0 B9R1.35 CC(=O)C1=CC(Br)=CS1 B13699 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.35 CC(=O)C1=CC(Cl)=CS1 A12844 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 CC(=O)C1=CC(N)=NN1 A11043 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 CC(=O)C1=CC=C(Br)S1 A12839 [0,0,0,0,0,0|1,0,0]=1 4 B9R1.35 CC(=O)C1=CC=C(C)S1 A46277 [0,0,0,0,0,0|0,0,0]=0 5 B9R1.35 CC(=O)C1=CN(C)N=C1 M3257 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.35 CC(=O)C1=CN=C(Br)S1 B32437 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.35 CC(=O)C1=CN=C(N)S1 A41052 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.35 CC(=O)C1=CNC(C)=C1 M46389 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.35 CC(=O)C1=CSC(Cl)=C1 A1568 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.35 CC(=O)C1=CSC(N)=N1 A41051 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.35 CC(=O)C1=NC(C)=CO1 M43141 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.35 CC(=O)C1=NC=C(Br)S1 B13063 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.35 CC(=O)C1=NC=C(Cl)S1 C13062 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.35 CC(=O)C1=NN(C)C=C1 A13629 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.35 CC(=O)C1=NNC(C)=C1 M62065 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.35 CC(=O)C1=NOC(C)=C1 M43142 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.35 CC(=O)N1C=C(I)C=N1 I30035 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.35 CC(=O)N1C=CC(=O)N1 A41035 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.35 CC(C)C1=CN=C(Br)S1 B43292 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.35 CC(C)C1=CN=C(N)S1 P67827 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.35 CC(C)C1=NC=C(Br)S1 B64788 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.35 CC1=CC(C(=O)O)=CN1 M43147 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.35 CC1=CC(C(=O)O)=CS1 M5852 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.35 CC1=CC(C(=O)O)=NN1 M7890 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.35 CC1=CC(C(=O)O)=NO1 M27266 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.35 CC1=CC(C(N)=O)=NO1 M67790 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.35 CC1=CC=C(B(O)O)O1 M4380 [0,0,0,0,0,0|2,1,1]=4 28 B9R1.35 CC1=CC=C(B(O)O)S1 M4600 [0,0,0,0,0,0|2,0,1]=3 29 B9R1.35 CC1=CC=C(C(=O)O)N1 M36732 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.35 CC1=CC=C(C(=O)O)O1 M38051 [0,0,0,0,0,0|1,1,0]=2 31 B9R1.35 CC1=CC=C(C(=O)O)S1 M42943 [0,0,0,0,0,0|1,0,0]=1 32 B9R1.35 CC1=CN=C(C(=O)O)S1 M40996 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.35 CC1=CN=C(C(=O)[O-])O1 S27747 [0,0,0,0,0,0|2,1,0]=3 34 B9R1.35 CC1=CSC(C(=O)O)=N1 M14993 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.35 CC1=CSC(C(C)C)=N1 P43783 [0,0,0,0,0,0|3,0,1]=4 36 B9R1.35 CC1=NC(C(=O)O)=CN1 M19958 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.35 CC1=NC(C(=O)O)=CO1 M62066 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.35 CC1=NC(C(=O)O)=CO1 M7132 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.35 CC1=NC(C(=O)O)=CS1 M3047 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.35 CC1=NC(C(N)=O)=CS1 M41050 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.35 CC1=NC=C(C(=O)O)O1 M9856 [0,0,0,0,0,0|2,1,0]=3 42 B9R1.35 CC1=NC=C(C(=O)O)S1 M5426 [0,0,0,0,0,0|2,0,0]=2 43 B9R1.35 CC1=NC=C([N+](=O)[O-])N1 M68352 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.35 CC1=NN=C(C(=O)[O-])O1 M15652 [0,0,0,0,0,0|3,1,0]=4 45 B9R1.35 CC1=NN=C(C(=O)[O-])S1 L40037 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.35 CC1=NOC(C(=O)O)=C1 M38698 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.35 CN1C=C(C(=O)O)C=N1 M7676 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.35 CN1C=CC(C(=O)O)=C1 M43143 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.35 CN1C=CC(C(=O)O)=N1 M9460 [0,0,0,0,0,0|3,0,0]=3 50 B9R1.35 CN1C=CC(C(N)=O)=N1 M41144 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.35 CN1C=NC(C(=O)O)=C1 M10536 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.35 CN1C=NC(C(N)=O)=C1 M41145 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.35 NC(=O)C1=CC(Br)=CN1 B40920 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.35 NC(=O)C1=CC(Br)=CO1 B40829 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.35 NC(=O)C1=CC(Br)=CS1 B40841 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.35 NC(=O)C1=CC=C(Br)N1 B8083 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.35 NC(=O)C1=CC=C(Br)S1 B68782 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.35 NC(=O)C1=CN=C(Br)S1 B40041 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.35 NC(=O)C1=CSC(Br)=C1 B40843 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.35 NC(=O)C1=CSC(Br)=N1 B61895 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.35 NC(=O)C1=CSC(N)=N1 A40145 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.35 NC1=CN=C(C(=O)O)S1 A14284 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.35 NC1=CN=C(C(=O)O)S1 A7363 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.35 NC1=CNC(C(=O)O)=N1 A20425 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.35 NC1=NC(C(=O)O)=CO1 A11266 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.35 NC1=NC(C(=O)O)=CS1 A2115 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.35 NC1=NC(C(=O)O)=CS1 A4882 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.35 NC1=NC=C(C(=O)O)S1 A3492 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.35 NC1=NC=C([N+](=O)[O-])S1 A61028 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 C40558 [0,0,0,0,0,0|2,0,0]=2 71 B9R1.35 O=C(O)C1=CC(Br)=CN1 B40831 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.35 O=C(O)C1=CC(Br)=CO1 B13536 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.35 O=C(O)C1=CC(Br)=CS1 B3026 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.35 O=C(O)C1=CC(Cl)=CS1 C12488 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.35 O=C(O)C1=CC=C(Br)O1 B4712 [0,0,0,0,0,0|2,1,0]=3 76 B9R1.35 O=C(O)C1=CC=C(Br)S1 B12755 [0,0,0,0,0,0|2,0,0]=2 77 B9R1.35 O=C(O)C1=CC=C(Cl)O1 C40690 [0,0,0,0,0,0|2,1,0]=3 78 B9R1.35 O=C(O)C1=CC=C(Cl)S1 C10492 [0,0,0,0,0,0|2,0,0]=2 79 B9R1.35 O=C(O)C1=CC=C(F)S1 F7718 [0,0,0,0,0,0|2,0,0]=2 80 B9R1.35 O=C(O)C1=CC=C(I)S1 K40688 [0,0,0,0,0,0|2,0,0]=2 81 B9R1.35 O=C(O)C1=CN=C(Br)O1 B32073 [0,0,0,0,0,0|3,1,0]=4 82 B9R1.35 O=C(O)C1=CN=C(Br)S1 B2125 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.35 O=C(O)C1=CN=C(Cl)S1 C2765 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.35 O=C(O)C1=COC(Br)=C1 B69658 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.35 O=C(O)C1=COC(Br)=N1 B15227 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.35 O=C(O)C1=COC(Cl)=N1 C15228 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.35 O=C(O)C1=CSC(Br)=C1 B12752 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.35 O=C(O)C1=CSC(Br)=N1 B2124 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.35 O=C(O)C1=CSC(Cl)=C1 C7720 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.35 O=C(O)C1=CSC(Cl)=N1 C2862 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.35 O=C(O)C1=CSC(F)=C1 F15451 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.35 O=C(O)C1=NC(Br)=CS1 B7895 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.35 O=C(O)C1=NC=C(Br)S1 B10955 [0,0,0,0,0,0|3,0,0]=3 94 B9R1.35 O=C(O)C1=NC=C(Cl)S1 C13056 [0,0,0,0,0,0|3,0,0]=3 95 B9R1.35 O=C1NC=C(C(=O)O)N1 X40079 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.35 O=[N+]([O-])C1=CC=C(Br)S1 B40011 [0,0,0,0,0,0|3,0,0]=3 97 B9R1.35 O=[N+]([O-])C1=CN=C(Cl)S1 C39897 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.35 O=[N+]([O-])C1=NC=C(Br)S1 B39896 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.35 OB(O)C1=CC=C(Br)S1 B1958 [0,0,0,0,0,0|3,0,1]=4 100 B9R1.35 OB(O)C1=CC=C(Cl)S1 C2300 [0,0,0,0,0,0|3,0,1]=4 101 B8R1.1 CC1=CC(C=O)=CS1 M29797 [1,0,0,0,0,0|2,0,0]=3 102 B8R1.1 CC1=CC(C=O)=NN1 M41030 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.1 CC1=CC=C(C#N)N1 M32172 [1,0,0,0,0,0|2,0,1]=4 104 B8R1.1 CC1=CC=C(C#N)S1 M12843 [1,0,0,0,0,0|1,0,1]=3 105 B8R1.1 CC1=CC=C(C=O)N1 M43134 [1,0,0,0,0,0|1,0,0]=2 106 B8R1.1 CC1=CC=C(C=O)S1 M39272 [1,0,0,0,0,0|0,0,0]=1 107 B8R1.1 CC1=CC=C(CN)O1 M37131 [1,0,0,0,0,0|1,1,1]=4 108 B8R1.1 CC1=CC=C(CO)O1 M43304 [1,0,0,0,0,0|0,1,2]=4 109 B8R1.1 CC1=CN=C(C=O)S1 M19270 [1,0,0,0,0,0|1,0,0]=2 110 B8R1.1 CC1=CN=C(CO)S1 M41173 [1,0,0,0,0,0|1,0,2]=4 111 B8R1.1 CC1=COC(C=O)=C1 M13538 [1,0,0,0,0,0|2,0,0]=3 112 B8R1.1 CC1=COC(C=O)=N1 M12937 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.1 CC1=CSC(C=O)=C1 M42959 [1,0,0,0,0,0|2,0,0]=3 114 B8R1.1 CC1=CSC(C=O)=N1 M14992 [1,0,0,0,0,0|2,0,0]=3 115 B8R1.1 CC1=NC(C=O)=CO1 M3278 [1,0,0,0,0,0|2,0,0]=3 116 B8R1.1 CC1=NC(C=O)=CS1 F2075 [1,0,0,0,0,0|2,0,0]=3 117 B8R1.1 CC1=NC(C=O)=NO1 M32392 [1,0,0,0,0,0|3,0,0]=4 118 B8R1.1 CC1=NC=C(C=O)S1 F2897 [1,0,0,0,0,0|1,0,0]=2 119 B8R1.1 CC1=NC=C(CBr)S1 B41111 [1,0,0,0,0,0|2,0,1]=4 120 B8R1.1 CC1=NC=C(CO)S1 M1967 [1,0,0,0,0,0|1,0,2]=4 121 B8R1.1 CC1=NN=C(C=O)O1 M36607 [1,0,0,0,0,0|2,1,0]=4 122 B8R1.1 CC1=NOC(C=O)=N1 M36862 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.1 CCC1=CC=C(C)S1 E43745 [1,0,0,0,0,0|0,0,1]=2 124 B8R1.1 CCC1=CN=C(C)N1 E41428 [1,0,0,0,0,0|2,0,1]=4 125 B8R1.1 CCC1=CN=C(N)S1 E41203 [1,0,0,0,0,0|2,0,1]=4 126 B8R1.1 CCC1=CN=C(N)S1 E69753 [1,0,0,0,0,0|2,0,1]=4 127 B8R1.1 CCC1=NC(C)=CS1 E43395 [1,0,0,0,0,0|2,0,1]=4 128 B8R1.1 CN1C=C(C=O)C=N1 M6127 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.1 CN1C=CC(C=O)=N1 M22764 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.1 CN1C=NC(C=O)=C1 M11287 [1,0,0,0,0,0|3,0,0]=4 131 B8R1.1 COC1=NC=C(Br)S1 B2563 [1,0,0,0,0,0|3,0,0]=4 132 B8R1.1 CSC1=CN=C(N)S1 M40191 [1,0,0,0,0,0|3,0,0]=4 133 B8R1.1 ClCC1=CC=C(Cl)S1 C40699 [1,0,0,0,0,0|2,0,1]=4 134 B8R1.1 N#CC1=CC=C(Br)S1 B7699 [1,0,0,0,0,0|2,0,1]=4 135 B8R1.1 N#CC1=CC=C(Cl)S1 C7716 [1,0,0,0,0,0|2,0,1]=4 136 B8R1.1 N#CC1=CC=C(F)S1 C7719 [1,0,0,0,0,0|2,0,1]=4 137 B8R1.1 N#CC1=CC=C(I)S1 K40542 [1,0,0,0,0,0|2,0,1]=4 138 B8R1.1 N#CC1=CC=C(N)S1 A40782 [1,0,0,0,0,0|2,0,1]=4 139 B8R1.1 NC1=NC=C(C=O)S1 A2114 [1,0,0,0,0,0|2,0,0]=3 140 B8R1.1 NC1=NC=C(C=O)S1 A40321 [1,0,0,0,0,0|2,0,0]=3 141 B8R1.1 NCC1=CC=C(Br)S1 A12757 [1,0,0,0,0,0|2,0,1]=4 142 B8R1.1 NCC1=CC=C(Cl)S1 A12836 [1,0,0,0,0,0|2,0,1]=4 143 B8R1.1 NCC1=CC=C(Cl)S1 C27089 [1,0,0,0,0,0|2,0,1]=4 144 B8R1.1 NCC1=CC=C(F)S1 F8124 [1,0,0,0,0,0|2,0,1]=4 145 B8R1.1 O=CC1=CC(Br)=CN1 B38751 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.1 O=CC1=CC(Br)=CO1 B13537 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.1 O=CC1=CC(Br)=CS1 B12758 [1,0,0,0,0,0|3,0,0]=4 148 B8R1.1 O=CC1=CC(Cl)=CN1 C14574 [1,0,0,0,0,0|3,0,0]=4 149 B8R1.1 O=CC1=CC(Cl)=CS1 C12489 [1,0,0,0,0,0|3,0,0]=4 150 B8R1.1 O=CC1=CC(I)=CN1 K40861 [1,0,0,0,0,0|3,0,0]=4 151 B8R1.1 O=CC1=CC(I)=CS1 K40696 [1,0,0,0,0,0|3,0,0]=4 152 B8R1.1 O=CC1=CC=C(Br)N1 B67724 [1,0,0,0,0,0|2,0,0]=3 153 B8R1.1 O=CC1=CC=C(Br)O1 B67849 [1,0,0,0,0,0|1,1,0]=3 154 B8R1.1 O=CC1=CC=C(Br)S1 B10476 [1,0,0,0,0,0|1,0,0]=2 155 B8R1.1 O=CC1=CC=C(Cl)O1 C38278 [1,0,0,0,0,0|1,1,0]=3 156 B8R1.1 O=CC1=CC=C(Cl)S1 C7717 [1,0,0,0,0,0|1,0,0]=2 157 B8R1.1 O=CC1=CN=C(Br)S1 B2119 [1,0,0,0,0,0|2,0,0]=3 158 B8R1.1 O=CC1=CN=C(Cl)S1 C5784 [1,0,0,0,0,0|2,0,0]=3 159 B8R1.1 O=CC1=CSC(Br)=C1 B12754 [1,0,0,0,0,0|3,0,0]=4 160 B8R1.1 O=CC1=CSC(Br)=N1 B2118 [1,0,0,0,0,0|3,0,0]=4 161 B8R1.1 O=CC1=CSC(Cl)=C1 C1739 [1,0,0,0,0,0|3,0,0]=4 162 B8R1.1 O=CC1=CSC(Cl)=N1 C2764 [1,0,0,0,0,0|3,0,0]=4 163 B8R1.1 O=CC1=NC(Br)=CS1 B2070 [1,0,0,0,0,0|3,0,0]=4 164 B8R1.1 O=CC1=NC=C(Br)S1 B2465 [1,0,0,0,0,0|2,0,0]=3 165 B8R1.1 O=CC1=NC=C(Cl)S1 C9512 [1,0,0,0,0,0|2,0,0]=3 166 B8R1.1 OCC1=CC=C(Br)S1 B12756 [1,0,0,0,0,0|1,0,2]=4 167 B8R1.1 OCC1=CC=C(Br)S1 B41016 [1,0,0,0,0,0|1,0,2]=4 168 B8R1.1 OCC1=CC=C(Cl)S1 C1567 [1,0,0,0,0,0|1,0,2]=4 169 B8R1.1 OCC1=CC=C(F)S1 F8123 [1,0,0,0,0,0|1,0,2]=4 170 B8R1.7 CC(=O)C1=CC=CN1 P68619 [1,0,0,0,0,0|1,0,0]=2 171 B8R1.7 CC(=O)C1=CC=CS1 A69304 [1,0,0,0,0,0|0,0,0]=1 172 B8R1.7 CC(=O)C1=CC=NN1 P61226 [1,0,0,0,0,0|2,0,0]=3 173 B8R1.7 CC(=O)C1=CC=NO1 K40990 [1,0,0,0,0,0|1,1,0]=3 174 B8R1.7 CC(=O)C1=CNC=C1 A37548 [1,0,0,0,0,0|2,0,0]=3 175 B8R1.7 CC(=O)C1=CNC=N1 A41019 [1,0,0,0,0,0|2,0,0]=3 176 B8R1.7 CC(=O)C1=CNN=C1 P22638 [1,0,0,0,0,0|3,0,0]=4 177 B8R1.7 CC(=O)C1=CSC=C1 A12828 [1,0,0,0,0,0|2,0,0]=3 178 B8R1.7 CC(=O)C1=CSC=N1 T41006 [1,0,0,0,0,0|2,0,0]=3 179 B8R1.7 CC(=O)C1=NC=CN1 K67604 [1,0,0,0,0,0|2,0,0]=3 180 B8R1.7 CC(=O)C1=NC=CS1 A22587 [1,0,0,0,0,0|1,0,0]=2 181 B8R1.7 CC(=O)C1=NOC=C1 K40989 [1,0,0,0,0,0|2,0,0]=3 182 B8R1.7 CC(=O)N1C=CN=C1 I37940 [1,0,0,0,0,0|3,0,0]=4 183 B8R1.7 CC(C)C1=CC=CO1 P43710 [1,0,0,0,0,0|1,1,1]=4 184 B8R1.7 C[C@@H](N)C1=CC=CS1 T43397 [1,0,0,0,0,0|1,0,1]=3 185 B8R1.7 C[C@@H](O)C1=CC=CO1 F43302 [1,0,0,0,0,0|0,1,2]=4 186 B8R1.7 C[C@H](N)C1=CC=CS1 T43555 [1,0,0,0,0,0|1,0,1]=3 187 B8R1.7 C[C@H](N)C1=NC=CS1 T41204 [1,0,0,0,0,0|2,0,1]=4 188 B8R1.7 C[C@H](N)C1=NC=CS1 T5352 [1,0,0,0,0,0|2,0,1]=4 189 B8R1.7 N=C(N)C1=NC=CS1 T8198 [1,0,0,0,0,0|3,0,0]=4 190 B8R1.7 NC(=O)C1=COC=N1 X40074 [1,0,0,0,0,0|3,0,0]=4 191 B8R1.7 NC(=O)C1=NC=CO1 X26086 [1,0,0,0,0,0|2,1,0]=4 192 B8R1.7 NC(=O)C1=NC=CS1 T61005 [1,0,0,0,0,0|2,0,0]=3 193 B8R1.7 NC(=O)C1=NNC=C1 P67746 [1,0,0,0,0,0|3,0,0]=4 194 B8R1.7 NC(=S)C1=CC=CS1 T41010 [1,0,0,0,0,0|1,1,0]=3 195 B8R1.7 O=C(Cl)C1=CC=CS1 T10056 [1,0,0,0,0,0|1,0,0]=2 196 B8R1.7 O=C(O)C1=CC=CN1 P24658 [1,0,0,0,0,0|2,0,0]=3 197 B8R1.7 O=C(O)C1=CC=CO1 F38499 [1,0,0,0,0,0|1,1,0]=3 198 B8R1.7 O=C(O)C1=CC=CS1 T69312 [1,0,0,0,0,0|1,0,0]=2 199 B8R1.7 O=C(O)C1=CC=NO1 K40064 [1,0,0,0,0,0|2,1,0]=4 200 B8R1.7 O=C(O)C1=CC=NS1 T40063 [1,0,0,0,0,0|2,0,0]=3 201 B8R1.7 O=C(O)C1=CN=CO1 O9363 [1,0,0,0,0,0|2,1,0]=4 202 B8R1.7 O=C(O)C1=CN=CS1 T2164 [1,0,0,0,0,0|2,0,0]=3 203 B8R1.7 O=C(O)C1=COC=C1 F14351 [1,0,0,0,0,0|3,0,0]=4 204 B8R1.7 O=C(O)C1=COC=N1 X9342 [1,0,0,0,0,0|3,0,0]=4 205 B8R1.7 O=C(O)C1=CSC=C1 T12825 [1,0,0,0,0,0|3,0,0]=4 206 B8R1.7 O=C(O)C1=CSC=N1 T2163 [1,0,0,0,0,0|3,0,0]=4 207 B8R1.7 O=C(O)C1=NC=CN1 I37951 [1,0,0,0,0,0|3,0,0]=4 208 B8R1.7 O=C(O)C1=NC=CS1 T9224 [1,0,0,0,0,0|2,0,0]=3 209 B8R1.7 O=C(O)C1=NNC=C1 P9459 [1,0,0,0,0,0|3,0,0]=4 210 B8R1.7 O=C(O)C1=NOC=C1 I12360 [1,0,0,0,0,0|3,0,0]=4 211 B8R1.7 O=C(O)C1=NSC=C1 I6110 [1,0,0,0,0,0|3,0,0]=4 212 B8R1.7 O=C([O-])C1=CC=CS1 C2751 [1,0,0,0,0,0|1,0,0]=2 213 B8R1.7 O=C([O-])C1=CC=CS1 C41403 [1,0,0,0,0,0|1,0,0]=2 214 B8R1.7 O=C([O-])C1=NC=CO1 S40296 [1,0,0,0,0,0|2,1,0]=4 215 B10R1.14 CC[C@@H](N)C1=CC=C(C)O1 M49548 [0,1,0,0,0,0|1,1,1]=4 216 B10R1.14 CNC(=O)C1=CN=C(N)S1 A41157 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.14 CNC(=O)C1=NOC(C)=C1 D43221 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.14 COC(=O)C1=CC(Br)=CN1 M12023 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.14 COC(=O)C1=CC(Br)=CO1 M42715 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.14 COC(=O)C1=CC(Br)=CS1 M7697 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.14 COC(=O)C1=CC(C)=NO1 M43162 [0,1,0,0,0,0|3,0,0]=4 222 B10R1.14 COC(=O)C1=CC(Cl)=CS1 M14084 [0,1,0,0,0,0|3,0,0]=4 223 B10R1.14 COC(=O)C1=CC(F)=CS1 M42707 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.14 COC(=O)C1=CC(N)=CS1 M43154 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.14 COC(=O)C1=CC=C(Br)N1 M9622 [0,1,0,0,0,0|2,0,0]=3 226 B10R1.14 COC(=O)C1=CC=C(Br)O1 M42716 [0,1,0,0,0,0|1,1,0]=3 227 B10R1.14 COC(=O)C1=CC=C(Br)S1 M7698 [0,1,0,0,0,0|1,0,0]=2 228 B10R1.14 COC(=O)C1=CC=C(C)N1 M46412 [0,1,0,0,0,0|1,0,0]=2 229 B10R1.14 COC(=O)C1=CC=C(C)O1 M46254 [0,1,0,0,0,0|0,1,0]=2 230 B10R1.14 COC(=O)C1=CC=C(Cl)S1 M66823 [0,1,0,0,0,0|1,0,0]=2 231 B10R1.14 COC(=O)C1=CC=C(I)S1 M42708 [0,1,0,0,0,0|1,0,0]=2 232 B10R1.14 COC(=O)C1=CC=C(N)O1 A11105 [0,1,0,0,0,0|1,1,0]=3 233 B10R1.14 COC(=O)C1=CC=C(N)S1 M9979 [0,1,0,0,0,0|1,0,0]=2 234 B10R1.14 COC(=O)C1=CN(C)C=N1 M29723 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.14 COC(=O)C1=CN=C(Br)O1 B3574 [0,1,0,0,0,0|2,1,0]=4 236 B10R1.14 COC(=O)C1=CN=C(Br)S1 M2155 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.14 COC(=O)C1=CN=C(C)N1 M43230 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.14 COC(=O)C1=CN=C(C)O1 M3277 [0,1,0,0,0,0|1,1,0]=3 239 B10R1.14 COC(=O)C1=CN=C(Cl)O1 M2777 [0,1,0,0,0,0|2,1,0]=4 240 B10R1.14 COC(=O)C1=CN=C(Cl)S1 M2695 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.14 COC(=O)C1=CN=C(N)O1 M2776 [0,1,0,0,0,0|2,1,0]=4 242 B10R1.14 COC(=O)C1=CN=C(N)S1 M2153 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.14 COC(=O)C1=CNC(=O)N1 M41045 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.14 COC(=O)C1=CNC(Br)=C1 M42853 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.14 COC(=O)C1=COC(Br)=N1 M3573 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.14 COC(=O)C1=COC(C)=C1 M46255 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.14 COC(=O)C1=COC(C)=N1 M7131 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.14 COC(=O)C1=COC(Cl)=N1 M2706 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.14 COC(=O)C1=COC(N)=N1 M2978 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.14 COC(=O)C1=CSC(Br)=C1 M12753 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.14 COC(=O)C1=CSC(Br)=N1 M2154 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.14 COC(=O)C1=CSC(C)=N1 M2884 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.14 COC(=O)C1=CSC(Cl)=C1 M1606 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.14 COC(=O)C1=CSC(Cl)=N1 M2986 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.14 COC(=O)C1=CSC(N)=N1 M2152 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.14 COC(=O)C1=NC(Br)=CS1 M8686 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.14 COC(=O)C1=NC(C)=CS1 M43155 [0,1,0,0,0,0|2,0,0]=3 258 B10R1.14 COC(=O)C1=NC=C(Br)S1 M17507 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.14 COC(=O)C1=NC=C(C)O1 M17998 [0,1,0,0,0,0|1,1,0]=3 260 B10R1.14 COC(=O)C1=NC=C(C)S1 M43156 [0,1,0,0,0,0|1,0,0]=2 261 B10R1.14 COC(=O)C1=NC=C(N)S1 M14283 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.14 COC(=O)C1=NN(C)C=C1 M29732 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.14 COC(=O)C1=NN(C)C=N1 M14788 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.14 COC(=O)C1=NNC(C)=C1 M9723 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.31 CC(=O)C1=CC=C(C=O)S1 A45521 [0,1,0,0,0,0|0,0,1]=2 266 B10R1.31 CC(=O)C1=CNC(C=O)=C1 A63189 [0,1,0,0,0,0|2,0,1]=4 267 B10R1.31 CCC1=CSC(C(=O)O)=N1 E43152 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.31 CCC1=NC(C(=O)O)=CS1 E38343 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.31 CCN1C=CC(C(=O)O)=N1 E43220 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.31 CN(C)C1=CC=C(C=O)S1 D46441 [0,1,0,0,0,0|2,0,1]=4 271 B10R1.31 COC1=CN=C(C(=O)O)O1 M41003 [0,1,0,0,0,0|2,1,0]=4 272 B10R1.31 N#CC1=CC=C(C(=O)O)O1 C41961 [0,1,0,0,0,0|1,1,1]=4 273 B10R1.31 N#CC1=CC=C([N+](=O)[O-])S1 N12842 [0,1,0,0,0,0|2,0,1]=4 274 B10R1.31 O=CC1=CC=C(C(=O)O)O1 F42334 [0,1,0,0,0,0|1,1,1]=4 275 B10R1.31 O=CC1=CC=C(C(=O)O)S1 F60808 [0,1,0,0,0,0|1,0,1]=3 276 B10R1.31 O=CC1=CC=C([N+](=O)[O-])S1 N12838 [0,1,0,0,0,0|2,0,1]=4 277 B10R1.31 O=[N+]([O-])C1=CC=C(CBr)S1 B40832 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.31 OCC1=CC=C(B(O)O)S1 H41182 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.55 CS(=O)(=O)C1=CC=C(Br)S1 B12841 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.55 O=S(=O)(Cl)C1=CC=C(Br)S1 B12840 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.55 O=S(=O)(Cl)C1=CC=C(Cl)S1 C12835 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.58 CC(=O)C1=CC(C)=C(Br)S1 B45953 [0,1,0,0,0,0|1,0,0]=2 283 B10R1.58 CC(=O)C1=CC(Cl)=C(Cl)S1 D42352 [0,1,0,0,0,0|1,0,0]=2 284 B10R1.58 CC1=C(Br)C=C(B(O)O)S1 B41120 [0,1,0,0,0,0|2,0,1]=4 285 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 B42699 [0,1,0,0,0,0|1,0,0]=2 286 B10R1.58 CC1=CC(C(=O)O)=NN1C D43228 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.58 CC1=CC(C(N)=O)=NN1C D43354 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.58 CN1N=C(C(=O)O)C=C1N A10962 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.58 CN1N=C(C(=O)O)C=C1O H3231 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.58 NC(=O)C1=CC(Cl)=C(Cl)N1 D40774 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 A40836 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.58 O=C(O)C1=CC(Br)=C(Br)O1 D40555 [0,1,0,0,0,0|2,1,0]=4 293 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 D40549 [0,1,0,0,0,0|2,0,0]=3 294 B10R1.58 O=C(O)C1=CC(Cl)=C(Br)S1 B40551 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.58 O=C(O)C1=CC(Cl)=C(Cl)S1 D40553 [0,1,0,0,0,0|2,0,0]=3 296 B10R1.59 CC(=O)C1=C(C)C=C(C)O1 D46833 [0,1,0,0,0,0|0,1,0]=2 297 B10R1.59 CC(=O)C1=C(C)N=C(Br)S1 B62817 [0,1,0,0,0,0|2,0,0]=3 298 B10R1.59 CC(=O)C1=C(C)N=C(C)S1 D46440 [0,1,0,0,0,0|1,0,0]=2 299 B10R1.59 CC(=O)C1=C(C)OC(C)=N1 D46406 [0,1,0,0,0,0|2,0,0]=3 300 B10R1.59 CC(=O)C1=C(C)SC(N)=N1 A43257 [0,1,0,0,0,0|3,0,0]=4 301 B10R1.59 CC(=O)C1=C(Cl)SC(Cl)=C1 A13751 [0,1,0,0,0,0|3,0,0]=4 302 B10R1.59 CC(=O)C1=CC(C)=NN1C D1042 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.59 CC1=C(C(=O)O)SC(Br)=N1 B40834 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 A41039 [0,1,0,0,0,0|3,0,0]=4 305 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 D62561 [0,1,0,0,0,0|3,0,0]=4 306 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 P64574 [0,1,0,0,0,0|3,0,0]=4 307 B10R1.59 CC1=CC(C(N)=O)=C(N)S1 A43256 [0,1,0,0,0,0|3,0,0]=4 308 B10R1.59 CC1=CN(C)N=C1C(=O)O D43227 [0,1,0,0,0,0|3,0,0]=4 309 B10R1.59 CC1=NC(C(=O)O)=C(Br)O1 B9781 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.59 CC1=NC(C(=O)O)=C(N)S1 A41040 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 D43161 [0,1,0,0,0,0|2,1,0]=4 312 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 D43157 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.59 CN1C=C(Br)C(C(=O)O)=N1 B40898 [0,1,0,0,0,0|3,0,0]=4 314 B10R1.59 CN1C=C(F)C(C(=O)O)=N1 F59943 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.59 CN1C=C(I)C(C(=O)O)=N1 K40910 [0,1,0,0,0,0|3,0,0]=4 316 B10R1.59 O=C(O)C1=C(Br)C=C(Cl)S1 B40550 [0,1,0,0,0,0|2,0,0]=3 317 B10R1.59 O=C(O)C1=C(Br)N=C(Br)S1 D37488 [0,1,0,0,0,0|3,0,0]=4 318 B10R1.59 O=C(O)C1=C(Cl)C=C(Cl)S1 D62978 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.59 O=C(O)C1=C(Cl)N=C(Cl)S1 D40287 [0,1,0,0,0,0|3,0,0]=4 320 B10R1.59 O=C(O)C1=C(F)C=C(Br)S1 B40552 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.194 CC(=O)C1=CNC(Br)=C1C B46179 [0,1,0,0,0,0|3,0,0]=4 322 B10R1.194 CC1=C(C(=O)O)C=CN1C D46413 [0,1,0,0,0,0|3,0,0]=4 323 B10R1.194 CC1=C(N)C(C(=O)O)=CS1 A43159 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.194 CC1=CNC(C(=O)O)=C1C D0626 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.194 CC1=CSC(C(=O)O)=C1C D46250 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.194 CN1C(Br)=CC=C1C(=O)O B42855 [0,1,0,0,0,0|3,0,0]=4 327 B8R0.28 CC(=O)CCC=C(C)C M68353 [0,0,1,0,0,0|1,0,2]=4 328 B10R1.13 C=C(C)C1=CC=C(F)C=C1 F51670 [0,0,0,0,0,1|3,0,0]=4 329 B10R1.13 C=C(C)C1=CC=C(O)C=C1 P49877 [0,0,0,0,0,1|3,0,0]=4 330 B10R1.13 CC(=O)C1=CC=C(C)C=C1 M68572 [0,0,0,0,0,1|1,0,0]=2 331 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 C68865 [0,0,0,0,0,1|2,0,0]=3 332 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F38426 [0,0,0,0,0,1|2,0,0]=3 333 B10R1.13 CC(=O)C1=CC=C(I)C=C1 K39500 [0,0,0,0,0,1|2,0,0]=3 334 B10R1.13 CC(=O)C1=CC=C(N)C=C1 A68181 [0,0,0,0,0,1|2,0,0]=3 335 B10R1.13 CC(=O)C1=CC=C(O)C=C1 H64899 [0,0,0,0,0,1|2,0,0]=3 336 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 B3106 [0,0,0,0,0,1|2,0,0]=3 337 B10R1.13 CC(=O)C1=CN=C(C)C=C1 A23296 [0,0,0,0,0,1|1,0,0]=2 338 B10R1.13 CC(=O)C1=CN=C(C)N=C1 M13671 [0,0,0,0,0,1|2,0,0]=3 339 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 A24257 [0,0,0,0,0,1|2,0,0]=3 340 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 C16565 [0,0,0,0,0,1|3,0,0]=4 341 B10R1.13 CC(=O)C1=CN=C(F)C=C1 F45498 [0,0,0,0,0,1|2,0,0]=3 342 B10R1.13 CC(=O)C1=CN=C(N)C=C1 A22139 [0,0,0,0,0,1|2,0,0]=3 343 B10R1.13 CC(=O)C1=CN=C(N)N=C1 A43099 [0,0,0,0,0,1|3,0,0]=4 344 B10R1.13 CC(=O)C1=CNC(=O)C=C1 A67563 [0,0,0,0,0,1|2,0,0]=3 345 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 B22347 [0,0,0,0,0,1|2,0,0]=3 346 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 B11274 [0,0,0,0,0,1|3,0,0]=4 347 B10R1.13 CC(=O)C1=NC=C(C)C=C1 M49266 [0,0,0,0,0,1|1,0,0]=2 348 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 C26822 [0,0,0,0,0,1|2,0,0]=3 349 B10R1.13 CC(=O)C1=NC=C(F)C=N1 F9990 [0,0,0,0,0,1|3,0,0]=4 350 B10R1.13 CC(=O)C1=NC=C(O)C=C1 H45820 [0,0,0,0,0,1|2,0,0]=3 351 B10R1.13 CC(=O)C1=NC=C(O)N=C1 H42776 [0,0,0,0,0,1|3,0,0]=4 352 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 A15077 [0,0,0,0,0,1|2,0,0]=3 353 B10R1.13 CC1=CC=C(C(=N)N)C=C1 M38078 [0,0,0,0,0,1|3,0,0]=4 354 B10R1.13 CC1=CC=C(C(=O)O)C=C1 M64877 [0,0,0,0,0,1|2,0,0]=3 355 B10R1.13 CC1=CC=C(C(C)C)C=C1 D60786 [0,0,0,0,0,1|2,0,1]=4 356 B10R1.13 CC1=CC=C(C(N)=O)C=C1 M39514 [0,0,0,0,0,1|2,0,0]=3 357 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T52161 [0,0,0,0,0,1|2,0,1]=4 358 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T60511 [0,0,0,0,0,1|2,0,1]=4 359 B10R1.13 CC1=CC=C([C@@H](C)O)C=C1 T50271 [0,0,0,0,0,1|1,0,2]=4 360 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 S38423 [0,0,0,0,0,1|3,0,0]=4 361 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 M65785 [0,0,0,0,0,1|2,0,0]=3 362 B10R1.13 CC1=CC=C([S@](N)=O)C=C1 M36646 [0,0,0,0,0,1|3,0,0]=4 363 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M23707 [0,0,0,0,0,1|2,0,0]=3 364 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M46550 [0,0,0,0,0,1|2,0,0]=3 365 B10R1.13 CC1=CN=C(C(=O)O)C=N1 M4677 [0,0,0,0,0,1|3,0,0]=4 366 B10R1.13 CC1=CN=C(C(=O)O)N=C1 M11475 [0,0,0,0,0,1|3,0,0]=4 367 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 M49667 [0,0,0,0,0,1|2,0,1]=4 368 B10R1.13 CC1=CN=C([N+](=O)[O-])C=C1 M42775 [0,0,0,0,0,1|3,0,0]=4 369 B10R1.13 CC1=NC=C(C(=O)O)C=C1 M10933 [0,0,0,0,0,1|2,0,0]=3 370 B10R1.13 CC1=NC=C([C@H](C)O)C=C1 H64312 [0,0,0,0,0,1|1,0,2]=4 371 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 M4745 [0,0,0,0,0,1|3,0,0]=4 372 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 B63199 [0,0,0,0,0,1|3,0,0]=4 373 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 B45467 [0,0,0,0,0,1|3,0,0]=4 374 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 C45478 [0,0,0,0,0,1|3,0,0]=4 375 B10R1.13 NC(=O)C1=CC=C(N)C=C1 A37818 [0,0,0,0,0,1|3,0,0]=4 376 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 B9626 [0,0,0,0,0,1|3,0,0]=4 377 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 C42457 [0,0,0,0,0,1|3,0,0]=4 378 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 B26330 [0,0,0,0,0,1|3,0,0]=4 379 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 C42456 [0,0,0,0,0,1|3,0,0]=4 380 B10R1.13 NC(=O)C1=NC=C(F)C=C1 F42460 [0,0,0,0,0,1|3,0,0]=4 381 B10R1.13 NC(=O)C1=NC=C(N)C=C1 A43096 [0,0,0,0,0,1|3,0,0]=4 382 B10R1.13 NC(=O)C1=NN=C(Cl)C=C1 C9732 [0,0,0,0,0,1|3,0,0]=4 383 B10R1.13 NC(=O)C1=NN=C(N)C=C1 A10801 [0,0,0,0,0,1|3,0,0]=4 384 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A1119 [0,0,0,0,0,1|3,0,0]=4 385 B10R1.13 NC1=NC=C(C(=O)O)C=C1 A4758 [0,0,0,0,0,1|3,0,0]=4 386 B10R1.13 NC1=NN=C(C(=O)O)C=C1 A7484 [0,0,0,0,0,1|3,0,0]=4 387 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 C42006 [0,0,0,0,0,1|3,0,0]=4 388 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 C67273 [0,0,0,0,0,1|3,0,0]=4 389 B10R1.13 O=C(O)C1=CC=C(I)C=C1 K39365 [0,0,0,0,0,1|3,0,0]=4 390 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M69070 [0,0,0,0,0,1|3,0,0]=4 391 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 B4499 [0,0,0,0,0,1|3,0,0]=4 392 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 C24114 [0,0,0,0,0,1|3,0,0]=4 393 B10R1.13 O=C(O)C1=CN=C(F)C=C1 F2849 [0,0,0,0,0,1|3,0,0]=4 394 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 B4511 [0,0,0,0,0,1|3,0,0]=4 395 B10R1.13 O=C(O)C1=NC=C(F)C=C1 F13767 [0,0,0,0,0,1|3,0,0]=4 396 B10R1.13 O=C(O)C1=NC=C(I)C=C1 I38885 [0,0,0,0,0,1|3,0,0]=4 397 B10R1.13 O=C(O)C1=NC=C(O)C=C1 H8151 [0,0,0,0,0,1|3,0,0]=4 398 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 B13479 [0,0,0,0,0,1|3,0,0]=4 399 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 C0263 [0,0,0,0,0,1|3,0,0]=4 400 B10R1.13 O=C(O)C1=NN=C(O)C=C1 H0266 [0,0,0,0,0,1|3,0,0]=4 401 B10R1.13 O=C(O)C1=NN=C(O)C=C1 H41345 [0,0,0,0,0,1|3,0,0]=4 402 B10R1.13 O=C1C=CC(C(=O)O)=CN1 H12738 [0,0,0,0,0,1|3,0,0]=4 403 B10R1.13 O=C1C=CC(C(=O)O)=CO1 C7780 [0,0,0,0,0,1|2,1,0]=4 404 B10R1.54 CC(=O)NC1=CC=C(Br)S1 B42894 [0,0,0,0,0,1|1,0,0]=2 405 B10R1.54 CC(=O)NC1=NC(C)=CS1 A68861 [0,0,0,0,0,1|2,0,0]=3 406 B10R1.54 CC(=O)NC1=NC=C(Br)S1 A2519 [0,0,0,0,0,1|2,0,0]=3 407 B10R1.54 CC(=O)NC1=NNC(C)=C1 M43357 [0,0,0,0,0,1|3,0,0]=4 408 B10R1.54 CC(=O)O[C@H]1C=CC(=O)C1 X24459 [0,0,0,0,0,1|2,0,1]=4 409 B10R1.54 NC1=NC=C(CC(=O)O)S1 A11834 [0,0,0,0,0,1|3,0,0]=4 410 B10R1.54 O=C(O)CC1=NC=C(Cl)S1 C11230 [0,0,0,0,0,1|3,0,0]=4 411 B10R1.113 C=C(C)C1=CC(Br)=CN=C1 B48877 [0,0,0,0,0,1|3,0,0]=4 412 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 A12880 [0,0,0,0,0,1|2,0,0]=3 413 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 B39012 [0,0,0,0,0,1|2,0,0]=3 414 B10R1.113 CC(=O)C1=CC(C)=CC=C1 T39528 [0,0,0,0,0,1|1,0,0]=2 415 B10R1.113 CC(=O)C1=CC(C)=NC=C1 M49265 [0,0,0,0,0,1|1,0,0]=2 416 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C0410 [0,0,0,0,0,1|2,0,0]=3 417 B10R1.113 CC(=O)C1=CC(F)=CN=C1 F45496 [0,0,0,0,0,1|2,0,0]=3 418 B10R1.113 CC(=O)C1=CC(N)=CC=C1 A68568 [0,0,0,0,0,1|2,0,0]=3 419 B10R1.113 CC(=O)C1=CC(O)=CC=C1 H60763 [0,0,0,0,0,1|2,0,0]=3 420 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 A45468 [0,0,0,0,0,1|2,0,0]=3 421 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 C69069 [0,0,0,0,0,1|2,0,0]=3 422 B10R1.113 CC(=O)C1=CC=CC(Cl)=N1 C45483 [0,0,0,0,0,1|2,0,0]=3 423 B10R1.113 CC(=O)C1=CC=CC(F)=C1 F48736 [0,0,0,0,0,1|2,0,0]=3 424 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F45497 [0,0,0,0,0,1|2,0,0]=3 425 B10R1.113 CC(=O)C1=CC=CC(I)=C1 I37889 [0,0,0,0,0,1|2,0,0]=3 426 B10R1.113 CC(=O)C1=CC=NC(Cl)=N1 C32407 [0,0,0,0,0,1|2,0,0]=3 427 B10R1.113 CC(=O)C1=CN=CC(C)=C1 M63719 [0,0,0,0,0,1|1,0,0]=2 428 B10R1.113 CC(=O)C1=NC(C)=CC=C1 A49259 [0,0,0,0,0,1|1,0,0]=2 429 B10R1.113 CC(=O)C1=NC(N)=CC=C1 A37132 [0,0,0,0,0,1|2,0,0]=3 430 B10R1.113 CC(=O)C1=NC(N)=NC=C1 A14288 [0,0,0,0,0,1|2,0,0]=3 431 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 B45471 [0,0,0,0,0,1|2,0,0]=3 432 B10R1.113 CC(=O)C1=NC=CC(C)=C1 M4575 [0,0,0,0,0,1|1,0,0]=2 433 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 C61244 [0,0,0,0,0,1|2,0,0]=3 434 B10R1.113 CC(=O)C1=NC=NC(C)=C1 M45984 [0,0,0,0,0,1|2,0,0]=3 435 B10R1.113 CC1=CC(C(=N)N)=NC=C1 M46572 [0,0,0,0,0,1|3,0,0]=4 436 B10R1.113 CC1=CC(C(=O)O)=CN=C1 M10515 [0,0,0,0,0,1|2,0,0]=3 437 B10R1.113 CC1=CC(C(=O)O)=CN=N1 M16625 [0,0,0,0,0,1|3,0,0]=4 438 B10R1.113 CC1=CC(C(=O)O)=NC=C1 M38719 [0,0,0,0,0,1|2,0,0]=3 439 B10R1.113 CC1=CC(C(=O)O)=NC=N1 M14544 [0,0,0,0,0,1|3,0,0]=4 440 B10R1.113 CC1=CC(C(=O)O)=NN=C1 M17544 [0,0,0,0,0,1|3,0,0]=4 441 B10R1.113 CC1=CC([N+](=O)[O-])=NC=C1 M42774 [0,0,0,0,0,1|3,0,0]=4 442 B10R1.113 CC1=CC=CC(C(=N)N)=C1 M49488 [0,0,0,0,0,1|3,0,0]=4 443 B10R1.113 CC1=CC=CC(C(=O)O)=N1 M45823 [0,0,0,0,0,1|2,0,0]=3 444 B10R1.113 CC1=CC=CC(N(C)C)=C1 T39548 [0,0,0,0,0,1|3,0,0]=4 445 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 T50311 [0,0,0,0,0,1|2,0,1]=4 446 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 T52159 [0,0,0,0,0,1|2,0,1]=4 447 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 T50309 [0,0,0,0,0,1|2,0,1]=4 448 B10R1.113 CC1=CC=CC([N+](=O)[O-])=N1 M42773 [0,0,0,0,0,1|3,0,0]=4 449 B10R1.113 CC1=CC=NC(C(=N)N)=N1 M7294 [0,0,0,0,0,1|3,0,0]=4 450 B10R1.113 CC1=CC=NC(C(=O)O)=N1 M14425 [0,0,0,0,0,1|2,0,0]=3 451 B10R1.113 CC1=CC=NC(C(N)=O)=N1 M43098 [0,0,0,0,0,1|2,0,0]=3 452 B10R1.113 CC1=CN=CC(C(=O)O)=N1 M10680 [0,0,0,0,0,1|2,0,0]=3 453 B10R1.113 CC1=CN=CC(C(N)=O)=N1 M43097 [0,0,0,0,0,1|2,0,0]=3 454 B10R1.113 CC1=NC=CC(C(=O)O)=C1 M15805 [0,0,0,0,0,1|2,0,0]=3 455 B10R1.113 CC1=NC=CC(C(=O)O)=N1 M42778 [0,0,0,0,0,1|2,0,0]=3 456 B10R1.113 CC1=NC=CC([N+](=O)[O-])=C1 M12848 [0,0,0,0,0,1|3,0,0]=4 457 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 B42448 [0,0,0,0,0,1|3,0,0]=4 458 B10R1.113 NC(=O)C1=CC(O)=CC=C1 H45813 [0,0,0,0,0,1|3,0,0]=4 459 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 B45466 [0,0,0,0,0,1|3,0,0]=4 460 B10R1.113 NC(=O)C1=CC=CC(F)=C1 F45492 [0,0,0,0,0,1|3,0,0]=4 461 B10R1.113 NC(=O)C1=CC=NC(Br)=N1 B37467 [0,0,0,0,0,1|3,0,0]=4 462 B10R1.113 NC(=O)C1=CC=NC(Cl)=N1 C4894 [0,0,0,0,0,1|3,0,0]=4 463 B10R1.113 NC(=O)C1=CN=CC(Cl)=N1 C40809 [0,0,0,0,0,1|3,0,0]=4 464 B10R1.113 NC(=O)C1=CN=CC(N)=C1 A43095 [0,0,0,0,0,1|3,0,0]=4 465 B10R1.113 NC(=O)C1=NC(N)=NC=C1 A41100 [0,0,0,0,0,1|3,0,0]=4 466 B10R1.113 NC(=O)C1=NC(O)=CC=C1 H42772 [0,0,0,0,0,1|3,0,0]=4 467 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 B12089 [0,0,0,0,0,1|3,0,0]=4 468 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 H15729 [0,0,0,0,0,1|3,0,0]=4 469 B10R1.113 NC(=O)C1=NC=CC(N)=C1 A43091 [0,0,0,0,0,1|3,0,0]=4 470 B10R1.113 NC1=CC(C(=O)O)=CN=C1 A4566 [0,0,0,0,0,1|3,0,0]=4 471 B10R1.113 NC1=CC(C(=O)O)=NC=C1 A10317 [0,0,0,0,0,1|3,0,0]=4 472 B10R1.113 NC1=CC=CC(C(=O)O)=C1 A69286 [0,0,0,0,0,1|3,0,0]=4 473 B10R1.113 NC1=CC=CC(C(=O)O)=N1 A4798 [0,0,0,0,0,1|3,0,0]=4 474 B10R1.113 NC1=CN=CC(C(=O)O)=N1 A40967 [0,0,0,0,0,1|3,0,0]=4 475 B10R1.113 NC1=NC=CC(C(=O)O)=C1 A3938 [0,0,0,0,0,1|3,0,0]=4 476 B10R1.113 NC1=NC=CC(C(=O)O)=N1 A3707 [0,0,0,0,0,1|3,0,0]=4 477 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 C64820 [0,0,0,0,0,1|3,0,0]=4 478 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=N1 C42007 [0,0,0,0,0,1|3,0,0]=4 479 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=N1 C40485 [0,0,0,0,0,1|3,0,0]=4 480 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 B69308 [0,0,0,0,0,1|3,0,0]=4 481 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 B2422 [0,0,0,0,0,1|3,0,0]=4 482 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 C10556 [0,0,0,0,0,1|3,0,0]=4 483 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 C12400 [0,0,0,0,0,1|3,0,0]=4 484 B10R1.113 O=C(O)C1=CC(F)=CN=C1 F12047 [0,0,0,0,0,1|3,0,0]=4 485 B10R1.113 O=C(O)C1=CC(F)=NC=C1 F42254 [0,0,0,0,0,1|3,0,0]=4 486 B10R1.113 O=C(O)C1=CC(O)=NC=C1 H3170 [0,0,0,0,0,1|3,0,0]=4 487 B10R1.113 O=C(O)C1=CC(O)=NC=C1 H38104 [0,0,0,0,0,1|3,0,0]=4 488 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 B39364 [0,0,0,0,0,1|3,0,0]=4 489 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 B4508 [0,0,0,0,0,1|3,0,0]=4 490 B10R1.113 O=C(O)C1=CC=CC(F)=C1 F68888 [0,0,0,0,0,1|3,0,0]=4 491 B10R1.113 O=C(O)C1=CC=CC(F)=N1 F3784 [0,0,0,0,0,1|3,0,0]=4 492 B10R1.113 O=C(O)C1=CC=CC(I)=C1 K68155 [0,0,0,0,0,1|3,0,0]=4 493 B10R1.113 O=C(O)C1=CC=NC(Br)=N1 B32155 [0,0,0,0,0,1|3,0,0]=4 494 B10R1.113 O=C(O)C1=CC=NC(Cl)=N1 C5854 [0,0,0,0,0,1|3,0,0]=4 495 B10R1.113 O=C(O)C1=CN=CC(Br)=N1 B32134 [0,0,0,0,0,1|3,0,0]=4 496 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 C0341 [0,0,0,0,0,1|3,0,0]=4 497 B10R1.113 O=C(O)C1=CN=CC(O)=C1 H4735 [0,0,0,0,0,1|3,0,0]=4 498 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B7920 [0,0,0,0,0,1|3,0,0]=4 499 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 C24201 [0,0,0,0,0,1|3,0,0]=4 500 B10R1.113 O=C(O)C1=NC=CC(F)=C1 F42252 [0,0,0,0,0,1|3,0,0]=4 501 B10R1.113 O=C(O)C1=NC=CC(I)=C1 I3949 [0,0,0,0,0,1|3,0,0]=4 502 B10R1.113 O=C(O)C1=NC=CC(O)=C1 H9415 [0,0,0,0,0,1|3,0,0]=4 503 B10R1.113 O=C1C=NC=C(C(=O)O)N1 X40760 [0,0,0,0,0,1|3,0,0]=4 504 B10R1.113 O=C1C=NC=C(C(=O)[O-])N1 S65540 [0,0,0,0,0,1|3,0,0]=4 505 B10R1.113 O=C1N=CC=C(C(=O)O)N1 X60835 [0,0,0,0,0,1|3,0,0]=4 506 B7R1.1 C#CC1=CC=CS1 E42371 [2,0,0,0,0,0|0,0,2]=4 507 B7R1.1 C=CC1=CC=CS1 V38168 [2,0,0,0,0,0|0,0,1]=3 508 B7R1.1 C=CC1=NC=CS1 V41009 [2,0,0,0,0,0|1,0,1]=4 509 B7R1.1 CNC1=NC=CS1 M67793 [2,0,0,0,0,0|2,0,0]=4 510 B7R1.1 COC1=CC=CS1 M41123 [2,0,0,0,0,0|1,0,0]=3 511 B7R1.1 COC1=NC=CS1 M2608 [2,0,0,0,0,0|2,0,0]=4 512 B7R1.1 N#CC1=CC=CS1 T40685 [2,0,0,0,0,0|1,0,1]=4 513 B7R1.1 NCC1=CC=CS1 A12813 [2,0,0,0,0,0|1,0,1]=4 514 B7R1.1 O=CC1=CC=CN1 P64891 [2,0,0,0,0,0|1,0,0]=3 515 B7R1.1 O=CC1=CC=CS1 T68614 [2,0,0,0,0,0|0,0,0]=2 516 B7R1.1 O=CC1=CC=NO1 K40060 [2,0,0,0,0,0|1,1,0]=4 517 B7R1.1 O=CC1=CN=CO1 X11928 [2,0,0,0,0,0|1,1,0]=4 518 B7R1.1 O=CC1=CN=CS1 T2161 [2,0,0,0,0,0|1,0,0]=3 519 B7R1.1 O=CC1=CNC=C1 P25022 [2,0,0,0,0,0|2,0,0]=4 520 B7R1.1 O=CC1=COC=C1 F65465 [2,0,0,0,0,0|2,0,0]=4 521 B7R1.1 O=CC1=CSC=C1 T12697 [2,0,0,0,0,0|2,0,0]=4 522 B7R1.1 O=CC1=CSC=N1 T2159 [2,0,0,0,0,0|2,0,0]=4 523 B7R1.1 O=CC1=NC=CN1 F2135 [2,0,0,0,0,0|2,0,0]=4 524 B7R1.1 O=CC1=NC=CS1 T2877 [2,0,0,0,0,0|1,0,0]=3 525 B7R1.1 O=CC1=NNC=C1 P23454 [2,0,0,0,0,0|2,0,0]=4 526 B7R1.1 O=CC1=NOC=C1 I0114 [2,0,0,0,0,0|2,0,0]=4 527 B7R1.1 OCC1=CC=CS1 T12815 [2,0,0,0,0,0|0,0,2]=4 528 B7R1.2 CC1=CC=C(Br)O1 B41015 [2,0,0,0,0,0|1,1,0]=4 529 B7R1.2 CC1=CC=C(Br)S1 B40865 [2,0,0,0,0,0|1,0,0]=3 530 B7R1.2 CC1=CC=C(C)S1 D43320 [2,0,0,0,0,0|0,0,0]=2 531 B7R1.2 CC1=CC=C(I)S1 K40868 [2,0,0,0,0,0|1,0,0]=3 532 B7R1.2 CC1=CN=C(Br)S1 B40104 [2,0,0,0,0,0|2,0,0]=4 533 B7R1.2 CC1=CN=C(C)S1 D38993 [2,0,0,0,0,0|1,0,0]=3 534 B7R1.2 CC1=CN=C(Cl)S1 C1978 [2,0,0,0,0,0|2,0,0]=4 535 B7R1.2 CC1=CN=C(N)S1 A69715 [2,0,0,0,0,0|2,0,0]=4 536 B7R1.2 CC1=CN=C(N)S1 M69725 [2,0,0,0,0,0|2,0,0]=4 537 B7R1.2 CC1=CNC(C)=N1 D41187 [2,0,0,0,0,0|2,0,0]=4 538 B7R1.2 CC1=CSC(C)=N1 D41174 [2,0,0,0,0,0|2,0,0]=4 539 B7R1.2 CC1=NC=C(Br)S1 B5222 [2,0,0,0,0,0|2,0,0]=4 540 B7R1.2 CC1=NC=C(N)S1 M40189 [2,0,0,0,0,0|2,0,0]=4 541 B7R1.2 CC1=NN(C)C=C1 D4115 [2,0,0,0,0,0|2,0,0]=4 542 B7R1.2 CN1C=CC(=O)N1 M40182 [2,0,0,0,0,0|2,0,0]=4 543 B7R1.2 ClC1=CC=C(Br)S1 B39971 [2,0,0,0,0,0|2,0,0]=4 544 B7R1.2 ClC1=CC=C(I)S1 C39974 [2,0,0,0,0,0|2,0,0]=4 545 B7R1.2 OC1=CC=C(Br)S1 B40069 [2,0,0,0,0,0|1,0,1]=4 546 B9R0.53 CC(C)=CC(=O)C=C(C)C D69148 [0,1,1,0,0,0|2,0,0]=4 547 B9R1.7 CC1=CC=C(CCO)O1 M43716 [1,1,0,0,0,0|0,1,1]=4 548 B9R1.7 CCCC1=CC=C(Br)S1 B38199 [1,1,0,0,0,0|1,0,1]=4 549 B9R1.21 CCC1=CSC(C=O)=N1 E43175 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.21 COC1=CC=C(OC)S1 D43309 [1,1,0,0,0,0|1,0,0]=3 551 B9R1.21 COC1=NC=C(C=O)S1 M40995 [1,1,0,0,0,0|1,0,0]=3 552 B9R1.21 N#CC1=CC=C(C=O)S1 F38024 [1,1,0,0,0,0|0,0,1]=3 553 B9R1.21 N#CC1=CC=C(CBr)S1 B42220 [1,1,0,0,0,0|1,0,1]=4 554 B9R1.21 O=CC1=CC=C(C=O)O1 F65460 [1,1,0,0,0,0|0,1,1]=4 555 B9R1.21 O=CC1=CC=C(C=O)S1 T42327 [1,1,0,0,0,0|0,0,1]=3 556 B9R1.21 O=CC1=CC=C(CO)N1 H43148 [1,1,0,0,0,0|1,0,0]=3 557 B9R1.22 CC1=C(C=O)SC(Br)=N1 B40845 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.22 CC1=CC(C)=C(C=O)N1 D37937 [1,1,0,0,0,0|1,0,0]=3 559 B9R1.22 CC1=NC(C)=C(C=O)N1 D39065 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.22 CN1C=C(Br)C(C=O)=N1 B22843 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.22 O=CC1=C(Br)N=C(Br)S1 D40289 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.22 O=CC1=C(Cl)N=C(Cl)S1 D2688 [1,1,0,0,0,0|2,0,0]=4 563 B9R1.23 CC1=C(Br)SC(C=O)=C1 B14087 [1,1,0,0,0,0|1,0,0]=3 564 B9R1.23 CC1=C(C)SC(C=O)=N1 D25172 [1,1,0,0,0,0|1,0,0]=3 565 B9R1.23 O=CC1=CC(Br)=C(Br)S1 D68664 [1,1,0,0,0,0|1,0,0]=3 566 B9R1.23 O=CC1=CC(Cl)=C(Cl)S1 D40557 [1,1,0,0,0,0|1,0,0]=3 567 B9R1.132 CC1=CNC(C=O)=C1C D12049 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.132 CC1=NC=C(C=O)N1C D61627 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.11 CCC(=O)C1=NC=CS1 T43174 [1,1,0,0,0,0|1,0,0]=3 570 B9R1.11 COC(=O)C1=CC=CN1 M11015 [1,1,0,0,0,0|1,0,0]=3 571 B9R1.11 COC(=O)C1=CC=CO1 M39270 [1,1,0,0,0,0|0,1,0]=3 572 B9R1.11 COC(=O)C1=CC=CS1 M42941 [1,1,0,0,0,0|0,0,0]=2 573 B9R1.11 COC(=O)C1=CC=NN1 M12748 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.11 COC(=O)C1=CN=CN1 M14078 [1,1,0,0,0,0|2,0,0]=4 575 B9R1.11 COC(=O)C1=CN=CN1 M41348 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.11 COC(=O)C1=CN=CO1 M40997 [1,1,0,0,0,0|1,1,0]=4 577 B9R1.11 COC(=O)C1=CN=CS1 M2158 [1,1,0,0,0,0|1,0,0]=3 578 B9R1.11 COC(=O)C1=CNC=C1 M37783 [1,1,0,0,0,0|2,0,0]=4 579 B9R1.11 COC(=O)C1=CSC=C1 M12826 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.11 COC(=O)C1=CSC=N1 M2932 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.11 COC(=O)C1=NC=CN1 M11275 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.11 COC(=O)C1=NC=CO1 M40998 [1,1,0,0,0,0|1,1,0]=4 583 B9R1.11 COC(=O)C1=NC=CS1 M40994 [1,1,0,0,0,0|1,0,0]=3 584 B9R1.11 NNC(=O)C1=CC=CO1 F66138 [1,1,0,0,0,0|1,1,0]=4 585 B9R1.11 N[C@@H](CO)C1=CC=CS1 A43554 [1,1,0,0,0,0|1,0,1]=4 586 B9R1.11 O=C(CBr)C1=CC=CS1 B42721 [1,1,0,0,0,0|0,0,0]=2 587 B9R1.11 O=C(CBr)C1=NC=CS1 B40844 [1,1,0,0,0,0|1,0,0]=3 588 B9R1.19 CS(=O)(=O)C1=CC=CS1 M12814 [1,1,0,0,0,0|1,0,0]=3 589 B9R1.19 NS(=O)(=O)C1=CC=CS1 T40161 [1,1,0,0,0,0|2,0,0]=4 590 B9R1.19 O=S(=O)(Cl)C1=CC=CS1 T2651 [1,1,0,0,0,0|2,0,0]=4 591 B9R1.19 O=S(=O)(O)C1=CC=CS1 T40111 [1,1,0,0,0,0|2,0,0]=4 592 B9R1.41 CC(=O)C1=C(C)N=CS1 M63978 [1,1,0,0,0,0|1,0,0]=3 593 B9R1.41 CC(=O)C1=C(C)SC=N1 M43176 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.41 CC(=O)C1=CN=CN1C M43213 [1,1,0,0,0,0|2,0,0]=4 595 B9R1.41 CC(=O)C1=CNC=C1C M67633 [1,1,0,0,0,0|2,0,0]=4 596 B9R1.41 CC(=O)C1=NC=CN1C A1591 [1,1,0,0,0,0|2,0,0]=4 597 B9R1.41 CC1=C(C(=O)O)NC=C1 M43146 [1,1,0,0,0,0|2,0,0]=4 598 B9R1.41 CC1=C(C(=O)O)OC=C1 M42945 [1,1,0,0,0,0|1,1,0]=4 599 B9R1.41 CC1=C(C(=O)O)SC=C1 M42942 [1,1,0,0,0,0|1,0,0]=3 600 B9R1.41 CC1=C(C(=O)O)SC=N1 M67956 [1,1,0,0,0,0|2,0,0]=4 601 B9R1.41 CN1C=CC=C1C(=O)O M68591 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.41 NC(=O)C1=CC=CN1N A5122 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.41 O=C(O)C1=C(Br)C=CO1 B40689 [1,1,0,0,0,0|1,1,0]=4 604 B9R1.41 O=C(O)C1=C(Br)C=CS1 B10327 [1,1,0,0,0,0|1,0,0]=3 605 B9R1.41 O=C(O)C1=C(Cl)C=CS1 C12482 [1,1,0,0,0,0|1,0,0]=3 606 B9R1.41 O=C(O)C1=C(Cl)C=NS1 C40015 [1,1,0,0,0,0|2,0,0]=4 607 B9R1.41 O=C(O)C1=C(F)C=CS1 F40687 [1,1,0,0,0,0|1,0,0]=3 608 B9R1.41 O=C(O)C1=C(O)C=CS1 H40863 [1,1,0,0,0,0|1,0,0]=3 609 B9R1.41 O=[N+]([O-])C1=C(Br)C=CS1 B40012 [1,1,0,0,0,0|2,0,0]=4 610 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 E62179 [0,1,0,0,0,1|1,0,1]=4 611 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 A51160 [0,1,0,0,0,1|1,0,1]=4 612 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 A51552 [0,1,0,0,0,1|1,0,1]=4 613 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 B36669 [0,1,0,0,0,1|1,0,0]=3 614 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 A52108 [0,1,0,0,0,1|1,0,0]=3 615 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 H49897 [0,1,0,0,0,1|1,0,0]=3 616 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 E61033 [0,1,0,0,0,1|2,0,0]=4 617 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 E49271 [0,1,0,0,0,1|2,0,0]=4 618 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 M60981 [0,1,0,0,0,1|2,0,0]=4 619 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 M50024 [0,1,0,0,0,1|1,0,0]=3 620 B11R1.3 COC1=CC=C(C(=O)O)C=C1 M64803 [0,1,0,0,0,1|2,0,0]=4 621 B11R1.3 COC1=CC=C(C(N)=O)C=C1 M49268 [0,1,0,0,0,1|2,0,0]=4 622 B11R1.3 COC1=CN=C(C(=O)O)C=C1 M14344 [0,1,0,0,0,1|2,0,0]=4 623 B11R1.3 COC1=CN=C(C(C)=O)C=C1 A15229 [0,1,0,0,0,1|1,0,0]=3 624 B11R1.3 COC1=NC=C(C(=O)O)C=C1 M12739 [0,1,0,0,0,1|2,0,0]=4 625 B11R1.3 COC1=NC=C(C(C)=O)C=C1 A49280 [0,1,0,0,0,1|1,0,0]=3 626 B11R1.3 COC1=NC=C(C(C)=O)C=N1 M46010 [0,1,0,0,0,1|2,0,0]=4 627 B11R1.3 COC1=NN=C(C(=O)O)C=C1 M24293 [0,1,0,0,0,1|2,0,0]=4 628 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 M62193 [0,1,0,0,0,1|2,0,0]=4 629 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 M49959 [0,1,0,0,0,1|1,0,0]=3 630 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 A37814 [0,1,0,0,0,1|2,0,0]=4 631 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 A49493 [0,1,0,0,0,1|2,0,0]=4 632 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 H49094 [0,1,0,0,0,1|2,0,0]=4 633 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 H32219 [0,1,0,0,0,1|2,0,0]=4 634 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 B52032 [0,1,0,0,0,1|1,0,0]=3 635 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 B39475 [0,1,0,0,0,1|2,0,0]=4 636 B11R1.21 CC(=O)C1=CC(Br)=C(I)C=C1 B48269 [0,1,0,0,0,1|2,0,0]=4 637 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 A49026 [0,1,0,0,0,1|2,0,0]=4 638 B11R1.21 CC(=O)C1=CC(Br)=C(O)C=C1 B48581 [0,1,0,0,0,1|2,0,0]=4 639 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=C1 B52034 [0,1,0,0,0,1|2,0,0]=4 640 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=N1 B63831 [0,1,0,0,0,1|2,0,0]=4 641 B11R1.21 CC(=O)C1=CC(C)=C(Cl)C=C1 C52042 [0,1,0,0,0,1|2,0,0]=4 642 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 F28728 [0,1,0,0,0,1|2,0,0]=4 643 B11R1.21 CC(=O)C1=CC(Cl)=C(Br)C=C1 B48245 [0,1,0,0,0,1|2,0,0]=4 644 B11R1.21 CC(=O)C1=CC(Cl)=C(C)C=C1 C61119 [0,1,0,0,0,1|1,0,0]=3 645 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 D39476 [0,1,0,0,0,1|2,0,0]=4 646 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 C48274 [0,1,0,0,0,1|2,0,0]=4 647 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 B48250 [0,1,0,0,0,1|2,0,0]=4 648 B11R1.21 CC(=O)C1=CC(F)=C(Cl)C=C1 C69014 [0,1,0,0,0,1|2,0,0]=4 649 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 D39477 [0,1,0,0,0,1|2,0,0]=4 650 B11R1.21 CC(=O)C1=CC(F)=C(N)C=C1 A49052 [0,1,0,0,0,1|2,0,0]=4 651 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 F48621 [0,1,0,0,0,1|2,0,0]=4 652 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 A50026 [0,1,0,0,0,1|1,0,0]=3 653 B11R1.21 CC(=O)C1=CC(N)=C(Cl)C=C1 A49040 [0,1,0,0,0,1|2,0,0]=4 654 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 D68113 [0,1,0,0,0,1|2,0,0]=4 655 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 C49042 [0,1,0,0,0,1|2,0,0]=4 656 B11R1.21 CC(=O)C1=CN=C(Cl)C(Cl)=C1 D37474 [0,1,0,0,0,1|2,0,0]=4 657 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 B48570 [0,1,0,0,0,1|2,0,0]=4 658 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=N1 B64856 [0,1,0,0,0,1|2,0,0]=4 659 B11R1.21 CC1=C(Br)C=C(C(=O)O)N=C1 B32388 [0,1,0,0,0,1|2,0,0]=4 660 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 D69089 [0,1,0,0,0,1|2,0,0]=4 661 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 D49279 [0,1,0,0,0,1|2,0,0]=4 662 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 C48593 [0,1,0,0,0,1|2,0,0]=4 663 B11R1.21 CC1=C(Cl)C=C(C(=O)O)N=C1 C26055 [0,1,0,0,0,1|2,0,0]=4 664 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 F48613 [0,1,0,0,0,1|2,0,0]=4 665 B11R1.21 CC1=C(F)C=C(C(=O)O)C=N1 F61560 [0,1,0,0,0,1|2,0,0]=4 666 B11R1.21 CC1=C(F)C=C(C(=O)O)N=C1 F62992 [0,1,0,0,0,1|2,0,0]=4 667 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 K25553 [0,1,0,0,0,1|2,0,0]=4 668 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 H49095 [0,1,0,0,0,1|2,0,0]=4 669 B11R1.21 CC1=CC=C(C(=O)O)N=C1Br B37453 [0,1,0,0,0,1|2,0,0]=4 670 B11R1.21 CC1=CC=C(C(=O)O)N=C1Cl C32429 [0,1,0,0,0,1|2,0,0]=4 671 B11R1.21 CC1=NC=C(C(=O)O)C=C1N A8134 [0,1,0,0,0,1|2,0,0]=4 672 B11R1.21 CC1=NC=C(C(N)=O)S[C@H]1C D43684 [0,1,0,0,0,1|2,0,0]=4 673 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 X51560 [0,1,0,0,0,1|1,0,1]=4 674 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 B52024 [0,1,0,0,0,1|1,0,0]=3 675 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 A52107 [0,1,0,0,0,1|1,0,0]=3 676 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 T46647 [0,1,0,0,0,1|2,0,0]=4 677 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 B16168 [0,1,0,0,0,1|2,0,0]=4 678 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 F39582 [0,1,0,0,0,1|2,0,0]=4 679 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 K52052 [0,1,0,0,0,1|2,0,0]=4 680 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 B49023 [0,1,0,0,0,1|2,0,0]=4 681 B11R1.22 CNC(=O)C1=CC=C(I)C=C1 K63815 [0,1,0,0,0,1|2,0,0]=4 682 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 A69158 [0,1,0,0,0,1|2,0,0]=4 683 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 C45698 [0,1,0,0,0,1|2,0,0]=4 684 B11R1.22 CNC(=O)C1=NC=C(Br)C=C1 B60995 [0,1,0,0,0,1|2,0,0]=4 685 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 M39489 [0,1,0,0,0,1|2,0,0]=4 686 B11R1.22 COC(=O)C1=CC=C(C)C=C1 M60598 [0,1,0,0,0,1|1,0,0]=3 687 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 M64818 [0,1,0,0,0,1|2,0,0]=4 688 B11R1.22 COC(=O)C1=CC=C(F)C=C1 M67923 [0,1,0,0,0,1|2,0,0]=4 689 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 M0015 [0,1,0,0,0,1|2,0,0]=4 690 B11R1.22 COC(=O)C1=CN=C(C)C=C1 M13760 [0,1,0,0,0,1|1,0,0]=3 691 B11R1.22 COC(=O)C1=CN=C(C)N=C1 M12380 [0,1,0,0,0,1|2,0,0]=4 692 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 M39382 [0,1,0,0,0,1|2,0,0]=4 693 B11R1.22 COC(=O)C1=CN=C(F)C=C1 M4740 [0,1,0,0,0,1|2,0,0]=4 694 B11R1.22 COC(=O)C1=CNC(=O)C=C1 M7692 [0,1,0,0,0,1|2,0,0]=4 695 B11R1.22 COC(=O)C1=COC(=O)C=C1 M38530 [0,1,0,0,0,1|1,1,0]=4 696 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 M10296 [0,1,0,0,0,1|2,0,0]=4 697 B11R1.22 COC(=O)C1=NC=C(C)C=C1 M22900 [0,1,0,0,0,1|1,0,0]=3 698 B11R1.22 COC(=O)C1=NC=C(C)C=N1 M10612 [0,1,0,0,0,1|2,0,0]=4 699 B11R1.22 COC(=O)C1=NC=C(C)N=C1 M46011 [0,1,0,0,0,1|2,0,0]=4 700 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 M45366 [0,1,0,0,0,1|2,0,0]=4 701 B11R1.22 COC(=O)C1=NC=C(F)C=C1 M16415 [0,1,0,0,0,1|2,0,0]=4 702 B11R1.22 COC(=O)C1=NC=C(I)C=C1 M45392 [0,1,0,0,0,1|2,0,0]=4 703 B11R1.22 COC(=O)C1=NC=C(N)C=C1 M0251 [0,1,0,0,0,1|2,0,0]=4 704 B11R1.22 COC(=O)C1=NC=C(O)C=C1 M7706 [0,1,0,0,0,1|2,0,0]=4 705 B11R1.22 COC(=O)C1=NN=C(Br)C=C1 M32242 [0,1,0,0,0,1|2,0,0]=4 706 B11R1.22 COC(=O)C1=NN=C(Cl)C=C1 C3617 [0,1,0,0,0,1|2,0,0]=4 707 B11R1.22 COC(=O)C1=NN=C(N)C=C1 M7641 [0,1,0,0,0,1|2,0,0]=4 708 B11R1.22 COC(=O)C1=NN=C(O)C=C1 M0452 [0,1,0,0,0,1|2,0,0]=4 709 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 B49032 [0,1,0,0,0,1|2,0,0]=4 710 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 A49045 [0,1,0,0,0,1|2,0,0]=4 711 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 A49617 [0,1,0,0,0,1|2,0,0]=4 712 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 B48246 [0,1,0,0,0,1|2,0,0]=4 713 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 C69024 [0,1,0,0,0,1|2,0,0]=4 714 B11R1.22 O=C(CCl)C1=CN=C(Cl)C=C1 C45047 [0,1,0,0,0,1|2,0,0]=4 715 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 B48242 [0,1,0,0,0,1|2,0,0]=4 716 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 B48579 [0,1,0,0,0,1|2,0,0]=4 717 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 D68875 [0,1,0,0,0,1|1,0,0]=3 718 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 H49903 [0,1,0,0,0,1|2,0,0]=4 719 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 B48244 [0,1,0,0,0,1|2,0,0]=4 720 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 C48277 [0,1,0,0,0,1|2,0,0]=4 721 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 B8298 [0,1,0,0,0,1|2,0,0]=4 722 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 C48275 [0,1,0,0,0,1|2,0,0]=4 723 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 D69359 [0,1,0,0,0,1|2,0,0]=4 724 B11R1.166 CC(=O)C1=C(F)C=C(F)C=N1 D67335 [0,1,0,0,0,1|2,0,0]=4 725 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 F48622 [0,1,0,0,0,1|2,0,0]=4 726 B11R1.166 CC(=O)C1=C(N)C=C(Br)C=C1 A49024 [0,1,0,0,0,1|2,0,0]=4 727 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 A50025 [0,1,0,0,0,1|1,0,0]=3 728 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 A49037 [0,1,0,0,0,1|2,0,0]=4 729 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 B9402 [0,1,0,0,0,1|2,0,0]=4 730 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 C61332 [0,1,0,0,0,1|2,0,0]=4 731 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 F69072 [0,1,0,0,0,1|2,0,0]=4 732 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 A49290 [0,1,0,0,0,1|2,0,0]=4 733 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl A9870 [0,1,0,0,0,1|2,0,0]=4 734 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl D63902 [0,1,0,0,0,1|2,0,0]=4 735 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C B37444 [0,1,0,0,0,1|2,0,0]=4 736 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 B25317 [0,1,0,0,0,1|2,0,0]=4 737 B11R1.166 CC1=CC(Br)=C(C(=O)O)N=C1 B45334 [0,1,0,0,0,1|2,0,0]=4 738 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 D49278 [0,1,0,0,0,1|2,0,0]=4 739 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 C38447 [0,1,0,0,0,1|2,0,0]=4 740 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=N1 C12703 [0,1,0,0,0,1|2,0,0]=4 741 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 F48610 [0,1,0,0,0,1|2,0,0]=4 742 B11R1.166 CC1=CC(F)=C(C(=O)O)N=C1 F11219 [0,1,0,0,0,1|2,0,0]=4 743 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 K61454 [0,1,0,0,0,1|2,0,0]=4 744 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 A49282 [0,1,0,0,0,1|2,0,0]=4 745 B11R1.166 CC1=CC(N)=C(C(=O)O)C=N1 A12850 [0,1,0,0,0,1|2,0,0]=4 746 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 A46651 [0,1,0,0,0,1|2,0,0]=4 747 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 M68144 [0,1,0,0,0,1|2,0,0]=4 748 B11R1.166 CC1=CC(O)=C(C(=O)O)C=N1 H39399 [0,1,0,0,0,1|2,0,0]=4 749 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 C10451 [0,1,0,0,0,1|2,0,0]=4 750 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 D61273 [0,1,0,0,0,1|2,0,0]=4 751 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 A10622 [0,1,0,0,0,1|2,0,0]=4 752 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 H45847 [0,1,0,0,0,1|2,0,0]=4 753 B11R1.39 COC(=O)CC1=CN=C(Cl)S1 M42862 [0,1,0,0,0,1|2,0,0]=4 754 B11R1.39 COC(=O)CC1=CN=C(N)S1 A1574 [0,1,0,0,0,1|2,0,0]=4 755 B11R1.39 COC(=O)CC1=NC=C(Cl)S1 M15324 [0,1,0,0,0,1|2,0,0]=4 756 B11R1.43 CC(=O)NC1=NC(CCl)=CS1 A2703 [0,1,0,0,0,1|2,0,0]=4 757 B11R1.645 CC1=NC(C)=C(CC(=O)O)S1 D29808 [0,1,0,0,0,1|2,0,0]=4 758 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 B52023 [0,1,0,0,0,1|1,0,0]=3 759 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 M46653 [0,1,0,0,0,1|2,0,0]=4 760 B11R1.23 CCC(=O)C1=CC(O)=CC=C1 H49893 [0,1,0,0,0,1|2,0,0]=4 761 B11R1.23 CCC(=O)C1=CC=CC(Br)=N1 B61988 [0,1,0,0,0,1|2,0,0]=4 762 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 F38669 [0,1,0,0,0,1|2,0,0]=4 763 B11R1.23 CCC(=O)C1=NC=CC(Cl)=C1 C49039 [0,1,0,0,0,1|2,0,0]=4 764 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 B69408 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 C45697 [0,1,0,0,0,1|2,0,0]=4 766 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 C45702 [0,1,0,0,0,1|2,0,0]=4 767 B11R1.23 COC(=O)C1=CC(=O)C=CN1 M45849 [0,1,0,0,0,1|2,0,0]=4 768 B11R1.23 COC(=O)C1=CC(=O)NC=C1 M1682 [0,1,0,0,0,1|2,0,0]=4 769 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 M12724 [0,1,0,0,0,1|2,0,0]=4 770 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 M22704 [0,1,0,0,0,1|2,0,0]=4 771 B11R1.23 COC(=O)C1=CC(C)=NC=C1 M67329 [0,1,0,0,0,1|1,0,0]=3 772 B11R1.23 COC(=O)C1=CC(Cl)=CN=C1 M60826 [0,1,0,0,0,1|2,0,0]=4 773 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 M0407 [0,1,0,0,0,1|2,0,0]=4 774 B11R1.23 COC(=O)C1=CC(F)=CN=C1 M0721 [0,1,0,0,0,1|2,0,0]=4 775 B11R1.23 COC(=O)C1=CC(F)=NC=C1 M23752 [0,1,0,0,0,1|2,0,0]=4 776 B11R1.23 COC(=O)C1=CC(N)=CC=C1 M69084 [0,1,0,0,0,1|2,0,0]=4 777 B11R1.23 COC(=O)C1=CC(N)=NC=C1 M4534 [0,1,0,0,0,1|2,0,0]=4 778 B11R1.23 COC(=O)C1=CC(O)=CC=C1 M37841 [0,1,0,0,0,1|2,0,0]=4 779 B11R1.23 COC(=O)C1=CC=CC(=O)N1 M38198 [0,1,0,0,0,1|2,0,0]=4 780 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 M48565 [0,1,0,0,0,1|2,0,0]=4 781 B11R1.23 COC(=O)C1=CC=CC(Br)=N1 M22709 [0,1,0,0,0,1|2,0,0]=4 782 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 M22864 [0,1,0,0,0,1|2,0,0]=4 783 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 M24789 [0,1,0,0,0,1|2,0,0]=4 784 B11R1.23 COC(=O)C1=CC=CC(F)=C1 M39493 [0,1,0,0,0,1|2,0,0]=4 785 B11R1.23 COC(=O)C1=CC=CC(F)=N1 M23753 [0,1,0,0,0,1|2,0,0]=4 786 B11R1.23 COC(=O)C1=CC=CC(I)=C1 M48629 [0,1,0,0,0,1|2,0,0]=4 787 B11R1.23 COC(=O)C1=CC=NC(Br)=N1 M32126 [0,1,0,0,0,1|2,0,0]=4 788 B11R1.23 COC(=O)C1=CC=NC(Cl)=N1 C7815 [0,1,0,0,0,1|2,0,0]=4 789 B11R1.23 COC(=O)C1=CN=CC(Br)=N1 M38724 [0,1,0,0,0,1|2,0,0]=4 790 B11R1.23 COC(=O)C1=CN=CC(C)=C1 M12907 [0,1,0,0,0,1|1,0,0]=3 791 B11R1.23 COC(=O)C1=CN=CC(Cl)=N1 M0687 [0,1,0,0,0,1|2,0,0]=4 792 B11R1.23 COC(=O)C1=CN=CC(I)=N1 M63354 [0,1,0,0,0,1|2,0,0]=4 793 B11R1.23 COC(=O)C1=CN=CC(N)=C1 M14137 [0,1,0,0,0,1|2,0,0]=4 794 B11R1.23 COC(=O)C1=CN=CC(O)=C1 M61635 [0,1,0,0,0,1|2,0,0]=4 795 B11R1.23 COC(=O)C1=CN=CC(O)=C1 M9186 [0,1,0,0,0,1|2,0,0]=4 796 B11R1.23 COC(=O)C1=NC(=O)NC=C1 M36852 [0,1,0,0,0,1|2,0,0]=4 797 B11R1.23 COC(=O)C1=NC(C)=CC=C1 M49292 [0,1,0,0,0,1|1,0,0]=3 798 B11R1.23 COC(=O)C1=NC(C)=CC=N1 M23011 [0,1,0,0,0,1|1,0,0]=3 799 B11R1.23 COC(=O)C1=NC(C)=CN=C1 M46012 [0,1,0,0,0,1|1,0,0]=3 800 B11R1.23 COC(=O)C1=NC(N)=CC=C1 M8927 [0,1,0,0,0,1|2,0,0]=4 801 B11R1.23 COC(=O)C1=NC(N)=CN=C1 M8739 [0,1,0,0,0,1|2,0,0]=4 802 B11R1.23 COC(=O)C1=NC(N)=NC=C1 M43110 [0,1,0,0,0,1|2,0,0]=4 803 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 M1665 [0,1,0,0,0,1|2,0,0]=4 804 B11R1.23 COC(=O)C1=NC=CC(C)=C1 M49276 [0,1,0,0,0,1|1,0,0]=3 805 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 M0974 [0,1,0,0,0,1|2,0,0]=4 806 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 M7541 [0,1,0,0,0,1|2,0,0]=4 807 B11R1.23 COC(=O)C1=NC=CC(I)=C1 M1513 [0,1,0,0,0,1|2,0,0]=4 808 B11R1.23 COC(=O)C1=NC=CC(N)=C1 M0975 [0,1,0,0,0,1|2,0,0]=4 809 B11R1.23 COC(=O)C1=NC=NC(C)=C1 M14453 [0,1,0,0,0,1|2,0,0]=4 810 B11R1.23 COC(=O)C1=NN=CC(C)=C1 M27709 [0,1,0,0,0,1|2,0,0]=4 811 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 B48248 [0,1,0,0,0,1|2,0,0]=4 812 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 B48255 [0,1,0,0,0,1|2,0,0]=4 813 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 B68743 [0,1,0,0,0,1|2,0,0]=4 814 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 B68490 [0,1,0,0,0,1|2,0,0]=4 815 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 D38007 [0,1,0,0,0,1|2,0,0]=4 816 B11R1.74 CC(=O)C1=CC(Br)=CC(Cl)=C1 B20352 [0,1,0,0,0,1|2,0,0]=4 817 B11R1.74 CC(=O)C1=CC(Br)=CC(F)=C1 B48253 [0,1,0,0,0,1|2,0,0]=4 818 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 B52033 [0,1,0,0,0,1|1,0,0]=3 819 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 D52785 [0,1,0,0,0,1|1,0,0]=3 820 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 D48272 [0,1,0,0,0,1|2,0,0]=4 821 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 D48284 [0,1,0,0,0,1|2,0,0]=4 822 B11R1.74 CC(=O)C1=CC(O)=CC(C)=C1 H49902 [0,1,0,0,0,1|1,0,0]=3 823 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 D49099 [0,1,0,0,0,1|2,0,0]=4 824 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 B48571 [0,1,0,0,0,1|2,0,0]=4 825 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=N1 B63466 [0,1,0,0,0,1|2,0,0]=4 826 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 D24167 [0,1,0,0,0,1|2,0,0]=4 827 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 C14183 [0,1,0,0,0,1|2,0,0]=4 828 B11R1.74 CC1=CC(C(=O)O)=CC(N)=C1 A49283 [0,1,0,0,0,1|2,0,0]=4 829 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 A12069 [0,1,0,0,0,1|2,0,0]=4 830 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 H49096 [0,1,0,0,0,1|2,0,0]=4 831 B11R1.74 CC1=CC(C(=O)O)=CC(O)=N1 H45844 [0,1,0,0,0,1|2,0,0]=4 832 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 C48594 [0,1,0,0,0,1|2,0,0]=4 833 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 C45370 [0,1,0,0,0,1|2,0,0]=4 834 B11R1.74 CC1=CC(Cl)=NC(C(=O)O)=C1 C45368 [0,1,0,0,0,1|2,0,0]=4 835 B11R1.74 CC1=CC(F)=CC(C(=O)O)=C1 F48614 [0,1,0,0,0,1|2,0,0]=4 836 B11R1.74 CC1=CC(I)=CC(C(=O)O)=C1 K48633 [0,1,0,0,0,1|2,0,0]=4 837 B11R1.74 CC1=NC(C(=O)O)=CC(=O)N1 M61613 [0,1,0,0,0,1|2,0,0]=4 838 B11R1.155 CC1=CC=NC(S(C)(=O)=O)=N1 M43238 [0,1,0,0,0,1|2,0,0]=4 839 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 D52783 [0,1,0,0,0,1|1,0,0]=3 840 B11R1.159 CC(=O)C1=C(C)C(O)=CC=C1 H49901 [0,1,0,0,0,1|2,0,0]=4 841 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 F52047 [0,1,0,0,0,1|1,0,0]=3 842 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 A61143 [0,1,0,0,0,1|2,0,0]=4 843 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 H27971 [0,1,0,0,0,1|1,0,0]=3 844 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 A69212 [0,1,0,0,0,1|2,0,0]=4 845 B11R1.159 CC(=O)C1=CC=CC(Br)=C1F B14139 [0,1,0,0,0,1|2,0,0]=4 846 B11R1.159 CC(=O)C1=CC=CC(Br)=C1O B48580 [0,1,0,0,0,1|2,0,0]=4 847 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl D48270 [0,1,0,0,0,1|2,0,0]=4 848 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1F C69015 [0,1,0,0,0,1|2,0,0]=4 849 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1N A49036 [0,1,0,0,0,1|2,0,0]=4 850 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1O C48602 [0,1,0,0,0,1|2,0,0]=4 851 B11R1.159 CC(=O)C1=CC=CC(F)=C1Br B48251 [0,1,0,0,0,1|2,0,0]=4 852 B11R1.159 CC(=O)C1=CC=CC(F)=C1Cl C48276 [0,1,0,0,0,1|2,0,0]=4 853 B11R1.159 CC(=O)C1=CC=CC(F)=C1F D48286 [0,1,0,0,0,1|2,0,0]=4 854 B11R1.159 CC(=O)C1=CC=CC(F)=C1O F61654 [0,1,0,0,0,1|2,0,0]=4 855 B11R1.159 CC(=O)C1=CC=CC(N)=C1F A49051 [0,1,0,0,0,1|2,0,0]=4 856 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br B48566 [0,1,0,0,0,1|2,0,0]=4 857 B11R1.159 CC1=CC=CC(C(=O)O)=C1C D65554 [0,1,0,0,0,1|2,0,0]=4 858 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl C48591 [0,1,0,0,0,1|2,0,0]=4 859 B11R1.159 CC1=CC=CC(C(=O)O)=C1F F48609 [0,1,0,0,0,1|2,0,0]=4 860 B11R1.159 CC1=CC=CC(C(=O)O)=C1I K48632 [0,1,0,0,0,1|2,0,0]=4 861 B11R1.159 CC1=CC=CC(C(=O)[O-])=C1O C3234 [0,1,0,0,0,1|2,0,0]=4 862 B11R1.159 CC1=CC=CC(C(N)=O)=C1N A46650 [0,1,0,0,0,1|2,0,0]=4 863 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 B48243 [0,1,0,0,0,1|2,0,0]=4 864 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 B48249 [0,1,0,0,0,1|2,0,0]=4 865 B11R1.167 CC(=O)C1=C(C)C=CC(Br)=C1 B61483 [0,1,0,0,0,1|2,0,0]=4 866 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 F62666 [0,1,0,0,0,1|2,0,0]=4 867 B11R1.167 CC(=O)C1=C(C)C=NC(Cl)=N1 C45701 [0,1,0,0,0,1|2,0,0]=4 868 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 B48247 [0,1,0,0,0,1|2,0,0]=4 869 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=N1 B45033 [0,1,0,0,0,1|2,0,0]=4 870 B11R1.167 CC(=O)C1=C(F)C=CC(Cl)=C1 C48279 [0,1,0,0,0,1|2,0,0]=4 871 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 D48287 [0,1,0,0,0,1|2,0,0]=4 872 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 A49053 [0,1,0,0,0,1|2,0,0]=4 873 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 F48623 [0,1,0,0,0,1|2,0,0]=4 874 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 F48292 [0,1,0,0,0,1|2,0,0]=4 875 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 A49025 [0,1,0,0,0,1|2,0,0]=4 876 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 A49038 [0,1,0,0,0,1|2,0,0]=4 877 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 A49049 [0,1,0,0,0,1|2,0,0]=4 878 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 B3183 [0,1,0,0,0,1|2,0,0]=4 879 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 H49899 [0,1,0,0,0,1|1,0,0]=3 880 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 C48603 [0,1,0,0,0,1|2,0,0]=4 881 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 F39496 [0,1,0,0,0,1|2,0,0]=4 882 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 A49291 [0,1,0,0,0,1|2,0,0]=4 883 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 D39506 [0,1,0,0,0,1|2,0,0]=4 884 B11R1.167 CC(=O)C1=CC(Br)=CN=C1C B49027 [0,1,0,0,0,1|2,0,0]=4 885 B11R1.167 CC(=O)C1=CC(Br)=CN=C1Cl B12729 [0,1,0,0,0,1|2,0,0]=4 886 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F B10880 [0,1,0,0,0,1|2,0,0]=4 887 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 B48567 [0,1,0,0,0,1|2,0,0]=4 888 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 D39532 [0,1,0,0,0,1|2,0,0]=4 889 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 C48592 [0,1,0,0,0,1|2,0,0]=4 890 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 C45365 [0,1,0,0,0,1|2,0,0]=4 891 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 F48611 [0,1,0,0,0,1|2,0,0]=4 892 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 F45384 [0,1,0,0,0,1|2,0,0]=4 893 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 I24082 [0,1,0,0,0,1|2,0,0]=4 894 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 A67448 [0,1,0,0,0,1|2,0,0]=4 895 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 A1742 [0,1,0,0,0,1|2,0,0]=4 896 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 A31834 [0,1,0,0,0,1|2,0,0]=4 897 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 A46002 [0,1,0,0,0,1|2,0,0]=4 898 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 H60608 [0,1,0,0,0,1|2,0,0]=4 899 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 A46652 [0,1,0,0,0,1|2,0,0]=4 900 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 A13502 [0,1,0,0,0,1|2,0,0]=4 901 B11R1.167 CC1=CC=C(O)C(C(=O)O)=N1 H45842 [0,1,0,0,0,1|2,0,0]=4 902 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 D46014 [0,1,0,0,0,1|2,0,0]=4 903 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 C45357 [0,1,0,0,0,1|2,0,0]=4 904 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=N1 C42409 [0,1,0,0,0,1|2,0,0]=4 905 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 F45381 [0,1,0,0,0,1|2,0,0]=4 906 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=N1 B14424 [0,1,0,0,0,1|2,0,0]=4 907 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 C62178 [0,1,0,0,0,1|2,0,0]=4 908 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=N1 C11200 [0,1,0,0,0,1|2,0,0]=4 909 B11R1.266 CC(=O)C1=CC(C#N)=CC=C1 A51159 [0,1,0,0,0,1|1,0,1]=4 910 B11R1.266 CC(=O)C1=NC(C#N)=CC=C1 A47868 [0,1,0,0,0,1|1,0,1]=4 911 B11R1.266 CC(=O)C1=NC=CC(C#N)=C1 A38324 [0,1,0,0,0,1|1,0,1]=4 912 B11R1.266 COC1=CC(C(=O)O)=CN=C1 M45836 [0,1,0,0,0,1|2,0,0]=4 913 B11R1.266 COC1=CC(C(=O)O)=NC=C1 M3752 [0,1,0,0,0,1|2,0,0]=4 914 B11R1.266 COC1=CC=CC(C(=O)O)=N1 M45837 [0,1,0,0,0,1|2,0,0]=4 915 B11R1.266 COC1=CC=CC(C(C)=O)=C1 M27970 [0,1,0,0,0,1|1,0,0]=3 916 B11R1.266 COC1=CC=CC(C(C)=O)=N1 A49277 [0,1,0,0,0,1|1,0,0]=3 917 B11R1.266 COC1=CC=CC(C(N)=O)=N1 M39020 [0,1,0,0,0,1|2,0,0]=4 918 B11R1.266 COC1=CN=CC(C(=O)O)=N1 M42788 [0,1,0,0,0,1|2,0,0]=4 919 B11R1.266 COC1=CN=CC(C(N)=O)=N1 M63359 [0,1,0,0,0,1|2,0,0]=4 920 B11R1.266 COC1=NC=CC(C(=O)O)=C1 M12734 [0,1,0,0,0,1|2,0,0]=4 921 B11R1.266 COC1=NC=CC(C(=O)O)=N1 M38982 [0,1,0,0,0,1|2,0,0]=4 922 B11R1.266 CSC1=CC(C(=O)O)=CC=C1 M49088 [0,1,0,0,0,1|2,0,0]=4 923 B11R1.266 CSC1=NC(C(=O)O)=CC=N1 M28646 [0,1,0,0,0,1|2,0,0]=4 924 B11R1.266 CSC1=NC(C(C)=O)=CC=N1 M46058 [0,1,0,0,0,1|1,0,0]=3 925 B11R1.266 NC(=O)C1=CC=CC(CBr)=C1 B39073 [0,1,0,0,0,1|2,0,0]=4 926 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 A49646 [0,1,0,0,0,1|2,0,0]=4 927 B11R1.266 NCC1=CC=CC(C(N)=O)=C1 A46649 [0,1,0,0,0,1|2,0,0]=4 928 B11R1.266 O=C(O)C1=CC(CO)=CC=C1 H62311 [0,1,0,0,0,1|2,0,0]=4 929 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 H63529 [0,1,0,0,0,1|2,0,0]=4 930 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 B38629 [0,1,0,0,0,1|2,0,0]=4 931 B11R1.266 O=C(O)C1=CC=CC(CCl)=C1 C48590 [0,1,0,0,0,1|2,0,0]=4 932 B11R1.266 O=C(O)C1=NC(CO)=CC=C1 H45841 [0,1,0,0,0,1|2,0,0]=4 933 B11R1.15 CCOC(=O)C1=CC(C)=CN1 E69074 [0,2,0,0,0,0|2,0,0]=4 934 B11R1.15 CCOC(=O)C1=CC=C(Br)O1 E45937 [0,2,0,0,0,0|1,1,0]=4 935 B11R1.15 CCOC(=O)C1=CC=C(Br)S1 E45907 [0,2,0,0,0,0|1,0,0]=3 936 B11R1.15 CCOC(=O)C1=CC=C(C)N1 E13124 [0,2,0,0,0,0|1,0,0]=3 937 B11R1.15 CCOC(=O)C1=CC=C(C)S1 E46839 [0,2,0,0,0,0|0,0,0]=2 938 B11R1.15 CCOC(=O)C1=CC=C(Cl)S1 E45915 [0,2,0,0,0,0|1,0,0]=3 939 B11R1.15 CCOC(=O)C1=CN=C(Br)S1 E2650 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.15 CCOC(=O)C1=CN=C(C)S1 E2885 [0,2,0,0,0,0|1,0,0]=3 941 B11R1.15 CCOC(=O)C1=CN=C(Cl)S1 E42860 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.15 CCOC(=O)C1=CN=C(N)S1 E2652 [0,2,0,0,0,0|2,0,0]=4 943 B11R1.15 CCOC(=O)C1=CNC(C)=C1 E64019 [0,2,0,0,0,0|2,0,0]=4 944 B11R1.15 CCOC(=O)C1=COC(C)=N1 E9858 [0,2,0,0,0,0|2,0,0]=4 945 B11R1.15 CCOC(=O)C1=CSC(C)=N1 E2046 [0,2,0,0,0,0|2,0,0]=4 946 B11R1.15 CCOC(=O)C1=NN(C)C=C1 E43656 [0,2,0,0,0,0|2,0,0]=4 947 B11R1.44 COC(=O)C1=CC(CN)=CS1 M46579 [0,2,0,0,0,0|2,0,0]=4 948 B11R1.44 COC(=O)C1=CC(CO)=CN1 M63509 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.44 COC(=O)C1=CC=C(C#N)N1 M36871 [0,2,0,0,0,0|1,0,1]=4 950 B11R1.44 COC(=O)C1=CC=C(C=O)N1 M45846 [0,2,0,0,0,0|1,0,1]=4 951 B11R1.44 COC(=O)C1=CC=C(C=O)S1 M67529 [0,2,0,0,0,0|0,0,1]=3 952 B11R1.44 COC(=O)C1=CC=C(CCl)O1 M45939 [0,2,0,0,0,0|0,1,0]=3 953 B11R1.44 COC(=O)C1=CC=C(CN)N1 M43667 [0,2,0,0,0,0|1,0,0]=3 954 B11R1.44 COC(=O)C1=CN=C(C=O)S1 M15091 [0,2,0,0,0,0|1,0,1]=4 955 B11R1.44 COC(=O)C1=COC(CCl)=N1 M2093 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.44 COC(=O)C1=CSC(CCl)=N1 M36783 [0,2,0,0,0,0|2,0,0]=4 957 B11R1.225 CC1=CN(C)N=C1C(=O)CBr B46324 [0,2,0,0,0,0|2,0,0]=4 958 B11R1.225 CN1C=C(Cl)C(C(=O)CBr)=N1 B38169 [0,2,0,0,0,0|2,0,0]=4 959 B11R1.225 COC(=O)C1=C(C)C=C(C)N1 M63511 [0,2,0,0,0,0|1,0,0]=3 960 B11R1.225 COC(=O)C1=C(C)N=C(N)S1 M43241 [0,2,0,0,0,0|2,0,0]=4 961 B11R1.225 COC(=O)C1=C(N)C=C(Br)S1 M11588 [0,2,0,0,0,0|1,0,0]=3 962 B11R1.225 COC(=O)C1=C(N)C=C(C)S1 M12253 [0,2,0,0,0,0|0,0,0]=2 963 B11R1.225 COC(=O)C1=C(N)C=C(I)S1 M42866 [0,2,0,0,0,0|1,0,0]=3 964 B11R1.225 COC(=O)C1=C(O)C=C(C)S1 M46270 [0,2,0,0,0,0|0,0,0]=2 965 B11R1.225 COC(=O)C1=C(O)C=C(Cl)S1 M42718 [0,2,0,0,0,0|1,0,0]=3 966 B11R1.225 COC(=O)C1=NN(C)C=C1Br M43034 [0,2,0,0,0,0|2,0,0]=4 967 B11R1.225 COC(=O)C1=NN(C)C=C1I M43049 [0,2,0,0,0,0|2,0,0]=4 968 B11R1.225 COC(=O)C1=NN(C)C=C1N M43367 [0,2,0,0,0,0|2,0,0]=4 969 B11R1.226 COC(=O)C1=CC(Br)=C(Br)O1 M42328 [0,2,0,0,0,0|1,1,0]=4 970 B11R1.226 COC(=O)C1=CC(Br)=C(Cl)S1 M66824 [0,2,0,0,0,0|1,0,0]=3 971 B11R1.226 COC(=O)C1=CC(Cl)=C(Cl)S1 M42320 [0,2,0,0,0,0|1,0,0]=3 972 B11R1.226 COC(=O)C1=NN(C)C(Br)=C1 M43035 [0,2,0,0,0,0|2,0,0]=4 973 B11R1.226 COC(=O)C1=NN(C)C(N)=C1 M13449 [0,2,0,0,0,0|2,0,0]=4 974 B11R1.226 COC(=O)C1=NN(C)C(O)=C1 M43250 [0,2,0,0,0,0|2,0,0]=4 975 B11R1.865 COC(=O)C1=C(N)C(C)=CS1 M39420 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.865 COC(=O)C1=CC=C(Br)N1C M32391 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.865 COC(=O)C1=CSC(C)=C1N M46425 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.45 NCC1=CC=C(S(N)(=O)=O)S1 A64663 [0,2,0,0,0,0|2,0,0]=4 979 B11R1.50 CNC1=NC(C)=C(C(C)=O)S1 M43687 [0,2,0,0,0,0|1,0,0]=3 980 B11R1.175 CC(=O)C1=CC=C(B(O)O)S1 A1130 [0,2,0,0,0,0|1,0,0]=3 981 B11R1.175 CC(=O)C1=CC=C(C(=O)O)S1 C64579 [0,2,0,0,0,0|0,0,1]=3 982 B11R1.175 CC(=O)C1=CC=C([N+](=O)[O-])S1 N42610 [0,2,0,0,0,0|1,0,0]=3 983 B11R1.175 CC(=O)C1=NC=C(C(=O)O)S1 A66026 [0,2,0,0,0,0|1,0,1]=4 984 B11R1.175 O=C(O)C1=CC=C(B(O)O)S1 C41014 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.175 O=C(O)C1=CC=C([N+](=O)[O-])S1 N12837 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.49 CCC1=C(C(=O)O)SC(C)=N1 E46419 [0,2,0,0,0,0|2,0,0]=4 987 B9R1.6 CC(=O)C1=NN=CC=C1 P0157 [0,0,1,1,0,0|2,0,0]=4 988 B9R1.69 CC1=CC(C)=C(Br)C=C1 D39510 [0,0,1,1,0,0|2,0,0]=4 989 B9R1.69 CC1=CC(C)=C([Mg+])C=C1 D31735 [0,0,1,1,0,0|2,0,0]=4 990 B9R1.69 CC1=CC=C(N)C(C)=N1 D43608 [0,0,1,1,0,0|2,0,0]=4 991 B9R1.69 CC1=NC(C)=C(Br)C=C1 B46082 [0,0,1,1,0,0|2,0,0]=4 992 B9R1.69 CC1=NC(C)=C(O)C=C1 D67987 [0,0,1,1,0,0|1,1,0]=4 993 B11R2.60 CN1C=CC2=C1CCC2=O M60434 [0,1,0,1,0,0|2,0,0]=4 994 B9R1.2 C=CC1=NC(C)=CC=C1 M16640 [1,0,0,0,0,1|1,0,1]=4 995 B9R1.2 CC1=CC(C=O)=CN=C1 M12908 [1,0,0,0,0,1|1,0,0]=3 996 B9R1.2 CC1=CC(C=O)=NC=C1 M3027 [1,0,0,0,0,1|1,0,0]=3 997 B9R1.2 CC1=CC=CC(C=O)=N1 M67935 [1,0,0,0,0,1|1,0,0]=3 998 B9R1.2 CC1=CC=NC(C=O)=N1 M14427 [1,0,0,0,0,1|1,0,0]=3 999 B9R1.2 CC1=CN=CC(C=O)=N1 M16928 [1,0,0,0,0,1|1,0,0]=3 1000 B9R1.2 CC1=NC=CC(C=O)=C1 M36797 [1,0,0,0,0,1|1,0,0]=3 1001 B9R1.2 CC1=NC=CC(C=O)=N1 M42771 [1,0,0,0,0,1|1,0,0]=3 1002 B9R1.2 CNC1=CC(C)=CC=C1 D46861 [1,0,0,0,0,1|2,0,0]=4 1003 B9R1.2 CNC1=NC(C)=CC=C1 D43615 [1,0,0,0,0,1|2,0,0]=4 1004 B9R1.2 COC1=CC(C)=NC=C1 M22575 [1,0,0,0,0,1|2,0,0]=4 1005 B9R1.2 COC1=NC(C)=CC=C1 M46380 [1,0,0,0,0,1|2,0,0]=4 1006 B9R1.2 COC1=NC(C)=CC=N1 M43202 [1,0,0,0,0,1|2,0,0]=4 1007 B9R1.2 COC1=NC(C)=NC=C1 M43205 [1,0,0,0,0,1|2,0,0]=4 1008 B9R1.2 COC1=NC=CC(C)=C1 M46379 [1,0,0,0,0,1|2,0,0]=4 1009 B9R1.2 NC1=CC(C=O)=NC=C1 A37575 [1,0,0,0,0,1|2,0,0]=4 1010 B9R1.2 NC1=CC=CC(C=O)=C1 A46548 [1,0,0,0,0,1|2,0,0]=4 1011 B9R1.2 O=CC1=CC(Br)=CN=C1 B3012 [1,0,0,0,0,1|2,0,0]=4 1012 B9R1.2 O=CC1=CC(Br)=NC=C1 B2598 [1,0,0,0,0,1|2,0,0]=4 1013 B9R1.2 O=CC1=CC(Cl)=CN=C1 C15036 [1,0,0,0,0,1|2,0,0]=4 1014 B9R1.2 O=CC1=CC(Cl)=NC=C1 C0408 [1,0,0,0,0,1|2,0,0]=4 1015 B9R1.2 O=CC1=CC(F)=CN=C1 F15543 [1,0,0,0,0,1|2,0,0]=4 1016 B9R1.2 O=CC1=CC(F)=NC=C1 F2753 [1,0,0,0,0,1|2,0,0]=4 1017 B9R1.2 O=CC1=CC(O)=CC=C1 H15969 [1,0,0,0,0,1|2,0,0]=4 1018 B9R1.2 O=CC1=CC(O)=NC=C1 H42599 [1,0,0,0,0,1|2,0,0]=4 1019 B9R1.2 O=CC1=CC=CC(Br)=C1 B68146 [1,0,0,0,0,1|2,0,0]=4 1020 B9R1.2 O=CC1=CC=CC(Br)=N1 B0253 [1,0,0,0,0,1|2,0,0]=4 1021 B9R1.2 O=CC1=CC=CC(Cl)=C1 C69283 [1,0,0,0,0,1|2,0,0]=4 1022 B9R1.2 O=CC1=CC=CC(Cl)=N1 C42296 [1,0,0,0,0,1|2,0,0]=4 1023 B9R1.2 O=CC1=CC=CC(F)=C1 F45149 [1,0,0,0,0,1|2,0,0]=4 1024 B9R1.2 O=CC1=CC=CC(F)=N1 F42303 [1,0,0,0,0,1|2,0,0]=4 1025 B9R1.2 O=CC1=CC=CC(I)=C1 K45152 [1,0,0,0,0,1|2,0,0]=4 1026 B9R1.2 O=CC1=CC=NC(Cl)=N1 C14545 [1,0,0,0,0,1|2,0,0]=4 1027 B9R1.2 O=CC1=CN=CC(Cl)=N1 C14597 [1,0,0,0,0,1|2,0,0]=4 1028 B9R1.2 O=CC1=CN=CC(O)=C1 H37579 [1,0,0,0,0,1|2,0,0]=4 1029 B9R1.2 O=CC1=NC=CC(Br)=C1 B15000 [1,0,0,0,0,1|2,0,0]=4 1030 B9R1.2 O=CC1=NC=CC(Cl)=C1 C10313 [1,0,0,0,0,1|2,0,0]=4 1031 B9R1.2 O=CC1=NC=CC(F)=C1 F16335 [1,0,0,0,0,1|2,0,0]=4 1032 B9R1.13 CC(=O)NC1=CSC=C1 T43173 [1,0,0,0,0,1|2,0,0]=4 1033 B9R1.13 O=C(Cl)CC1=CC=CS1 T39261 [1,0,0,0,0,1|1,0,0]=3 1034 B9R1.13 O=C(O)CC1=CC=CO1 F42944 [1,0,0,0,0,1|1,1,0]=4 1035 B9R1.13 O=C(O)CC1=CC=CS1 T12816 [1,0,0,0,0,1|1,0,0]=3 1036 B9R1.13 O=C(O)CC1=NC=CS1 T15370 [1,0,0,0,0,1|2,0,0]=4 1037 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 B52021 [0,0,0,0,0,2|2,0,0]=4 1038 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 C52036 [0,0,0,0,0,2|2,0,0]=4 1039 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 F52043 [0,0,0,0,0,2|2,0,0]=4 1040 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 H46009 [0,0,0,0,0,2|2,0,0]=4 1041 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 B45690 [0,0,0,0,0,2|2,0,0]=4 1042 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 H46008 [0,0,0,0,0,2|2,0,0]=4 1043 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 A66708 [0,0,0,0,0,2|2,0,0]=4 1044 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 A64153 [0,0,0,0,0,2|2,0,0]=4 1045 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 T37815 [0,0,0,0,0,2|2,0,0]=4 1046 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 M49647 [0,0,0,0,0,2|2,0,0]=4 1047 B11R1.20 CC1=NC=C(CC(=O)O)C=C1 M61975 [0,0,0,0,0,2|2,0,0]=4 1048 B11R1.75 CC1=CC=C(\C=C\C(=O)O)S1 M61065 [0,0,0,0,0,2|1,0,0]=3 1049 B11R1.75 O=C(O)\C=C\C1=CC=C(Br)S1 B62002 [0,0,0,0,0,2|2,0,0]=4 1050 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 B64129 [0,0,0,0,0,2|2,0,0]=4 1051 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 C52040 [0,0,0,0,0,2|2,0,0]=4 1052 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 F52045 [0,0,0,0,0,2|2,0,0]=4 1053 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 C3776 [0,0,0,0,0,2|2,0,0]=4 1054 B11R1.157 CC(=O)NC1=CC=CC(Br)=N1 B45691 [0,0,0,0,0,2|2,0,0]=4 1055 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 F2848 [0,0,0,0,0,2|2,0,0]=4 1056 B11R1.157 CC(=O)NC1=NC(=O)NC=C1 X39275 [0,0,0,0,0,2|2,0,0]=4 1057 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 A46342 [0,0,0,0,0,2|2,0,0]=4 1058 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 B45689 [0,0,0,0,0,2|2,0,0]=4 1059 B11R1.157 CC(=O)NC1=NC=CC(Cl)=C1 C45700 [0,0,0,0,0,2|2,0,0]=4 1060 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 F48608 [0,0,0,0,0,2|2,0,0]=4 1061 B11R1.157 CC(=O)OC1=CC=CC(I)=C1 K48628 [0,0,0,0,0,2|2,0,0]=4 1062 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 T49882 [0,0,0,0,0,2|2,0,0]=4 1063 B11R1.157 CC1=CC=CC(CC(=O)[O-])=N1 S49484 [0,0,0,0,0,2|2,0,0]=4