|1,0,0]=3 1487 B11R1.222 O=C(CBr)C1=CC=CC=C1F SY022607 [0,2,0,0,0,0|1,0,0]=3 1488 B11R1.222 O=C(CO)C1=CC=CC=C1Br SY130966 [0,2,0,0,0,0|1,0,0]=3 1489 B11R1.222 O=C(CO)C1=CC=CC=C1Cl SY032642 [0,2,0,0,0,0|1,0,0]=3 1490 B11R1.222 O=C(CO)C1=CC=CC=C1F SY130968 [0,2,0,0,0,0|1,0,0]=3 1491 B11R1.222 O=C(CO)C1=CC=CC=C1I SY130988 [0,2,0,0,0,0|1,0,0]=3 1492 B11R1.222 O=C(NO)C1=CC=CC=C1O SY046520 [0,2,0,0,0,0|2,0,0]=4 1493 B11R1.87 CC(C)(C)C1=NC=CC=C1O SY146834 [0,2,0,0,0,0|1,0,1]=4 1494 B11R1.87 CC1=CC=CC=C1S(C)(=O)=O SY311823 [0,2,0,0,0,0|2,0,0]=4 1495 B11R1.87 CP(C)(=O)C1=CC=CC=C1N SY033213 [0,2,0,0,0,0|2,0,0]=4 1496 B11R1.87 CS(=O)(=O)C1=C(Br)C=CC=C1 SY004099 [0,2,0,0,0,0|2,0,0]=4 1497 B11R1.87 CS(=O)(=O)C1=C(N)C=CC=N1 SY006354 [0,2,0,0,0,0|1,0,0]=3 1498 B11R1.87 CS(=O)(=O)C1=CC=CC=C1N SY130679 [0,2,0,0,0,0|2,0,0]=4 1499 B11R1.155 CC(C)(C)C1=CC=CC(Br)=N1 SY110158 [0,2,0,0,0,0|1,0,1]=4 1500 B11R1.155 CC(C)(C)C1=NC=CC(O)=C1 SY278090 [0,2,0,0,0,0|1,0,1]=4 1501 B11R1.155 CC(C)(O)C1=NC(Br)=CC=C1 SY045747 [0,2,0,0,0,0|0,0,2]=4 1502 B11R1.155 CC(C)(O)C1=NC=CC(Br)=C1 SY034845 [0,2,0,0,0,0|0,0,2]=4 1503 B11R1.155 CC1=NC(S(C)(=O)=O)=NC=C1 SY069163 [0,2,0,0,0,0|2,0,0]=4 1504 B11R1.155 CS(=O)(=O)C1=CC(Br)=CC=C1 SY009420 [0,2,0,0,0,0|2,0,0]=4 1505 B11R1.155 CS(=O)(=O)C1=CC(Cl)=CC=C1 SY030765 [0,2,0,0,0,0|2,0,0]=4 1506 B11R1.155 CS(=O)(=O)C1=CC(N)=CC=C1 SY006327 [0,2,0,0,0,0|2,0,0]=4 1507 B11R1.155 CS(=O)(=O)C1=NC=CC(Br)=N1 SY021345 [0,2,0,0,0,0|2,0,0]=4 1508 B11R1.155 CS(=O)(=O)C1=NC=CC(Cl)=N1 SY017916 [0,2,0,0,0,0|2,0,0]=4 1509 B11R1.53 C#CC1=CC=CC=C1C(=O)O SY101655 [0,2,0,0,0,0|2,0,0]=4 1510 B11R1.53 CC(=O)C1=CC=CC=C1C#N SY012002 [0,2,0,0,0,0|1,0,0]=3 1511 B11R1.53 CCC1=CC=CC=C1C(=O)O SY014274 [0,2,0,0,0,0|2,0,0]=4 1512 B11R1.53 CCC1=NC=CN=C1C(C)=O SY027477 [0,2,0,0,0,0|1,0,0]=3 1513 B11R1.53 COC1=C(C(=O)O)C=CC=C1 SY003594 [0,2,0,0,0,0|2,0,0]=4 1514 B11R1.53 COC1=CC=CC=C1C(C)=O SY036008 [0,2,0,0,0,0|1,0,0]=3 1515 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] SY014533 [0,2,0,0,0,0|2,0,0]=4 1516 B11R1.53 COC1=NC=CC=C1C(C)=O SY038106 [0,2,0,0,0,0|2,0,0]=4 1517 B11R1.53 CSC1=CC=CC=C1C(=O)O SY048265 [0,2,0,0,0,0|2,0,0]=4 1518 B11R1.53 CSC1=CC=CN=C1[N+](=O)[O-] SY284231 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.53 N#CC1=C(C(=O)O)C=CC=C1 SY005782 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.53 N#CC1=CC=CN=C1C(=O)O SY026700 [0,2,0,0,0,0|1,0,0]=3 1521 B11R1.53 NNC1=CC=CC=C1C(=O)O SY017791 [0,2,0,0,0,0|2,0,0]=4 1522 B11R1.53 O=C(O)C1=CC=CC=C1CO SY117339 [0,2,0,0,0,0|2,0,0]=4 1523 B11R1.53 O=CC1=CC=CC=C1C(=O)O SY001395 [0,2,0,0,0,0|2,0,0]=4 1524 B11R1.156 CC(=O)C1=C(C)C=CC=C1C SY074169 [0,2,0,0,0,0|1,0,0]=3 1525 B11R1.156 CC(=O)C1=C(C)C=CC=C1O SY031337 [0,2,0,0,0,0|1,0,0]=3 1526 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl SY035729 [0,2,0,0,0,0|1,0,0]=3 1527 B11R1.156 CC(=O)C1=C(F)C=CC=C1Br SY110819 [0,2,0,0,0,0|1,0,0]=3 1528 B11R1.156 CC(=O)C1=C(F)C=CC=C1Cl SY025862 [0,2,0,0,0,0|1,0,0]=3 1529 B11R1.156 CC(=O)C1=C(F)C=CC=C1F SY001308 [0,2,0,0,0,0|1,0,0]=3 1530 B11R1.156 CC(=O)C1=C(I)C=CN=C1Cl SY282848 [0,2,0,0,0,0|2,0,0]=4 1531 B11R1.156 CC(=O)C1=C(I)C=CN=C1F SY282847 [0,2,0,0,0,0|2,0,0]=4 1532 B11R1.156 CC(=O)C1=C(O)C=CC=C1Br SY038184 [0,2,0,0,0,0|1,0,0]=3 1533 B11R1.156 CC(=O)C1=C(O)C=CC=C1F SY031353 [0,2,0,0,0,0|1,0,0]=3 1534 B11R1.156 CC(=O)C1=C(O)C=CC=C1O SY001633 [0,2,0,0,0,0|1,0,0]=3 1535 B11R1.156 CC1=C(C(=O)Cl)C(Cl)=CC=C1 SY012203 [0,2,0,0,0,0|2,0,0]=4 1536 B11R1.156 CC1=C(C(=O)O)C(Br)=CC=C1 SY024836 [0,2,0,0,0,0|2,0,0]=4 1537 B11R1.156 CC1=C(C(=O)O)C(Cl)=CC=C1 SY012233 [0,2,0,0,0,0|2,0,0]=4 1538 B11R1.156 CC1=C(C(=O)O)C(O)=CC=C1 SY030546 [0,2,0,0,0,0|2,0,0]=4 1539 B11R1.156 CC1=CC=CC(C)=C1C(=O)Cl SY262919 [0,2,0,0,0,0|2,0,0]=4 1540 B11R1.156 CC1=CC=CC(C)=C1C(=O)O SY009326 [0,2,0,0,0,0|2,0,0]=4 1541 B11R1.156 CC1=CC=CC(F)=C1C(=O)O SY004929 [0,2,0,0,0,0|2,0,0]=4 1542 B11R1.156 CC1=CC=CC(N)=C1C(=O)O SY008213 [0,2,0,0,0,0|2,0,0]=4 1543 B11R1.156 NC(=O)C1=C(Br)C=CC=C1N SY030676 [0,2,0,0,0,0|2,0,0]=4 1544 B11R1.156 NC(=O)C1=C(F)C=CC=C1F SY003317 [0,2,0,0,0,0|2,0,0]=4 1545 B11R1.156 NC(=O)C1=C(F)C=CC=C1N SY002732 [0,2,0,0,0,0|2,0,0]=4 1546 B11R1.156 NC1=C(C(=O)O)C(Br)=CC=C1 SY005767 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.156 NC1=C(C(=O)O)C(F)=CC=C1 SY005291 [0,2,0,0,0,0|2,0,0]=4 1548 B11R1.156 NC1=CC=CC(Cl)=C1C(=O)O SY001857 [0,2,0,0,0,0|2,0,0]=4 1549 B11R1.156 NC1=CC=CC(I)=C1C(=O)O SY027424 [0,2,0,0,0,0|2,0,0]=4 1550 B11R1.156 O=C(Cl)C1=C(F)C=CC=C1Cl SY049328 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Br SY023708 [0,2,0,0,0,0|2,0,0]=4 1552 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl SY002588 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.156 O=C(O)C1=C(F)C=CC=C1Br SY004390 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.156 O=C(O)C1=C(F)C=CC=C1Cl SY014386 [0,2,0,0,0,0|2,0,0]=4 1555 B11R1.156 O=C(O)C1=C(F)C=CC=C1F SY003297 [0,2,0,0,0,0|2,0,0]=4 1556 B11R1.156 O=C(O)C1=C(F)C=CC=C1O SY016812 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.156 O=C(O)C1=C(I)C=CC=C1Cl SY103266 [0,2,0,0,0,0|2,0,0]=4 1558 B11R1.156 O=C(O)C1=C(I)C=CC=C1F SY017830 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.156 O=C(O)C1=C(O)C=CC=C1O SY005481 [0,2,0,0,0,0|2,0,0]=4 1560 B11R1.159 CC(=O)C1=C(O)C(F)=CC=C1 SY008708 [0,2,0,0,0,0|1,0,0]=3 1561 B11R1.159 CC(=O)C1=CC=CC(Br)=C1C SY125106 [0,2,0,0,0,0|1,0,0]=3 1562 B11R1.159 CC(=O)C1=CC=CC(Br)=C1F SY018858 [0,2,0,0,0,0|1,0,0]=3 1563 B11R1.159 CC(=O)C1=CC=CC(Br)=C1O SY029325 [0,2,0,0,0,0|1,0,0]=3 1564 B11R1.159 CC(=O)C1=CC=CC(C)=C1C SY045549 [0,2,0,0,0,0|1,0,0]=3 1565 B11R1.159 CC(=O)C1=CC=CC(C)=C1O SY102951 [0,2,0,0,0,0|1,0,0]=3 1566 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl SY106381 [0,2,0,0,0,0|1,0,0]=3 1567 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1F SY037334 [0,2,0,0,0,0|1,0,0]=3 1568 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1O SY045761 [0,2,0,0,0,0|1,0,0]=3 1569 B11R1.159 CC(=O)C1=CC=CC(F)=C1Br SY121372 [0,2,0,0,0,0|1,0,0]=3 1570 B11R1.159 CC(=O)C1=CC=CC(N)=C1O SY022839 [0,2,0,0,0,0|1,0,0]=3 1571 B11R1.159 CC(=O)C1=NC=NC(Cl)=C1F SY247539 [0,2,0,0,0,0|1,0,0]=3 1572 B11R1.159 CC1=C(Br)C(C(=O)O)=CC=C1 SY005150 [0,2,0,0,0,0|2,0,0]=4 1573 B11R1.159 CC1=C(Br)C=CC=C1C(=O)O SY004585 [0,2,0,0,0,0|2,0,0]=4 1574 B11R1.159 CC1=C(C(=O)O)C=CC=C1F SY017155 [0,2,0,0,0,0|2,0,0]=4 1575 B11R1.159 CC1=C(C)C(C(=O)O)=CC=C1 SY004805 [0,2,0,0,0,0|2,0,0]=4 1576 B11R1.159 CC1=C(Cl)C(C(=O)O)=CC=C1 SY014477 [0,2,0,0,0,0|2,0,0]=4 1577 B11R1.159 CC1=C(Cl)C=CC=C1C(=O)O SY014306 [0,2,0,0,0,0|2,0,0]=4 1578 B11R1.159 CC1=C(I)C(C(=O)O)=CC=C1 SY025091 [0,2,0,0,0,0|2,0,0]=4 1579 B11R1.159 CC1=C(I)C=CC=C1C(=O)O SY017775 [0,2,0,0,0,0|2,0,0]=4 1580 B11R1.159 CC1=C(N)C(C(=O)O)=CC=C1 SY010470 [0,2,0,0,0,0|2,0,0]=4 1581 B11R1.159 CC1=C(N)C(C(C)C)=NC=C1 SY251570 [0,2,0,0,0,0|1,0,1]=4 1582 B11R1.159 CC1=C(N)C=CC=C1C(=O)O SY013487 [0,2,0,0,0,0|2,0,0]=4 1583 B11R1.159 CC1=C(O)C(C(=O)O)=CC=C1 SY014329 [0,2,0,0,0,0|2,0,0]=4 1584 B11R1.159 CC1=C(O)C(C(N)=O)=CC=C1 SY033355 [0,2,0,0,0,0|2,0,0]=4 1585 B11R1.159 CC1=C(O)C([N+](=O)[O-])=NC=C1 SY107602 [0,2,0,0,0,0|2,0,0]=4 1586 B11R1.159 CC1=C(O)C=CC=C1C(=O)O SY001962 [0,2,0,0,0,0|2,0,0]=4 1587 B11R1.159 CC1=CC=CC(C(=O)O)=C1F SY014074 [0,2,0,0,0,0|2,0,0]=4 1588 B11R1.159 NC(=O)C1=C(Cl)C(Cl)=CC=N1 SY010638 [0,2,0,0,0,0|1,0,0]=3 1589 B11R1.159 NC(=O)C1=C(I)C(Cl)=CC=N1 SY010640 [0,2,0,0,0,0|1,0,0]=3 1590 B11R1.159 NC(=O)C1=CC=CC(Br)=C1N SY034768 [0,2,0,0,0,0|2,0,0]=4 1591 B11R1.159 NC(=O)C1=CC=CC(N)=C1N SY033300 [0,2,0,0,0,0|2,0,0]=4 1592 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O SY004317 [0,2,0,0,0,0|2,0,0]=4 1593 B11R1.159 NC1=C(Cl)C=CC=C1C(=O)O SY030539 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 SY110162 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.159 NC1=C(F)C=CC=C1C(=O)O SY005278 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.159 NC1=C(I)C=CC=C1C(=O)O SY027083 [0,2,0,0,0,0|2,0,0]=4 1597 B11R1.159 NC1=C(O)C=CC=C1C(=O)O SY030553 [0,2,0,0,0,0|2,0,0]=4 1598 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Cl SY024817 [0,2,0,0,0,0|2,0,0]=4 1599 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F SY002982 [0,2,0,0,0,0|2,0,0]=4 1600 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Br SY024816 [0,2,0,0,0,0|2,0,0]=4 1601 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Cl SY023164 [0,2,0,0,0,0|2,0,0]=4 1602 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F SY014701 [0,2,0,0,0,0|2,0,0]=4 1603 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O SY030141 [0,2,0,0,0,0|2,0,0]=4 1604 B11R1.159 O=C(O)C1=CC=CC(F)=C1Br SY003121 [0,2,0,0,0,0|2,0,0]=4 1605 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl SY019211 [0,2,0,0,0,0|2,0,0]=4 1606 B11R1.159 O=C(O)C1=CC=CC(F)=C1F SY012745 [0,2,0,0,0,0|2,0,0]=4 1607 B11R1.159 O=C(O)C1=CC=CC(I)=C1Br SY040811 [0,2,0,0,0,0|2,0,0]=4 1608 B11R1.159 O=C(O)C1=CC=CC(I)=C1F SY107047 [0,2,0,0,0,0|2,0,0]=4 1609 B11R1.159 O=C(O)C1=CC=CC(O)=C1F SY005530 [0,2,0,0,0,0|2,0,0]=4 1610 B11R1.159 O=C(O)C1=CC=CC(O)=C1O SY003494 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.159 O=C(O)C1=NC=CC(Cl)=C1Cl SY012333 [0,2,0,0,0,0|1,0,0]=3 1612 B11R1.159 O=[N+]([O-])C1=NC=CC(Br)=C1O SY274219 [0,2,0,0,0,0|2,0,0]=4 1613 B11R1.167 CC(=O)C1=C(F)C=NC(Cl)=C1 SY299578 [0,2,0,0,0,0|2,0,0]=4 1614 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 SY011591 [0,2,0,0,0,0|1,0,0]=3 1615 B11R1.167 CC(=O)C1=CC(Br)=CC=C1F SY022874 [0,2,0,0,0,0|1,0,0]=3 1616 B11R1.167 CC(=O)C1=CC(Br)=CC=C1N SY025672 [0,2,0,0,0,0|1,0,0]=3 1617 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O SY018236 [0,2,0,0,0,0|1,0,0]=3 1618 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F SY097071 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.167 CC(=O)C1=CC(C)=CC=C1O SY048474 [0,2,0,0,0,0|1,0,0]=3 1620 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1Br SY067370 [0,2,0,0,0,0|1,0,0]=3 1621 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1Cl SY003147 [0,2,0,0,0,0|1,0,0]=3 1622 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1F SY038015 [0,2,0,0,0,0|1,0,0]=3 1623 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1N SY035053 [0,2,0,0,0,0|1,0,0]=3 1624 B11R1.167 CC(=O)C1=CC(F)=CC=C1Br SY047075 [0,2,0,0,0,0|1,0,0]=3 1625 B11R1.167 CC(=O)C1=CC(F)=CC=C1Cl SY003104 [0,2,0,0,0,0|1,0,0]=3 1626 B11R1.167 CC(=O)C1=CC(F)=CC=C1F SY037528 [0,2,0,0,0,0|1,0,0]=3 1627 B11R1.167 CC(=O)C1=CC(F)=CC=C1I SY078739 [0,2,0,0,0,0|1,0,0]=3 1628 B11R1.167 CC(=O)C1=CC(F)=CC=C1N SY113404 [0,2,0,0,0,0|1,0,0]=3 1629 B11R1.167 CC(=O)C1=CC(F)=CC=C1O SY002859 [0,2,0,0,0,0|1,0,0]=3 1630 B11R1.167 CC(=O)C1=CC(N)=CC=C1Cl SY262880 [0,2,0,0,0,0|1,0,0]=3 1631 B11R1.167 CC(=O)C1=NC(Br)=CC=C1F SY166525 [0,2,0,0,0,0|0,0,0]=2 1632 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 SY004815 [0,2,0,0,0,0|2,0,0]=4 1633 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 SY003687 [0,2,0,0,0,0|2,0,0]=4 1634 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 SY012919 [0,2,0,0,0,0|2,0,0]=4 1635 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 SY013534 [0,2,0,0,0,0|2,0,0]=4 1636 B11R1.167 CC1=CC=C(Br)C(C(=O)O)=C1 SY017020 [0,2,0,0,0,0|2,0,0]=4 1637 B11R1.167 CC1=CC=C(Br)C(C(=O)O)=N1 SY041255 [0,2,0,0,0,0|1,0,0]=3 1638 B11R1.167 CC1=CC=C(Br)N=C1C(=O)Cl SY261966 [0,2,0,0,0,0|1,0,0]=3 1639 B11R1.167 CC1=CC=C(Cl)C=C1C(=O)O SY002657 [0,2,0,0,0,0|2,0,0]=4 1640 B11R1.167 CC1=CC=C(Cl)N=C1C(=O)O SY104819 [0,2,0,0,0,0|1,0,0]=3 1641 B11R1.167 CC1=CC=C(F)C(C(=O)O)=C1 SY016924 [0,2,0,0,0,0|2,0,0]=4 1642 B11R1.167 CC1=CC=C(I)C(C(=O)O)=C1 SY017105 [0,2,0,0,0,0|2,0,0]=4 1643 B11R1.167 CC1=CC=C(I)C=C1C(=O)O SY021476 [0,2,0,0,0,0|2,0,0]=4 1644 B11R1.167 CC1=CC=C(N)C(C(=O)O)=C1 SY002917 [0,2,0,0,0,0|2,0,0]=4 1645 B11R1.167 CC1=CC=C(N)C=C1C(=O)O SY031003 [0,2,0,0,0,0|2,0,0]=4 1646 B11R1.167 CC1=CC=C(O)C([N+](=O)[O-])=N1 SY078886 [0,2,0,0,0,0|2,0,0]=4 1647 B11R1.167 CC1=CC=C(O)C=C1C(=O)O SY013428 [0,2,0,0,0,0|2,0,0]=4 1648 B11R1.167 CS(=O)C1=CC(F)=CC=C1N SY280325 [0,2,0,0,0,0|2,0,0]=4 1649 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 SY017256 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.167 NC(=O)C1=CC(Br)=CC=C1N SY062852 [0,2,0,0,0,0|2,0,0]=4 1651 B11R1.167 NC(=O)C1=CC(Br)=CC=C1O SY046600 [0,2,0,0,0,0|2,0,0]=4 1652 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1O SY020990 [0,2,0,0,0,0|2,0,0]=4 1653 B11R1.167 NC(=O)C1=CC(F)=CC=C1N SY047056 [0,2,0,0,0,0|2,0,0]=4 1654 B11R1.167 NC(=O)C1=CC(N)=CC=C1Cl SY168131 [0,2,0,0,0,0|2,0,0]=4 1655 B11R1.167 NC(=O)C1=NC(Br)=CC=C1N SY260187 [0,2,0,0,0,0|1,0,0]=3 1656 B11R1.167 NC(=O)C1=NC(Br)=CN=C1O SY102916 [0,2,0,0,0,0|2,0,0]=4 1657 B11R1.167 NC(=O)C1=NC(Cl)=CC=C1N SY044691 [0,2,0,0,0,0|1,0,0]=3 1658 B11R1.167 NC(=O)C1=NC(Cl)=CN=C1O SY040393 [0,2,0,0,0,0|2,0,0]=4 1659 B11R1.167 NC(=O)C1=NC(F)=CNC1=O SY110833 [0,2,0,0,0,0|2,0,0]=4 1660 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 SY004954 [0,2,0,0,0,0|2,0,0]=4 1661 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 SY007113 [0,2,0,0,0,0|2,0,0]=4 1662 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 SY003280 [0,2,0,0,0,0|2,0,0]=4 1663 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 SY018051 [0,2,0,0,0,0|2,0,0]=4 1664 B11R1.167 NC1=CC=C(Br)C(C(=O)O)=C1 SY013433 [0,2,0,0,0,0|2,0,0]=4 1665 B11R1.167 NC1=CC=C(Br)N=C1C(=O)O SY129388 [0,2,0,0,0,0|1,0,0]=3 1666 B11R1.167 NC1=CC=C(Cl)C=C1C(=O)O SY001607 [0,2,0,0,0,0|2,0,0]=4 1667 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O SY006459 [0,2,0,0,0,0|1,0,0]=3 1668 B11R1.167 NC1=CC=C(F)C(C(=O)O)=C1 SY030633 [0,2,0,0,0,0|2,0,0]=4 1669 B11R1.167 NC1=CC=C(O)C(C(=O)O)=C1 SY002854 [0,2,0,0,0,0|2,0,0]=4 1670 B11R1.167 NC1=CC=C(O)C(C(=O)[O-])=C1 SY022045 [0,2,0,0,0,0|2,0,0]=4 1671 B11R1.167 O=C(Cl)C1=CC(Br)=CC=C1I SY247915 [0,2,0,0,0,0|2,0,0]=4 1672 B11R1.167 O=C(Cl)C1=CC(Cl)=CC=C1Cl SY051215 [0,2,0,0,0,0|2,0,0]=4 1673 B11R1.167 O=C(Cl)C1=CC(F)=CC=C1Br SY292633 [0,2,0,0,0,0|2,0,0]=4 1674 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 SY013560 [0,2,0,0,0,0|2,0,0]=4 1675 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 SY013711 [0,2,0,0,0,0|2,0,0]=4 1676 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 SY013549 [0,2,0,0,0,0|2,0,0]=4 1677 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 SY017058 [0,2,0,0,0,0|2,0,0]=4 1678 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 SY009582 [0,2,0,0,0,0|2,0,0]=4 1679 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 SY013536 [0,2,0,0,0,0|2,0,0]=4 1680 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 SY007435 [0,2,0,0,0,0|2,0,0]=4 1681 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 SY014321 [0,2,0,0,0,0|2,0,0]=4 1682 B11R1.167 O=C(O)C1=CC(Br)=CC=C1Cl SY001457 [0,2,0,0,0,0|2,0,0]=4 1683 B11R1.167 O=C(O)C1=CC(Br)=CC=C1F SY010172 [0,2,0,0,0,0|2,0,0]=4 1684 B11R1.167 O=C(O)C1=CC(Br)=CC=C1I SY015033 [0,2,0,0,0,0|2,0,0]=4 1685 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1I SY025681 [0,2,0,0,0,0|2,0,0]=4 1686 B11R1.167 O=C(O)C1=CC(F)=CC=C1Br SY001902 [0,2,0,0,0,0|2,0,0]=4 1687 B11R1.167 O=C(O)C1=CC(F)=CC=C1Cl SY019215 [0,2,0,0,0,0|2,0,0]=4 1688 B11R1.167 O=C(O)C1=CC(F)=CC=C1I SY030950 [0,2,0,0,0,0|2,0,0]=4 1689 B11R1.167 O=C(O)C1=CC(I)=CC=C1Br SY013658 [0,2,0,0,0,0|2,0,0]=4 1690 B11R1.167 O=C(O)C1=CC(I)=CC=C1Cl SY006737 [0,2,0,0,0,0|2,0,0]=4 1691 B11R1.167 O=C(O)C1=CC(I)=CC=C1F SY018260 [0,2,0,0,0,0|2,0,0]=4 1692 B11R1.167 O=C(O)C1=CC(I)=CC=C1I SY062550 [0,2,0,0,0,0|2,0,0]=4 1693 B11R1.167 O=C(O)C1=CC(I)=CC=C1O SY049057 [0,2,0,0,0,0|2,0,0]=4 1694 B11R1.167 O=C(O)C1=CC(O)=CC=C1F SY021836 [0,2,0,0,0,0|2,0,0]=4 1695 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br SY143982 [0,2,0,0,0,0|1,0,0]=3 1696 B11R1.167 O=C(O)C1=NC(Br)=CC=C1F SY045464 [0,2,0,0,0,0|1,0,0]=3 1697 B11R1.167 O=C(O)C1=NC(Br)=CN=C1Br SY021153 [0,2,0,0,0,0|2,0,0]=4 1698 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br SY023711 [0,2,0,0,0,0|1,0,0]=3 1699 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F SY077990 [0,2,0,0,0,0|1,0,0]=3 1700 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Cl SY111755 [0,2,0,0,0,0|2,0,0]=4 1701 B11R1.167 O=C(O)C1=NC(F)=CC=C1Br SY153635 [0,2,0,0,0,0|1,0,0]=3 1702 B11R1.167 O=C([O-])C1=CC(Cl)=CC=C1Cl SY040595 [0,2,0,0,0,0|2,0,0]=4 1703 B11R1.167 O=[N+]([O-])C1=NC(Br)=CC=C1O SY042932 [0,2,0,0,0,0|2,0,0]=4 1704 B11R1.167 O=[N+]([O-])C1=NC(Cl)=CC=C1O SY035151 [0,2,0,0,0,0|2,0,0]=4 1705 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 SY019787 [0,2,0,0,0,0|1,0,0]=3 1706 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 SY050158 [0,2,0,0,0,0|1,0,0]=3 1707 B11R1.74 CC(=O)C1=CC(Cl)=CC(Br)=C1 SY108552 [0,2,0,0,0,0|1,0,0]=3 1708 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 SY029088 [0,2,0,0,0,0|1,0,0]=3 1709 B11R1.74 CC(=O)C1=CC(F)=CC(Br)=C1 SY018857 [0,2,0,0,0,0|1,0,0]=3 1710 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 SY019254 [0,2,0,0,0,0|1,0,0]=3 1711 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 SY015793 [0,2,0,0,0,0|1,0,0]=3 1712 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 SY018398 [0,2,0,0,0,0|2,0,0]=4 1713 B11R1.74 CC1=CC(C(=O)O)=CC(F)=C1 SY019007 [0,2,0,0,0,0|2,0,0]=4 1714 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 SY023413 [0,2,0,0,0,0|1,0,0]=3 1715 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 SY012192 [0,2,0,0,0,0|2,0,0]=4 1716 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 SY023243 [0,2,0,0,0,0|2,0,0]=4 1717 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 SY012261 [0,2,0,0,0,0|2,0,0]=4 1718 B11R1.74 CC1=NC(C(=O)O)=CC(=O)N1 SY045137 [0,2,0,0,0,0|2,0,0]=4 1719 B11R1.74 NC(=O)C1=NC(Cl)=NC(Cl)=C1 SY111600 [0,2,0,0,0,0|2,0,0]=4 1720 B11R1.74 NC1=CC(C(=O)O)=CC(Br)=C1 SY025599 [0,2,0,0,0,0|2,0,0]=4 1721 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 SY001026 [0,2,0,0,0,0|2,0,0]=4 1722 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 SY002353 [0,2,0,0,0,0|2,0,0]=4 1723 B11R1.74 NC1=CC(Cl)=CC(C(=O)O)=C1 SY007084 [0,2,0,0,0,0|2,0,0]=4 1724 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 SY006266 [0,2,0,0,0,0|2,0,0]=4 1725 B11R1.74 O=C(O)C1=CC(Br)=CC(I)=C1 SY008050 [0,2,0,0,0,0|2,0,0]=4 1726 B11R1.74 O=C(O)C1=CC(Cl)=CC(Br)=C1 SY024815 [0,2,0,0,0,0|2,0,0]=4 1727 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 SY001678 [0,2,0,0,0,0|2,0,0]=4 1728 B11R1.74 O=C(O)C1=CC(F)=CC(Br)=C1 SY016894 [0,2,0,0,0,0|2,0,0]=4 1729 B11R1.74 O=C(O)C1=CC(F)=CC(Cl)=C1 SY019216 [0,2,0,0,0,0|2,0,0]=4 1730 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 SY013820 [0,2,0,0,0,0|2,0,0]=4 1731 B11R1.74 O=C(O)C1=CC(I)=CC(Cl)=C1 SY041675 [0,2,0,0,0,0|2,0,0]=4 1732 B11R1.74 O=C(O)C1=CC(O)=CC(Br)=C1 SY036587 [0,2,0,0,0,0|2,0,0]=4 1733 B11R1.74 O=C(O)C1=CC(O)=CC(Cl)=C1 SY025109 [0,2,0,0,0,0|2,0,0]=4 1734 B11R1.74 O=C(O)C1=CC(O)=CC(F)=C1 SY030488 [0,2,0,0,0,0|2,0,0]=4 1735 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 SY003472 [0,2,0,0,0,0|2,0,0]=4 1736 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 SY057644 [0,2,0,0,0,0|1,0,0]=3 1737 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=N1 SY018399 [0,2,0,0,0,0|2,0,0]=4 1738 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 SY003231 [0,2,0,0,0,0|2,0,0]=4 1739 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 SY283676 [0,2,0,0,0,0|1,0,0]=3 1740 B11R1.266 CC(=O)C1=CC(C#N)=CC=C1 SY002919 [0,2,0,0,0,0|1,0,0]=3 1741 B11R1.266 CC(C)C1=CC(C#N)=CC=N1 SY263213 [0,2,0,0,0,0|1,0,1]=4 1742 B11R1.266 COC1=CC(C(=O)O)=CC=C1 SY002325 [0,2,0,0,0,0|2,0,0]=4 1743 B11R1.266 COC1=CC(C(=O)O)=NC=C1 SY003218 [0,2,0,0,0,0|1,0,0]=3 1744 B11R1.266 COC1=CC(C(C)=O)=CC=C1 SY003673 [0,2,0,0,0,0|1,0,0]=3 1745 B11R1.266 COC1=CC([N+](=O)[O-])=NC=C1 SY289330 [0,2,0,0,0,0|2,0,0]=4 1746 B11R1.266 COC1=CC=CC(C(=O)O)=N1 SY007551 [0,2,0,0,0,0|1,0,0]=3 1747 B11R1.266 COC1=NC(C(=O)O)=CN=C1 SY004494 [0,2,0,0,0,0|2,0,0]=4 1748 B11R1.266 CSC1=CC(C(=O)O)=CC=C1 SY115628 [0,2,0,0,0,0|2,0,0]=4 1749 B11R1.266 CSC1=NC(C(=O)O)=CC=N1 SY024244 [0,2,0,0,0,0|2,0,0]=4 1750 B11R1.266 N#CC1=CC(C(=O)O)=NC=C1 SY029383 [0,2,0,0,0,0|1,0,0]=3 1751 B11R1.266 NC(=O)C1=CC=CC(C=O)=C1 SY065783 [0,2,0,0,0,0|2,0,0]=4 1752 B11R1.266 NC(=O)C1=CC=CC(CBr)=C1 SY113429 [0,2,0,0,0,0|2,0,0]=4 1753 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 SY018502 [0,2,0,0,0,0|2,0,0]=4 1754 B11R1.266 NNC1=CC(C(=O)O)=CC=C1 SY022176 [0,2,0,0,0,0|2,0,0]=4 1755 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 SY018871 [0,2,0,0,0,0|2,0,0]=4 1756 B11R1.266 O=C(O)C1=CC=CC(CO)=C1 SY110718 [0,2,0,0,0,0|2,0,0]=4 1757 B11R1.266 O=CC1=CC(C(=O)O)=CC=C1 SY003064 [0,2,0,0,0,0|2,0,0]=4 1758 B9R1.13 CC(=O)NC1=NC=CS1 SY049337 [0,0,1,1,0,0|2,0,0]=4 1759 B9R1.13 CC(=O)NC1=NNC=C1 SY013182 [0,0,1,1,0,0|2,0,0]=4 1760 B9R1.5 O=C1C=CC=CC=C1O SY009930 [0,0,1,1,0,0|1,0,1]=4 1761 B9R2.50 C1=CC=C2CCC2=C1 SY052978 [1,0,0,1,0,0|1,0,1]=4 1762 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 SY004720 [0,0,0,1,0,1|2,0,0]=4 1763 B11R2.10 CC1=CC2=C(C=CC=C2)C1 SY037985 [0,0,0,1,0,1|2,0,0]=4 1764 B11R2.10 CC1=CC2=CC=CC=C2O1 SY039830 [0,0,0,1,0,1|1,0,1]=4 1765 B11R2.10 CC1=CN2C=CC=CC2=C1 SY261692 [0,0,0,1,0,1|1,0,1]=4 1766 B11R2.10 CC1=NC2=CC=CC=C2N1 SY015991 [0,0,0,1,0,1|2,0,0]=4 1767 B11R2.10 CC1=NC2=CC=CC=C2O1 SY048477 [0,0,0,1,0,1|1,0,1]=4 1768 B11R2.10 CC1=NC2=CC=CC=C2S1 SY001190 [0,0,0,1,0,1|1,1,0]=4 1769 B11R2.10 CC1=NC2=CC=CN=C2O1 SY018740 [0,0,0,1,0,1|1,0,0]=3 1770 B11R2.10 CC1=NC2=NC=CC=C2O1 SY018743 [0,0,0,1,0,1|0,0,1]=3 1771 B11R2.10 ClC1=NC2=CC=CN=C2O1 SY047505 [0,0,0,1,0,1|2,0,0]=4 1772 B11R2.10 ClC1=NC2=NC=CC=C2O1 SY130040 [0,0,0,1,0,1|1,0,1]=4 1773 B11R2.10 NC1=NC2=CC=CN=C2O1 SY130073 [0,0,0,1,0,1|2,0,0]=4 1774 B11R2.10 NC1=NC2=NC=CC=C2N1 SY039624 [0,0,0,1,0,1|2,0,0]=4 1775 B11R2.10 NC1=NC2=NC=CC=C2O1 SY130061 [0,0,0,1,0,1|1,0,1]=4 1776 B11R2.10 NC1=NC2=NC=CC=C2S1 SY103526 [0,0,0,1,0,1|1,1,0]=4 1777 B11R2.10 O=C1CC2=C(C=CC=C2)C1 SY001481 [0,0,0,1,0,1|1,0,0]=3 1778 B11R2.10 O=C1CC2=C(C=CC=C2)O1 SY038967 [0,0,0,1,0,1|1,0,0]=3 1779 B11R2.10 O=C1CC2=CC=CC=C2N1 SY004718 [0,0,0,1,0,1|1,0,0]=3 1780 B11R2.10 O=C1CC2=CC=CN=C2N1 SY008090 [0,0,0,1,0,1|0,0,0]=2 1781 B11R2.10 O=C1NC2=C(C=CC=C2)O1 SY007021 [0,0,0,1,0,1|2,0,0]=4 1782 B11R2.10 O=C1NC2=C(N=CC=C2)N1 SY007153 [0,0,0,1,0,1|1,0,0]=3 1783 B11R2.10 O=C1NC2=CC=CN=C2O1 SY116296 [0,0,0,1,0,1|1,0,0]=3 1784 B11R2.10 O=C1NC2=NC=CC=C2O1 SY007988 [0,0,0,1,0,1|1,0,0]=3 1785 B11R2.10 S=C1NC2=CC=CN=C2O1 SY130024 [0,0,0,1,0,1|1,1,0]=4 1786 B11R2.10 S=C1NC2=NC=CC=C2O1 SY086794 [0,0,0,1,0,1|1,0,1]=4 1787 B11R2.34 FC1=CN=C(C2CC2)C=C1 SY203733 [0,1,0,1,0,0|1,0,1]=4 1788 B11R2.1 BrC1=C2N=CC=CC2=NS1 SY290118 [0,1,0,1,0,0|1,1,0]=4 1789 B11R2.1 BrC1=CNC2=CC=CN=C12 SY065439 [0,1,0,1,0,0|1,0,1]=4 1790 B11R2.1 BrC1=NNC2=CC=CN=C21 SY008435 [0,1,0,1,0,0|2,0,0]=4 1791 B11R2.1 C=C1CCC2=C1C=CC=C2 SY031740 [0,1,0,1,0,0|2,0,0]=4 1792 B11R2.1 CC1=C2C=CC=CC2=NO1 SY246355 [0,1,0,1,0,0|1,0,1]=4 1793 B11R2.1 CC1=COC2=CC=CC=C12 SY028461 [0,1,0,1,0,0|1,0,1]=4 1794 B11R2.1 CC1=NNC2=C1C=CC=C2 SY015996 [0,1,0,1,0,0|2,0,0]=4 1795 B11R2.1 CN1C=CC2=C1N=CC=C2 SY060390 [0,1,0,1,0,0|2,0,0]=4 1796 B11R2.1 NC1=NCC2=C1C=CC=C2 SY027372 [0,1,0,1,0,0|2,0,0]=4 1797 B11R2.1 O=C1CCC2=C1C=CC=C2 SY001380 [0,1,0,1,0,0|1,0,0]=3 1798 B11R2.1 O=C1CCC2=C1C=CN=C2 SY009406 [0,1,0,1,0,0|2,0,0]=4 1799 B11R2.1 O=C1CCC2=CC=CN=C12 SY009408 [0,1,0,1,0,0|0,0,0]=2 1800 B11R2.1 O=C1CCC2=NC=CC=C12 SY009444 [0,1,0,1,0,0|2,0,0]=4 1801 B11R2.1 O=C1COC2=C1C=CC=C2 SY011530 [0,1,0,1,0,0|1,0,0]=3 1802 B11R2.1 O=C1CSC2=CC=CC=C12 SY030591 [0,1,0,1,0,0|1,0,0]=3 1803 B11R2.1 O=C1NCC2=C1C=CC=C2 SY020116 [0,1,0,1,0,0|1,0,0]=3 1804 B11R2.1 O=C1NCC2=CC=CN=C12 SY206198 [0,1,0,1,0,0|0,0,0]=2 1805 B11R2.1 O=C1NNC2=C1C=CC=C2 SY051085 [0,1,0,1,0,0|2,0,0]=4 1806 B11R2.1 O=C1OCC2=C1C=CC=C2 SY001701 [0,1,0,1,0,0|1,0,0]=3 1807 B11R2.1 O=C1OCC2=C1C=CN=C2 SY045272 [0,1,0,1,0,0|2,0,0]=4 1808 B11R2.1 O=C1OCC2=NC=CC=C12 SY033776 [0,1,0,1,0,0|2,0,0]=4 1809 B11R2.1 O=C1SSC2=CC=CC=C12 SY123412 [0,1,0,1,0,0|2,0,0]=4 1810 B11R2.1 OC1CCC2=C1N=CC=C2 SY017306 [0,1,0,1,0,0|0,0,2]=4 1811 B11R2.40 NC1(C2=CC=CC=N2)CC1 SY012362 [0,1,0,1,0,0|1,0,1]=4 1812 B11R2.40 NC1(C2=NC=CC=C2)CC1 SY010720 [0,1,0,1,0,0|1,0,1]=4 1813 B11R2.40 OC1(C2=NC=CC=C2)CC1 SY262670 [0,1,0,1,0,0|0,0,2]=4 1814 B11R2.239 C1=CN=C(C2CNC2)C=C1 SY267180 [0,1,0,1,0,0|1,0,1]=4 1815 B11R2.55 BrC1=CC=CN=C1C2CC2 SY041201 [0,1,0,1,0,0|1,0,1]=4 1816 B11R2.55 CC1=CC=CN=C1C2CC2 SY264189 [0,1,0,1,0,0|1,0,1]=4 1817 B11R2.35 CC1=CC(C2CC2)=NC=C1 SY264183 [0,1,0,1,0,0|1,0,1]=4 1818 B11R2.35 CC1=NC(C2CC2)=CC=C1 SY264181 [0,1,0,1,0,0|1,0,1]=4 1819 B7R1.1 C=CC1=CC=CS1 SY024253 [1,0,0,0,1,0|1,0,1]=4 1820 B7R1.1 CCC1=CC=CS1 SY048489 [1,0,0,0,1,0|1,0,1]=4 1821 B7R1.1 CCC1=CNC=N1 SY055411 [1,0,0,0,1,0|1,0,1]=4 1822 B7R1.1 CCC1=CSC=C1 SY036406 [1,0,0,0,1,0|1,0,1]=4 1823 B7R1.1 CCN1C=CC=N1 SY014479 [1,0,0,0,1,0|1,0,1]=4 1824 B7R1.1 CNC1=NC=CS1 SY104581 [1,0,0,0,1,0|2,0,0]=4 1825 B7R1.1 COC1=NNC=C1 SY147600 [1,0,0,0,1,0|2,0,0]=4 1826 B7R1.1 CSC1=NC=CN1 SY025774 [1,0,0,0,1,0|2,0,0]=4 1827 B7R1.1 O=CC1=CC=CN1 SY001497 [1,0,0,0,1,0|0,0,1]=3 1828 B7R1.1 O=CC1=CN=CO1 SY025934 [1,0,0,0,1,0|2,0,0]=4 1829 B7R1.1 O=CC1=CN=CS1 SY005766 [1,0,0,0,1,0|2,0,0]=4 1830 B7R1.1 O=CC1=CNC=C1 SY010726 [1,0,0,0,1,0|1,0,0]=3 1831 B7R1.1 O=CC1=CNC=N1 SY003074 [1,0,0,0,1,0|1,0,0]=3 1832 B7R1.1 O=CC1=CNN=C1 SY013236 [1,0,0,0,1,0|2,0,0]=4 1833 B7R1.1 O=CC1=COC=C1 SY013826 [1,0,0,0,1,0|1,0,0]=3 1834 B7R1.1 O=CC1=COC=N1 SY051228 [1,0,0,0,1,0|1,0,0]=3 1835 B7R1.1 O=CC1=CSC=N1 SY019858 [1,0,0,0,1,0|1,0,0]=3 1836 B7R1.1 O=CC1=NC=CN1 SY014217 [1,0,0,0,1,0|1,0,0]=3 1837 B7R1.1 O=CC1=NC=CS1 SY005879 [1,0,0,0,1,0|1,0,0]=3 1838 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SY051763 [0,0,0,0,0,2|1,0,0]=3 1839 B11R1.91 CC(=O)CCC1=CC=CC=C1 SY013502 [0,0,0,0,0,2|1,0,0]=3 1840 B11R1.91 CC(=O)COC1=NC=CC=C1 SY251719 [0,0,0,0,0,2|0,0,0]=2 1841 B11R1.91 NC(=O)CCC1=NC=CC=C1 SY022420 [0,0,0,0,0,2|1,0,0]=3 1842 B11R1.91 NC(=O)NCC1=CC=CC=C1 SY049437 [0,0,0,0,0,2|2,0,0]=4 1843 B11R1.91 NC(=O)OCC1=CC=CC=C1 SY015067 [0,0,0,0,0,2|2,0,0]=4 1844 B11R1.91 O=C(O)C#CC1=CC=CC=C1 SY023402 [0,0,0,0,0,2|2,0,0]=4 1845 B11R1.91 O=C(O)C#CC1=NC=CC=C1 SY022410 [0,0,0,0,0,2|1,0,0]=3 1846 B11R1.91 O=C(O)CCC1=CC=CC=C1 SY001654 [0,0,0,0,0,2|2,0,0]=4 1847 B11R1.91 O=C(O)CCC1=NC=CC=C1 SY013900 [0,0,0,0,0,2|1,0,0]=3 1848 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 SY016110 [0,0,0,0,0,2|1,0,0]=3