0 B10R1.13 BrC1=CN=C(C=N1)C(=O)O AK-24192 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.13 BrC1=CN=C(N=C1)C(=O)O AK-21808 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.13 C(C)(=O)C1=CC=C(N=C1)Br AK-25404 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 C1=C(B(O)O)C=CC(=C1)C AK-39805 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.13 C1=C(C(=N)N)C=CC(=C1)Cl AK-49053 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.13 C1=C(C(C)C)C=CC(=C1)Br AK-47451 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.13 C1=C(C=CC(=C1)Br)B(O)O AK-44722 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.13 C1=C(C=CC(=C1)F)B(O)O AK-46490 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.13 C1=C(C=CC(=C1)O)B(O)O AK-44804 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.13 C1=C(C=CC(=N1)Cl)B(O)O AK-29256 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.13 C1=C(C=CC(=N1)F)B(O)O AK-29209 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.13 C1=C(C=CC(=N1)F)[N+]([O-])=O AK-25997 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.13 C1=C(C=CC(=N1)[N+]([O-])=O)Cl AK-47611 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.13 C1=C(C=NC(=C1)N)C(=O)O AK-25111 [0,0,0,0,0,0|1,0,0]=1 14 B10R1.13 C1=C(C=NC(=N1)N)[N+]([O-])=O AK-27269 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.13 C1=C(N(C)C)C=CC(=C1)Br AK-47628 [0,0,0,0,0,0|4,0,0]=4 16 B10R1.13 C1=C(N=CC(=C1)C(C)=O)C AK-25853 [0,0,0,0,0,0|3,0,0]=3 17 B10R1.13 C1=C([N+](=O)[O-])N=CC(=C1)C AK-28721 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.13 C1=CC(=CC=C1C(C)=O)F AK-41690 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.13 C1=CC(=CC=C1C(N)=O)F AK-47676 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.13 C1=CC(=CC=C1C(O)=O)Br AK-50463 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.13 C1=CC(=CC=C1C(O)=O)F AK-73077 [0,0,0,0,0,0|1,0,0]=1 22 B10R1.13 C1=CC(=CN=C1C(O)=O)C AK-27814 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.13 C1=CC(=CN=C1[N+](=O)[O-])Br AK-25916 [0,0,0,0,0,0|3,0,1]=4 24 B10R1.13 C1=CC(=NC=C1C(N)=O)C AK-48877 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Br AK-35205 [0,0,0,0,0,0|3,0,1]=4 26 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Cl AK-25992 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])N AK-30014 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.13 C1=NC(=CC=C1C(=O)O)F AK-25936 [0,0,0,0,0,0|2,0,0]=2 29 B10R1.13 C1=NC(=CN=C1C(=O)N)Cl AK-28055 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.13 C1=NC(=CN=C1C(=O)O)Cl AK-24710 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.13 CC(=O)C1=CC=C(N)N=C1 AK-67650 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.13 CC(Br)C1=CC=C(F)C=C1 AK-94758 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.13 CC(C1=CC=C(Br)C=C1)=O AK124422 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.13 CC(C1=CC=C(C)C=C1)=O AK-41305 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.13 CC(C1=CC=C(F)N=C1)=O AK-29672 [0,0,0,0,0,0|3,0,0]=3 36 B10R1.13 CC(C1=CC=C(N)C=C1)=O AK110424 [0,0,0,0,0,0|1,0,0]=1 37 B10R1.13 CC(C1=CC=C(O)C=C1)=O AK-86441 [0,0,0,0,0,0|2,0,0]=2 38 B10R1.13 CC(C1=CC=C(O)N=C1)=O AK-40333 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.13 CC(C1=CN=C(Cl)N=C1)=O AK135579 [0,0,0,0,0,0|4,0,0]=4 40 B10R1.13 CC(C1=CN=C(N)C=C1)C AK-81363 [0,0,0,0,0,0|3,0,1]=4 41 B10R1.13 CC(C1=NC=C(Br)C=C1)=O AK-28454 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.13 CC(C1=NC=C(Br)C=N1)=O AK129384 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.13 CC(C1=NC=C(Cl)C=C1)=O AK-77099 [0,0,0,0,0,0|3,0,0]=3 44 B10R1.13 CC(C1=NC=C(Cl)N=C1)=O AK-42149 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.13 CC(C1=NC=C(O)C=C1)=O AK116053 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.13 CC(C1=NC=C(O)N=C1)=O AK134806 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.13 CC(N)C1=CC=C(I)C=C1 AK-77292 [0,0,0,0,0,0|3,0,1]=4 48 B10R1.13 CC(O)C1=CC=C(Br)C=C1 AK117026 [0,0,0,0,0,0|2,0,1]=3 49 B10R1.13 CC(O)C1=CC=C(N)C=C1 AK109742 [0,0,0,0,0,0|1,0,1]=2 50 B10R1.13 CC(O)C1=CN=C(C)C=C1 AK-32149 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.13 CC1=CC=C(S(O)=O)C=C1 AK-46949 [0,0,0,0,0,0|2,0,0]=2 52 B10R1.13 CC1=NC=C(C=C1)B(O)O AK-27039 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.13 CC1=NC=C(C=N1)C(=O)O AK-25207 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.13 CN(C)C1=CC=C(C=C1)I AK101968 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 AK136579 [0,0,0,0,0,0|4,0,0]=4 56 B10R1.13 CN(C)C1=CC=C(O)C=C1 AK-64702 [0,0,0,0,0,0|4,0,0]=4 57 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-45030 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-89611 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 AK-43006 [0,0,0,0,0,0|3,0,1]=4 60 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 AK-79215 [0,0,0,0,0,0|2,0,1]=3 61 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AK-34471 [0,0,0,0,0,0|3,0,1]=4 62 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 AK548805 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 AK-79189 [0,0,0,0,0,0|2,0,1]=3 64 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 AK-79216 [0,0,0,0,0,0|2,0,1]=3 65 B10R1.13 ClC1=CC=C(B(O)O)C=C1 AK-26616 [0,0,0,0,0,0|2,0,1]=3 66 B10R1.13 ClC1=CC=C(C(C)=O)C=N1 AK-26129 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.13 ClC1=CC=C(N=C1)C(=O)O AK-26702 [0,0,0,0,0,0|2,0,0]=2 68 B10R1.13 ClC1=CC=C(N=N1)C(=O)N AK-28115 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.13 ClC1=CC=C(N=N1)C(=O)O AK-23862 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.13 ClC1=CN=C(C=C1)B(O)O AK-24785 [0,0,0,0,0,0|3,0,1]=4 71 B10R1.13 FC(C1=CC=C(Cl)C=C1)F AK-77798 [0,0,0,0,0,0|3,0,1]=4 72 B10R1.13 FC1=CC=C(N=C1)C(=O)O AK-28724 [0,0,0,0,0,0|2,0,0]=2 73 B10R1.13 IC1=CC=C(B(O)O)C=C1 AK-24763 [0,0,0,0,0,0|2,0,1]=3 74 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 AK-89169 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 AK107083 [0,0,0,0,0,0|3,0,0]=3 76 B10R1.13 N=C(N)C1=CC=C(F)C=C1 AK-35244 [0,0,0,0,0,0|3,0,0]=3 77 B10R1.13 N=C(N)C1=CC=C(N)C=C1 AK-34349 [0,0,0,0,0,0|2,0,0]=2 78 B10R1.13 N=C(N)C1=CC=C(O)C=C1 AK-16801 [0,0,0,0,0,0|3,0,0]=3 79 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 AK-67868 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.13 N=C(N)C1=NC=C(F)C=C1 AK130362 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AK-76760 [0,0,0,0,0,0|2,0,0]=2 82 B10R1.13 NC(=O)C1=NC=C(N)C=N1 AK-82639 [0,0,0,0,0,0|3,0,0]=3 83 B10R1.13 NC(=O)C1=NC=C(N)N=C1 AK102768 [0,0,0,0,0,0|3,0,0]=3 84 B10R1.13 NC1=CC=C(B(O)O)C=C1 AK-44817 [0,0,0,0,0,0|1,0,1]=2 85 B10R1.13 NC1=CC=C(C(C)C)N=C1 AK-30855 [0,0,0,0,0,0|3,0,1]=4 86 B10R1.13 NC1=CC=C(C(F)F)N=C1 AK143270 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.13 NC1=CC=C(N=C1)C(F)F AK104590 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.13 NC1=CC=C([N+]([O-])=O)C=C1 AK136006 [0,0,0,0,0,0|1,0,1]=2 89 B10R1.13 NC1=CN=C(C=C1)C(=O)O AK-25651 [0,0,0,0,0,0|1,0,0]=1 90 B10R1.13 NC1=CN=C(C=C1)[N+](=O)[O-] AK-23524 [0,0,0,0,0,0|2,0,1]=3 91 B10R1.13 NC1=CN=C(N=C1)C(O)=O AK-29407 [0,0,0,0,0,0|2,0,0]=2 92 B10R1.13 NC1=NC=C(B(O)O)C=N1 AK-62138 [0,0,0,0,0,0|3,0,1]=4 93 B10R1.13 NC1=NC=C(C=C1)B(O)O AK-36570 [0,0,0,0,0,0|2,0,1]=3 94 B10R1.13 NC1=NC=C(N=C1)C(=O)O AK-24195 [0,0,0,0,0,0|2,0,0]=2 95 B10R1.13 N[C@@H](C1=CC=C(Br)C=C1)C AK-35249 [0,0,0,0,0,0|3,0,1]=4 96 B10R1.13 N[C@@H](C1=CC=C(C)C=C1)C AK-45033 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.13 N[C@H](C1=CC=C(F)C=C1)C AK-98664 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.13 O=C(C1=CC=C(Cl)N=C1)N AK-44668 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.13 O=C(C1=CN=C(Cl)N=C1)O AK-25020 [0,0,0,0,0,0|3,0,0]=3 100 B10R1.13 O=C(C1=CN=C(N)N=C1)O AK-17303 [0,0,0,0,0,0|2,0,0]=2 101 B10R1.13 O=C(C1=CN=C(O)N=C1)O AK-55017 [0,0,0,0,0,0|3,0,0]=3 102 B10R1.13 O=C(C1=CNC(C=N1)=O)O AK-24756 [0,0,0,0,0,0|3,0,0]=3 103 B10R1.13 O=C(C1=NC=C(Br)C=C1)N AK-36812 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.13 O=C(C1=NC=C(Br)C=C1)O AK-25747 [0,0,0,0,0,0|2,0,0]=2 105 B10R1.13 O=C(C1=NC=C(Br)C=N1)N AK-75832 [0,0,0,0,0,0|4,0,0]=4 106 B10R1.13 O=C(C1=NC=C(Br)N=C1)N AK156282 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.13 O=C(C1=NC=C(C)C=N1)O AK-29650 [0,0,0,0,0,0|3,0,0]=3 108 B10R1.13 O=C(C1=NC=C(N)C=C1)N AK-40127 [0,0,0,0,0,0|2,0,0]=2 109 B10R1.13 O=C(C1=NC=C(O)C=N1)O AK-40704 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.13 O=C(C1=NN=C(N)C=C1)O AK-26163 [0,0,0,0,0,0|2,0,0]=2 111 B10R1.13 O=C(C1=NN=C(O)C=C1)O AK-25880 [0,0,0,0,0,0|3,0,0]=3 112 B10R1.13 O=C(C1=NN=C(O)C=C1)O AK601861 [0,0,0,0,0,0|3,0,0]=3 113 B10R1.13 O=C(N)C1=CC=C(Cl)C=C1 AK113058 [0,0,0,0,0,0|2,0,0]=2 114 B10R1.13 O=C(N)C1=CC=C(N)C=C1 AK151254 [0,0,0,0,0,0|1,0,0]=1 115 B10R1.13 O=C(N)C1=CC=C(O)C=C1 AK151255 [0,0,0,0,0,0|2,0,0]=2 116 B10R1.13 O=C(N)C1=CN=C(Br)C=C1 AK-41744 [0,0,0,0,0,0|3,0,0]=3 117 B10R1.13 O=C(N)C1=CN=C(N)C=C1 AK161454 [0,0,0,0,0,0|2,0,0]=2 118 B10R1.13 O=C(N)C1=NC=C(Cl)C=C1 AK142780 [0,0,0,0,0,0|3,0,0]=3 119 B10R1.13 O=C(N)C1=NC=C(F)C=C1 AK110171 [0,0,0,0,0,0|3,0,0]=3 120 B10R1.13 O=C(O)C1=CC=C(C)C=C1 AK106262 [0,0,0,0,0,0|1,0,0]=1 121 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 AK-44086 [0,0,0,0,0,0|1,0,0]=1 122 B10R1.13 O=C(O)C1=CC=C(I)C=C1 AK-73094 [0,0,0,0,0,0|1,0,0]=1 123 B10R1.13 O=C(O)C1=CC=C(N)C=C1 AK-41178 [0,0,0,0,0,0|0,0,0]=0 124 B10R1.13 O=C(O)C1=CC=C(O)C=C1 AK106263 [0,0,0,0,0,0|1,0,0]=1 125 B10R1.13 O=C(O)C1=CN=C(C)C=C1 AK-29149 [0,0,0,0,0,0|2,0,0]=2 126 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AK-26081 [0,0,0,0,0,0|2,0,0]=2 127 B10R1.13 O=C(O)C1=CNC(C=C1)=O AK-26034 [0,0,0,0,0,0|2,0,0]=2 128 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AK-24769 [0,0,0,0,0,0|2,0,0]=2 129 B10R1.13 O=C([O-])C1=CC=C(N)C=C1 AK116649 [0,0,0,0,0,0|0,0,1]=1 130 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 AK306852 [0,0,0,0,0,0|1,0,1]=2 131 B10R1.13 O=C1C=CC(C(O)=O)=CO1 AK-46024 [0,0,0,0,0,0|2,0,0]=2 132 B10R1.13 O=S(C1=CC=C(C)C=C1)O AK143296 [0,0,0,0,0,0|2,0,0]=2 133 B10R1.13 O=S(C1=CC=C(C)C=C1)[O-] AK106973 [0,0,0,0,0,0|2,0,1]=3 134 B10R1.13 O=S(C1=CC=C(F)C=C1)[O-] AK114760 [0,0,0,0,0,0|2,0,1]=3 135 B10R1.13 O=[N+](C1=CN=C(C)C=C1)[O-] AK-28977 [0,0,0,0,0,0|3,0,1]=4 136 B10R1.13 O=[N+](C1=NC=C(F)C=C1)[O-] AK-36376 [0,0,0,0,0,0|3,0,1]=4 137 B10R1.13 O=[N+]([O-])C1=CNC(=O)C=C1 AK-29363 [0,0,0,0,0,0|3,0,1]=4 138 B10R1.13 O=[S@@](C1=CC=C(C)C=C1)N AK-81446 [0,0,0,0,0,0|3,0,0]=3 139 B10R1.13 OB(C1=CC=C(O)N=C1)O AK-40749 [0,0,0,0,0,0|3,0,1]=4 140 B10R1.13 OB(C1=CC=C(S)C=C1)O AK-41540 [0,0,0,0,0,0|2,0,1]=3 141 B10R1.13 OB(C1=CN=C(Br)C=C1)O AK-27206 [0,0,0,0,0,0|3,0,1]=4 142 B10R1.13 OC(=O)C1=CC=C(Br)N=C1 AK-26208 [0,0,0,0,0,0|2,0,0]=2 143 B10R1.13 OC(=O)C1=NC=C(Cl)C=N1 AK-64297 [0,0,0,0,0,0|3,0,0]=3 144 B10R1.13 OC(=O)C1=NC=C(I)C=C1 AK-29144 [0,0,0,0,0,0|2,0,0]=2 145 B10R1.13 OC1=CC=C(C(=S)N)C=C1 AK-21819 [0,0,0,0,0,0|2,1,0]=3 146 B10R1.13 OC1=CC=C(C(C)=C)C=C1 AK117164 [0,0,0,0,0,0|3,0,0]=3 147 B10R1.13 OC1=CC=C(C(O)C)C=C1 AK-45202 [0,0,0,0,0,0|2,0,1]=3 148 B10R1.13 OC1=CC=C(C=C1)C(F)F AK-76781 [0,0,0,0,0,0|3,0,1]=4 149 B10R1.13 OC1=CC=C(N(C)C)C=C1 AK103764 [0,0,0,0,0,0|4,0,0]=4 150 B10R1.13 OC1=CC=C([C@H](N)C)C=C1 AK608003 [0,0,0,0,0,0|3,0,1]=4 151 B10R1.13 OC1=CN=C(C=C1)[N+](=O)[O-] AK-23835 [0,0,0,0,0,0|3,0,1]=4 152 B9R1.1 C1=C(C=CC(=C1)Br)C#C AK-39898 [1,0,0,0,0,0|2,0,1]=4 153 B9R1.1 C1=C(C=CC(=C1)CN)O AK-47356 [1,0,0,0,0,0|2,0,1]=4 154 B9R1.1 C1=C(C=CC(=C1)F)C#N AK-44484 [1,0,0,0,0,0|2,0,1]=4 155 B9R1.1 C1=C(C=CC(=C1)I)C=O AK-75599 [1,0,0,0,0,0|1,0,0]=2 156 B9R1.1 C1=C(C=NC(=C1)CO)Br AK-26386 [1,0,0,0,0,0|2,0,1]=4 157 B9R1.1 C1=C(NN)C=CC(=C1)C AK-47398 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.1 C1=CC(=CC=C1Br)CC AK-47528 [1,0,0,0,0,0|2,0,1]=4 159 B9R1.1 C1=CC(=CC=C1CO)O AK-47325 [1,0,0,0,0,0|1,0,1]=3 160 B9R1.1 C1=CC(=CC=C1I)NC AK-39846 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.1 C1=CC(=CN=C1OC)N AK-24754 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.1 C1=CC(=NC=C1CO)Cl AK-28987 [1,0,0,0,0,0|2,0,1]=4 163 B9R1.1 C1=NC(=CC=C1C=O)Br AK-25442 [1,0,0,0,0,0|2,0,0]=3 164 B9R1.1 C1=NC(=CC=C1C=O)Cl AK-25624 [1,0,0,0,0,0|2,0,0]=3 165 B9R1.1 C1=NC(=NC=C1C=O)N AK-28546 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.1 CC1=CC=C(C=O)C=C1 AK-65210 [1,0,0,0,0,0|1,0,0]=2 167 B9R1.1 CC1=CC=C(CO)C=N1 AK-78311 [1,0,0,0,0,0|2,0,1]=4 168 B9R1.1 CC1=CN=C(C=C1)C=O AK-35332 [1,0,0,0,0,0|2,0,0]=3 169 B9R1.1 CC1=NC=C(C=C1)C=O AK-26076 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.1 CNC1=CC=C(Cl)C=C1 AK129065 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.1 CNC1=CC=C(F)C=C1 AK-87253 [1,0,0,0,0,0|3,0,0]=4 172 B9R1.1 COC1=CC=C(Cl)C=C1 AK116963 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.1 COC1=CC=C(I)C=C1 AK-44747 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.1 COC1=CC=C(O)C=C1 AK-46469 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.1 CSC1=CN=C(N)C=C1 AK-40039 [1,0,0,0,0,0|3,0,0]=4 176 B9R1.1 ClC1=CC=C(C=C1)C#N AK-54448 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.1 ClC1=CN=C(C=C1)C=O AK-44636 [1,0,0,0,0,0|2,0,0]=3 178 B9R1.1 ClC1=NC=C(C=O)C=N1 AK-29616 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.1 ClC1=NC=C(C=O)N=C1 AK-87373 [1,0,0,0,0,0|3,0,0]=4 180 B9R1.1 FC1=NC=C(C=C1)C=O AK-25098 [1,0,0,0,0,0|2,0,0]=3 181 B9R1.1 IC1=CC=C(CBr)C=C1 AK-54650 [1,0,0,0,0,0|2,0,1]=4 182 B9R1.1 IC1=CC=C(CC)C=C1 AK121966 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.1 N#CC1=CC=C(I)C=C1 AK-45950 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.1 N#CC1=CC=C(N)C=C1 AK-41176 [1,0,0,0,0,0|1,0,1]=3 185 B9R1.1 N#CC1=CN=C(N)C=C1 AK-32349 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.1 NC1=CC=C(C#C)C=C1 AK-59413 [1,0,0,0,0,0|1,0,1]=3 187 B9R1.1 NC1=CC=C(C=N1)CO AK-29786 [1,0,0,0,0,0|1,0,1]=3 188 B9R1.1 NC1=CC=C(CC)N=C1 AK-78651 [1,0,0,0,0,0|2,0,1]=4 189 B9R1.1 NC1=CC=C(NC)C=C1 AK-86240 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.1 NC1=CN=C(NC)C=C1 AK-75542 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.1 NC1=CN=C(NC)C=C1 AK141591 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.1 NC1=NC=C(C=C1)OC AK-27987 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.1 NCC1=CC=C(Br)C=C1 AK-46356 [1,0,0,0,0,0|2,0,1]=4 194 B9R1.1 NCC1=CC=C(Br)C=C1 AK-49170 [1,0,0,0,0,0|2,0,1]=4 195 B9R1.1 NCC1=CC=C(Cl)C=C1 AK-44456 [1,0,0,0,0,0|2,0,1]=4 196 B9R1.1 NCC1=CC=C(I)C=C1 AK-81624 [1,0,0,0,0,0|2,0,1]=4 197 B9R1.1 NNC1=CC=C(Br)C=C1 AK-26194 [1,0,0,0,0,0|3,0,0]=4 198 B9R1.1 NNC1=CC=C(Cl)C=C1 AK-41259 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.1 NNC1=CC=C(Cl)C=C1 AK132992 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.1 NNC1=CC=C(F)C=C1 AK-85652 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.1 NNC1=CC=C(I)C=C1 AK-64633 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.1 O=C1C=CC(CO)=CN1 AK-29768 [1,0,0,0,0,0|2,0,1]=4 203 B9R1.1 O=CC1=CC=C(Br)C=C1 AK-80048 [1,0,0,0,0,0|1,0,0]=2 204 B9R1.1 O=CC1=CC=C(Cl)C=C1 AK-76679 [1,0,0,0,0,0|1,0,0]=2 205 B9R1.1 O=CC1=CC=C(F)C=C1 AK-84401 [1,0,0,0,0,0|1,0,0]=2 206 B9R1.1 O=CC1=CC=C(O)C=C1 AK-77323 [1,0,0,0,0,0|1,0,0]=2 207 B9R1.1 O=CC1=CN=C(C)N=C1 AK-36829 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.1 O=CC1=CN=C(N)C=C1 AK114395 [1,0,0,0,0,0|1,0,0]=2 209 B9R1.1 O=CC1=CN=C(N)C=C1 AK125046 [1,0,0,0,0,0|1,0,0]=2 210 B9R1.1 O=CC1=CN=C(N)N=C1 AK118712 [1,0,0,0,0,0|2,0,0]=3 211 B9R1.1 O=CC1=CN=C(O)N=C1 AK199230 [1,0,0,0,0,0|3,0,0]=4 212 B9R1.1 O=CC1=NC=C(Br)C=C1 AK-27944 [1,0,0,0,0,0|2,0,0]=3 213 B9R1.1 O=CC1=NC=C(C)N=C1 AK-40389 [1,0,0,0,0,0|3,0,0]=4 214 B9R1.1 O=CC1=NC=C(F)C=C1 AK-34624 [1,0,0,0,0,0|2,0,0]=3 215 B9R1.1 O=CC1=NC=C(O)C=C1 AK-34625 [1,0,0,0,0,0|2,0,0]=3 216 B9R1.1 O=CC=1C=CC(NC1)=O AK-28718 [1,0,0,0,0,0|2,0,0]=3 217 B9R1.1 OC1=CC=C(C=C)C=C1 AK113778 [1,0,0,0,0,0|2,0,0]=3 218 B9R1.1 OC1=CC=C(C=C1)C#N AK-44095 [1,0,0,0,0,0|2,0,1]=4 219 B9R1.1 OC1=CC=C(CO)N=C1 AK-68040 [1,0,0,0,0,0|2,0,1]=4 220 B9R1.1 OCC1=CC=C(Br)C=C1 AK-93775 [1,0,0,0,0,0|1,0,1]=3 221 B9R1.1 OCC1=CC=C(Br)N=C1 AK-28751 [1,0,0,0,0,0|2,0,1]=4 222 B9R1.1 OCC1=CC=C(C)C=C1 AK-92302 [1,0,0,0,0,0|1,0,1]=3 223 B9R1.1 OCC1=CC=C(Cl)C=C1 AK-94754 [1,0,0,0,0,0|1,0,1]=3 224 B9R1.1 OCC1=CC=C(F)N=C1 AK-76831 [1,0,0,0,0,0|2,0,1]=4 225 B9R1.1 OCC1=CC=C(I)C=C1 AK-72872 [1,0,0,0,0,0|1,0,1]=3 226 B9R1.1 OCC1=CC=C(N)C=C1 AK-51503 [1,0,0,0,0,0|0,0,1]=2 227 B9R1.1 OCC1=CN=C(N)N=C1 AK117617 [1,0,0,0,0,0|2,0,1]=4 228 B9R1.1 OCC1=NC=C(Cl)C=C1 AK136128 [1,0,0,0,0,0|2,0,1]=4 229 B9R1.1 OCC1=NC=C(F)C=C1 AK-36421 [1,0,0,0,0,0|2,0,1]=4 230 B9R1.6 C1=C(C(=O)C)C=CN=C1 AK-65203 [1,0,0,0,0,0|2,0,0]=3 231 B9R1.6 C1=C(C(C)=O)N=CC=C1 AK-53417 [1,0,0,0,0,0|2,0,0]=3 232 B9R1.6 C1=C(C(N)=O)C=CN=C1 AK-47864 [1,0,0,0,0,0|2,0,0]=3 233 B9R1.6 C1=C(C=CC=C1)B(O)O AK-50285 [1,0,0,0,0,0|1,0,1]=3 234 B9R1.6 C1=C(C=CN=C1)B(O)O AK-26762 [1,0,0,0,0,0|2,0,1]=4 235 B9R1.6 C1=C(N=CC=N1)C(=O)C AK-16901 [1,0,0,0,0,0|3,0,0]=4 236 B9R1.6 C1=C(N=NC=C1)C(O)=O AK-28139 [1,0,0,0,0,0|2,0,0]=3 237 B9R1.6 C1=CN=CN=C1C(=O)O AK-23926 [1,0,0,0,0,0|2,0,0]=3 238 B9R1.6 C1=NC=CN=C1C(O)=O AK-47505 [1,0,0,0,0,0|2,0,0]=3 239 B9R1.6 C1=NC=NC=C1C(=O)O AK-24470 [1,0,0,0,0,0|2,0,0]=3 240 B9R1.6 CC(=O)C1=CC=CN=N1 AK-83539 [1,0,0,0,0,0|3,0,0]=4 241 B9R1.6 CC(=O)C1=CC=NN=C1 AK-30816 [1,0,0,0,0,0|3,0,0]=4 242 B9R1.6 CC(=O)C1=NC=CC=N1 AK-35526 [1,0,0,0,0,0|3,0,0]=4 243 B9R1.6 CC(C1=CN=CN=C1)=O AK-32388 [1,0,0,0,0,0|3,0,0]=4 244 B9R1.6 CC(C1=NC=NC=C1)=O AK-40767 [1,0,0,0,0,0|3,0,0]=4 245 B9R1.6 CC(O)C1=NC=CC=C1 AK-53453 [1,0,0,0,0,0|2,0,1]=4 246 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AK668263 [1,0,0,0,0,0|2,0,1]=4 247 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AK-79205 [1,0,0,0,0,0|1,0,1]=3 248 B9R1.6 C[C@@H](O)C1=CC=NC=C1 AK-45022 [1,0,0,0,0,0|2,0,1]=4 249 B9R1.6 C[C@@H](O)C1=NC=CC=C1 AK-79201 [1,0,0,0,0,0|2,0,1]=4 250 B9R1.6 C[C@H](O)C1=CC=NC=C1 AK-79199 [1,0,0,0,0,0|2,0,1]=4 251 B9R1.6 N1=C(C=CC=C1)C(N)=S AK-65332 [1,0,0,0,0,0|2,1,0]=4 252 B9R1.6 N1=C(N=CC=C1)C(=O)O AK-24353 [1,0,0,0,0,0|2,0,0]=3 253 B9R1.6 N1=NC=C(C=C1)C(=O)O AK-26044 [1,0,0,0,0,0|2,0,0]=3 254 B9R1.6 N=C(N)C1=CC=CC=C1 AK-47930 [1,0,0,0,0,0|2,0,0]=3 255 B9R1.6 N=C(N)C1=CC=NC=C1 AK-84875 [1,0,0,0,0,0|3,0,0]=4 256 B9R1.6 N=C(N)C1=CC=NC=C1 AK546382 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.6 N=C(N)C1=CN=CC=C1 AK-76662 [1,0,0,0,0,0|3,0,0]=4 258 B9R1.6 N=C(N)C1=NC=CC=C1 AK-26055 [1,0,0,0,0,0|3,0,0]=4 259 B9R1.6 NC(=N)C1=CC=CC=C1 AK-48017 [1,0,0,0,0,0|2,0,0]=3 260 B9R1.6 NC(=O)C1=CN=CC=N1 AK-94813 [1,0,0,0,0,0|3,0,0]=4 261 B9R1.6 NC(C1=CC=CC=C1)=S AK-46849 [1,0,0,0,0,0|1,1,0]=3 262 B9R1.6 O=C(Cl)C1=NC=CC=C1 AK-49118 [1,0,0,0,0,0|2,0,0]=3 263 B9R1.6 O=C(N)C1=CC=CC=C1 AK-77684 [1,0,0,0,0,0|1,0,0]=2 264 B9R1.6 O=C(N)C1=CN=CC=C1 AK112769 [1,0,0,0,0,0|2,0,0]=3 265 B9R1.6 O=C(N)C1=NC=CC=C1 AK106190 [1,0,0,0,0,0|2,0,0]=3 266 B9R1.6 O=C(O)C1=CN=CC=C1 AK-46486 [1,0,0,0,0,0|1,0,0]=2 267 B9R1.6 O=C(O)C1=NC=CC=C1 AK-50286 [1,0,0,0,0,0|1,0,0]=2 268 B9R1.6 O=S(C1=CC=CC=C1)[O-] AK162411 [1,0,0,0,0,0|1,0,1]=3 269 B9R1.6 OB(C1=CC=CN=C1)O AK-26799 [1,0,0,0,0,0|2,0,1]=4 270 B9R1.6 OB(C1=NC=CC=C1)O AK-26642 [1,0,0,0,0,0|2,0,1]=4 271 B9R1.6 OC(=O)C1=CC=NC=C1 AK-49896 [1,0,0,0,0,0|1,0,0]=2 272 B11R1.3 BrCC1=CC=C(C=C1)B(O)O AK-32249 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.3 C(#C)C1=CC=C(C(=O)O)C=C1 AK-44236 [0,1,0,0,0,0|1,0,0]=2 274 B11R1.3 C1=C(C=CC(=C1)C#N)B(O)O AK-44971 [0,1,0,0,0,0|1,0,2]=4 275 B11R1.3 C1=C(C=CC(=C1)C=O)C(O)=O AK-45367 [0,1,0,0,0,0|1,0,0]=2 276 B11R1.3 C1=C(C=CC(=C1)CN)C(O)=O AK-35678 [0,1,0,0,0,0|0,0,0]=1 277 B11R1.3 C1=C(C=CC(=C1)CO)B(O)O AK-47289 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.3 C1=C(C=CC(=C1)OC)B(O)O AK-39804 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.3 C1=CC(=CC=C1C(O)=O)CO AK-25734 [0,1,0,0,0,0|1,0,0]=2 280 B11R1.3 C1=CC(=CC=C1[N+](=O)[O-])CO AK-46675 [0,1,0,0,0,0|2,0,1]=4 281 B11R1.3 C1=CC(=NC=C1C(=O)O)NN AK-33131 [0,1,0,0,0,0|1,0,0]=2 282 B11R1.3 C=CC1=CC=C([N+]([O-])=O)C=C1 AK135882 [0,1,0,0,0,0|2,0,1]=4 283 B11R1.3 CC(C)C1=CC=C(CN)C=C1 AK-61820 [0,1,0,0,0,0|2,0,1]=4 284 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O AK-35404 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.3 CC(C1=CC=C(CN)C=C1)=O AK158889 [0,1,0,0,0,0|1,0,0]=2 286 B11R1.3 CC(C1=CC=C(NC)C=C1)=O AK145581 [0,1,0,0,0,0|1,0,0]=2 287 B11R1.3 CC(C1=CC=C(OC)N=C1)=O AK-76404 [0,1,0,0,0,0|3,0,0]=4 288 B11R1.3 CC(C1=CC=C(SC)C=C1)=O AK164075 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.3 CCC1=CN=C(C=C1)C(O)=O AK-29521 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O AK103062 [0,1,0,0,0,0|2,0,1]=4 291 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O AK103063 [0,1,0,0,0,0|2,0,1]=4 292 B11R1.3 COC1=CN=C(C=C1)C(=O)O AK-29097 [0,1,0,0,0,0|2,0,0]=3 293 B11R1.3 COC1=CN=C(C=N1)C(=O)O AK-25141 [0,1,0,0,0,0|3,0,0]=4 294 B11R1.3 N#CC1=CC=C(C(C)=O)C=C1 AK-44531 [0,1,0,0,0,0|1,0,1]=3 295 B11R1.3 N=C(N)C1=CC=C(C#N)C=C1 AK209127 [0,1,0,0,0,0|2,0,1]=4 296 B11R1.3 N=C(N)C1=CC=C(OC)C=C1 AK-98683 [0,1,0,0,0,0|3,0,0]=4 297 B11R1.3 NNC1=CC=C(C=C1)N(=O)=O AK-72989 [0,1,0,0,0,0|1,0,1]=3 298 B11R1.3 O=C(C1=CN=C(NC)N=C1)O AK115951 [0,1,0,0,0,0|2,0,0]=3 299 B11R1.3 O=C(C1=CN=C(OC)C=C1)O AK-30103 [0,1,0,0,0,0|2,0,0]=3 300 B11R1.3 O=C(C1=CN=C(SC)N=C1)O AK-26821 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.3 O=C(C1=NC=C(C#N)N=C1)O AK137311 [0,1,0,0,0,0|2,0,1]=4 302 B11R1.3 O=C(N)C1=CC=C(CN)C=C1 AK155450 [0,1,0,0,0,0|1,0,0]=2 303 B11R1.3 O=C(N)C1=CC=C(OC)C=C1 AK114264 [0,1,0,0,0,0|2,0,0]=3 304 B11R1.3 O=C(O)C1=CC=C(C=C)C=C1 AK-45760 [0,1,0,0,0,0|1,0,0]=2 305 B11R1.3 O=C(O)C1=CC=C(CC)C=C1 AK114313 [0,1,0,0,0,0|1,0,0]=2 306 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 AK-79152 [0,1,0,0,0,0|0,0,0]=1 307 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 AK-88500 [0,1,0,0,0,0|0,0,0]=1 308 B11R1.3 O=C(O)C1=CC=C(OC)C=C1 AK-41188 [0,1,0,0,0,0|1,0,0]=2 309 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 AK123526 [0,1,0,0,0,0|2,0,0]=3 310 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 AK127091 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.3 O=CC1=CC=C([N+]([O-])=O)C=C1 AK-49906 [0,1,0,0,0,0|2,0,1]=4 312 B11R1.3 O=[N+](C1=CC=C(C#C)C=C1)[O-] AK-85658 [0,1,0,0,0,0|2,0,1]=4 313 B11R1.3 OB(C1=CC=C(C=C)C=C1)O AK-45734 [0,1,0,0,0,0|2,0,1]=4 314 B11R1.3 OB(C1=CC=C(C=O)C=C1)O AK-45038 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.19 C1=C(C(F)(F)F)C=CC(=C1)N AK-46769 [0,1,0,0,0,0|2,0,1]=4 316 B11R1.19 C1=C([S](C)(=O)=O)C=CC(=C1)Cl AK-50496 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.19 C1=C([S](C)(=O)=O)C=CC(=C1)O AK-73113 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.19 CC(O)(C1=CC=C(Br)C=C1)C AK-41776 [0,1,0,0,0,0|2,0,1]=4 319 B11R1.19 CC1=CC=C(C=C1)P(=O)(O)O AK-80283 [0,1,0,0,0,0|2,0,0]=3 320 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AK-93752 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.19 CC1=CC=C(S(=O)([O-])=O)C=C1 AK-48060 [0,1,0,0,0,0|2,0,1]=4 322 B11R1.19 NC1=CC=C(C(C)(C)C)C=C1 AK136142 [0,1,0,0,0,0|2,0,1]=4 323 B11R1.19 NC1=CC=C(S(=O)(C)=O)C=C1 AK-32256 [0,1,0,0,0,0|1,0,1]=3 324 B11R1.19 NS(=O)(=O)C1=CC=C(Br)C=C1 AK-26275 [0,1,0,0,0,0|2,0,1]=4 325 B11R1.19 O=S(C1=CC=C(Br)C=C1)(C)=O AK-76561 [0,1,0,0,0,0|2,0,1]=4 326 B11R1.19 O=S(C1=CC=C(C)C=C1)(C)=O AK-94753 [0,1,0,0,0,0|2,0,1]=4 327 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK-45062 [0,1,0,0,0,0|2,0,0]=3 328 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK-77681 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK101690 [0,1,0,0,0,0|2,0,0]=3 330 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK150790 [0,1,0,0,0,0|2,0,0]=3 331 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK164877 [0,1,0,0,0,0|2,0,0]=3 332 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK311262 [0,1,0,0,0,0|2,0,0]=3 333 B11R1.19 O=S(C1=CC=C(C)C=C1)([O-])=O AK-54466 [0,1,0,0,0,0|2,0,1]=4 334 B11R1.19 O=S(C1=CC=C(C)C=C1)([O-])=O AK126645 [0,1,0,0,0,0|2,0,1]=4 335 B11R1.19 O=S(C1=CC=C(Cl)C=C1)(N)=O AK151256 [0,1,0,0,0,0|2,0,1]=4 336 B11R1.19 O=S(C1=CC=C(N)C=C1)([O-])=O AK114546 [0,1,0,0,0,0|1,0,1]=3 337 B11R1.19 O=S(C1=CC=C(N)N=C1)(O)=O AK-63658 [0,1,0,0,0,0|2,0,0]=3 338 B11R1.19 O=S(C1=CC=C(O)C=C1)([O-])=O AK117280 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.21 BrC1=C(C=C(C(=O)O)C=C1)O AK-39977 [0,1,0,0,0,0|1,0,0]=2 340 B11R1.21 BrC1=C(C=C(C=C1)C(C)=O)F AK-34604 [0,1,0,0,0,0|2,0,0]=3 341 B11R1.21 BrC1=C(C=CC(=C1)C(=O)O)Cl AK-30019 [0,1,0,0,0,0|1,0,0]=2 342 B11R1.21 BrC1=C(C=CC(=C1)[N+](=O)[O-])Cl AK-33593 [0,1,0,0,0,0|2,0,1]=4 343 B11R1.21 BrC1=CN=C(C=C1C)C(=O)O AK-37510 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.21 C1=C(B(O)O)C=CC(=C1Cl)F AK-28494 [0,1,0,0,0,0|2,0,1]=4 345 B11R1.21 C1=C(C(=CC(=C1)B(O)O)Cl)Cl AK-33407 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.21 C1=C(C(=CC=C1C(=O)C)F)C AK-48194 [0,1,0,0,0,0|2,0,0]=3 347 B11R1.21 C1=C(C(=CC=C1C(=O)O)C)N AK-34321 [0,1,0,0,0,0|1,0,0]=2 348 B11R1.21 C1=C(C(=CC=C1C(=O)O)N)C AK-34339 [0,1,0,0,0,0|0,0,0]=1 349 B11R1.21 C1=C(C(=CC=C1C(C)=O)F)Br AK-50601 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.21 C1=C(C(=CC=C1C(O)=O)Cl)O AK-25796 [0,1,0,0,0,0|1,0,0]=2 351 B11R1.21 C1=C(C(=CC=C1C(O)=O)O)C AK-46719 [0,1,0,0,0,0|1,0,0]=2 352 B11R1.21 C1=C(C(=CC=C1[N+](=O)[O-])F)Br AK-26276 [0,1,0,0,0,0|2,0,1]=4 353 B11R1.21 C1=C(C=CC(=C1Br)C)C(O)=O AK-36339 [0,1,0,0,0,0|1,0,0]=2 354 B11R1.21 C1=C(C=CC(=C1C)Cl)C(O)=O AK-47580 [0,1,0,0,0,0|1,0,0]=2 355 B11R1.21 C1=C(C=CC(=C1Cl)Cl)C(O)=O AK-46631 [0,1,0,0,0,0|1,0,0]=2 356 B11R1.21 C1=C(C=CC(=C1F)C)C(O)=O AK-34796 [0,1,0,0,0,0|1,0,0]=2 357 B11R1.21 C1=C(C=CC(=C1F)Cl)[N+](=O)[O-] AK-34799 [0,1,0,0,0,0|2,0,1]=4 358 B11R1.21 C1=C(C=CC(=C1F)F)B(O)O AK-33624 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.21 C1=C(C=CC(=C1F)F)C(O)=O AK-47373 [0,1,0,0,0,0|1,0,0]=2 360 B11R1.21 C1=C(C=CC(=C1F)F)[N+](=O)[O-] AK-46774 [0,1,0,0,0,0|2,0,1]=4 361 B11R1.21 C1=C(C=CC(=C1F)O)C(C)=O AK-42173 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.21 C1=C(C=CC(=C1N)F)[N+](=O)[O-] AK-34890 [0,1,0,0,0,0|2,0,1]=4 363 B11R1.21 C1=C(C=CC(=C1O)O)C(O)=O AK-47644 [0,1,0,0,0,0|1,0,0]=2 364 B11R1.21 C1=C(Cl)C(=CC=C1[N+]([O-])=O)O AK-35873 [0,1,0,0,0,0|2,0,1]=4 365 B11R1.21 C1=C(F)C(=CC=C1B(O)O)C AK-26865 [0,1,0,0,0,0|2,0,1]=4 366 B11R1.21 C1=C(O)C(=CC=C1C(=O)O)N AK-34278 [0,1,0,0,0,0|0,0,0]=1 367 B11R1.21 C1=C([N+]([O-])=O)C=CC(=C1Br)N AK-23608 [0,1,0,0,0,0|1,0,1]=3 368 B11R1.21 C1=C([N+]([O-])=O)C=CC(=C1I)N AK-35920 [0,1,0,0,0,0|1,0,1]=3 369 B11R1.21 C1=C([N+]([O-])=O)C=CC(=C1O)C AK-40855 [0,1,0,0,0,0|2,0,1]=4 370 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)F AK-35058 [0,1,0,0,0,0|1,0,0]=2 371 B11R1.21 C1=CC(=C(C=C1C(O)=O)F)N AK-35239 [0,1,0,0,0,0|0,0,0]=1 372 B11R1.21 C1=CC(=CC(=C1F)Cl)C(=O)C AK-49084 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.21 C1=CC(=CC(=C1O)Br)[N+]([O-])=O AK-29436 [0,1,0,0,0,0|2,0,1]=4 374 B11R1.21 CC(C1=CC(C)=C(Cl)N=C1)=O AK139010 [0,1,0,0,0,0|3,0,0]=4 375 B11R1.21 CC(C1=CC=C(Br)C(C)=C1)=O AK-65018 [0,1,0,0,0,0|2,0,0]=3 376 B11R1.21 CC(C1=CC=C(Br)C(Cl)=C1)=O AK114290 [0,1,0,0,0,0|2,0,0]=3 377 B11R1.21 CC(C1=CC=C(Cl)C(C)=C1)=O AK-51511 [0,1,0,0,0,0|2,0,0]=3 378 B11R1.21 CC(C1=CC=C(Cl)C(Cl)=C1)=O AK-41915 [0,1,0,0,0,0|2,0,0]=3 379 B11R1.21 CC(C1=CC=C(Cl)C(N)=C1)=O AK-45178 [0,1,0,0,0,0|2,0,0]=3 380 B11R1.21 CC(C1=CC=C(F)C(F)=C1)=O AK-53703 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.21 CC(C1=CC=C(I)C(Br)=C1)=O AK482929 [0,1,0,0,0,0|2,0,0]=3 382 B11R1.21 CC(C1=CC=C(N)C(F)=C1)=O AK-94340 [0,1,0,0,0,0|1,0,0]=2 383 B11R1.21 CC(C1=CC=C(O)C(Br)=C1)=O AK201265 [0,1,0,0,0,0|2,0,0]=3 384 B11R1.21 CC(C1=CC=C(O)C(C)=C1)=O AK-41189 [0,1,0,0,0,0|2,0,0]=3 385 B11R1.21 CC(C1=CC=C(O)C(O)=C1)=O AK-42350 [0,1,0,0,0,0|2,0,0]=3 386 B11R1.21 CC1=C(C)N=C(C=C1)C(O)=O AK-89986 [0,1,0,0,0,0|2,0,0]=3 387 B11R1.21 CC1=C(F)C=CC(=N1)C(O)=O AK-38458 [0,1,0,0,0,0|2,0,0]=3 388 B11R1.21 CC1=C(I)C=CC(=C1)[N+]([O-])=O AK-81676 [0,1,0,0,0,0|2,0,1]=4 389 B11R1.21 CC1=CC(=CN=C1N)[N+]([O-])=O AK-26897 [0,1,0,0,0,0|2,0,1]=4 390 B11R1.21 CC1=CC(=CNC1=O)C(O)=O AK-78282 [0,1,0,0,0,0|2,0,0]=3 391 B11R1.21 CC1=CC(B(O)O)=CC=C1O AK-85496 [0,1,0,0,0,0|2,0,1]=4 392 B11R1.21 FC1=C(C=C(C=C1)B(O)O)O AK-36847 [0,1,0,0,0,0|2,0,1]=4 393 B11R1.21 FC1=C(C=CC(=C1)C(=O)O)I AK-36475 [0,1,0,0,0,0|1,0,0]=2 394 B11R1.21 FC1=CC([N+]([O-])=O)=CC=C1Br AK-46352 [0,1,0,0,0,0|2,0,1]=4 395 B11R1.21 FC1=CC=C([N+]([O-])=O)C=C1Cl AK-34798 [0,1,0,0,0,0|2,0,1]=4 396 B11R1.21 IC1=CC=C([N+]([O-])=O)C=C1F AK-34584 [0,1,0,0,0,0|2,0,1]=4 397 B11R1.21 N=C(N)C1=CC=C(C)C(F)=C1 AK-63979 [0,1,0,0,0,0|3,0,0]=4 398 B11R1.21 NC(=O)C1=CC(Br)=C(F)C=C1 AK-87520 [0,1,0,0,0,0|2,0,0]=3 399 B11R1.21 NC1=C(F)C=CC(=C1)B(O)O AK-36640 [0,1,0,0,0,0|2,0,1]=4 400 B11R1.21 NC1=C(I)C=CC(=C1)C(O)=O AK-82318 [0,1,0,0,0,0|1,0,0]=2 401 B11R1.21 NC1=C(O)C=CC(=C1)C(O)=O AK-33476 [0,1,0,0,0,0|1,0,0]=2 402 B11R1.21 NC1=CC(=CC=C1Cl)C(O)=O AK-73058 [0,1,0,0,0,0|1,0,0]=2 403 B11R1.21 NC1=CC([N+]([O-])=O)=CC=C1Br AK-32717 [0,1,0,0,0,0|2,0,1]=4 404 B11R1.21 NC1=CC([N+]([O-])=O)=CC=C1C AK-44165 [0,1,0,0,0,0|2,0,1]=4 405 B11R1.21 NC1=CC=C([N+]([O-])=O)C=C1F AK-34889 [0,1,0,0,0,0|1,0,1]=3 406 B11R1.21 NC1=CC=C([N+]([O-])=O)C=C1N AK-29652 [0,1,0,0,0,0|1,0,1]=3 407 B11R1.21 NC1=NC=C(C=C1Cl)[N+](=O)[O-] AK-21932 [0,1,0,0,0,0|2,0,1]=4 408 B11R1.21 NC1=NC=C(C=C1I)[N+](=O)[O-] AK-24380 [0,1,0,0,0,0|2,0,1]=4 409 B11R1.21 NC1=NC=C([N+]([O-])=O)C=C1Br AK-28838 [0,1,0,0,0,0|2,0,1]=4 410 B11R1.21 O=C(C1=CC(Br)=C(Br)N=C1)O AK-29099 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.21 O=C(C1=CC(Cl)=C(Cl)N=C1)O AK-25953 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.21 O=C(C1=NC(Cl)=C(C)C=C1)O AK-76573 [0,1,0,0,0,0|2,0,0]=3 413 B11R1.21 O=C(C1=NC(Cl)=C(Cl)N=C1)O AK133010 [0,1,0,0,0,0|3,0,0]=4 414 B11R1.21 O=C(C=1C=CC(N(C1)C)=O)N AK145245 [0,1,0,0,0,0|3,0,0]=4 415 B11R1.21 O=C(C=1C=CC(N(C1)C)=O)O AK-34900 [0,1,0,0,0,0|2,0,0]=3 416 B11R1.21 O=C(C=1C=CN(C)C(C1)=O)O AK-34747 [0,1,0,0,0,0|2,0,0]=3 417 B11R1.21 O=C(N)C1=CC=C(N)C(O)=C1 AK437623 [0,1,0,0,0,0|1,0,0]=2 418 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 AK-64921 [0,1,0,0,0,0|1,0,0]=2 419 B11R1.21 O=C(O)C1=CC=C(Br)C(C)=C1 AK-26325 [0,1,0,0,0,0|1,0,0]=2 420 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 AK-86432 [0,1,0,0,0,0|1,0,0]=2 421 B11R1.21 O=C(O)C1=CC=C(Br)C(F)=C1 AK-50383 [0,1,0,0,0,0|1,0,0]=2 422 B11R1.21 O=C(O)C1=CC=C(Br)C(N)=C1 AK-34514 [0,1,0,0,0,0|1,0,0]=2 423 B11R1.21 O=C(O)C1=CC=C(C)C(Cl)=C1 AK-73060 [0,1,0,0,0,0|1,0,0]=2 424 B11R1.21 O=C(O)C1=CC=C(C)C(I)=C1 AK-51540 [0,1,0,0,0,0|1,0,0]=2 425 B11R1.21 O=C(O)C1=CC=C(C)C(O)=C1 AK-61869 [0,1,0,0,0,0|1,0,0]=2 426 B11R1.21 O=C(O)C1=CC=C(Cl)C(F)=C1 AK-35057 [0,1,0,0,0,0|1,0,0]=2 427 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 AK-32644 [0,1,0,0,0,0|1,0,0]=2 428 B11R1.21 O=C(O)C1=CC=C(F)C(C)=C1 AK-35056 [0,1,0,0,0,0|1,0,0]=2 429 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 AK-53849 [0,1,0,0,0,0|1,0,0]=2 430 B11R1.21 O=C(O)C1=CC=C(F)C(N)=C1 AK-34274 [0,1,0,0,0,0|1,0,0]=2 431 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 AK-35418 [0,1,0,0,0,0|1,0,0]=2 432 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 AK174208 [0,1,0,0,0,0|1,0,0]=2 433 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 AK-44390 [0,1,0,0,0,0|1,0,0]=2 434 B11R1.21 O=C(O)C1=CC=C(N)C(Br)=C1 AK-35930 [0,1,0,0,0,0|0,0,0]=1 435 B11R1.21 O=C(O)C1=CC=C(N)C(Cl)=C1 AK-34340 [0,1,0,0,0,0|0,0,0]=1 436 B11R1.21 O=C(O)C1=CC=C(N)C(N)=C1 AK-45165 [0,1,0,0,0,0|0,0,0]=1 437 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 AK-34797 [0,1,0,0,0,0|1,0,0]=2 438 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 AK-23816 [0,1,0,0,0,0|2,0,0]=3 439 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 AK173995 [0,1,0,0,0,0|2,0,0]=3 440 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 AK324930 [0,1,0,0,0,0|2,0,0]=3 441 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 AK-49660 [0,1,0,0,0,0|2,0,0]=3 442 B11R1.21 O=C(O)C1=CN=C(N)C(Br)=C1 AK-25059 [0,1,0,0,0,0|1,0,0]=2 443 B11R1.21 O=C(O)C1=CN=C(N)C(N)=C1 AK126240 [0,1,0,0,0,0|1,0,0]=2 444 B11R1.21 O=C(O)C1=NC(Br)=C(C)C=C1 AK138206 [0,1,0,0,0,0|2,0,0]=3 445 B11R1.21 O=C(O)C1=NC(Br)=C(Cl)C=C1 AK-53664 [0,1,0,0,0,0|2,0,0]=3 446 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 AK-53910 [0,1,0,0,0,0|2,0,0]=3 447 B11R1.21 O=C(O)C1=NC(C)=C(Br)C=C1 AK-61563 [0,1,0,0,0,0|2,0,0]=3 448 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 AK-53898 [0,1,0,0,0,0|2,0,0]=3 449 B11R1.21 O=C(O)C1=NC(Cl)=C(F)C=C1 AK-53913 [0,1,0,0,0,0|2,0,0]=3 450 B11R1.21 O=C(O)C1=NC(O)=C(Br)C=C1 AK-92903 [0,1,0,0,0,0|2,0,0]=3 451 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 AK-55136 [0,1,0,0,0,0|2,0,0]=3 452 B11R1.21 O=C(O)C1=NC=C(C)C(Br)=C1 AK137974 [0,1,0,0,0,0|2,0,0]=3 453 B11R1.21 O=[N+](C1=CC=C(Br)C(Br)=C1)[O-] AK130574 [0,1,0,0,0,0|2,0,1]=4 454 B11R1.21 O=[N+](C1=CC=C(Br)C(C)=C1)[O-] AK-54902 [0,1,0,0,0,0|2,0,1]=4 455 B11R1.21 O=[N+](C1=CC=C(Br)C(Cl)=C1)[O-] AK-79128 [0,1,0,0,0,0|2,0,1]=4 456 B11R1.21 O=[N+](C1=CC=C(C)C(Br)=C1)[O-] AK-36359 [0,1,0,0,0,0|2,0,1]=4 457 B11R1.21 O=[N+](C1=CC=C(C)C(I)=C1)[O-] AK-36358 [0,1,0,0,0,0|2,0,1]=4 458 B11R1.21 O=[N+](C1=CC=C(Cl)C(C)=C1)[O-] AK-54903 [0,1,0,0,0,0|2,0,1]=4 459 B11R1.21 O=[N+](C1=CC=C(Cl)C(I)=C1)[O-] AK114426 [0,1,0,0,0,0|2,0,1]=4 460 B11R1.21 O=[N+](C1=CC=C(F)C(C)=C1)[O-] AK-35240 [0,1,0,0,0,0|2,0,1]=4 461 B11R1.21 O=[N+](C1=CC=C(F)C(I)=C1)[O-] AK136589 [0,1,0,0,0,0|2,0,1]=4 462 B11R1.21 OB(C1=CC=C(C)C(C)=C1)O AK-45214 [0,1,0,0,0,0|2,0,1]=4 463 B11R1.21 OB(C1=CC=C(Cl)C(C)=C1)O AK-33546 [0,1,0,0,0,0|2,0,1]=4 464 B11R1.21 OB(C1=CC=C(F)C(C)=C1)O AK-33223 [0,1,0,0,0,0|2,0,1]=4 465 B11R1.21 OB(C1=CC=C(O)C(F)=C1)O AK-33809 [0,1,0,0,0,0|2,0,1]=4 466 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 AK-33192 [0,1,0,0,0,0|2,0,1]=4 467 B11R1.21 OC(=O)C1=CC(=O)C(O)=CN1 AK-89588 [0,1,0,0,0,0|2,0,0]=3 468 B11R1.21 OC(=O)C1=CC(Br)=C(I)C=C1 AK-80847 [0,1,0,0,0,0|1,0,0]=2 469 B11R1.21 OC(=O)C1=CC(I)=C(Br)C=C1 AK-64714 [0,1,0,0,0,0|1,0,0]=2 470 B11R1.21 OC(=O)C1=CC(I)=C(Cl)C=C1 AK-35135 [0,1,0,0,0,0|1,0,0]=2 471 B11R1.21 OC(=O)C1=CC=C(Cl)C(=O)N1 AK100453 [0,1,0,0,0,0|2,0,0]=3 472 B11R1.21 OC(=O)C1=NC=C(Cl)C(Cl)=C1 AK-67884 [0,1,0,0,0,0|2,0,0]=3 473 B11R1.21 OC1=C(Br)C=CC(=C1)[N+]([O-])=O AK-80891 [0,1,0,0,0,0|2,0,1]=4 474 B11R1.21 OC1=CC(=CC=C1Cl)N(=O)=O AK-26191 [0,1,0,0,0,0|2,0,1]=4 475 B11R1.21 OC1=CC(B(O)O)=CC=C1Cl AK-93984 [0,1,0,0,0,0|2,0,1]=4 476 B11R1.21 OC1=CC([N+]([O-])=O)=CC=C1F AK-34204 [0,1,0,0,0,0|2,0,1]=4 477 B11R1.21 OC1=CC([N+]([O-])=O)=CN=C1N AK-30819 [0,1,0,0,0,0|2,0,1]=4 478 B11R1.21 OC1=CC=C(B(O)O)C=C1Cl AK-61628 [0,1,0,0,0,0|2,0,1]=4 479 B11R1.21 OC1=CC=C([N+]([O-])=O)C=C1F AK-30391 [0,1,0,0,0,0|2,0,1]=4 480 B11R1.22 BrC1=CC=C(C(N)CO)C=C1 AK607944 [0,1,0,0,0,0|2,0,1]=4 481 B11R1.22 BrC1=CC=C([C@@H](N)CO)C=C1 AK172682 [0,1,0,0,0,0|2,0,1]=4 482 B11R1.22 BrC1=CN=C(C=N1)C(=O)OC AK-24801 [0,1,0,0,0,0|3,0,0]=4 483 B11R1.22 C1=C(C=CC(=C1)Br)C(OC)=O AK-47340 [0,1,0,0,0,0|1,0,0]=2 484 B11R1.22 C1=C(C=CC(=C1)C)C(CBr)=O AK-73063 [0,1,0,0,0,0|2,0,0]=3 485 B11R1.22 C1=C(C=CC(=C1)Cl)C(CC)=O AK-47430 [0,1,0,0,0,0|2,0,0]=3 486 B11R1.22 C1=C(C=CC(=C1)N)C(OC)=O AK-48394 [0,1,0,0,0,0|0,0,0]=1 487 B11R1.22 C1=CC(=CN=C1C(OC)=O)Br AK-25721 [0,1,0,0,0,0|2,0,0]=3 488 B11R1.22 C1=CC(=NC=C1C(OC)=O)Cl AK-32450 [0,1,0,0,0,0|2,0,0]=3 489 B11R1.22 C1=NC(=CC=C1C(=O)OC)Br AK-27762 [0,1,0,0,0,0|2,0,0]=3 490 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 AK544255 [0,1,0,0,0,0|2,0,1]=4 491 B11R1.22 CCC(C1=CC=C(Br)C=C1)=O AK133038 [0,1,0,0,0,0|2,0,0]=3 492 B11R1.22 CCC(C1=CC=C(F)C=C1)=O AK-77665 [0,1,0,0,0,0|2,0,0]=3 493 B11R1.22 CCC(C1=CC=C(I)C=C1)=O AK149241 [0,1,0,0,0,0|2,0,0]=3 494 B11R1.22 CCC(C1=CC=C(O)C=C1)=O AK-44068 [0,1,0,0,0,0|2,0,0]=3 495 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 AK-42930 [0,1,0,0,0,0|1,0,0]=2 496 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 AK-57163 [0,1,0,0,0,0|1,0,0]=2 497 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 AK-25021 [0,1,0,0,0,0|3,0,0]=4 498 B11R1.22 COC(C1=NC=C(C=N1)Br)=O AK-28412 [0,1,0,0,0,0|3,0,0]=4 499 B11R1.22 ClC1=CC=C(C(CN)=O)C=C1 AK-27718 [0,1,0,0,0,0|2,0,0]=3 500 B11R1.22 ClC1=CC=C(C=C1)C(=O)C=O AK-10005 [0,1,0,0,0,0|1,0,1]=3 501 B11R1.22 ClC1=CC=C(N=N1)C(=O)OC AK-24016 [0,1,0,0,0,0|3,0,0]=4 502 B11R1.22 ClC1=CC=C([C@@H](N)CO)C=C1 AK486779 [0,1,0,0,0,0|2,0,1]=4 503 B11R1.22 ClC1=CC=C([C@H](N)CO)C=C1 AK607971 [0,1,0,0,0,0|2,0,1]=4 504 B11R1.22 ClC1=CN=C(C=N1)C(=O)OC AK-23920 [0,1,0,0,0,0|3,0,0]=4 505 B11R1.22 FC1=CC=C(C=N1)C(=O)OC AK-40001 [0,1,0,0,0,0|2,0,0]=3 506 B11R1.22 FC1=CC=C([C@@H](N)CO)C=C1 AK117861 [0,1,0,0,0,0|2,0,1]=4 507 B11R1.22 FC1=CC=C([C@H](N)CO)C=C1 AK117823 [0,1,0,0,0,0|2,0,1]=4 508 B11R1.22 FC1=CC=C([C@H](N)CO)C=C1 AK117858 [0,1,0,0,0,0|2,0,1]=4 509 B11R1.22 IC1=CC=C(C(CBr)=O)C=C1 AK-25760 [0,1,0,0,0,0|2,0,0]=3 510 B11R1.22 N1C=C(C(=O)NN)C=CC1=O AK-25381 [0,1,0,0,0,0|3,0,0]=4 511 B11R1.22 NC1=CC=C(C(C)CC)C=C1 AK-76838 [0,1,0,0,0,0|2,0,1]=4 512 B11R1.22 NC1=CN=C(C=C1)C(=O)OC AK-24592 [0,1,0,0,0,0|1,0,0]=2 513 B11R1.22 NC1=NC=C(C=N1)C(=O)OC AK-21981 [0,1,0,0,0,0|2,0,0]=3 514 B11R1.22 NCC(=O)C1=CC=C(C=C1)F AK-32227 [0,1,0,0,0,0|2,0,0]=3 515 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 AK101127 [0,1,0,0,0,0|2,0,0]=3 516 B11R1.22 NCC(C1=CC=C(Br)C=C1)=O AK-42272 [0,1,0,0,0,0|2,0,0]=3 517 B11R1.22 NCC(O)C1=CC=C(O)C=C1 AK163650 [0,1,0,0,0,0|2,0,1]=4 518 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 AK-76998 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 AK101499 [0,1,0,0,0,0|2,0,1]=4 520 B11R1.22 O=C(C1=CC=C(Br)C=C1)CCl AK-41703 [0,1,0,0,0,0|2,0,0]=3 521 B11R1.22 O=C(C1=CC=C(F)C=C1)C=O AK-10004 [0,1,0,0,0,0|1,0,1]=3 522 B11R1.22 O=C(C1=CNC(N=C1)=O)OC AK138906 [0,1,0,0,0,0|3,0,0]=4 523 B11R1.22 O=C(C1=COC(C=C1)=O)OC AK-94193 [0,1,0,0,0,0|2,0,0]=3 524 B11R1.22 O=C(C1=NC=C(Cl)C=C1)OC AK-33121 [0,1,0,0,0,0|2,0,0]=3 525 B11R1.22 O=C(C1=NC=C(F)C=N1)OC AK128119 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.22 O=C(C1=NC=C(N)N=C1)OC AK-59002 [0,1,0,0,0,0|2,0,0]=3 527 B11R1.22 O=C(C1=NC=C(O)C=C1)OC AK-48134 [0,1,0,0,0,0|2,0,0]=3 528 B11R1.22 O=C(NC)C1=CC=C(Br)C=C1 AK-86242 [0,1,0,0,0,0|2,0,0]=3 529 B11R1.22 O=C(NC)C1=CN=C(Cl)C=C1 AK-41767 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.22 O=C(NN)C1=NC=C(F)C=C1 AK-97226 [0,1,0,0,0,0|3,0,0]=4 531 B11R1.22 O=C(OC)C1=CC=C(C)C=C1 AK110414 [0,1,0,0,0,0|1,0,0]=2 532 B11R1.22 O=C(OC)C1=CC=C(F)C=C1 AK-45398 [0,1,0,0,0,0|1,0,0]=2 533 B11R1.22 O=C(OC)C1=CC=C(I)C=C1 AK-45406 [0,1,0,0,0,0|1,0,0]=2 534 B11R1.22 O=C(OC)C1=CC=C(O)C=C1 AK-54335 [0,1,0,0,0,0|1,0,0]=2 535 B11R1.22 O=C(OC)C1=CN=C(C)C=C1 AK-28562 [0,1,0,0,0,0|2,0,0]=3 536 B11R1.22 O=C(OC)C1=CN=C(N)C=C1 AK-25008 [0,1,0,0,0,0|1,0,0]=2 537 B11R1.22 O=C(OC)C1=CN=C(O)C=C1 AK-26234 [0,1,0,0,0,0|2,0,0]=3 538 B11R1.22 O=C(OC)C1=NC=C(C)C=C1 AK-76225 [0,1,0,0,0,0|2,0,0]=3 539 B11R1.22 O=C1NN=C(C=C1)C(=O)OC AK-72777 [0,1,0,0,0,0|3,0,0]=4 540 B11R1.22 OC1=CC=C(C=C1)C(=O)CBr AK-34343 [0,1,0,0,0,0|2,0,0]=3 541 B11R1.22 OC1=CC=C([C@@H](N)CO)C=C1 AK544250 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.22 OC1=CC=C([C@H](N)CO)C=C1 AK608028 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.22 OC1=CN=C(C=N1)C(=O)OC AK-24812 [0,1,0,0,0,0|3,0,0]=4 544 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 AK110007 [0,1,0,0,0,0|1,0,2]=4 545 B11R1.22 OC[C@@H](N)C1=CC=C(Br)C=C1 AK338220 [0,1,0,0,0,0|2,0,1]=4 546 B11R1.22 OC[C@H](N)C1=CC=C(Br)C=C1 AK202041 [0,1,0,0,0,0|2,0,1]=4 547 B11R1.166 BrC1=C(C(=O)O)C=CC(=C1)Cl AK-36919 [0,1,0,0,0,0|1,0,0]=2 548 B11R1.166 BrC1=C(C=CC(=C1)Cl)[N+](=O)[O-] AK-35960 [0,1,0,0,0,0|2,0,1]=4 549 B11R1.166 BrC1=C(C=CC(=C1)F)[N+](=O)[O-] AK-32212 [0,1,0,0,0,0|2,0,1]=4 550 B11R1.166 BrC1=C(C=CC(=C1)N)[N+](=O)[O-] AK-35079 [0,1,0,0,0,0|1,0,1]=3 551 B11R1.166 BrC1=CC(=C(C=C1)[N+](=O)[O-])F AK-28435 [0,1,0,0,0,0|2,0,1]=4 552 B11R1.166 BrC1=CC(=C(C=C1)[N+](=O)[O-])O AK-29073 [0,1,0,0,0,0|2,0,1]=4 553 B11R1.166 BrC1=CN=C(C(=C1)C)C(=O)O AK-26400 [0,1,0,0,0,0|2,0,0]=3 554 B11R1.166 C1=C(C(=CC(=C1)Br)N)C(=O)O AK-34046 [0,1,0,0,0,0|1,0,0]=2 555 B11R1.166 C1=C(C(=CC(=C1)Cl)I)C(O)=O AK-46379 [0,1,0,0,0,0|1,0,0]=2 556 B11R1.166 C1=C(C(=CC(=C1)Cl)N)C(O)=O AK-36798 [0,1,0,0,0,0|1,0,0]=2 557 B11R1.166 C1=C(C(=CC(=C1)F)Cl)[N+]([O-])=O AK-31880 [0,1,0,0,0,0|2,0,1]=4 558 B11R1.166 C1=C(C(=CC=C1C)B(O)O)Cl AK-39980 [0,1,0,0,0,0|2,0,1]=4 559 B11R1.166 C1=C(C(=CC=C1C)C(=O)O)N AK-25621 [0,1,0,0,0,0|1,0,0]=2 560 B11R1.166 C1=C(C(=CC=C1Cl)C(C)=O)Cl AK-47301 [0,1,0,0,0,0|2,0,0]=3 561 B11R1.166 C1=C(C(=CC=C1N)C(=O)O)C AK-27038 [0,1,0,0,0,0|0,0,0]=1 562 B11R1.166 C1=C(Cl)C=CC(=C1F)B(O)O AK-33526 [0,1,0,0,0,0|2,0,1]=4 563 B11R1.166 C1=C(Cl)C=NC(=C1Cl)C(=O)O AK-24701 [0,1,0,0,0,0|2,0,0]=3 564 B11R1.166 C1=C(F)C=CC(=C1F)B(O)O AK-33282 [0,1,0,0,0,0|2,0,1]=4 565 B11R1.166 C1=C([N+]([O-])=O)C(=CC(=C1)C)Cl AK-53744 [0,1,0,0,0,0|2,0,1]=4 566 B11R1.166 C1=C([N+]([O-])=O)C(=CC(=C1)F)N AK-32563 [0,1,0,0,0,0|2,0,1]=4 567 B11R1.166 C1=C([N+]([O-])=O)C(=CC(=C1)O)C AK-49132 [0,1,0,0,0,0|2,0,1]=4 568 B11R1.166 C1=CC(=C(C=C1N)Cl)C(O)=O AK-29059 [0,1,0,0,0,0|0,0,0]=1 569 B11R1.166 C1=CC(=CC(=C1B(O)O)Cl)Cl AK-36109 [0,1,0,0,0,0|2,0,1]=4 570 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)F AK-46615 [0,1,0,0,0,0|2,0,0]=3 571 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)O AK-49094 [0,1,0,0,0,0|2,0,0]=3 572 B11R1.166 C1=CC(=CC(=C1C(O)=O)Br)Br AK-45532 [0,1,0,0,0,0|1,0,0]=2 573 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)Br AK-26260 [0,1,0,0,0,0|1,0,0]=2 574 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)C AK-47303 [0,1,0,0,0,0|1,0,0]=2 575 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)Cl AK-32606 [0,1,0,0,0,0|1,0,0]=2 576 B11R1.166 C1=CC(=CC(=C1C(O)=O)Cl)Cl AK-46538 [0,1,0,0,0,0|1,0,0]=2 577 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)C AK-26324 [0,1,0,0,0,0|1,0,0]=2 578 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)F AK-49138 [0,1,0,0,0,0|1,0,0]=2 579 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)N AK-25984 [0,1,0,0,0,0|0,0,0]=1 580 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)C AK-73066 [0,1,0,0,0,0|1,0,0]=2 581 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)Cl AK-47585 [0,1,0,0,0,0|1,0,0]=2 582 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)F AK-29195 [0,1,0,0,0,0|1,0,0]=2 583 B11R1.166 C1=CC(=CC(=C1[N+]([O-])=O)O)Cl AK-30056 [0,1,0,0,0,0|2,0,1]=4 584 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 AK-75553 [0,1,0,0,0,0|2,0,0]=3 585 B11R1.166 CC(C1=CC=C(Br)C=C1Cl)=O AK-77175 [0,1,0,0,0,0|2,0,0]=3 586 B11R1.166 CC(C1=CC=C(Br)C=C1F)=O AK-46535 [0,1,0,0,0,0|2,0,0]=3 587 B11R1.166 CC(C1=CC=C(Br)C=C1N)=O AK-38008 [0,1,0,0,0,0|2,0,0]=3 588 B11R1.166 CC(C1=CC=C(Br)C=C1O)=O AK-40002 [0,1,0,0,0,0|2,0,0]=3 589 B11R1.166 CC(C1=CC=C(C)C=C1F)=O AK115609 [0,1,0,0,0,0|2,0,0]=3 590 B11R1.166 CC(C1=CC=C(Cl)C=C1Br)=O AK-75637 [0,1,0,0,0,0|2,0,0]=3 591 B11R1.166 CC(C1=CC=C(Cl)N=C1Cl)=O AK-49093 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.166 CC(C1=CC=C(F)C=C1Cl)=O AK-53695 [0,1,0,0,0,0|2,0,0]=3 593 B11R1.166 CC(C1=CC=C(O)C=C1Br)=O AK-75734 [0,1,0,0,0,0|2,0,0]=3 594 B11R1.166 CC(C1=CC=C(O)C=C1C)=O AK-50197 [0,1,0,0,0,0|2,0,0]=3 595 B11R1.166 CC(C1=CC=C(O)C=C1Cl)=O AK-36102 [0,1,0,0,0,0|2,0,0]=3 596 B11R1.166 CC(C1=CC=C(O)C=C1O)=O AK-50224 [0,1,0,0,0,0|2,0,0]=3 597 B11R1.166 CC1=C(C=CC(=C1)C)B(O)O AK-35632 [0,1,0,0,0,0|2,0,1]=4 598 B11R1.166 CC1=C(C=NC(Cl)=C1)C(O)=O AK-42673 [0,1,0,0,0,0|2,0,0]=3 599 B11R1.166 CC1=CC(F)=CC=C1[N+]([O-])=O AK-35196 [0,1,0,0,0,0|2,0,1]=4 600 B11R1.166 CC1=CC=C([N+]([O-])=O)C(F)=C1 AK-23702 [0,1,0,0,0,0|2,0,1]=4 601 B11R1.166 CC1=CC=C([N+]([O-])=O)C(N)=C1 AK-35723 [0,1,0,0,0,0|2,0,1]=4 602 B11R1.166 CC1=NC(C)=C(C=N1)C(O)=O AK-36268 [0,1,0,0,0,0|3,0,0]=4 603 B11R1.166 CC1=NC(N)=CC=C1[N+]([O-])=O AK-25614 [0,1,0,0,0,0|2,0,1]=4 604 B11R1.166 ClC1=C(C(=O)O)C=CC(=N1)O AK-25883 [0,1,0,0,0,0|2,0,0]=3 605 B11R1.166 ClC1=CC(=C(C=C1)B(O)O)C AK-28971 [0,1,0,0,0,0|2,0,1]=4 606 B11R1.166 ClC1=CC(=C(C=C1)C(C)=O)F AK-46375 [0,1,0,0,0,0|2,0,0]=3 607 B11R1.166 ClC1=CN=C(C(=C1)C)C(=O)O AK-29698 [0,1,0,0,0,0|2,0,0]=3 608 B11R1.166 ClC1=NC=C(C(=N1)Cl)C(=O)O AK-24354 [0,1,0,0,0,0|3,0,0]=4 609 B11R1.166 FC1=C(C(=O)O)C=CC(=C1)I AK-33039 [0,1,0,0,0,0|1,0,0]=2 610 B11R1.166 FC1=C(C=CC(=C1)C)B(O)O AK-27195 [0,1,0,0,0,0|2,0,1]=4 611 B11R1.166 FC1=NC(=C(C(=O)O)C=C1)C AK-30364 [0,1,0,0,0,0|2,0,0]=3 612 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 AK108398 [0,1,0,0,0,0|2,0,0]=3 613 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 AK-77547 [0,1,0,0,0,0|2,0,0]=3 614 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl AK-97072 [0,1,0,0,0,0|3,0,0]=4 615 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N AK-64550 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1Cl AK100505 [0,1,0,0,0,0|3,0,0]=4 617 B11R1.166 NC1=C(C(=O)O)C=CC(=N1)Cl AK-31140 [0,1,0,0,0,0|2,0,0]=3 618 B11R1.166 NC1=CC(=C(C=C1)C(C)=O)O AK-34336 [0,1,0,0,0,0|1,0,0]=2 619 B11R1.166 NC1=CC(Br)=CC=C1[N+]([O-])=O AK-67591 [0,1,0,0,0,0|2,0,1]=4 620 B11R1.166 NC1=CC(Cl)=CC=C1N(=O)=O AK-26977 [0,1,0,0,0,0|2,0,1]=4 621 B11R1.166 NC1=CC=C([N+]([O-])=O)C(C)=C1 AK-35841 [0,1,0,0,0,0|1,0,1]=3 622 B11R1.166 NC1=CC=C([N+]([O-])=O)C(Cl)=C1 AK-61331 [0,1,0,0,0,0|1,0,1]=3 623 B11R1.166 NC1=CC=C([N+]([O-])=O)C(F)=C1 AK-34276 [0,1,0,0,0,0|1,0,1]=3 624 B11R1.166 NC1=CC=C([N+]([O-])=O)C(N)=C1 AK-93482 [0,1,0,0,0,0|1,0,1]=3 625 B11R1.166 NC1=NC(Cl)=C([N+]([O-])=O)C=C1 AK-86662 [0,1,0,0,0,0|2,0,1]=4 626 B11R1.166 NC1=NC=C(C(Br)=C1)[N+]([O-])=O AK100167 [0,1,0,0,0,0|2,0,1]=4 627 B11R1.166 NC1=NC=C(C(N)=C1)[N+]([O-])=O AK-55154 [0,1,0,0,0,0|2,0,1]=4 628 B11R1.166 NC1=NC=C([N+]([O-])=O)C(Cl)=C1 AK-29057 [0,1,0,0,0,0|2,0,1]=4 629 B11R1.166 O=C(C1=CN=C(N)N=C1N)N AK484800 [0,1,0,0,0,0|3,0,0]=4 630 B11R1.166 O=C(C1=NC=C(F)C=C1F)O AK-36274 [0,1,0,0,0,0|2,0,0]=3 631 B11R1.166 O=C(C=1C(O)=CC(NC1)=O)O AK-27721 [0,1,0,0,0,0|2,0,0]=3 632 B11R1.166 O=C(N)C1=CC=C(C)C=C1N AK-49754 [0,1,0,0,0,0|2,0,0]=3 633 B11R1.166 O=C(N)C1=CC=C(Cl)C=C1N AK-43520 [0,1,0,0,0,0|2,0,0]=3 634 B11R1.166 O=C(N)C1=CC=C(F)C=C1F AK-86226 [0,1,0,0,0,0|2,0,0]=3 635 B11R1.166 O=C(N)C1=CC=C(I)C=C1Br AK349625 [0,1,0,0,0,0|2,0,0]=3 636 B11R1.166 O=C(N)C1=CN=C(Cl)C=C1Cl AK-29452 [0,1,0,0,0,0|3,0,0]=4 637 B11R1.166 O=C(N)C1=NC=C(Br)C=C1N AK-48703 [0,1,0,0,0,0|3,0,0]=4 638 B11R1.166 O=C(O)C1=C(C)N=C(Br)C=C1 AK144236 [0,1,0,0,0,0|2,0,0]=3 639 B11R1.166 O=C(O)C1=C(C)N=C(Cl)C=C1 AK-58691 [0,1,0,0,0,0|2,0,0]=3 640 B11R1.166 O=C(O)C1=C(Cl)N=C(C)C=C1 AK-84877 [0,1,0,0,0,0|2,0,0]=3 641 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 AK-25090 [0,1,0,0,0,0|2,0,0]=3 642 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 AK120480 [0,1,0,0,0,0|2,0,0]=3 643 B11R1.166 O=C(O)C1=C(N)N=C(Br)C=C1 AK-77320 [0,1,0,0,0,0|2,0,0]=3 644 B11R1.166 O=C(O)C1=C(O)N=C(Cl)C=C1 AK-68352 [0,1,0,0,0,0|2,0,0]=3 645 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Cl AK-40035 [0,1,0,0,0,0|1,0,0]=2 646 B11R1.166 O=C(O)C1=CC=C(Br)C=C1F AK-45932 [0,1,0,0,0,0|1,0,0]=2 647 B11R1.166 O=C(O)C1=CC=C(Br)C=C1I AK-73142 [0,1,0,0,0,0|1,0,0]=2 648 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O AK-44937 [0,1,0,0,0,0|1,0,0]=2 649 B11R1.166 O=C(O)C1=CC=C(C)C=C1Br AK-36340 [0,1,0,0,0,0|1,0,0]=2 650 B11R1.166 O=C(O)C1=CC=C(C)C=C1Cl AK-36338 [0,1,0,0,0,0|1,0,0]=2 651 B11R1.166 O=C(O)C1=CC=C(C)C=C1I AK201253 [0,1,0,0,0,0|1,0,0]=2 652 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br AK-32641 [0,1,0,0,0,0|1,0,0]=2 653 B11R1.166 O=C(O)C1=CC=C(F)C=C1C AK-34672 [0,1,0,0,0,0|1,0,0]=2 654 B11R1.166 O=C(O)C1=CC=C(F)C=C1I AK-29400 [0,1,0,0,0,0|1,0,0]=2 655 B11R1.166 O=C(O)C1=CC=C(F)C=C1N AK-25985 [0,1,0,0,0,0|1,0,0]=2 656 B11R1.166 O=C(O)C1=CC=C(I)C=C1N AK-34047 [0,1,0,0,0,0|1,0,0]=2 657 B11R1.166 O=C(O)C1=CC=C(N)C=C1O AK-46320 [0,1,0,0,0,0|0,0,0]=1 658 B11R1.166 O=C(O)C1=CC=C(O)C=C1C AK-40693 [0,1,0,0,0,0|1,0,0]=2 659 B11R1.166 O=C(O)C1=CC=C(O)C=C1F AK-35989 [0,1,0,0,0,0|1,0,0]=2 660 B11R1.166 O=C(O)C1=CC=C(O)C=C1O AK-88714 [0,1,0,0,0,0|1,0,0]=2 661 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br AK-55073 [0,1,0,0,0,0|2,0,0]=3 662 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl AK161047 [0,1,0,0,0,0|2,0,0]=3 663 B11R1.166 O=C(O)C1=CN=C(C)C=C1C AK-29000 [0,1,0,0,0,0|2,0,0]=3 664 B11R1.166 O=C(O)C1=CN=C(C)C=C1Cl AK-28459 [0,1,0,0,0,0|2,0,0]=3 665 B11R1.166 O=C(O)C1=CN=C(C)C=C1N AK-29804 [0,1,0,0,0,0|2,0,0]=3 666 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Br AK167576 [0,1,0,0,0,0|2,0,0]=3 667 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl AK-26772 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1N AK121862 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.166 O=C(O)C1=CN=C(F)C=C1C AK123501 [0,1,0,0,0,0|2,0,0]=3 670 B11R1.166 O=C(O)C1=CN=C(F)C=C1F AK-26362 [0,1,0,0,0,0|2,0,0]=3 671 B11R1.166 O=C(O)C1=CN=C(N)C=C1C AK-68341 [0,1,0,0,0,0|1,0,0]=2 672 B11R1.166 O=C(O)C1=CN=C(N)C=C1Cl AK153190 [0,1,0,0,0,0|1,0,0]=2 673 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl AK-55097 [0,1,0,0,0,0|2,0,0]=3 674 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl AK-53906 [0,1,0,0,0,0|2,0,0]=3 675 B11R1.166 O=C(O)C1=NC=C(C)C=C1Br AK-76925 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br AK101091 [0,1,0,0,0,0|2,0,0]=3 677 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1N AK120030 [0,1,0,0,0,0|2,0,0]=3 678 B11R1.166 O=C(O)C1=NC=C(F)C=C1Br AK-53675 [0,1,0,0,0,0|2,0,0]=3 679 B11R1.166 O=C([O-])C1=CC=C(N)C=C1O AK154081 [0,1,0,0,0,0|0,0,1]=2 680 B11R1.166 O=C1C(=CNC(N1)=O)C(O)=O AK-25649 [0,1,0,0,0,0|3,0,0]=4 681 B11R1.166 O=[N+](C1=CC=C(Br)C=C1Br)[O-] AK-51080 [0,1,0,0,0,0|2,0,1]=4 682 B11R1.166 O=[N+](C1=CC=C(Br)C=C1C)[O-] AK-35477 [0,1,0,0,0,0|2,0,1]=4 683 B11R1.166 O=[N+](C1=CC=C(Cl)C=C1F)[O-] AK-39807 [0,1,0,0,0,0|2,0,1]=4 684 B11R1.166 O=[N+](C1=CN=C(N)C=C1C)[O-] AK-25608 [0,1,0,0,0,0|2,0,1]=4 685 B11R1.166 OB(C1=CC=C(F)C=C1C)O AK-33224 [0,1,0,0,0,0|2,0,1]=4 686 B11R1.166 OB(C1=CC=C(F)C=C1Cl)O AK-34635 [0,1,0,0,0,0|2,0,1]=4 687 B11R1.166 OB(C1=CC=C(F)C=C1O)O AK-46419 [0,1,0,0,0,0|2,0,1]=4 688 B11R1.166 OB(C1=CC=C(O)C=C1C)O AK-29297 [0,1,0,0,0,0|2,0,1]=4 689 B11R1.166 OB(C1=CC=C(O)C=C1Cl)O AK-43746 [0,1,0,0,0,0|2,0,1]=4 690 B11R1.166 OB(O)C1=C(F)C=C(I)C=C1 AK-25870 [0,1,0,0,0,0|2,0,1]=4 691 B11R1.166 OC(=O)C1=C(Br)C=C(I)C=C1 AK-61744 [0,1,0,0,0,0|1,0,0]=2 692 B11R1.166 OC(=O)C1=C(F)C=C(Br)C=N1 AK-53915 [0,1,0,0,0,0|2,0,0]=3 693 B11R1.166 OC(=O)C1=NC=C(Br)C=C1Br AK-30252 [0,1,0,0,0,0|2,0,0]=3 694 B11R1.166 OC(=O)C1=NC=C(Cl)N=C1Cl AK-51403 [0,1,0,0,0,0|3,0,0]=4 695 B11R1.166 OC(=O)C1=NC=C(F)C=C1Cl AK109963 [0,1,0,0,0,0|2,0,0]=3 696 B11R1.166 OC1=C(C=CC(I)=C1)[N+]([O-])=O AK-80852 [0,1,0,0,0,0|2,0,1]=4 697 B11R1.166 OC1=CC(=NC=C1C(=O)O)C AK-25007 [0,1,0,0,0,0|2,0,0]=3 698 B11R1.166 OC1=CC(C)=CC=C1[N+]([O-])=O AK-29443 [0,1,0,0,0,0|2,0,1]=4 699 B11R1.166 OC1=CC(Cl)=C(C=C1)[N+]([O-])=O AK109849 [0,1,0,0,0,0|2,0,1]=4 700 B11R1.166 OC1=CC=C(B(O)O)C(F)=C1 AK-62257 [0,1,0,0,0,0|2,0,1]=4 701 B11R1.166 OC1=CC=C([N+]([O-])=O)C(Br)=C1 AK-76862 [0,1,0,0,0,0|2,0,1]=4 702 B11R1.166 OC1=CC=C([N+]([O-])=O)C(F)=C1 AK-25905 [0,1,0,0,0,0|2,0,1]=4 703 B11R1.166 OC1=CC=C([N+]([O-])=O)C(I)=C1 AK-39967 [0,1,0,0,0,0|2,0,1]=4 704 B11R1.166 S=C1NC(C(=CN1)C(O)=O)=O AK327607 [0,1,0,0,0,0|3,0,0]=4 705 B11R1.166 [O-][N+](=O)C1=C(F)C=C(I)C=C1 AK-64473 [0,1,0,0,0,0|2,0,1]=4 706 B11R2.34 NC1=CC=C(C2CC2)C=C1 AK124361 [0,0,0,1,0,0|2,0,1]=4 707 B9R1.35 BrC1=CC(=CS1)C(=O)O AK-28622 [0,0,0,0,1,0|2,0,0]=3 708 B9R1.35 BrC1=CC(=CS1)C(C)=O AK-35777 [0,0,0,0,1,0|3,0,0]=4 709 B9R1.35 C1=C(C(=O)O)SC(=N1)N AK-24488 [0,0,0,0,1,0|2,0,0]=3 710 B9R1.35 C1=C(C)[NH]N=C1C(O)=O AK-27812 [0,0,0,0,1,0|3,0,0]=4 711 B9R1.35 C1=C(N=C(S1)N)C(=O)C AK-54799 [0,0,0,0,1,0|3,0,0]=4 712 B9R1.35 C1=C(OC(=C1)Br)C(O)=O AK-35759 [0,0,0,0,1,0|2,0,0]=3 713 B9R1.35 C1=C(OC(=C1)C)C(O)=O AK-44799 [0,0,0,0,1,0|2,0,0]=3 714 B9R1.35 C1=C(ON=C1Br)C(=O)O AK-21783 [0,0,0,0,1,0|3,0,0]=4 715 B9R1.35 C1=C(SC(=C1)C(O)=O)Cl AK-29045 [0,0,0,0,1,0|2,0,0]=3 716 B9R1.35 C1=C(SC(=C1)C)C(=O)C AK-33183 [0,0,0,0,1,0|3,0,0]=4 717 B9R1.35 C1=C(SC(=C1)Cl)C(C)=O AK-47623 [0,0,0,0,1,0|3,0,0]=4 718 B9R1.35 C1=C(SC(=N1)C)C(=O)O AK-35030 [0,0,0,0,1,0|3,0,0]=4 719 B9R1.35 CC(=O)C1=CC=C(C)O1 AK-77189 [0,0,0,0,1,0|3,0,0]=4 720 B9R1.35 CC(C1=CC(Cl)=CS1)=O AK-77338 [0,0,0,0,1,0|3,0,0]=4 721 B9R1.35 CC1=CC=C(N1)C(O)=O AK100045 [0,0,0,0,1,0|2,0,0]=3 722 B9R1.35 CC1=CN=C(S1)C(=O)O AK-26650 [0,0,0,0,1,0|3,0,0]=4 723 B9R1.35 CN1C=CC(=C1)C(O)=O AK-28665 [0,0,0,0,1,0|2,0,0]=3 724 B9R1.35 ClC1=CC(=CS1)C(=O)O AK-29222 [0,0,0,0,1,0|2,0,0]=3 725 B9R1.35 NC1=NN=C(N1)C(O)=O AK-24773 [0,0,0,0,1,0|3,0,0]=4 726 B9R1.35 N[C@H]1C=C[C@@H](C(O)=O)C1 AK-65072 [0,0,0,0,1,0|0,0,3]=4 727 B9R1.35 N[C@H]1C=C[C@@H](C(O)=O)C1 AK113066 [0,0,0,0,1,0|0,0,3]=4 728 B9R1.35 O=C(C1=CC(Br)=CN1)N AK106602 [0,0,0,0,1,0|3,0,0]=4 729 B9R1.35 O=C(C1=CC(Br)=CO1)N AK120768 [0,0,0,0,1,0|3,0,0]=4 730 B9R1.35 O=C(C1=CC(Br)=CS1)N AK-90412 [0,0,0,0,1,0|3,0,0]=4 731 B9R1.35 O=C(C1=CC(Br)=CS1)O AK-24697 [0,0,0,0,1,0|2,0,0]=3 732 B9R1.35 O=C(C1=CC(C)=NO1)O AK-29291 [0,0,0,0,1,0|3,0,0]=4 733 B9R1.35 O=C(C1=CC(O)=NO1)O AK-58553 [0,0,0,0,1,0|3,0,0]=4 734 B9R1.35 O=C(C1=CC=C(Br)S1)O AK-26297 [0,0,0,0,1,0|2,0,0]=3 735 B9R1.35 O=C(C1=CC=C(C)S1)O AK-25546 [0,0,0,0,1,0|2,0,0]=3 736 B9R1.35 O=C(C1=CC=C(Cl)O1)O AK-94156 [0,0,0,0,1,0|2,0,0]=3 737 B9R1.35 O=C(C1=CC=C(F)S1)O AK-35162 [0,0,0,0,1,0|2,0,0]=3 738 B9R1.35 O=C(C1=CC=C(I)S1)O AK113691 [0,0,0,0,1,0|2,0,0]=3 739 B9R1.35 O=C(C1=CN(C)C=N1)O AK-30010 [0,0,0,0,1,0|3,0,0]=4 740 B9R1.35 O=C(C1=CN(C)N=C1)O AK-39751 [0,0,0,0,1,0|3,0,0]=4 741 B9R1.35 O=C(C1=CN=C(Br)S1)O AK-26941 [0,0,0,0,1,0|3,0,0]=4 742 B9R1.35 O=C(C1=CN=C(C)O1)O AK-43778 [0,0,0,0,1,0|3,0,0]=4 743 B9R1.35 O=C(C1=CNC(C)=C1)O AK-78330 [0,0,0,0,1,0|2,0,0]=3 744 B9R1.35 O=C(C1=CNC(C)=N1)O AK-78654 [0,0,0,0,1,0|3,0,0]=4 745 B9R1.35 O=C(C1=COC(Br)=N1)O AK-76031 [0,0,0,0,1,0|3,0,0]=4 746 B9R1.35 O=C(C1=COC(I)=N1)O AK-41227 [0,0,0,0,1,0|3,0,0]=4 747 B9R1.35 O=C(C1=CSC(Br)=C1)N AK138264 [0,0,0,0,1,0|3,0,0]=4 748 B9R1.35 O=C(C1=CSC(Br)=N1)O AK-23610 [0,0,0,0,1,0|3,0,0]=4 749 B9R1.35 O=C(C1=CSC(Cl)=N1)O AK-48303 [0,0,0,0,1,0|3,0,0]=4 750 B9R1.35 O=C(C1=CSC(N)=N1)N AK109042 [0,0,0,0,1,0|3,0,0]=4 751 B9R1.35 O=C(C1=NC(Br)=CS1)O AK-40795 [0,0,0,0,1,0|3,0,0]=4 752 B9R1.35 O=C(C1=NC(C)=CN1)O AK-29453 [0,0,0,0,1,0|3,0,0]=4 753 B9R1.35 O=C(C1=NC=C(Br)S1)O AK122038 [0,0,0,0,1,0|3,0,0]=4 754 B9R1.35 O=C(C1=NN(C)C=C1)O AK-79303 [0,0,0,0,1,0|3,0,0]=4 755 B9R1.35 O=C(C1=NNC(Br)=C1)O AK128451 [0,0,0,0,1,0|3,0,0]=4 756 B9R1.35 O=C(C1=NNC(Cl)=C1)O AK112708 [0,0,0,0,1,0|3,0,0]=4 757 B9R1.35 O=C(C1=NOC(C)=C1)O AK-25795 [0,0,0,0,1,0|3,0,0]=4 758 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 AK-48243 [0,0,0,0,1,0|3,0,0]=4 759 B9R1.35 O=C(O)C1=CC(Br)=CO1 AK-41331 [0,0,0,0,1,0|2,0,0]=3 760 B9R1.35 OC(=O)C1=CC(Br)=CN1 AK-27737 [0,0,0,0,1,0|2,0,0]=3 761 B9R1.35 OC(=O)C1=CC(Cl)=CS1 AK-89071 [0,0,0,0,1,0|2,0,0]=3 762 B9R1.35 OC(=O)C1=CC(F)=CS1 AK-29152 [0,0,0,0,1,0|2,0,0]=3 763 B9R1.35 OC(=O)C1=CC=C(Br)N1 AK100216 [0,0,0,0,1,0|2,0,0]=3 764 B9R1.35 OC(=O)C1=CNC(=O)N1 AK-68699 [0,0,0,0,1,0|3,0,0]=4 765 B9R1.35 OC(=O)C1=COC(Cl)=N1 AK-72648 [0,0,0,0,1,0|3,0,0]=4 766 B9R1.35 OC(=O)C1=NNC(O)=C1 AK-96196 [0,0,0,0,1,0|3,0,0]=4 767 B11R1.20 BrC1=CN=C(C=C1)CC(=O)O AK-46600 [0,0,0,0,0,1|2,0,0]=3 768 B11R1.20 C1=C(C=CC(=C1)F)CC(O)=O AK-49121 [0,0,0,0,0,1|1,0,0]=2 769 B11R1.20 C1=CC(=CC=C1CC(C)=O)F AK-50578 [0,0,0,0,0,1|2,0,0]=3 770 B11R1.20 C1=CC(=CC=C1N)CC(O)=O AK-47573 [0,0,0,0,0,1|0,0,0]=1 771 B11R1.20 CC(NC1=CC=C(C)C=C1)=O AK208638 [0,0,0,0,0,1|2,0,0]=3 772 B11R1.20 CC(NC1=CC=C(I)C=C1)=O AK115722 [0,0,0,0,0,1|2,0,0]=3 773 B11R1.20 CC(NC1=CC=C(O)N=C1)=O AK152813 [0,0,0,0,0,1|3,0,0]=4 774 B11R1.20 CC(NC1=NC=C(Br)C=C1)=O AK-32386 [0,0,0,0,0,1|3,0,0]=4 775 B11R1.20 CC(NC1=NC=C(O)C=C1)=O AK114074 [0,0,0,0,0,1|3,0,0]=4 776 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 AK-59139 [0,0,0,0,0,1|2,0,0]=3 777 B11R1.20 NC1=CC=C(CN(C)C)C=C1 AK-35964 [0,0,0,0,0,1|3,0,0]=4 778 B11R1.20 NC1=CC=C(OC(C)C)C=C1 AK-42665 [0,0,0,0,0,1|2,0,1]=4 779 B11R1.20 O=C(N)CC1=CC=C(Cl)C=C1 AK201413 [0,0,0,0,0,1|2,0,0]=3 780 B11R1.20 O=C(N)CC1=NC=C(Br)C=C1 AK141365 [0,0,0,0,0,1|3,0,0]=4 781 B11R1.20 O=C(O)CC1=CC=C(C)C=C1 AK-45538 [0,0,0,0,0,1|1,0,0]=2 782 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 AK-48828 [0,0,0,0,0,1|2,0,0]=3 783 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 AK-45403 [0,0,0,0,0,1|1,0,0]=2 784 B11R1.20 O=C(O)CC1=CC=C(N)N=C1 AK112112 [0,0,0,0,0,1|1,0,0]=2 785 B11R1.20 O=C(O)CC1=NC=C(C)C=C1 AK139129 [0,0,0,0,0,1|2,0,0]=3 786 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 AK-43706 [0,0,0,0,0,1|3,0,0]=4 787 B11R1.20 OC(=O)CC1=CC=C(Br)C=C1 AK-45378 [0,0,0,0,0,1|1,0,0]=2 788 B11R1.20 OC(=O)CC1=CC=C(Cl)C=C1 AK-76702 [0,0,0,0,0,1|1,0,0]=2 789 B11R1.20 OC(=O)CC1=CC=C(O)C=C1 AK101098 [0,0,0,0,0,1|1,0,0]=2 790 B11R1.20 S=C(N)NC1=CC=C(C)C=C1 AK161770 [0,0,0,0,0,1|2,1,0]=4 791 B8R1.2 ICC1=CC=CC=C1 AK-54444 [2,0,0,0,0,0|1,0,1]=4 792 B8R1.2 N#CC1=CC=CC=C1 AK-49389 [2,0,0,0,0,0|1,0,1]=4 793 B8R1.2 N1=CN=C(C=C1)C=O AK-23925 [2,0,0,0,0,0|2,0,0]=4 794 B8R1.2 N1=CN=CC(=C1)C=O AK-25240 [2,0,0,0,0,0|2,0,0]=4 795 B8R1.2 NNC1=CC=CC=C1 AK114548 [2,0,0,0,0,0|2,0,0]=4 796 B8R1.2 NOC1=CC=CC=C1 AK-77703 [2,0,0,0,0,0|2,0,0]=4 797 B8R1.2 O=CC1=CC=NC=C1 AK-50192 [2,0,0,0,0,0|1,0,0]=3 798 B8R1.2 OCC1=CC=CN=C1 AK-46173 [2,0,0,0,0,0|1,0,1]=4 799 B8R1.2 OCC1=CC=NC=C1 AK-44706 [2,0,0,0,0,0|1,0,1]=4 800 B8R1.2 OCC1=CC=NC=C1 AK175384 [2,0,0,0,0,0|1,0,1]=4 801 B8R1.2 OCC1=NC=CC=C1 AK-53905 [2,0,0,0,0,0|1,0,1]=4 802 B8R1.2 ONC1=CC=CC=C1 AK139965 [2,0,0,0,0,0|1,0,0]=3 803 B8R1.3 BrC1=CC=C(Br)C=C1 AK-77031 [2,0,0,0,0,0|2,0,0]=4 804 B8R1.3 C1=C(C=NC(=C1)C)N AK-26763 [2,0,0,0,0,0|1,0,1]=4 805 B8R1.3 C1=C(C=NC(=C1)Cl)O AK-25948 [2,0,0,0,0,0|2,0,0]=4 806 B8R1.3 C1=C(C=NC(=C1)N)I AK-27741 [2,0,0,0,0,0|2,0,0]=4 807 B8R1.3 C1=C(O)C=NC(=C1)C AK-27703 [2,0,0,0,0,0|2,0,0]=4 808 B8R1.3 C1=CC(=CC=C1Br)I AK-46448 [2,0,0,0,0,0|2,0,0]=4 809 B8R1.3 C1=CC(=CC=C1I)I AK-72778 [2,0,0,0,0,0|2,0,0]=4 810 B8R1.3 C1=CC(=NC=C1Br)N AK-26973 [2,0,0,0,0,0|2,0,0]=4 811 B8R1.3 C1=NC(=CC=C1F)N AK-25604 [2,0,0,0,0,0|2,0,0]=4 812 B8R1.3 CC1=CC=C(I)C=C1 AK-95999 [2,0,0,0,0,0|1,0,1]=4 813 B8R1.3 ClC1=CC=C(Br)C=C1 AK-98696 [2,0,0,0,0,0|2,0,0]=4 814 B8R1.3 ClC1=NC=C(N)C=C1 AK-27135 [2,0,0,0,0,0|2,0,0]=4 815 B8R1.3 FC1=CC=C(I)C=C1 AK-48799 [2,0,0,0,0,0|2,0,0]=4 816 B8R1.3 IC1=CC=C(Cl)C=C1 AK-50754 [2,0,0,0,0,0|2,0,0]=4 817 B8R1.3 IC1=CNC(=O)C=C1 AK-25382 [2,0,0,0,0,0|2,0,0]=4 818 B8R1.3 NC1=CC=C(Br)N=C1 AK-25387 [2,0,0,0,0,0|2,0,0]=4 819 B8R1.3 NC1=CC=C(Cl)C=N1 AK-32799 [2,0,0,0,0,0|2,0,0]=4 820 B8R1.3 NC1=CC=C(I)C=C1 AK-49877 [2,0,0,0,0,0|1,0,0]=3 821 B8R1.3 NC1=CC=C(O)C=N1 AK-40830 [2,0,0,0,0,0|1,0,0]=3 822 B8R1.3 NC1=CN=C(C=C1)F AK-25524 [2,0,0,0,0,0|2,0,0]=4 823 B8R1.3 NC1=CN=C(N)C=C1 AK-64957 [2,0,0,0,0,0|2,0,0]=4 824 B8R1.3 NC1=CN=C(O)C=C1 AK-48682 [2,0,0,0,0,0|1,0,0]=3 825 B8R1.3 O=C1C=CC(Cl)=CN1 AK-30015 [2,0,0,0,0,0|2,0,0]=4 826 B8R1.3 O=C1C=CC(N)=CN1 AK-30033 [2,0,0,0,0,0|1,0,0]=3 827 B8R1.3 O=C1C=CC(N)=NN1 AK113263 [2,0,0,0,0,0|2,0,0]=4 828 B8R1.3 OC1=CC=C(F)C=C1 AK-48196 [2,0,0,0,0,0|1,0,0]=3 829 B8R1.3 OC1=CC=C(F)N=C1 AK-23515 [2,0,0,0,0,0|2,0,0]=4 830 B8R1.3 OC1=CC=C(N)C=C1 AK109176 [2,0,0,0,0,0|0,0,0]=2 831 B8R1.3 OC1=CC=C(N)N=C1 AK-28002 [2,0,0,0,0,0|1,0,0]=3 832 B8R1.3 OC1=CN=C(Br)C=C1 AK-25164 [2,0,0,0,0,0|2,0,0]=4 833 B8R1.3 OC1=CNC(=O)C=C1 AK-86050 [2,0,0,0,0,0|2,0,0]=4 834 B8R1.3 OC1=NC=C(Br)C=C1 AK-28009 [2,0,0,0,0,0|2,0,0]=4 835 B8R1.3 OC1=NC=C(C)C=C1 AK-25236 [2,0,0,0,0,0|2,0,0]=4 836 B10R1.1 BrC1=CC=C(C=C1)CC=O AK-25692 [1,1,0,0,0,0|1,0,0]=3 837 B10R1.1 C1=C(C=CC(=C1)Br)CCO AK-35260 [1,1,0,0,0,0|1,0,1]=4 838 B10R1.1 C1=CC(=CC=C1CCO)I AK-40186 [1,1,0,0,0,0|1,0,1]=4 839 B10R1.1 C1=CC(=CC=C1CCO)O AK-35340 [1,1,0,0,0,0|1,0,1]=4 840 B10R1.1 CNCC1=CC=C(N)C=C1 AK-78884 [1,1,0,0,0,0|1,0,1]=4 841 B10R1.1 ClC1=CC=C(CCO)C=C1 AK-86505 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.1 FC1=CC=C(CCO)C=C1 AK-51236 [1,1,0,0,0,0|1,0,1]=4 843 B10R1.1 NC1=CC=C(CC#N)C=C1 AK100092 [1,1,0,0,0,0|1,0,1]=4 844 B10R1.1 NC1=CC=C(CCO)C=C1 AK-47701 [1,1,0,0,0,0|0,0,1]=3 845 B10R1.1 NC1=CC=C(COC)C=C1 AK-78891 [1,1,0,0,0,0|0,0,1]=3 846 B10R1.1 NCCC1=CC=C(N)C=C1 AK-45820 [1,1,0,0,0,0|1,0,1]=4 847 B10R1.1 NOCC1=CC=C(F)C=C1 AK-86671 [1,1,0,0,0,0|1,0,1]=4 848 B10R1.1 OC1=CC=C(COC)C=C1 AK-42631 [1,1,0,0,0,0|1,0,1]=4 849 B10R1.3 C(=O)C1=CN=C(C=C1)C#N AK-49150 [1,1,0,0,0,0|1,0,1]=4 850 B10R1.3 C1=C(C=CC(=C1)CN)C#N AK-33511 [1,1,0,0,0,0|1,0,1]=4 851 B10R1.3 CNC1=CC=C(OC)C=C1 AK-89674 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.3 COC1=CC=C(C=C)C=C1 AK-46470 [1,1,0,0,0,0|2,0,0]=4 853 B10R1.3 COC1=CC=C(CO)C=C1 AK-46460 [1,1,0,0,0,0|1,0,1]=4 854 B10R1.3 N#CC1=CC=C(CN)C=C1 AK-45455 [1,1,0,0,0,0|1,0,1]=4 855 B10R1.3 N#CC1=CC=C(CO)C=C1 AK142802 [1,1,0,0,0,0|0,0,2]=4 856 B10R1.3 NCC1=CC=C(C#C)C=C1 AK-80240 [1,1,0,0,0,0|1,0,1]=4 857 B10R1.3 NCC1=CC=C(CN)C=C1 AK-76712 [1,1,0,0,0,0|1,0,1]=4 858 B10R1.3 NCC1=CC=C(CO)C=C1 AK-32003 [1,1,0,0,0,0|0,0,1]=3 859 B10R1.3 NNC1=CC=C(C#N)C=C1 AK-45093 [1,1,0,0,0,0|1,0,1]=4 860 B10R1.3 NNC1=CC=C(C=C1)C#N AK103460 [1,1,0,0,0,0|1,0,1]=4 861 B10R1.3 NNC1=CC=C(CC)C=C1 AK-88865 [1,1,0,0,0,0|1,0,1]=4 862 B10R1.3 NNC1=CC=C(OC)C=C1 AK-47322 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.3 O=CC1=CC=C(C#C)C=C1 AK-51699 [1,1,0,0,0,0|1,0,0]=3 864 B10R1.3 O=CC1=CC=C(C#N)C=C1 AK-41243 [1,1,0,0,0,0|0,0,1]=3 865 B10R1.3 O=CC1=CC=C(C=N1)C#N AK-40989 [1,1,0,0,0,0|1,0,1]=4 866 B10R1.3 O=CC1=CC=C(C=O)C=C1 AK-40107 [1,1,0,0,0,0|1,0,0]=3 867 B10R1.3 O=CC1=CC=C(CCl)C=C1 AK113959 [1,1,0,0,0,0|1,0,0]=3 868 B10R1.3 O=CC1=CN=C(OC)C=C1 AK-36019 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.3 O=CC1=NC=C(CC)C=C1 AK118117 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.3 O=CC1=NC=C(OC)C=C1 AK-34181 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.3 OCC1=CC=C(C#C)C=C1 AK164494 [1,1,0,0,0,0|1,0,1]=4 872 B10R1.3 OCC1=CC=C(C=O)C=C1 AK-77797 [1,1,0,0,0,0|1,0,0]=3 873 B10R1.3 OCC1=CC=C(CBr)C=C1 AK-81957 [1,1,0,0,0,0|1,0,1]=4 874 B10R1.3 OCC1=CC=C(CCl)C=C1 AK-64050 [1,1,0,0,0,0|1,0,1]=4 875 B10R1.3 OCC1=CC=C(CO)C=C1 AK-45211 [1,1,0,0,0,0|1,0,1]=4 876 B10R1.25 BrC1=C(C=O)C=CC(=C1)Cl AK-36523 [1,1,0,0,0,0|1,0,0]=3 877 B10R1.25 BrC1=C(C=O)C=CC(=C1)I AK-34421 [1,1,0,0,0,0|1,0,0]=3 878 B10R1.25 BrC1=CC(=C(C=O)C=C1)C AK-61711 [1,1,0,0,0,0|1,0,0]=3 879 B10R1.25 C1=C(C(=CC=C1F)C=O)Cl AK-36516 [1,1,0,0,0,0|1,0,0]=3 880 B10R1.25 C1=CC(=CC(=C1C=O)F)Br AK-27093 [1,1,0,0,0,0|1,0,0]=3 881 B10R1.25 CC1=C(C=CC(N)=C1)C#N AK-89475 [1,1,0,0,0,0|1,0,1]=4 882 B10R1.25 CC1=CC(Cl)=NC=C1C=O AK-46659 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.25 COC1=C(O)C=C(N)C=C1 AK-63517 [1,1,0,0,0,0|2,0,0]=4 884 B10R1.25 ClC1=C(C=O)C=CC(=C1)Br AK-25465 [1,1,0,0,0,0|1,0,0]=3 885 B10R1.25 ClC1=C(C=O)C=CC(=C1)O AK-24943 [1,1,0,0,0,0|1,0,0]=3 886 B10R1.25 ClC1=CC(=C(C=O)C=C1)O AK-23506 [1,1,0,0,0,0|1,0,0]=3 887 B10R1.25 ClC1=NC(=CC=C1C=O)Cl AK-35627 [1,1,0,0,0,0|2,0,0]=4 888 B10R1.25 FC1=C(C=O)C=CC(=C1)O AK-25823 [1,1,0,0,0,0|1,0,0]=3 889 B10R1.25 FC1=CC=C(C(=C1)O)C=O AK-25824 [1,1,0,0,0,0|1,0,0]=3 890 B10R1.25 FC1=NC(=CC=C1C=O)F AK-33458 [1,1,0,0,0,0|2,0,0]=4 891 B10R1.25 N#CC1=CC=C(N)C=C1Br AK-64862 [1,1,0,0,0,0|1,0,1]=4 892 B10R1.25 N#CC1=CC=C(N)C=C1Cl AK-34061 [1,1,0,0,0,0|1,0,1]=4 893 B10R1.25 N#CC1=CC=C(N)C=C1F AK-30618 [1,1,0,0,0,0|1,0,1]=4 894 B10R1.25 N#CC1=CC=C(N)C=C1O AK321552 [1,1,0,0,0,0|1,0,1]=4 895 B10R1.25 NC1=C(C=O)C=CC(=C1)Br AK-24355 [1,1,0,0,0,0|1,0,0]=3 896 B10R1.25 NC1=C(C=O)C=CC(F)=C1 AK-40610 [1,1,0,0,0,0|1,0,0]=3 897 B10R1.25 NC1=CC=C(OC)C(Br)=C1 AK-33883 [1,1,0,0,0,0|2,0,0]=4 898 B10R1.25 NC1=CC=C(OC)C(C)=C1 AK-33185 [1,1,0,0,0,0|2,0,0]=4 899 B10R1.25 NC1=CC=C(OC)C(F)=C1 AK-25856 [1,1,0,0,0,0|2,0,0]=4 900 B10R1.25 NC1=CC=C(OC)C(I)=C1 AK-39498 [1,1,0,0,0,0|2,0,0]=4 901 B10R1.25 NC1=CC=C(OC)C(I)=C1 AK-61933 [1,1,0,0,0,0|2,0,0]=4 902 B10R1.25 NC1=CC=C(OC)C(N)=C1 AK-93491 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.25 NC1=NC=C(C=O)C(N)=N1 AK-28963 [1,1,0,0,0,0|2,0,0]=4 904 B10R1.25 O=CC1=C(Cl)N=C(Br)C=C1 AK-98155 [1,1,0,0,0,0|2,0,0]=4 905 B10R1.25 O=CC1=CC=C(Br)C=C1Br AK-94346 [1,1,0,0,0,0|1,0,0]=3 906 B10R1.25 O=CC1=CC=C(Br)C=C1O AK-24055 [1,1,0,0,0,0|1,0,0]=3 907 B10R1.25 O=CC1=CC=C(C)C=C1Br AK-36471 [1,1,0,0,0,0|1,0,0]=3 908 B10R1.25 O=CC1=CC=C(C)C=C1C AK-51228 [1,1,0,0,0,0|1,0,0]=3 909 B10R1.25 O=CC1=CC=C(C)C=C1Cl AK-51348 [1,1,0,0,0,0|1,0,0]=3 910 B10R1.25 O=CC1=CC=C(C)C=C1F AK-25429 [1,1,0,0,0,0|1,0,0]=3 911 B10R1.25 O=CC1=CC=C(C)C=C1O AK-30310 [1,1,0,0,0,0|1,0,0]=3 912 B10R1.25 O=CC1=CC=C(Cl)C=C1C AK-35038 [1,1,0,0,0,0|1,0,0]=3 913 B10R1.25 O=CC1=CC=C(Cl)C=C1F AK-53686 [1,1,0,0,0,0|1,0,0]=3 914 B10R1.25 O=CC1=CC=C(Cl)C=C1N AK137796 [1,1,0,0,0,0|1,0,0]=3 915 B10R1.25 O=CC1=CC=C(F)C=C1Br AK-35776 [1,1,0,0,0,0|1,0,0]=3 916 B10R1.25 O=CC1=CC=C(F)C=C1C AK-35928 [1,1,0,0,0,0|1,0,0]=3 917 B10R1.25 O=CC1=CC=C(F)C=C1F AK-44552 [1,1,0,0,0,0|1,0,0]=3 918 B10R1.25 O=CC1=CC=C(I)C=C1O AK137741 [1,1,0,0,0,0|1,0,0]=3 919 B10R1.25 O=CC1=CC=C(N)C=C1Br AK149311 [1,1,0,0,0,0|0,0,0]=2 920 B10R1.25 O=CC1=CC=C(N)C=C1N AK136530 [1,1,0,0,0,0|0,0,0]=2 921 B10R1.25 O=CC1=CC=C(O)C=C1O AK-50262 [1,1,0,0,0,0|1,0,0]=3 922 B10R1.25 O=CC1=CN=C(Br)C=C1C AK-61554 [1,1,0,0,0,0|2,0,0]=4 923 B10R1.25 O=CC1=CN=C(C)C=C1C AK146838 [1,1,0,0,0,0|2,0,0]=4 924 B10R1.25 O=CC1=CN=C(Cl)C=C1Br AK123512 [1,1,0,0,0,0|2,0,0]=4 925 B10R1.25 O=CC1=CN=C(Cl)C=C1Cl AK-86655 [1,1,0,0,0,0|2,0,0]=4 926 B10R1.25 O=CC1=CN=C(Cl)C=C1N AK113060 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.25 O=CC1=CN=C(F)C=C1Cl AK121839 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.25 OC1=CC(=C(C=O)C=C1)C AK-24767 [1,1,0,0,0,0|1,0,0]=3 929 B10R1.25 OC1=CC(Br)=C(C=O)C=C1 AK-99903 [1,1,0,0,0,0|1,0,0]=3 930 B10R1.25 OC1=CC(I)=C(C=O)C=C1 AK100265 [1,1,0,0,0,0|1,0,0]=3 931 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 AK-76830 [1,1,0,0,0,0|1,0,1]=4 932 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 AK-46376 [1,1,0,0,0,0|1,0,1]=4 933 B10R1.25 OCC1=CC=C(Br)C=C1C AK-59623 [1,1,0,0,0,0|1,0,1]=4 934 B10R1.25 OCC1=CC=C(Br)C=C1N AK-30952 [1,1,0,0,0,0|1,0,1]=4 935 B10R1.25 OCC1=CC=C(C)C=C1C AK-61593 [1,1,0,0,0,0|1,0,1]=4 936 B10R1.25 OCC1=CC=C(Cl)C=C1Cl AK-86288 [1,1,0,0,0,0|1,0,1]=4 937 B10R1.25 OCC1=CC=C(N)C=C1C AK143112 [1,1,0,0,0,0|0,0,1]=3 938 B10R1.176 BrC1=C(Br)C=C(C=O)C=C1 AK111131 [1,1,0,0,0,0|1,0,0]=3 939 B10R1.176 BrC1=C(C=C(C=O)C=C1)C AK-54790 [1,1,0,0,0,0|1,0,0]=3 940 B10R1.176 BrC1=C(C=C(C=O)C=C1)F AK-25371 [1,1,0,0,0,0|1,0,0]=3 941 B10R1.176 BrC1=C(N)C=CC(=C1)OC AK-34684 [1,1,0,0,0,0|2,0,0]=4 942 B10R1.176 C1=C(C#N)C=C(C(=C1)N)Cl AK-34131 [1,1,0,0,0,0|1,0,1]=4 943 B10R1.176 C1=C(C(=CC=C1C=O)O)C AK-45466 [1,1,0,0,0,0|1,0,0]=3 944 B10R1.176 C1=C(C(=CC=C1C=O)O)Cl AK-44952 [1,1,0,0,0,0|1,0,0]=3 945 B10R1.176 C1=C(C(=CC=C1CO)Cl)Cl AK-46784 [1,1,0,0,0,0|1,0,1]=4 946 B10R1.176 C1=C(C(=CC=C1OC)N)F AK-35251 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.176 C1=C(C=CC(=C1Br)O)CO AK-45658 [1,1,0,0,0,0|1,0,1]=4 948 B10R1.176 C1=C(C=CC(=C1F)Cl)C=O AK-29387 [1,1,0,0,0,0|1,0,0]=3 949 B10R1.176 C1=C(C=CC(=C1F)N)C#N AK-35927 [1,1,0,0,0,0|1,0,1]=4 950 B10R1.176 C1=C(C=CC(=C1O)O)C=O AK-39223 [1,1,0,0,0,0|1,0,0]=3 951 B10R1.176 C=CC1=CC=C(Cl)C(Cl)=C1 AK-45907 [1,1,0,0,0,0|2,0,0]=4 952 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 AK-39755 [1,1,0,0,0,0|1,0,0]=3 953 B10R1.176 CC1=C(Br)C=C(CO)C=C1 AK104804 [1,1,0,0,0,0|1,0,1]=4 954 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 AK-44210 [1,1,0,0,0,0|1,0,0]=3 955 B10R1.176 COC1=CC=C(N)C(N)=C1 AK-46468 [1,1,0,0,0,0|2,0,0]=4 956 B10R1.176 ClC1=C(Br)C=CC(C=O)=C1 AK-40221 [1,1,0,0,0,0|1,0,0]=3 957 B10R1.176 ClC1=NC=C(C=C1Cl)C=O AK-36201 [1,1,0,0,0,0|2,0,0]=4 958 B10R1.176 N#CC1=CC=C(N)C(O)=C1 AK-80498 [1,1,0,0,0,0|1,0,1]=4 959 B10R1.176 NC1=C(Br)C=C(C=C1)C#N AK-35354 [1,1,0,0,0,0|1,0,1]=4 960 B10R1.176 NC1=C(I)C=C(C=C1)C#N AK-34727 [1,1,0,0,0,0|1,0,1]=4 961 B10R1.176 NC1=CC=C(C=C1N)C#N AK-45091 [1,1,0,0,0,0|1,0,1]=4 962 B10R1.176 NC1=CC=C(CC)C=C1F AK112540 [1,1,0,0,0,0|1,0,1]=4 963 B10R1.176 NC1=CC=C(CC)C=C1N AK112821 [1,1,0,0,0,0|1,0,1]=4 964 B10R1.176 NC1=CC=C(OC)C=C1C AK-32687 [1,1,0,0,0,0|2,0,0]=4 965 B10R1.176 NC1=CC=C(OC)C=C1Cl AK-61306 [1,1,0,0,0,0|2,0,0]=4 966 B10R1.176 NC1=CC=C(OC)C=C1F AK130572 [1,1,0,0,0,0|2,0,0]=4 967 B10R1.176 NC1=CC=C(OC)C=C1I AK-33894 [1,1,0,0,0,0|2,0,0]=4 968 B10R1.176 O=CC1=CC=C(C)C(C)=C1 AK-88497 [1,1,0,0,0,0|1,0,0]=3 969 B10R1.176 O=CC1=CC=C(C)C(Cl)=C1 AK-61770 [1,1,0,0,0,0|1,0,0]=3 970 B10R1.176 O=CC1=CC=C(C)C(O)=C1 AK142786 [1,1,0,0,0,0|1,0,0]=3 971 B10R1.176 O=CC1=CC=C(Cl)C(Br)=C1 AK-36603 [1,1,0,0,0,0|1,0,0]=3 972 B10R1.176 O=CC1=CC=C(Cl)C(I)=C1 AK177782 [1,1,0,0,0,0|1,0,0]=3 973 B10R1.176 O=CC1=CC=C(Cl)C(O)=C1 AK-65100 [1,1,0,0,0,0|1,0,0]=3 974 B10R1.176 O=CC1=CC=C(F)C(Br)=C1 AK-29530 [1,1,0,0,0,0|1,0,0]=3 975 B10R1.176 O=CC1=CC=C(F)C(C)=C1 AK-28780 [1,1,0,0,0,0|1,0,0]=3 976 B10R1.176 O=CC1=CC=C(O)C(I)=C1 AK108364 [1,1,0,0,0,0|1,0,0]=3 977 B10R1.176 O=CC1=CN=C(Br)C(C)=C1 AK-62075 [1,1,0,0,0,0|2,0,0]=4 978 B10R1.176 O=CC1=NC(Br)=C(Cl)C=C1 AK152007 [1,1,0,0,0,0|2,0,0]=4 979 B10R1.176 O=CC1=NC(C)=C(Br)C=C1 AK-61562 [1,1,0,0,0,0|2,0,0]=4 980 B10R1.176 O=CC1=NC=C(Br)C(C)=C1 AK-80548 [1,1,0,0,0,0|2,0,0]=4 981 B10R1.176 O=CC1=NC=C(C)C(Br)=C1 AK137977 [1,1,0,0,0,0|2,0,0]=4 982 B10R1.176 OC1=C(Br)C=C(C=O)C=C1 AK-48127 [1,1,0,0,0,0|1,0,0]=3 983 B10R1.176 OC1=C(Br)C=CC(C=O)=C1 AK-89484 [1,1,0,0,0,0|1,0,0]=3 984 B10R1.176 OC1=CC(CC)=CC=C1N AK-93570 [1,1,0,0,0,0|1,0,1]=4 985 B10R1.176 OC1=CC(CO)=CC=C1F AK270577 [1,1,0,0,0,0|1,0,1]=4 986 B10R1.176 OC1=CC(CO)=CC=C1I AK-84465 [1,1,0,0,0,0|1,0,1]=4 987 B10R1.176 OC1=CC(OC)=CC=C1N AK-82144 [1,1,0,0,0,0|2,0,0]=4 988 B10R1.176 OC1=CC=C(CO)C=C1C AK-98675 [1,1,0,0,0,0|1,0,1]=4 989 B10R1.176 OCC1=CC(Br)=C(N)N=C1 AK137409 [1,1,0,0,0,0|1,0,1]=4 990 B10R1.176 OCC1=CC=C(Br)C(C)=C1 AK-86221 [1,1,0,0,0,0|1,0,1]=4 991 B10R1.176 OCC1=CC=C(Br)C(F)=C1 AK-53787 [1,1,0,0,0,0|1,0,1]=4 992 B10R1.176 OCC1=CC=C(C)C(C)=C1 AK-79908 [1,1,0,0,0,0|1,0,1]=4 993 B10R1.176 OCC1=CC=C(F)C(F)=C1 AK-61983 [1,1,0,0,0,0|1,0,1]=4 994 B10R1.176 OCC1=CC=C(I)C(F)=C1 AK-94385 [1,1,0,0,0,0|1,0,1]=4 995 B10R1.15 C1=C(C(OC)=O)C=CN=C1 AK-46755 [1,1,0,0,0,0|1,0,0]=3 996 B10R1.15 C1=C(C(OC)=O)N=CC=C1 AK-46574 [1,1,0,0,0,0|1,0,0]=3 997 B10R1.15 C1=CC=NC=C1C(OC)=O AK-47410 [1,1,0,0,0,0|1,0,0]=3 998 B10R1.15 C1=NC=CN=C1C(OC)=O AK-47365 [1,1,0,0,0,0|2,0,0]=4 999 B10R1.15 N1=NC=C(C=C1)C(=O)OC AK-48857 [1,1,0,0,0,0|2,0,0]=4 1000 B10R1.15 NCC(C1=CC=CC=C1)=O AK-26107 [1,1,0,0,0,0|1,0,0]=3 1001 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AK-45230 [1,1,0,0,0,0|1,0,1]=4 1002 B10R1.15 NNC(=O)C1=CC=NC=C1 AK-46317 [1,1,0,0,0,0|2,0,0]=4 1003 B10R1.15 NNC(C1=CC=CN=C1)=O AK-44810 [1,1,0,0,0,0|2,0,0]=4 1004 B10R1.15 N[C@H](C1=CC=CC=C1)CO AK-41249 [1,1,0,0,0,0|1,0,1]=4 1005 B10R1.15 O=C(C1=NC=CC=C1)CBr AK-44981 [1,1,0,0,0,0|2,0,0]=4 1006 B10R1.15 O=C(C1=NC=CC=N1)OC AK-24352 [1,1,0,0,0,0|2,0,0]=4 1007 B10R1.15 O=C(C1=NN=CC=C1)OC AK-68100 [1,1,0,0,0,0|2,0,0]=4 1008 B10R1.15 O=C(NC)C1=CC=CC=C1 AK323662 [1,1,0,0,0,0|1,0,0]=3 1009 B10R1.15 O=C(NN)C1=NC=CC=C1 AK117449 [1,1,0,0,0,0|2,0,0]=4 1010 B10R1.15 O=CN(C)C1=CC=CC=C1 AK-48601 [1,1,0,0,0,0|2,0,0]=4 1011 B10R1.15 O=S(C1=CC=CC=C1)OC AK109245 [1,1,0,0,0,0|1,0,0]=3 1012 B10R1.15 OC(C1=CC=CC=C1)CBr AK-76552 [1,1,0,0,0,0|1,0,1]=4 1013 B10R1.15 OC(C1=CC=CC=C1)CO AK117070 [1,1,0,0,0,0|0,0,2]=4 1014 B10R1.15 OCC(=O)C1=CC=CC=C1 AK-94786 [1,1,0,0,0,0|0,0,0]=2 1015 B10R1.15 OCC(N)C1=CC=CC=C1 AK-47370 [1,1,0,0,0,0|1,0,1]=4 1016 B10R1.15 O[C@@H](C1=CC=CC=C1)CO AK-45210 [1,1,0,0,0,0|0,0,2]=4 1017 B10R1.15 O[C@H](C1=CC=CC=C1)CO AK-33573 [1,1,0,0,0,0|0,0,2]=4 1018 B10R1.15 [C@H](N)(C1=CC=CC=C1)CO AK-41260 [1,1,0,0,0,0|1,0,1]=4 1019 B10R1.28 C1=C([S](O)(=O)=O)C=CC=C1 AK-51336 [1,1,0,0,0,0|1,0,0]=3 1020 B10R1.28 O=S(C1=CC=CC=C1)(N)=O AK-77414 [1,1,0,0,0,0|1,0,1]=4 1021 B10R1.28 O=S(C1=CC=CN=C1)(O)=O AK-47361 [1,1,0,0,0,0|2,0,0]=4 1022 B10R1.61 BrC1=C(C(=O)N)C=CN=C1 AK-29834 [1,1,0,0,0,0|2,0,0]=4 1023 B10R1.61 BrC1=C(C=CN=C1)C(=O)O AK-23517 [1,1,0,0,0,0|1,0,0]=3 1024 B10R1.61 BrC1=CC=CN=C1C(=O)O AK-25745 [1,1,0,0,0,0|1,0,0]=3 1025 B10R1.61 BrC1=CN=CN=C1C(=O)O AK-23815 [1,1,0,0,0,0|2,0,0]=4 1026 B10R1.61 BrC1=NC=CN=C1C(=O)O AK-30736 [1,1,0,0,0,0|2,0,0]=4 1027 B10R1.61 C1=C(C(=CC=C1)B(O)O)O AK-45876 [1,1,0,0,0,0|1,0,1]=4 1028 B10R1.61 C1=C(C(=NC=C1)Cl)C(N)=O AK-39181 [1,1,0,0,0,0|2,0,0]=4 1029 B10R1.61 C1=C(C(=NC=C1)Cl)C(O)=O AK-27015 [1,1,0,0,0,0|1,0,0]=3 1030 B10R1.61 C1=C(C(=NC=C1)F)C(O)=O AK-25163 [1,1,0,0,0,0|1,0,0]=3 1031 B10R1.61 C1=CC=CC(=C1B(O)O)Br AK-34317 [1,1,0,0,0,0|1,0,1]=4 1032 B10R1.61 C1=CC=CC(=C1B(O)O)C AK-33581 [1,1,0,0,0,0|1,0,1]=4 1033 B10R1.61 C1=CC=CC(=C1C(C)=O)Br AK-48030 [1,1,0,0,0,0|1,0,0]=3 1034 B10R1.61 C1=CC=CC(=C1C(C)=O)N AK-27106 [1,1,0,0,0,0|1,0,0]=3 1035 B10R1.61 C1=CC=CC(=C1C(O)=O)F AK-40433 [1,1,0,0,0,0|0,0,0]=2 1036 B10R1.61 C1=CC=CC(=C1O)C(=O)C AK-44482 [1,1,0,0,0,0|1,0,0]=3 1037 B10R1.61 C1=CC=NC(=C1C)C(O)=O AK-26613 [1,1,0,0,0,0|1,0,0]=3 1038 B10R1.61 C1=CN=C(C(=C1)C(=O)N)F AK-25200 [1,1,0,0,0,0|2,0,0]=4 1039 B10R1.61 C1=CN=C(C(=N1)C(O)=O)N AK-16902 [1,1,0,0,0,0|2,0,0]=4 1040 B10R1.61 C1=CN=CC(=C1C(=O)O)F AK-25903 [1,1,0,0,0,0|1,0,0]=3 1041 B10R1.61 C1=NC=CC(=C1C(O)=O)C AK-34679 [1,1,0,0,0,0|1,0,0]=3 1042 B10R1.61 CC(=O)C1=C(I)C=CC=C1 AK-84650 [1,1,0,0,0,0|1,0,0]=3 1043 B10R1.61 CC(=O)C1=CC=CN=C1F AK-36408 [1,1,0,0,0,0|2,0,0]=4 1044 B10R1.61 CC(=O)C1=CC=CN=C1N AK-61895 [1,1,0,0,0,0|2,0,0]=4 1045 B10R1.61 CC(=O)C1=NC=CC=C1F AK-36671 [1,1,0,0,0,0|2,0,0]=4 1046 B10R1.61 CC(C1=C(O)C=NC=C1)=O AK-68365 [1,1,0,0,0,0|2,0,0]=4 1047 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [1,1,0,0,0,0|1,0,0]=3 1048 B10R1.61 CC(C1=CC=CC=C1F)=O AK-44672 [1,1,0,0,0,0|1,0,0]=3 1049 B10R1.61 CC(C1=CC=CN=C1C)=O AK-60286 [1,1,0,0,0,0|2,0,0]=4 1050 B10R1.61 CC(C1=NC=CC=C1Br)=O AK-91392 [1,1,0,0,0,0|2,0,0]=4 1051 B10R1.61 CC(C1=NC=CC=C1Cl)=O AK128527 [1,1,0,0,0,0|2,0,0]=4 1052 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [1,1,0,0,0,0|2,0,0]=4 1053 B10R1.61 CC1=C(C(=O)N)C=CC=N1 AK-39636 [1,1,0,0,0,0|2,0,0]=4 1054 B10R1.61 CC1=C(C(=O)O)C=CC=N1 AK-25768 [1,1,0,0,0,0|1,0,0]=3 1055 B10R1.61 CC1=C(C=NC=N1)C(O)=O AK-32530 [1,1,0,0,0,0|2,0,0]=4 1056 B10R1.61 CC1=NC=CN=C1C(=O)O AK-25946 [1,1,0,0,0,0|2,0,0]=4 1057 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl AK-49059 [1,1,0,0,0,0|1,0,1]=4 1058 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl AK-57726 [1,1,0,0,0,0|1,0,1]=4 1059 B10R1.61 C[C@H](O)C1=CC=CC=C1F AK114295 [1,1,0,0,0,0|1,0,1]=4 1060 B10R1.61 ClC1=C(C(=O)O)C=CN=C1 AK-26411 [1,1,0,0,0,0|1,0,0]=3 1061 B10R1.61 ClC1=C(C=CC=C1)B(O)O AK-34973 [1,1,0,0,0,0|1,0,1]=4 1062 B10R1.61 ClC1=CC=CN=C1C(=O)O AK-23699 [1,1,0,0,0,0|1,0,0]=3 1063 B10R1.61 ClC1=CC=NC=C1C(=O)O AK-25252 [1,1,0,0,0,0|1,0,0]=3 1064 B10R1.61 ClC1=NC=CN=C1C(=O)O AK-24100 [1,1,0,0,0,0|2,0,0]=4 1065 B10R1.61 FC1=C(C(=N)N)C=CC=C1 AK-16801-8 [1,1,0,0,0,0|2,0,0]=4 1066 B10R1.61 FC1=C(C=CN=C1)C(C)=O AK-37142 [1,1,0,0,0,0|2,0,0]=4 1067 B10R1.61 FC1=C(N=CC=C1)C(=O)O AK-28801 [1,1,0,0,0,0|1,0,0]=3 1068 B10R1.61 FC1=CC=CC=C1B(O)O AK-45733 [1,1,0,0,0,0|1,0,1]=4 1069 B10R1.61 NC1=C(C=CN=N1)C(=O)O AK-24603 [1,1,0,0,0,0|2,0,0]=4 1070 B10R1.61 NC1=C(C=NC=C1)C(=O)N AK-29493 [1,1,0,0,0,0|2,0,0]=4 1071 B10R1.61 NC1=C(C=NC=C1)C(O)=O AK-27731 [1,1,0,0,0,0|1,0,0]=3 1072 B10R1.61 NC1=CC=CC=C1B(O)O AK-77788 [1,1,0,0,0,0|1,0,1]=4 1073 B10R1.61 O=C(C1=CN=CN=C1N)O AK-34045 [1,1,0,0,0,0|2,0,0]=4 1074 B10R1.61 O=C(C1=CN=CNC1=O)O AK-39341 [1,1,0,0,0,0|2,0,0]=4 1075 B10R1.61 O=C(C1=NC=CC=C1N)O AK-25432 [1,1,0,0,0,0|1,0,0]=3 1076 B10R1.61 O=C(C1=NC=CN=C1I)O AK-30598 [1,1,0,0,0,0|2,0,0]=4 1077 B10R1.61 O=C(C1=NC=CNC1=O)O AK-30536 [1,1,0,0,0,0|2,0,0]=4 1078 B10R1.61 O=C(C1=NC=NC=C1C)O AK140920 [1,1,0,0,0,0|2,0,0]=4 1079 B10R1.61 O=C(N)C1=CC=CC=C1Br AK-47071 [1,1,0,0,0,0|1,0,0]=3 1080 B10R1.61 O=C(N)C1=CC=CC=C1Cl AK128986 [1,1,0,0,0,0|1,0,0]=3 1081 B10R1.61 O=C(N)C1=CC=CC=C1F AK161780 [1,1,0,0,0,0|1,0,0]=3 1082 B10R1.61 O=C(N)C1=CC=CC=C1I AK115884 [1,1,0,0,0,0|1,0,0]=3 1083 B10R1.61 O=C(N)C1=CC=CC=C1N AK109256 [1,1,0,0,0,0|1,0,0]=3 1084 B10R1.61 O=C(N)C1=CC=NC=C1C AK-29933 [1,1,0,0,0,0|2,0,0]=4 1085 B10R1.61 O=C(N)C1=CC=NC=C1N AK-77290 [1,1,0,0,0,0|2,0,0]=4 1086 B10R1.61 O=C(N)C1=NC=CC=C1C AK-48603 [1,1,0,0,0,0|2,0,0]=4 1087 B10R1.61 O=C(N)C1=NC=CC=C1N AK-35369 [1,1,0,0,0,0|2,0,0]=4 1088 B10R1.61 O=C(O)C1=C(N)N=CC=C1 AK-26982 [1,1,0,0,0,0|1,0,0]=3 1089 B10R1.61 O=C(O)C1=C(S)N=CC=C1 AK-48961 [1,1,0,0,0,0|1,0,0]=3 1090 B10R1.61 O=C(O)C1=CC=CC=C1Br AK-77301 [1,1,0,0,0,0|0,0,0]=2 1091 B10R1.61 O=C(O)C1=CC=CC=C1C AK116916 [1,1,0,0,0,0|0,0,0]=2 1092 B10R1.61 O=C(O)C1=CC=CC=C1Cl AK-44481 [1,1,0,0,0,0|0,0,0]=2 1093 B10R1.61 O=C(O)C1=CC=CC=C1I AK-73132 [1,1,0,0,0,0|0,0,0]=2 1094 B10R1.61 O=C(O)C1=CC=NC=C1C AK-30383 [1,1,0,0,0,0|1,0,0]=3 1095 B10R1.61 O=C(O)C1=CC=NC=C1N AK-23678 [1,1,0,0,0,0|1,0,0]=3 1096 B10R1.61 O=C(O)C1=CC=NC=C1O AK-23523 [1,1,0,0,0,0|1,0,0]=3 1097 B10R1.61 O=C(O)C1=CN=CC=C1Br AK-25100 [1,1,0,0,0,0|1,0,0]=3 1098 B10R1.61 O=C(O)C1=CN=CC=C1C AK-75600 [1,1,0,0,0,0|1,0,0]=3 1099 B10R1.61 O=C(O)C1=NC=CC=C1I AK-29488 [1,1,0,0,0,0|1,0,0]=3 1100 B10R1.61 O=C(O)C1=NC=CC=C1O AK-26380 [1,1,0,0,0,0|1,0,0]=3 1101 B10R1.61 O=C1C(=CC=CN1)C(O)=O AK-47329 [1,1,0,0,0,0|1,0,0]=3 1102 B10R1.61 O=C1C(=CNC=C1)C(=O)O AK-26174 [1,1,0,0,0,0|1,0,0]=3 1103 B10R1.61 O=C1C(C(C)=O)=CC=CN1 AK-35911 [1,1,0,0,0,0|2,0,0]=4 1104 B10R1.61 O=C1C(C(C)=O)=CNC=C1 AK501394 [1,1,0,0,0,0|2,0,0]=4 1105 B10R1.61 OB(C1=CC=CC=C1N)O AK-35638 [1,1,0,0,0,0|1,0,1]=4 1106 B10R1.61 OC(=O)C1=CC=CN=C1Br AK-25846 [1,1,0,0,0,0|1,0,0]=3 1107 B10R1.61 OC(=O)C1=CC=NNC1=O AK-89567 [1,1,0,0,0,0|2,0,0]=4 1108 B10R1.61 OC1=CC=CC=C1C(N)=O AK-81394 [1,1,0,0,0,0|1,0,0]=3 1109 B10R1.61 OC1=CC=CC=C1C(O)=O AK397674 [1,1,0,0,0,0|0,0,0]=2 1110 B10R1.61 [O-]C1=CC=CC=C1[N+]([O-])=O AK135512 [1,1,0,0,0,0|1,0,1]=4 1111 B10R1.113 C(C)(=O)C1=CC(=CN=C1)Br AK-25899 [1,1,0,0,0,0|2,0,0]=4 1112 B10R1.113 C(C)(=O)C1=CC(=NC=C1)C AK-26955 [1,1,0,0,0,0|2,0,0]=4 1113 B10R1.113 C(C)(=O)C1=NC(=CC=C1)Br AK-30565 [1,1,0,0,0,0|2,0,0]=4 1114 B10R1.113 C1=C(C(C)=O)C=C(C=C1)O AK-46681 [1,1,0,0,0,0|1,0,0]=3 1115 B10R1.113 C1=C(C=C(N=C1)N)C(=O)O AK-25375 [1,1,0,0,0,0|1,0,0]=3 1116 B10R1.113 C1=C(C=CC=C1Br)B(O)O AK-23693 [1,1,0,0,0,0|1,0,1]=4 1117 B10R1.113 C1=C(C=CC=C1Cl)C(O)=O AK-43975 [1,1,0,0,0,0|0,0,0]=2 1118 B10R1.113 C1=C(C=CC=C1F)C(O)=O AK-53854 [1,1,0,0,0,0|0,0,0]=2 1119 B10R1.113 C1=C(C=NC=C1Br)C(N)=O AK-34529 [1,1,0,0,0,0|2,0,0]=4 1120 B10R1.113 C1=C(C=NC=C1C(O)=O)F AK-25931 [1,1,0,0,0,0|1,0,0]=3 1121 B10R1.113 C1=C(C=NC=C1C)C(O)=O AK-23837 [1,1,0,0,0,0|1,0,0]=3 1122 B10R1.113 C1=C(C=NC=C1Cl)C(O)=O AK-25160 [1,1,0,0,0,0|1,0,0]=3 1123 B10R1.113 C1=CC=C(F)N=C1C(=O)O AK-30385 [1,1,0,0,0,0|1,0,0]=3 1124 B10R1.113 C1=CC=C(N=C1C(O)=O)C AK-27736 [1,1,0,0,0,0|1,0,0]=3 1125 B10R1.113 C1=NC=C(C=C1C(=O)N)N AK-26169 [1,1,0,0,0,0|2,0,0]=4 1126 B10R1.113 C1=NC=C(Cl)N=C1C(=O)O AK-27777 [1,1,0,0,0,0|2,0,0]=4 1127 B10R1.113 C1=NC=C(N=C1C(=O)O)C AK-26120 [1,1,0,0,0,0|2,0,0]=4 1128 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AK-34279 [1,1,0,0,0,0|2,0,0]=4 1129 B10R1.113 CC(C1=CC(F)=CN=C1)=O AK101043 [1,1,0,0,0,0|2,0,0]=4 1130 B10R1.113 CC(C1=CC(N)=NC=C1)=O AK134215 [1,1,0,0,0,0|2,0,0]=4 1131 B10R1.113 CC(C1=CC=CC(Br)=C1)=O AK-44590 [1,1,0,0,0,0|1,0,0]=3 1132 B10R1.113 CC(C1=CC=CC(C)=C1)=O AK143347 [1,1,0,0,0,0|1,0,0]=3 1133 B10R1.113 CC(C1=NC(Cl)=CC=C1)=O AK-29671 [1,1,0,0,0,0|2,0,0]=4 1134 B10R1.113 CC(C1=NC(F)=CC=C1)=O AK-74181 [1,1,0,0,0,0|2,0,0]=4 1135 B10R1.113 CC(C1=NC=CC(C)=C1)=O AK-61872 [1,1,0,0,0,0|2,0,0]=4 1136 B10R1.113 CC(C1=NC=CC(Cl)=C1)=O AK-30041 [1,1,0,0,0,0|2,0,0]=4 1137 B10R1.113 CC1=CC(B(O)O)=CC=C1 AK-41078 [1,1,0,0,0,0|1,0,1]=4 1138 B10R1.113 CC1=CC=CC(=C1)C(N)=N AK-45199 [1,1,0,0,0,0|2,0,0]=4 1139 B10R1.113 CC1=CC=CC(C(C)=O)=N1 AK-30134 [1,1,0,0,0,0|2,0,0]=4 1140 B10R1.113 CC1=CC=NC(=C1)C(=O)O AK-30381 [1,1,0,0,0,0|1,0,0]=3 1141 B10R1.113 CC1=CC=NC(=N1)C(O)=O AK-36910 [1,1,0,0,0,0|2,0,0]=4 1142 B10R1.113 CC1=NC=CC(=N1)C(=O)O AK-23648 [1,1,0,0,0,0|2,0,0]=4 1143 B10R1.113 C[C@@H](O)C1=CC=CC(Cl)=C1 AK103057 [1,1,0,0,0,0|1,0,1]=4 1144 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 AK-58281 [1,1,0,0,0,0|1,0,1]=4 1145 B10R1.113 ClC1=CC=CC(=C1)B(O)O AK-47360 [1,1,0,0,0,0|1,0,1]=4 1146 B10R1.113 ClC1=NC=CC(=N1)C(=O)O AK-28365 [1,1,0,0,0,0|2,0,0]=4 1147 B10R1.113 FC1=CC(B(O)O)=CC=C1 AK-45904 [1,1,0,0,0,0|1,0,1]=4 1148 B10R1.113 IC1=CC=CC(=C1)B(O)O AK-45910 [1,1,0,0,0,0|1,0,1]=4 1149 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 AK-16801-7 [1,1,0,0,0,0|2,0,0]=4 1150 B10R1.113 NC1=CC(C(C)=O)=CC=C1 AK-83273 [1,1,0,0,0,0|1,0,0]=3 1151 B10R1.113 NC1=CC=NC(=C1)C(=O)O AK-72771 [1,1,0,0,0,0|1,0,0]=3 1152 B10R1.113 NC1=CN=CC(=C1)C(O)=O AK-34306 [1,1,0,0,0,0|1,0,0]=3 1153 B10R1.113 NC1=CN=CC(=N1)C(=O)O AK-30537 [1,1,0,0,0,0|2,0,0]=4 1154 B10R1.113 O=C(C1=CC(=O)N=CN1)O AK-24985 [1,1,0,0,0,0|2,0,0]=4 1155 B10R1.113 O=C(C1=CC=CC(Cl)=N1)O AK-26005 [1,1,0,0,0,0|1,0,0]=3 1156 B10R1.113 O=C(C1=CC=CC(N1)=O)O AK-25557 [1,1,0,0,0,0|1,0,0]=3 1157 B10R1.113 O=C(C1=NC(Br)=CN=C1)O AK158200 [1,1,0,0,0,0|2,0,0]=4 1158 B10R1.113 O=C(C1=NC(Br)=NC=C1)O AK145986 [1,1,0,0,0,0|2,0,0]=4 1159 B10R1.113 O=C(C1=NC(N)=NC=C1)O AK-65335 [1,1,0,0,0,0|2,0,0]=4 1160 B10R1.113 O=C(C1=NC=CC(Br)=C1)O AK-23753 [1,1,0,0,0,0|1,0,0]=3 1161 B10R1.113 O=C(C1=NC=NC(C)=C1)O AK114394 [1,1,0,0,0,0|2,0,0]=4 1162 B10R1.113 O=C(C1=NN=CC(Cl)=C1)O AK398901 [1,1,0,0,0,0|2,0,0]=4 1163 B10R1.113 O=C(C=1C=CNC(C1)=O)O AK-75663 [1,1,0,0,0,0|1,0,0]=3 1164 B10R1.113 O=C(C=1C=CNC(C1)=S)O AK161760 [1,1,0,0,0,0|1,0,0]=3 1165 B10R1.113 O=C(N)C1=CC=CC(Br)=C1 AK-61366 [1,1,0,0,0,0|1,0,0]=3 1166 B10R1.113 O=C(N)C1=NC=CC(N)=C1 AK103735 [1,1,0,0,0,0|2,0,0]=4 1167 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 AK-77039 [1,1,0,0,0,0|0,0,0]=2 1168 B10R1.113 O=C(O)C1=CC=CC(C)=C1 AK116994 [1,1,0,0,0,0|0,0,0]=2 1169 B10R1.113 O=C(O)C1=CC=CC(I)=C1 AK-40488 [1,1,0,0,0,0|0,0,0]=2 1170 B10R1.113 O=C(O)C1=CC=CC(N)=C1 AK-41177 [1,1,0,0,0,0|0,0,0]=2 1171 B10R1.113 O=C(O)C1=CC=CC(O)=C1 AK-50288 [1,1,0,0,0,0|0,0,0]=2 1172 B10R1.113 O=C(O)C1=CC=NC(Br)=C1 AK-26241 [1,1,0,0,0,0|1,0,0]=3 1173 B10R1.113 O=C(O)C1=CC=NC(C)=C1 AK-23516 [1,1,0,0,0,0|1,0,0]=3 1174 B10R1.113 O=C(O)C1=CC=NC(O)=C1 AK-27187 [1,1,0,0,0,0|1,0,0]=3 1175 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 AK-25583 [1,1,0,0,0,0|1,0,0]=3 1176 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AK-28811 [1,1,0,0,0,0|1,0,0]=3 1177 B10R1.113 O=C(O)C1=CN=CC(O)=C1 AK-25698 [1,1,0,0,0,0|1,0,0]=3 1178 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AK-23768 [1,1,0,0,0,0|1,0,0]=3 1179 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AK-30405 [1,1,0,0,0,0|1,0,0]=3 1180 B10R1.113 O=C1NC(=CC=N1)C(=O)O AK-30175 [1,1,0,0,0,0|2,0,0]=4 1181 B10R1.113 O=C1NN=CC(=C1)C(=O)O AK-26372 [1,1,0,0,0,0|2,0,0]=4 1182 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-27034 [1,1,0,0,0,0|1,0,1]=4 1183 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-43360 [1,1,0,0,0,0|1,0,1]=4 1184 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-44816 [1,1,0,0,0,0|1,0,1]=4 1185 B10R1.113 OB(C1=CC=CC(O)=C1)O AK-44803 [1,1,0,0,0,0|1,0,1]=4 1186 B10R1.113 OC(=O)C1=CC(Cl)=NC=C1 AK-26209 [1,1,0,0,0,0|1,0,0]=3 1187 B10R1.113 OC(=O)C1=CC(F)=NC=C1 AK-25930 [1,1,0,0,0,0|1,0,0]=3 1188 B10R1.113 OC(=O)C1=NC(Br)=CC=C1 AK-25597 [1,1,0,0,0,0|1,0,0]=3 1189 B10R1.113 OC(=O)C1=NC=NC(Cl)=C1 AK-29233 [1,1,0,0,0,0|2,0,0]=4 1190 B10R1.14 C1=C(C(OC)=O)N=C(S1)N AK-15127 [0,1,0,0,1,0|2,0,0]=4 1191 B10R1.14 C1=C(C(OC)=O)SC(=N1)N AK-23910 [0,1,0,0,1,0|2,0,0]=4 1192 B10R1.14 C1=C(SC=C1N)C(OC)=O AK-36782 [0,1,0,0,1,0|1,0,0]=3 1193 B10R1.14 COC(=O)C1=CC(=CO1)Br AK-39920 [0,1,0,0,1,0|2,0,0]=4 1194 B10R1.14 COC(=O)C1=CC(Br)=CN1 AK-23914 [0,1,0,0,1,0|2,0,0]=4 1195 B10R1.14 COC(=O)C1=CC(Br)=CS1 AK-55210 [0,1,0,0,1,0|2,0,0]=4 1196 B10R1.14 COC(=O)C1=CNC(Br)=C1 AK-63235 [0,1,0,0,1,0|2,0,0]=4 1197 B10R1.14 COC(=O)C1=COC(C)=C1 AK-28257 [0,1,0,0,1,0|2,0,0]=4 1198 B10R1.14 NC1=CC(=N[NH]1)C(=O)OC AK-35933 [0,1,0,0,1,0|2,0,0]=4 1199 B10R1.14 O=C(C1=CC=C(Br)N1)OC AK-47142 [0,1,0,0,1,0|2,0,0]=4 1200 B10R1.14 O=C(C1=CC=C(Br)O1)OC AK-43914 [0,1,0,0,1,0|2,0,0]=4 1201 B10R1.14 O=C(C1=CC=C(Br)S1)OC AK-40321 [0,1,0,0,1,0|2,0,0]=4 1202 B10R1.14 O=C(C1=CC=C(C)O1)OC AK124407 [0,1,0,0,1,0|2,0,0]=4 1203 B10R1.14 O=C(C1=CC=C(N)S1)OC AK-40138 [0,1,0,0,1,0|1,0,0]=3 1204 B10R1.14 O=C(C1=CSC(Br)=C1)OC AK138265 [0,1,0,0,1,0|2,0,0]=4 1205 B10R1.31 C1=C(OC(=C1)CO)C(=O)O AK-26213 [0,1,0,0,1,0|2,0,0]=4 1206 B10R1.31 CSC1=CC=C(S1)C(O)=O AK-34056 [0,1,0,0,1,0|2,0,0]=4 1207 B10R1.31 O=C(C1=CC(C#N)=CO1)O AK-42021 [0,1,0,0,1,0|1,0,1]=4 1208 B10R1.31 O=C(C1=CC=C(C=O)O1)O AK-58389 [0,1,0,0,1,0|2,0,0]=4 1209 B10R1.31 O=C(C1=CC=C(C=O)S1)O AK-35246 [0,1,0,0,1,0|2,0,0]=4 1210 B10R1.31 OC(=O)C1=CC=C(O1)C#N AK-40423 [0,1,0,0,1,0|1,0,1]=4 1211 B10R1.58 O=C(C1=CC(Br)=C(Cl)S1)O AK127057 [0,1,0,0,1,0|2,0,0]=4 1212 B10R1.58 O=C(C1=CC(Cl)=C(Br)S1)O AK127116 [0,1,0,0,1,0|2,0,0]=4 1213 B10R1.58 O=C(C1=CC(Cl)=C(Cl)S1)O AK-76939 [0,1,0,0,1,0|2,0,0]=4 1214 B10R1.58 O=C(C1=CC(N)=C(Br)S1)O AK-30179 [0,1,0,0,1,0|1,0,0]=3 1215 B10R1.58 OC(=O)C1=CC(Br)=C(Br)S1 AK-82334 [0,1,0,0,1,0|2,0,0]=4 1216 B10R1.59 O=C(C1=C(Br)C=C(Cl)S1)O AK156001 [0,1,0,0,1,0|2,0,0]=4 1217 B10R1.59 O=C(C1=C(Br)SC(Br)=C1)O AK-64336 [0,1,0,0,1,0|2,0,0]=4 1218 B10R1.59 O=C(C1=C(C)SC(N)=N1)O AK-50040 [0,1,0,0,1,0|2,0,0]=4 1219 B10R1.59 O=C(C1=C(Cl)SC(Cl)=C1)O AK-34842 [0,1,0,0,1,0|2,0,0]=4 1220 B10R1.59 O=C(C1=CC(Br)=CN1C)O AK101071 [0,1,0,0,1,0|2,0,0]=4 1221 B10R1.194 O=C(C1=C(C)C(C)=CS1)O AK-36791 [0,1,0,0,1,0|2,0,0]=4 1222 B10R1.194 O=C(C1=C(C)N(C)C=C1)O AK164868 [0,1,0,0,1,0|2,0,0]=4 1223 B10R1.194 O=C(C1=CC=C(Br)N1C)O AK-36608 [0,1,0,0,1,0|2,0,0]=4 1224 B10R1.194 O=C(C1=CSC(C)=C1N)O AK161687 [0,1,0,0,1,0|2,0,0]=4 1225 B12R1.4 C1=C(CC(C)=O)C=CC(=C1)OC AK-43869 [0,1,0,0,0,1|2,0,0]=4 1226 B12R1.4 C1=CC(=CC=C1OC)CC(O)=O AK-47564 [0,1,0,0,0,1|1,0,0]=3 1227 B12R1.4 CC(NC1=CC=C(C#N)C=C1)=O AK-80147 [0,1,0,0,0,1|1,0,1]=4 1228 B12R1.4 CC(NC1=CC=C(C=O)C=C1)=O AK-46288 [0,1,0,0,0,1|2,0,0]=4 1229 B12R1.4 CC(NC1=CC=C(CN)C=C1)=O AK144131 [0,1,0,0,0,1|1,0,0]=3 1230 B12R1.4 CC(OC1=CC=C(CBr)C=C1)=O AK146329 [0,1,0,0,0,1|2,0,0]=4 1231 B12R1.4 O=C(O)CC1=CC=C(C#N)C=C1 AK-59632 [0,1,0,0,0,1|0,0,1]=3 1232 B12R1.4 O=C(O)CC1=CC=C(CN)C=C1 AK-93749 [0,1,0,0,0,1|0,0,0]=2 1233 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 AK135016 [0,1,0,0,0,1|1,0,0]=3 1234 B12R1.4 O=C(O)CC1=CC=C(SC)C=C1 AK-45539 [0,1,0,0,0,1|1,0,0]=3 1235 B12R1.19 BrC1=C(C=C(C=C1)CC(=O)O)F AK-36941 [0,1,0,0,0,1|1,0,0]=3 1236 B12R1.19 BrC1=C(C=CC(=C1)CC(=O)O)F AK-33922 [0,1,0,0,0,1|1,0,0]=3 1237 B12R1.19 C1=C(C=CC(=C1Cl)Cl)CC(O)=O AK-47326 [0,1,0,0,0,1|1,0,0]=3 1238 B12R1.19 C1=C(C=CC(=C1Cl)Cl)NC(N)=O AK-32560 [0,1,0,0,0,1|2,0,0]=4 1239 B12R1.19 C1=C(C=CC(=C1Cl)O)NC(C)=O AK-39312 [0,1,0,0,0,1|2,0,0]=4 1240 B12R1.19 CC(NC1=CC=C(O)C(C)=C1)=O AK147875 [0,1,0,0,0,1|2,0,0]=4 1241 B12R1.19 CC1=C(F)C=C(CC(O)=O)C=C1 AK-34427 [0,1,0,0,0,1|1,0,0]=3 1242 B12R1.19 NC1=C(F)C=C(CC(O)=O)C=C1 AK-35348 [0,1,0,0,0,1|0,0,0]=2 1243 B12R1.19 O=C(O)CC1=CC=C(Br)C(C)=C1 AK-94397 [0,1,0,0,0,1|1,0,0]=3 1244 B12R1.19 O=C(O)CC1=CC=C(Cl)C(Br)=C1 AK119698 [0,1,0,0,0,1|1,0,0]=3 1245 B12R1.19 O=C(O)CC1=CC=C(Cl)C(F)=C1 AK-39619 [0,1,0,0,0,1|1,0,0]=3 1246 B12R1.19 O=C(O)CC1=CC=C(N)C(C)=C1 AK151433 [0,1,0,0,0,1|0,0,0]=2 1247 B12R1.19 O=C(O)CC1=CC=C(O)C(F)=C1 AK-35250 [0,1,0,0,0,1|1,0,0]=3 1248 B12R1.19 O=C(O)CC1=CC=C(O)C(O)=C1 AK-45471 [0,1,0,0,0,1|1,0,0]=3 1249 B12R1.19 OC(=O)CC1=CC(Br)=C(O)C=C1 AK-34961 [0,1,0,0,0,1|1,0,0]=3 1250 B12R1.19 OC(=O)CC1=CC(F)=C(F)C=C1 AK-41956 [0,1,0,0,0,1|1,0,0]=3 1251 B12R1.20 CC(C1=CC=C(C)C=C1)C(O)=O AK-36931 [0,1,0,0,0,1|1,0,0]=3 1252 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br AK-36176 [0,1,0,0,0,1|1,0,0]=3 1253 B12R1.20 NC(C(O)=O)C1=CC=C(O)C=C1 AK-44146 [0,1,0,0,0,1|1,0,0]=3 1254 B12R1.20 O=C(O)C(N)C1=CC=C(C)C=C1 AK-44517 [0,1,0,0,0,1|1,0,0]=3 1255 B12R1.20 O=C(O)C(N)C1=CC=C(Cl)C=C1 AK-47447 [0,1,0,0,0,1|1,0,0]=3 1256 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 AK-88708 [0,1,0,0,0,1|1,0,0]=3 1257 B12R1.20 O=C(O)[C@@H](N)C1=CC=C(Cl)C=C1 AK-45149 [0,1,0,0,0,1|1,0,0]=3 1258 B12R1.20 O=C(O)[C@@H](N)C1=CC=C(F)C=C1 AK-33958 [0,1,0,0,0,1|1,0,0]=3 1259 B12R1.20 O=C(O)[C@@H](N)C1=CC=C(O)C=C1 AK-28583 [0,1,0,0,0,1|1,0,0]=3 1260 B12R1.20 O=C(O)[C@H](C1=CC=C(Cl)C=C1)O AK-87117 [0,1,0,0,0,1|1,0,0]=3 1261 B12R1.20 O=C(O)[C@H](N)C1=CC=C(Cl)C=C1 AK-44673 [0,1,0,0,0,1|1,0,0]=3 1262 B12R1.20 O=C(O)[C@H](N)C1=CC=C(F)C=C1 AK-45454 [0,1,0,0,0,1|1,0,0]=3 1263 B12R1.20 O=C(O)[C@H](N)C1=CC=C(F)C=C1 AK-50779 [0,1,0,0,0,1|1,0,0]=3 1264 B12R1.20 O=C(O)[C@H](N)C1=CC=C(N)C=C1 AK484894 [0,1,0,0,0,1|0,0,0]=2 1265 B12R1.20 O=C(O)[C@H](N)C1=CC=C(O)C=C1 AK-76523 [0,1,0,0,0,1|1,0,0]=3 1266 B12R1.20 OC(C([O-])=O)C1=CC=C(O)C=C1 AK104635 [0,1,0,0,0,1|1,0,1]=4 1267 B12R1.49 C1=C(CC(OC)=O)C=CC(=C1)Br AK-25954 [0,1,0,0,0,1|1,0,0]=3 1268 B12R1.49 C1=C(CC(OC)=O)C=CC(=C1)O AK-46608 [0,1,0,0,0,1|1,0,0]=3 1269 B12R1.49 O=C(OC)CC1=CC=C(Cl)C=C1 AK-46979 [0,1,0,0,0,1|1,0,0]=3 1270 B12R1.49 O=C(OC)CC1=CC=C(Cl)N=C1 AK137274 [0,1,0,0,0,1|2,0,0]=4 1271 B12R1.49 O=C(OC)CC1=CC=C(F)C=C1 AK117500 [0,1,0,0,0,1|1,0,0]=3 1272 B12R1.49 O=C(OC)CC1=NC=C(Br)C=C1 AK144847 [0,1,0,0,0,1|2,0,0]=4 1273 B12R1.233 BrC1=C(C=CC(=C1)F)CC(=O)O AK-35843 [0,1,0,0,0,1|1,0,0]=3 1274 B12R1.233 C1=C(C(=CC=C1Cl)CC(O)=O)Cl AK-46751 [0,1,0,0,0,1|1,0,0]=3 1275 B12R1.233 CC(=O)CC1=C(Br)C=C(Cl)C=C1 AK101124 [0,1,0,0,0,1|2,0,0]=4 1276 B12R1.233 CC(NC1=CC=C(Br)C=C1Cl)=O AK499528 [0,1,0,0,0,1|2,0,0]=4 1277 B12R1.233 CC1=CC(F)=C(CC(O)=O)C=C1 AK-35440 [0,1,0,0,0,1|1,0,0]=3 1278 B12R1.233 FC1=C(C=CC(=C1)O)CC(=O)O AK-36113 [0,1,0,0,0,1|1,0,0]=3 1279 B12R1.233 NC1=CC(=CN=C1CC(=O)O)Br AK-26406 [0,1,0,0,0,1|2,0,0]=4 1280 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1Cl AK-94393 [0,1,0,0,0,1|1,0,0]=3 1281 B12R1.233 O=C(O)CC1=CC=C(Br)C=C1F AK-29792 [0,1,0,0,0,1|1,0,0]=3 1282 B12R1.233 O=C(O)CC1=CC=C(Cl)C=C1Br AK-35501 [0,1,0,0,0,1|1,0,0]=3 1283 B12R1.233 O=C(O)CC1=CC=C(F)C=C1C AK-37488 [0,1,0,0,0,1|1,0,0]=3 1284 B12R1.233 O=C(O)CC1=CC=C(F)C=C1Cl AK-33766 [0,1,0,0,0,1|1,0,0]=3 1285 B12R1.233 OC(=O)CC1=C(F)C=C(Cl)C=C1 AK-46377 [0,1,0,0,0,1|1,0,0]=3 1286 B12R1.5 C(=O)C1=NC=C(C(=O)OC)C=C1 AK-30222 [0,2,0,0,0,0|2,0,0]=4 1287 B12R1.5 C(C)C1=CC=C(C=C1)C(=O)C=O AK-10028 [0,2,0,0,0,0|1,0,1]=4 1288 B12R1.5 C1=C(C(OC)=O)C=CC(=C1)C=O AK-30551 [0,2,0,0,0,0|1,0,0]=3 1289 B12R1.5 C1=CC(=CC=C1C(OC)=O)C#N AK-46102 [0,2,0,0,0,0|0,0,1]=3 1290 B12R1.5 C1=CC(=CC=C1OC)C(OC)=O AK-46595 [0,2,0,0,0,0|1,0,0]=3 1291 B12R1.5 CCC(C1=CC=C(CC)C=C1)=O AK-94191 [0,2,0,0,0,0|2,0,0]=4 1292 B12R1.5 CCC1=CC=C(C=C1)C(=O)CBr AK110622 [0,2,0,0,0,0|2,0,0]=4 1293 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 AK-46926 [0,2,0,0,0,0|1,0,0]=3 1294 B12R1.5 COC(=O)C1=CN=C(CBr)C=C1 AK-49350 [0,2,0,0,0,0|2,0,0]=4 1295 B12R1.5 COC(C1=CN=C(C=C1)CO)=O AK-23866 [0,2,0,0,0,0|2,0,0]=4 1296 B12R1.5 COC1=CC=C(C(CBr)=O)C=C1 AK114282 [0,2,0,0,0,0|2,0,0]=4 1297 B12R1.5 O=C(NC)C1=CC=C(OC)C=C1 AK120611 [0,2,0,0,0,0|2,0,0]=4 1298 B12R1.5 O=C(NN)C1=CC=C(C#N)C=C1 AK-92904 [0,2,0,0,0,0|1,0,1]=4 1299 B12R1.5 O=C(OC)C1=CC=C(C#C)C=C1 AK-88481 [0,2,0,0,0,0|1,0,0]=3 1300 B12R1.5 O=C(OC)C1=CC=C(CN)C=C1 AK-46915 [0,2,0,0,0,0|0,0,0]=2 1301 B12R1.5 O=C(OC)C1=CC=C(NN)C=C1 AK165897 [0,2,0,0,0,0|0,0,0]=2 1302 B12R1.5 O=C(OC)C1=CN=C(C#C)C=C1 AK151766 [0,2,0,0,0,0|2,0,0]=4 1303 B12R1.5 O=C(OC)C1=CN=C(OC)C=C1 AK-29959 [0,2,0,0,0,0|2,0,0]=4 1304 B12R1.5 O=C(OC)C1=NC=C(CBr)C=C1 AK153186 [0,2,0,0,0,0|2,0,0]=4 1305 B12R1.6 C1=C(C=CC(=C1)CN)[S](=O)(=O)N AK-22175 [0,2,0,0,0,0|1,0,1]=4 1306 B12R1.6 CNC1=CC=C(C=C1)[S](=O)(=O)C AK-39565 [0,2,0,0,0,0|1,0,1]=4 1307 B12R1.6 CS(=O)(=O)C1=CC=C(CN)C=C1 AK-50284 [0,2,0,0,0,0|1,0,1]=4 1308 B12R1.6 NNC1=CC=C(S(=O)(C)=O)C=C1 AK-75913 [0,2,0,0,0,0|1,0,1]=4 1309 B12R1.6 O=S(C1=CC=C(CN)C=C1)(N)=O AK-32299 [0,2,0,0,0,0|1,0,1]=4 1310 B12R1.6 O=S(C1=CC=C(CN)C=C1)(N)=O AK-33093 [0,2,0,0,0,0|1,0,1]=4 1311 B12R1.6 O=S(C1=CC=C(NN)C=C1)(N)=O AK-86218 [0,2,0,0,0,0|1,0,1]=4 1312 B12R1.48 C(#N)C1=C(C=C(C(=O)O)C=C1)C AK-54802 [0,2,0,0,0,0|0,0,1]=3 1313 B12R1.48 C(#N)C1=C(C=C(C(=O)O)C=C1)F AK-33745 [0,2,0,0,0,0|0,0,1]=3 1314 B12R1.48 C1=C(C(=CC=C1C(C)=O)OC)O AK-50384 [0,2,0,0,0,0|2,0,0]=4 1315 B12R1.48 CC(C1=CC=C(OC)C(Br)=C1)=O AK-24248 [0,2,0,0,0,0|2,0,0]=4 1316 B12R1.48 CC(C1=CC=C(OC)C(C)=C1)=O AK-68223 [0,2,0,0,0,0|2,0,0]=4 1317 B12R1.48 COC1=C(Cl)C=C(C=C1)C(O)=O AK-79135 [0,2,0,0,0,0|1,0,0]=3 1318 B12R1.48 FC1=CC(B(O)O)=CC=C1CN AK-84741 [0,2,0,0,0,0|1,0,1]=4 1319 B12R1.48 NC1=CC([N+]([O-])=O)=CC=C1NC AK-35111 [0,2,0,0,0,0|1,0,1]=4 1320 B12R1.48 NCC1=C(F)C=C(C=C1)[N+]([O-])=O AK-76783 [0,2,0,0,0,0|1,0,1]=4 1321 B12R1.48 O=C(N)C1=CC=C(OC)C(N)=C1 AK-63939 [0,2,0,0,0,0|2,0,0]=4 1322 B12R1.48 O=C(O)C1=CC=C(C#N)C(Cl)=C1 AK608481 [0,2,0,0,0,0|0,0,1]=3 1323 B12R1.48 O=C(O)C1=CC=C(C#N)C(N)=C1 AK200894 [0,2,0,0,0,0|0,0,1]=3 1324 B12R1.48 O=C(O)C1=CC=C(C=O)C(O)=C1 AK-30254 [0,2,0,0,0,0|1,0,0]=3 1325 B12R1.48 O=C(O)C1=CC=C(CC)C(Br)=C1 AK-93351 [0,2,0,0,0,0|1,0,0]=3 1326 B12R1.48 O=C(O)C1=CC=C(CC)C(N)=C1 AK-35408 [0,2,0,0,0,0|1,0,0]=3 1327 B12R1.48 O=C(O)C1=CC=C(NC)C(N)=C1 AK-36039 [0,2,0,0,0,0|0,0,0]=2 1328 B12R1.48 O=C(O)C1=CC=C(OC)C(C)=C1 AK-32602 [0,2,0,0,0,0|1,0,0]=3 1329 B12R1.48 O=C(O)C1=CC=C(OC)C(O)=C1 AK-72971 [0,2,0,0,0,0|1,0,0]=3 1330 B12R1.48 O=C(O)C1=CN=C(OC)C(Br)=C1 AK151001 [0,2,0,0,0,0|2,0,0]=4 1331 B12R1.48 O=C(O)C1=CN=C(OC)C(F)=C1 AK100002 [0,2,0,0,0,0|2,0,0]=4 1332 B12R1.48 O=C(O)C1=NC(Cl)=C(C#N)C=C1 AK127173 [0,2,0,0,0,0|1,0,1]=4 1333 B12R1.48 O=[N+](C1=CC=C(C(C)=C1)NC)[O-] AK136012 [0,2,0,0,0,0|1,0,1]=4 1334 B12R1.48 OC(=O)C1=CC(Br)=C(C=O)C=C1 AK100358 [0,2,0,0,0,0|1,0,0]=3 1335 B12R1.113 NCCC1=CC=C(C=C1)[N+]([O-])=O AK-77041 [0,2,0,0,0,0|1,0,1]=4 1336 B12R1.113 NCCC1=CC=C([N+]([O-])=O)C=C1 AK-50720 [0,2,0,0,0,0|1,0,1]=4 1337 B12R1.113 NOCC1=CC=C([N+]([O-])=O)C=C1 AK124241 [0,2,0,0,0,0|1,0,1]=4 1338 B12R1.113 O=C(O)C1=CC=C(CCBr)C=C1 AK-77033 [0,2,0,0,0,0|1,0,0]=3 1339 B12R1.113 O=C(O)C1=CC=C(CCC)C=C1 AK116594 [0,2,0,0,0,0|1,0,0]=3 1340 B12R1.113 O=C(O)C1=CC=C(OCC)C=C1 AK112939 [0,2,0,0,0,0|1,0,0]=3 1341 B12R1.113 O=C(O)C1=NC=C(OCC)C=C1 AK-66857 [0,2,0,0,0,0|2,0,0]=4 1342 B12R1.113 O=[N+](C1=CC=C(CNC)C=C1)[O-] AK684577 [0,2,0,0,0,0|1,0,1]=4 1343 B12R1.113 OC(=O)C1=CC=C(CC#N)C=C1 AK-43276 [0,2,0,0,0,0|0,0,1]=3 1344 B12R1.256 C1=C(C(C)=O)C=CC(=C1)C(O)=O AK-45767 [0,2,0,0,0,0|1,0,0]=3 1345 B12R1.256 C1=C(C=CC(=C1)B(O)O)C(=O)N AK-47634 [0,2,0,0,0,0|1,0,1]=4 1346 B12R1.256 C1=CC(=CC=C1B(O)O)C(=O)O AK-45039 [0,2,0,0,0,0|1,0,0]=3 1347 B12R1.256 C1=CC(=CC=C1C(C)C)C(O)=O AK-47310 [0,2,0,0,0,0|1,0,0]=3 1348 B12R1.256 C1=CC(=NC=C1C(O)=O)[N+]([O-])=O AK-24485 [0,2,0,0,0,0|1,0,1]=4 1349 B12R1.256 CC(C1=CC=C(N(C)C)C=C1)=O AK136066 [0,2,0,0,0,0|1,0,0]=3 1350 B12R1.256 CC(C1=CC=C([N+]([O-])=O)C=C1)=O AK-46491 [0,2,0,0,0,0|1,0,1]=4 1351 B12R1.256 CN(C)C1=CC=C(C=C1)B(O)O AK-25708 [0,2,0,0,0,0|1,0,1]=4 1352 B12R1.256 C[C@H](N)C1=CC=C([N+]([O-])=O)C=C1 AK-57955 [0,2,0,0,0,0|1,0,1]=4 1353 B12R1.256 N[C@H](C)C1=CC=C([N+]([O-])=O)C=C1 AK-35692 [0,2,0,0,0,0|1,0,1]=4 1354 B12R1.256 O=C(N)C1=CC=C(C(N)=N)C=C1 AK-51220 [0,2,0,0,0,0|1,0,0]=3 1355 B12R1.256 O=C(N)C1=CC=C(C(O)C)C=C1 AK149703 [0,2,0,0,0,0|1,0,1]=4 1356 B12R1.256 O=C(N)C1=CC=C(N(C)C)C=C1 AK-64565 [0,2,0,0,0,0|1,0,0]=3 1357 B12R1.256 O=C(O)C1=CC=C(C(N)=N)C=C1 AK139166 [0,2,0,0,0,0|0,0,0]=2 1358 B12R1.256 O=C(O)C1=CC=C(C(O)C)C=C1 AK140628 [0,2,0,0,0,0|1,0,0]=3 1359 B12R1.256 O=C(O)C1=CC=C(N(C)C)C=C1 AK-41190 [0,2,0,0,0,0|0,0,0]=2 1360 B12R1.256 O=C(O)C1=CC=C([C@@H](N)C)C=C1 AK154798 [0,2,0,0,0,0|0,0,0]=2 1361 B12R1.256 O=C(O)C1=CC=C([C@@H](N)C)C=C1 AK157590 [0,2,0,0,0,0|0,0,0]=2 1362 B12R1.256 O=C(O)C1=CC=C([C@H](N)C)C=C1 AK155202 [0,2,0,0,0,0|0,0,0]=2 1363 B12R1.256 O=C(O)C1=CC=C([N+]([O-])=O)C=C1 AK-77655 [0,2,0,0,0,0|0,0,1]=3 1364 B12R1.256 OB(C1=CC=C(C(C)=O)C=C1)O AK-45484 [0,2,0,0,0,0|2,0,0]=4 1365 B12R1.256 OC(=O)C1=CN=C(C=C1)C(O)=O AK-41175 [0,2,0,0,0,0|2,0,0]=4 1366 B12R1.256 [N+](=O)([O-])C1=CN=C(C=C1)C(=O)O AK-23840 [0,2,0,0,0,0|1,0,1]=4 1367 B12R1.452 C1=CC(=CC(=C1C(C)=O)F)OC AK-36270 [0,2,0,0,0,0|2,0,0]=4 1368 B12R1.452 C1=CC(=CC(=C1C(O)=O)N)OC AK-25965 [0,2,0,0,0,0|1,0,0]=3 1369 B12R1.452 CC(C1=CC=C(OC)C=C1O)=O AK-79421 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.452 COC1=CC(=C(C=C1)C(=O)O)Cl AK-34147 [0,2,0,0,0,0|1,0,0]=3 1371 B12R1.452 COC1=CC(O)=C(C=C1)C(O)=O AK-34197 [0,2,0,0,0,0|1,0,0]=3 1372 B12R1.452 COC1=CC(O)=C(C=C1)C([O-])=O AK103858 [0,2,0,0,0,0|1,0,1]=4 1373 B12R1.452 O=C(O)C1=CC=C(C#N)C=C1Br AK152705 [0,2,0,0,0,0|0,0,1]=3 1374 B12R1.452 O=C(O)C1=CC=C(C#N)C=C1Cl AK150302 [0,2,0,0,0,0|0,0,1]=3 1375 B12R1.452 O=C(O)C1=CC=C(C#N)C=C1F AK-33580 [0,2,0,0,0,0|0,0,1]=3 1376 B12R1.452 O=C(O)C1=CC=C(C#N)C=C1I AK-89899 [0,2,0,0,0,0|0,0,1]=3 1377 B12R1.452 O=C(O)C1=CC=C(NN)C=C1Cl AK172625 [0,2,0,0,0,0|0,0,0]=2 1378 B12R1.452 O=C(O)C1=CC=C(OC)C=C1Br AK-86973 [0,2,0,0,0,0|1,0,0]=3 1379 B12R1.452 O=C(O)C1=CC=C(OC)C=C1C AK-51514 [0,2,0,0,0,0|1,0,0]=3 1380 B12R1.9 CC1=CC=C(S(=O)(OC)=O)C=C1 AK-48103 [0,2,0,0,0,0|2,0,0]=4 1381 B12R1.9 NC1=CC=C(C=C1)C(CO)(C)C AK-30925 [0,2,0,0,0,0|1,0,1]=4 1382 B12R1.23 C1=CC(=CC(=C1N)C)[S](N)(=O)=O AK-16617 [0,2,0,0,0,0|1,0,1]=4 1383 B12R1.23 FC1=C(N)C=CC(=C1)[S](=O)(=O)C AK-36497 [0,2,0,0,0,0|1,0,1]=4 1384 B12R1.23 NC1=CC=C(S(=O)(N)=O)C=C1Cl AK-45683 [0,2,0,0,0,0|1,0,1]=4 1385 B12R1.23 O=S(C1=CC=C(N)C(N)=C1)(O)=O AK-50087 [0,2,0,0,0,0|1,0,0]=3 1386 B12R1.56 BrC1=C(C=C(C(=O)O)C=C1)OC AK-35652 [0,2,0,0,0,0|1,0,0]=3 1387 B12R1.56 C1=C(C(=CC=C1C(O)=O)N)OC AK-24762 [0,2,0,0,0,0|0,0,0]=2 1388 B12R1.56 C1=C(OC)C(=CC=C1C(O)=O)O AK-32998 [0,2,0,0,0,0|1,0,0]=3 1389 B12R1.56 CC(C1=CC=C(Br)C(OC)=C1)=O AK144652 [0,2,0,0,0,0|2,0,0]=4 1390 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)F AK-36487 [0,2,0,0,0,0|1,0,0]=3 1391 B12R1.56 N#CC1=CC(C(C)=O)=CC=C1Br AK141319 [0,2,0,0,0,0|2,0,0]=4 1392 B12R1.56 N#CC1=CC(C(C)=O)=CC=C1F AK-94339 [0,2,0,0,0,0|2,0,0]=4 1393 B12R1.56 NC1=CC=C(C=C1C#N)N(=O)=O AK-44961 [0,2,0,0,0,0|1,0,1]=4 1394 B12R1.56 O=C(O)C1=CC=C(Br)C(CO)=C1 AK-93326 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.56 O=C(O)C1=CC=C(C)C(OC)=C1 AK-36196 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.56 O=C(O)C1=CC=C(Cl)C(OC)=C1 AK-36584 [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.56 O=C(O)C1=CC=C(F)C(C=O)=C1 AK-32005 [0,2,0,0,0,0|1,0,0]=3 1398 B12R1.56 O=C(O)C1=CC=C(N)C(C#N)=C1 AK141776 [0,2,0,0,0,0|0,0,0]=2 1399 B12R1.56 O=C(O)C1=CC=C(N)C(CC)=C1 AK-92304 [0,2,0,0,0,0|0,0,0]=2 1400 B12R1.56 O=C(O)C1=CC=C(N)C(CO)=C1 AK503090 [0,2,0,0,0,0|0,0,0]=2 1401 B12R1.56 O=C(O)C1=CC=C(O)C(C=O)=C1 AK-82772 [0,2,0,0,0,0|1,0,0]=3 1402 B12R1.56 O=C(O)C1=NC(OC)=C(Br)C=C1 AK100452 [0,2,0,0,0,0|2,0,0]=4 1403 B12R1.56 O=C(O)C1=NC(OC)=C(Cl)C=C1 AK-76603 [0,2,0,0,0,0|2,0,0]=4 1404 B12R1.56 OC(=O)C1=CC(C#N)=C(O)C=C1 AK-32532 [0,2,0,0,0,0|1,0,0]=3 1405 B12R1.232 BrC1=CC(=C(C=C1F)F)C(C)=O AK-50185 [0,2,0,0,0,0|2,0,0]=4 1406 B12R1.232 CC(C1=CC(Cl)=C(Cl)C=C1Cl)=O AK155537 [0,2,0,0,0,0|2,0,0]=4 1407 B12R1.232 CC(C1=CC(F)=C(Br)C=C1O)=O AK252572 [0,2,0,0,0,0|2,0,0]=4 1408 B12R1.232 CC(C1=CC(F)=C(Cl)C=C1Cl)=O AK160309 [0,2,0,0,0,0|2,0,0]=4 1409 B12R1.232 CC(C1=CC(O)=C(O)C=C1O)=O AK153502 [0,2,0,0,0,0|2,0,0]=4 1410 B12R1.232 CC1=C(N)C=C(Cl)C(=C1)[N+]([O-])=O AK-27776 [0,2,0,0,0,0|1,0,1]=4 1411 B12R1.232 CC1=CC(Br)=C(C=C1N)C(O)=O AK-80930 [0,2,0,0,0,0|1,0,0]=3 1412 B12R1.232 ClC1=CC(=C(C(=O)O)C=C1Cl)F AK-29091 [0,2,0,0,0,0|1,0,0]=3 1413 B12R1.232 ClC1=CC(=C(C=C1F)F)C(=O)O AK-25349 [0,2,0,0,0,0|1,0,0]=3 1414 B12R1.232 FC1=C(C(=O)O)C=C(C(=C1)F)C AK-34879 [0,2,0,0,0,0|1,0,0]=3 1415 B12R1.232 NC1=C(C(=O)O)C=C(C(=C1)Br)Cl AK-33403 [0,2,0,0,0,0|1,0,0]=3 1416 B12R1.232 NC1=C(C(=O)O)C=C(C(=C1)F)F AK-47218 [0,2,0,0,0,0|1,0,0]=3 1417 B12R1.232 NC1=C(N)C=C(C(F)=C1)[N+]([O-])=O AK-74258 [0,2,0,0,0,0|1,0,1]=4 1418 B12R1.232 NC1=CC(F)=C([N+]([O-])=O)C=C1Br AK128101 [0,2,0,0,0,0|1,0,1]=4 1419 B12R1.232 NC1=CC([N+]([O-])=O)=C(C)C=C1N AK-74263 [0,2,0,0,0,0|1,0,1]=4 1420 B12R1.232 O=C(C1=CC(F)=C(Cl)N=C1Cl)O AK-36478 [0,2,0,0,0,0|2,0,0]=4 1421 B12R1.232 O=C(O)C1=C(Br)N=C(Br)C(Cl)=C1 AK126935 [0,2,0,0,0,0|2,0,0]=4 1422 B12R1.232 O=C(O)C1=C(Cl)N=C(C)C(Br)=C1 AK482401 [0,2,0,0,0,0|2,0,0]=4 1423 B12R1.232 O=C(O)C1=CC(Br)=C(Br)C=C1N AK-36295 [0,2,0,0,0,0|1,0,0]=3 1424 B12R1.232 O=C(O)C1=CC(Br)=C(Cl)C=C1F AK-34535 [0,2,0,0,0,0|1,0,0]=3 1425 B12R1.232 O=C(O)C1=CC(Br)=C(F)C=C1F AK105135 [0,2,0,0,0,0|1,0,0]=3 1426 B12R1.232 O=C(O)C1=CC(C)=C(Br)C=C1F AK-25951 [0,2,0,0,0,0|1,0,0]=3 1427 B12R1.232 O=C(O)C1=CC(C)=C(C)C=C1C AK-81413 [0,2,0,0,0,0|1,0,0]=3 1428 B12R1.232 O=C(O)C1=CC(C)=C(C)C=C1N AK142825 [0,2,0,0,0,0|1,0,0]=3 1429 B12R1.232 O=C(O)C1=CC(C)=C(F)C=C1Br AK-37286 [0,2,0,0,0,0|1,0,0]=3 1430 B12R1.232 O=C(O)C1=CC(C)=C(N)C=C1C AK167268 [0,2,0,0,0,0|0,0,0]=2 1431 B12R1.232 O=C(O)C1=CC(Cl)=C(Br)C=C1Cl AK-80102 [0,2,0,0,0,0|1,0,0]=3 1432 B12R1.232 O=C(O)C1=CC(Cl)=C(Br)C=C1F AK144854 [0,2,0,0,0,0|1,0,0]=3 1433 B12R1.232 O=C(O)C1=CC(Cl)=C(Cl)C=C1C AK194313 [0,2,0,0,0,0|1,0,0]=3 1434 B12R1.232 O=C(O)C1=CC(Cl)=C(Cl)C=C1Cl AK-94169 [0,2,0,0,0,0|1,0,0]=3 1435 B12R1.232 O=C(O)C1=CC(Cl)=C(Cl)C=C1N AK-76661 [0,2,0,0,0,0|1,0,0]=3 1436 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1C AK126066 [0,2,0,0,0,0|1,0,0]=3 1437 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1Cl AK-53856 [0,2,0,0,0,0|1,0,0]=3 1438 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1F AK-64859 [0,2,0,0,0,0|1,0,0]=3 1439 B12R1.232 O=C(O)C1=CC(F)=C(Br)C=C1N AK341393 [0,2,0,0,0,0|1,0,0]=3 1440 B12R1.232 O=C(O)C1=CC(F)=C(C)C=C1F AK-32713 [0,2,0,0,0,0|1,0,0]=3 1441 B12R1.232 O=C(O)C1=CC(F)=C(Cl)C=C1N AK-64743 [0,2,0,0,0,0|1,0,0]=3 1442 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1Br AK-35982 [0,2,0,0,0,0|1,0,0]=3 1443 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1Cl AK-25292 [0,2,0,0,0,0|1,0,0]=3 1444 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1F AK-27025 [0,2,0,0,0,0|1,0,0]=3 1445 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1I AK-57307 [0,2,0,0,0,0|1,0,0]=3 1446 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1O AK243242 [0,2,0,0,0,0|1,0,0]=3 1447 B12R1.232 O=C(O)C1=CC(I)=C(F)C=C1Cl AK137717 [0,2,0,0,0,0|1,0,0]=3 1448 B12R1.232 O=C(O)C1=NC(Cl)=C(Cl)C=C1Cl AK-31174 [0,2,0,0,0,0|2,0,0]=4 1449 B12R1.232 OC(=O)C1=C(F)C=C(F)C(I)=C1 AK-87448 [0,2,0,0,0,0|1,0,0]=3 1450 B12R1.232 OC(=O)C1=CC(Cl)=C(Cl)N=C1Cl AK-80695 [0,2,0,0,0,0|2,0,0]=4 1451 B12R1.367 BrC1=C(C=C(C(=O)OC)C=C1)O AK-46937 [0,2,0,0,0,0|1,0,0]=3 1452 B12R1.367 C1=C(C(=CC=C1C(OC)=O)C)N AK-47538 [0,2,0,0,0,0|1,0,0]=3 1453 B12R1.367 C1=C(C(=O)OC)C=NC(=C1Br)Cl AK-23917 [0,2,0,0,0,0|2,0,0]=4 1454 B12R1.367 C1=C(C(OC)=O)C=CC(=C1N)N AK-49131 [0,2,0,0,0,0|0,0,0]=2 1455 B12R1.367 C1=C(C=CC(=C1Br)C)C(OC)=O AK-47512 [0,2,0,0,0,0|1,0,0]=3 1456 B12R1.367 C1=C(C=CC(=C1C)Br)C(OC)=O AK-32180 [0,2,0,0,0,0|1,0,0]=3 1457 B12R1.367 CCC(C1=CC=C(C)C(C)=C1)=O AK-63917 [0,2,0,0,0,0|2,0,0]=4 1458 B12R1.367 CCC(C1=CC=C(F)C(F)=C1)=O AK115109 [0,2,0,0,0,0|2,0,0]=4 1459 B12R1.367 COC(=O)C1=CC(Br)=C(F)C=C1 AK-81963 [0,2,0,0,0,0|1,0,0]=3 1460 B12R1.367 COC(=O)C1=CC(Br)=C(I)C=C1 AK-80259 [0,2,0,0,0,0|1,0,0]=3 1461 B12R1.367 COC(=O)C1=CC(Br)=C(N)C=C1 AK-32787 [0,2,0,0,0,0|0,0,0]=2 1462 B12R1.367 COC(=O)C1=CC(C)=C(I)C=C1 AK-26110 [0,2,0,0,0,0|1,0,0]=3 1463 B12R1.367 COC(=O)C1=CC(Cl)=C(N)C=C1 AK-86922 [0,2,0,0,0,0|0,0,0]=2 1464 B12R1.367 COC(=O)C1=CC(I)=C(N)C=C1 AK-61655 [0,2,0,0,0,0|0,0,0]=2 1465 B12R1.367 COC(=O)C1=CC(O)=C(Cl)C=C1 AK-76886 [0,2,0,0,0,0|1,0,0]=3 1466 B12R1.367 COC(=O)C1=COC(=O)C(Br)=C1 AK111325 [0,2,0,0,0,0|2,0,0]=4 1467 B12R1.367 COC(C1=CC(=C(C=C1)Cl)F)=O AK-39900 [0,2,0,0,0,0|1,0,0]=3 1468 B12R1.367 ClC1=C(C=CC(=C1)C(=O)C=O)Cl AK-10037 [0,2,0,0,0,0|1,0,1]=4 1469 B12R1.367 ClC1=C(C=CC(=C1)C(=O)OC)F AK-72962 [0,2,0,0,0,0|1,0,0]=3 1470 B12R1.367 ClC1=CC=C(C(CBr)=O)C=C1Cl AK-46858 [0,2,0,0,0,0|2,0,0]=4 1471 B12R1.367 FC1=C(C=C(C(=O)OC)C=C1)C AK-46648 [0,2,0,0,0,0|1,0,0]=3 1472 B12R1.367 NC1=C(C=CC(=C1)C(=O)OC)Br AK-35256 [0,2,0,0,0,0|1,0,0]=3 1473 B12R1.367 NC1=C(C=CC(=C1)C(=O)OC)F AK-40058 [0,2,0,0,0,0|1,0,0]=3 1474 B12R1.367 O=C(C1=CC=C(Br)C(N1)=O)OC AK100454 [0,2,0,0,0,0|2,0,0]=4 1475 B12R1.367 O=C(C1=CC=C(F)C(F)=C1)C=O AK-10019 [0,2,0,0,0,0|1,0,1]=4 1476 B12R1.367 O=C(OC)C1=CC=C(Br)C(F)=C1 AK-44121 [0,2,0,0,0,0|1,0,0]=3 1477 B12R1.367 O=C(OC)C1=CC=C(C)C(F)=C1 AK-39787 [0,2,0,0,0,0|1,0,0]=3 1478 B12R1.367 O=C(OC)C1=CC=C(Cl)C(C)=C1 AK117510 [0,2,0,0,0,0|1,0,0]=3 1479 B12R1.367 O=C(OC)C1=CC=C(Cl)C(N)=C1 AK115355 [0,2,0,0,0,0|1,0,0]=3 1480 B12R1.367 O=C(OC)C1=CC=C(I)C(N)=C1 AK-61810 [0,2,0,0,0,0|1,0,0]=3 1481 B12R1.367 O=C(OC)C1=CC=C(I)C(O)=C1 AK-31800 [0,2,0,0,0,0|1,0,0]=3 1482 B12R1.367 O=C(OC)C1=CC=C(N)C(C)=C1 AK-41505 [0,2,0,0,0,0|0,0,0]=2 1483 B12R1.367 O=C(OC)C1=CC=C(N)C(F)=C1 AK-53872 [0,2,0,0,0,0|0,0,0]=2 1484 B12R1.367 O=C(OC)C1=CC=C(N)C(O)=C1 AK-45500 [0,2,0,0,0,0|0,0,0]=2 1485 B12R1.367 O=C(OC)C1=CC=C(O)C(Br)=C1 AK-68225 [0,2,0,0,0,0|1,0,0]=3 1486 B12R1.367 O=C(OC)C1=CC=C(O)C(C)=C1 AK-78928 [0,2,0,0,0,0|1,0,0]=3 1487 B12R1.367 O=C(OC)C1=CC=C(O)C(Cl)=C1 AK-82339 [0,2,0,0,0,0|1,0,0]=3 1488 B12R1.367 O=C(OC)C1=CC=C(O)C(F)=C1 AK-79057 [0,2,0,0,0,0|1,0,0]=3 1489 B12R1.367 O=C(OC)C1=CC=C(O)C(I)=C1 AK-47890 [0,2,0,0,0,0|1,0,0]=3 1490 B12R1.367 O=C(OC)C1=CC=C(O)C(N)=C1 AK-76584 [0,2,0,0,0,0|1,0,0]=3 1491 B12R1.367 O=C(OC)C1=CC=C(O)C(O)=C1 AK-73115 [0,2,0,0,0,0|1,0,0]=3 1492 B12R1.367 O=C(OC)C1=CN=C(Br)C(C)=C1 AK-29742 [0,2,0,0,0,0|2,0,0]=4 1493 B12R1.367 O=C(OC)C1=CN=C(Cl)C(Cl)=C1 AK123985 [0,2,0,0,0,0|2,0,0]=4 1494 B12R1.367 O=C(OC)C1=CN=C(N)C(Br)=C1 AK-25058 [0,2,0,0,0,0|1,0,0]=3 1495 B12R1.367 O=C(OC)C1=NC(Br)=C(N)C=C1 AK339630 [0,2,0,0,0,0|1,0,0]=3 1496 B12R1.367 O=C(OC)C1=NC(C)=C(F)C=C1 AK-82789 [0,2,0,0,0,0|2,0,0]=4 1497 B12R1.367 O=C(OC)C1=NC(Cl)=C(Br)C=C1 AK100450 [0,2,0,0,0,0|2,0,0]=4 1498 B12R1.367 O=C(OC)C1=NC(Cl)=C(C)C=C1 AK-88627 [0,2,0,0,0,0|2,0,0]=4 1499 B12R1.367 O=C(OC)C1=NC(N)=C(Br)C=C1 AK-51186 [0,2,0,0,0,0|2,0,0]=4 1500 B12R1.367 O=C(OC)C1=NC(O)=C(O)C=C1 AK-26588 [0,2,0,0,0,0|2,0,0]=4 1501 B12R1.367 O=C(OC)C1=NC=C(Br)C(C)=C1 AK-36736 [0,2,0,0,0,0|2,0,0]=4 1502 B12R1.367 O=C(OC)C1=NC=C(C)C(Cl)=C1 AK-88624 [0,2,0,0,0,0|2,0,0]=4 1503 B12R1.367 O=C(OC)C1=NC=C(N)C(N)=C1 AK-82285 [0,2,0,0,0,0|1,0,0]=3 1504 B12R1.367 OC1=CC=C(C(CCl)=O)C=C1O AK-88433 [0,2,0,0,0,0|2,0,0]=4 1505 B12R1.893 CC(=O)C1=C(F)C(Br)=C(F)C=C1 AK-79661 [0,2,0,0,0,0|2,0,0]=4 1506 B12R1.893 CC(=O)C1=C(F)C(F)=C(F)C=C1 AK-79660 [0,2,0,0,0,0|2,0,0]=4 1507 B12R1.893 CC1=C(F)C(F)=C(C=C1)C(O)=O AK-48081 [0,2,0,0,0,0|1,0,0]=3 1508 B12R1.893 CC1=C(N)C=CC(=C1Cl)[N+]([O-])=O AK101143 [0,2,0,0,0,0|1,0,1]=4 1509 B12R1.893 CC1=C(N)C=CC(C(O)=O)=C1C AK-35654 [0,2,0,0,0,0|0,0,0]=2 1510 B12R1.893 ClC1=C(C(=O)O)C=CC(=C1Cl)F AK-33445 [0,2,0,0,0,0|1,0,0]=3 1511 B12R1.893 FC1=C(C(=O)O)C=CC(=C1C)F AK-32867 [0,2,0,0,0,0|1,0,0]=3 1512 B12R1.893 O=C(O)C1=CC=C(Br)C(C)=C1F AK162975 [0,2,0,0,0,0|1,0,0]=3 1513 B12R1.893 O=C(O)C1=CC=C(Br)C(F)=C1F AK-33927 [0,2,0,0,0,0|1,0,0]=3 1514 B12R1.893 O=C(O)C1=CC=C(Br)C(F)=C1N AK200341 [0,2,0,0,0,0|1,0,0]=3 1515 B12R1.893 O=C(O)C1=CC=C(C)C(C)=C1N AK-35356 [0,2,0,0,0,0|1,0,0]=3 1516 B12R1.893 O=C(O)C1=CC=C(Cl)C(C)=C1F AK545113 [0,2,0,0,0,0|1,0,0]=3 1517 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1F AK113235 [0,2,0,0,0,0|1,0,0]=3 1518 B12R1.893 O=C(O)C1=CC=C(F)C(C)=C1N AK601793 [0,2,0,0,0,0|1,0,0]=3 1519 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1C AK-33483 [0,2,0,0,0,0|1,0,0]=3 1520 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1Cl AK128546 [0,2,0,0,0,0|1,0,0]=3 1521 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1O AK135175 [0,2,0,0,0,0|1,0,0]=3 1522 B12R1.893 O=C(O)C1=CC=C(I)C(F)=C1F AK135717 [0,2,0,0,0,0|1,0,0]=3 1523 B12R1.893 O=C(O)C1=CC=C(N)C(Cl)=C1Cl AK174297 [0,2,0,0,0,0|0,0,0]=2 1524 B12R1.893 O=C(O)C1=CC=C(N)C(F)=C1F AK-33926 [0,2,0,0,0,0|0,0,0]=2 1525 B12R1.893 O=C(O)C1=CC=C(O)C(O)=C1Cl AK316952 [0,2,0,0,0,0|1,0,0]=3 1526 B12R1.893 O=C(O)C1=CC=C(O)C(O)=C1O AK-94172 [0,2,0,0,0,0|1,0,0]=3 1527 B12R1.893 O=C(O)C1=CN=C(F)C(F)=C1Cl AK-38070 [0,2,0,0,0,0|2,0,0]=4 1528 B12R1.893 OC(=O)C1=C(Br)C(F)=C(F)C=C1 AK-33648 [0,2,0,0,0,0|1,0,0]=3 1529 B12R1.1005 C1=C(C=C(Br)C(=C1Br)O)C(O)=O AK-47662 [0,2,0,0,0,0|1,0,0]=3 1530 B12R1.1005 C1=C(C=C(Br)C(=C1Cl)N)[N+](=O)[O-] AK-44555 [0,2,0,0,0,0|1,0,1]=4 1531 B12R1.1005 C1=C(C=C(Cl)C(=C1Cl)N)C(C)=O AK-46677 [0,2,0,0,0,0|1,0,0]=3 1532 B12R1.1005 C1=C(C=C(F)C(=C1F)F)C(C)=O AK-48906 [0,2,0,0,0,0|2,0,0]=4 1533 B12R1.1005 CC1=CC(=CC(C)=C1N)C(O)=O AK-68222 [0,2,0,0,0,0|0,0,0]=2 1534 B12R1.1005 CC1=CC(=CC(C)=C1N)[N+]([O-])=O AK-63626 [0,2,0,0,0,0|1,0,1]=4 1535 B12R1.1005 CC1=CC(=CC(C)=C1O)C(O)=O AK-35312 [0,2,0,0,0,0|1,0,0]=3 1536 B12R1.1005 NC1=C(F)C=C(C=C1F)C(O)=O AK-61347 [0,2,0,0,0,0|0,0,0]=2 1537 B12R1.1005 NC1=C(F)C=C(C=C1F)[N+]([O-])=O AK-34247 [0,2,0,0,0,0|1,0,1]=4 1538 B12R1.1005 O=C(C=1C=C(C)C(N(C1)C)=O)O AK-78283 [0,2,0,0,0,0|2,0,0]=4 1539 B12R1.1005 O=C(O)C1=CC(Br)=C(N)C(Br)=C1 AK-35094 [0,2,0,0,0,0|0,0,0]=2 1540 B12R1.1005 O=C(O)C1=CC(Cl)=C(Br)C(Cl)=C1 AK106948 [0,2,0,0,0,0|1,0,0]=3 1541 B12R1.1005 O=C(O)C1=CC(Cl)=C(C)C(Cl)=C1 AK-35015 [0,2,0,0,0,0|1,0,0]=3 1542 B12R1.1005 O=C(O)C1=CC(Cl)=C(Cl)C(Cl)=C1 AK-48299 [0,2,0,0,0,0|1,0,0]=3 1543 B12R1.1005 O=C(O)C1=CC(F)=C(C)C(Br)=C1 AK158504 [0,2,0,0,0,0|1,0,0]=3 1544 B12R1.1005 O=C(O)C1=CC(F)=C(F)C(F)=C1 AK-79140 [0,2,0,0,0,0|1,0,0]=3 1545 B12R1.1005 O=C(O)C1=CC(F)=C(N)C(Br)=C1 AK134869 [0,2,0,0,0,0|0,0,0]=2 1546 B12R1.1005 O=C(O)C1=CC(N)=C(C)C(N)=C1 AK326738 [0,2,0,0,0,0|1,0,0]=3 1547 B12R1.1005 O=C(O)C1=CC(O)=C(C)C(F)=C1 AK-36756 [0,2,0,0,0,0|1,0,0]=3 1548 B12R1.1005 O=C(O)C1=CC(O)=C(O)C(Cl)=C1 AK142333 [0,2,0,0,0,0|1,0,0]=3 1549 B12R1.1005 OC(=O)C1=CC(Br)=C(F)C(F)=C1 AK-92296 [0,2,0,0,0,0|1,0,0]=3 1550 B12R1.1005 OC(=O)C1=CC(Cl)=C(F)C(F)=C1 AK-33397 [0,2,0,0,0,0|1,0,0]=3 1551 B12R1.1005 OC(=O)C1=CC(Cl)=C(O)C(Cl)=C1 AK110730 [0,2,0,0,0,0|1,0,0]=3 1552 B12R1.1005 OC(=O)C1=CC(F)=C(Br)C(F)=C1 AK-82192 [0,2,0,0,0,0|1,0,0]=3 1553 B12R1.1005 OC1=CC(C(O)=O)=CC(O)=C1O AK-65266 [0,2,0,0,0,0|1,0,0]=3 1554 B12R1.16 C(C)OC(=O)C1=NC=C(C=C1)Br AK-26326 [0,2,0,0,0,0|2,0,0]=4 1555 B12R1.16 C(C)OC(C1=CN=C(C=C1)Br)=O AK-25676 [0,2,0,0,0,0|2,0,0]=4 1556 B12R1.16 C(OC(=O)C1=CNC(=O)C=C1)C AK-25535 [0,2,0,0,0,0|2,0,0]=4 1557 B12R1.16 C1=C(C(OCC)=O)C=CC(=C1)Br AK-47339 [0,2,0,0,0,0|1,0,0]=3 1558 B12R1.16 C1=CC(=CC=C1C(OCC)=O)F AK-46539 [0,2,0,0,0,0|1,0,0]=3 1559 B12R1.16 CCCC(C1=CC=C(F)C=C1)=O AK324839 [0,2,0,0,0,0|2,0,0]=4 1560 B12R1.16 CCCC(C1=CC=C(O)C=C1)=O AK114518 [0,2,0,0,0,0|2,0,0]=4 1561 B12R1.16 CCOC(=O)C1=CC=C(C)N=C1 AK-47039 [0,2,0,0,0,0|2,0,0]=4 1562 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 AK-29299 [0,2,0,0,0,0|2,0,0]=4 1563 B12R1.16 COCC(C1=CC=C(O)C=C1)=O AK144287 [0,2,0,0,0,0|1,0,0]=3 1564 B12R1.16 ClCCC(=O)C1=CC=C(Br)C=C1 AK-48143 [0,2,0,0,0,0|2,0,0]=4 1565 B12R1.16 N#CCC(C1=CC=C(F)C=C1)=O AK-84420 [0,2,0,0,0,0|2,0,0]=4 1566 B12R1.16 NC1=CN=C(C=N1)C(=O)OCC AK-24065 [0,2,0,0,0,0|2,0,0]=4 1567 B12R1.16 O=C(C1=CC=C(Cl)C=C1)CC#N AK-42875 [0,2,0,0,0,0|2,0,0]=4 1568 B12R1.16 O=C(C1=CN=C(N)N=C1)OCC AK-50608 [0,2,0,0,0,0|2,0,0]=4 1569 B12R1.16 O=C(OCC)C1=CC=C(Cl)C=C1 AK109118 [0,2,0,0,0,0|1,0,0]=3 1570 B12R1.16 O=C(OCC)C1=CC=C(I)C=C1 AK-43962 [0,2,0,0,0,0|1,0,0]=3 1571 B12R1.16 O=C(OCC)C1=CC=C(N)C=C1 AK-46733 [0,2,0,0,0,0|0,0,0]=2 1572 B12R1.16 O=C(OCC)C1=CC=C(O)C=C1 AK-49315 [0,2,0,0,0,0|1,0,0]=3 1573 B12R1.16 O=C(OCC)C1=CN=C(N)C=C1 AK-32375 [0,2,0,0,0,0|1,0,0]=3 1574 B12R1.16 O=C(OCC)C1=NC=C(C)C=C1 AK-68218 [0,2,0,0,0,0|2,0,0]=4 1575 B12R1.16 O=C(OCC)C1=NC=C(N)C=C1 AK112557 [0,2,0,0,0,0|1,0,0]=3 1576 B12R1.16 OCC[C@H](N)C1=CC=C(N)C=C1 AK310897 [0,2,0,0,0,0|1,0,1]=4 1577 B12R1.1703 BrC1=C(C(=O)OC)C=CC(=C1)C AK-46754 [0,2,0,0,0,0|1,0,0]=3 1578 B12R1.1703 BrC1=CC(=C(C(=O)OC)C=C1)C AK-28097 [0,2,0,0,0,0|1,0,0]=3 1579 B12R1.1703 C1=C(C(=CC(=C1)F)Cl)C(OC)=O AK-47401 [0,2,0,0,0,0|1,0,0]=3 1580 B12R1.1703 C1=C(C(=CC(=C1)O)O)C(OC)=O AK-50554 [0,2,0,0,0,0|1,0,0]=3 1581 B12R1.1703 C1=CC(=CC(=C1C(OC)=O)O)N AK-45502 [0,2,0,0,0,0|0,0,0]=2 1582 B12R1.1703 COC(=O)C1=C(Br)C=C(F)C=C1 AK-46746 [0,2,0,0,0,0|1,0,0]=3 1583 B12R1.1703 COC(=O)C1=C(C)C=C(I)C=C1 AK-77363 [0,2,0,0,0,0|1,0,0]=3 1584 B12R1.1703 COC(=O)C1=C(F)C=C(Br)C=C1 AK-46835 [0,2,0,0,0,0|1,0,0]=3 1585 B12R1.1703 COC(=O)C1=C(N)C=C(I)C=C1 AK-37605 [0,2,0,0,0,0|1,0,0]=3 1586 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 AK-82342 [0,2,0,0,0,0|1,0,0]=3 1587 B12R1.1703 COC(=O)C1=CC=C(C)C=C1N AK-61296 [0,2,0,0,0,0|1,0,0]=3 1588 B12R1.1703 COC(=O)C1=CC=C(O)C=C1Cl AK-32726 [0,2,0,0,0,0|1,0,0]=3 1589 B12R1.1703 COC(=O)C1=NC=C(C=C1C)Br AK-25600 [0,2,0,0,0,0|2,0,0]=4 1590 B12R1.1703 COC(C1=C(C=C(C=C1)N)F)=O AK-75833 [0,2,0,0,0,0|0,0,0]=2 1591 B12R1.1703 ClC1=CC(=NC=C1C(=O)OC)Cl AK-23913 [0,2,0,0,0,0|2,0,0]=4 1592 B12R1.1703 FC1=C(C(=O)OC)C=CC(=C1)O AK-41478 [0,2,0,0,0,0|1,0,0]=3 1593 B12R1.1703 FC1=CC(=C(C(=O)OC)C=C1)O AK-49085 [0,2,0,0,0,0|1,0,0]=3 1594 B12R1.1703 FC1=CC=C(C(CCl)=O)C(F)=C1 AK-51748 [0,2,0,0,0,0|2,0,0]=4 1595 B12R1.1703 NC1=CC(=C(C(=O)OC)C=C1)C AK-46101 [0,2,0,0,0,0|0,0,0]=2 1596 B12R1.1703 NC1=CC(=C(C(=O)OC)C=C1)Cl AK-40022 [0,2,0,0,0,0|0,0,0]=2 1597 B12R1.1703 O=C(NC)C1=CC=C(Br)C=C1F AK-98185 [0,2,0,0,0,0|2,0,0]=4 1598 B12R1.1703 O=C(NC)C1=CC=C(N)C=C1F AK135551 [0,2,0,0,0,0|1,0,0]=3 1599 B12R1.1703 O=C(OC)C1=C(C)N=C(F)C=C1 AK198785 [0,2,0,0,0,0|2,0,0]=4 1600 B12R1.1703 O=C(OC)C1=C(Cl)N=C(C)C=C1 AK-28460 [0,2,0,0,0,0|2,0,0]=4 1601 B12R1.1703 O=C(OC)C1=C(Cl)N=C(Cl)C=C1 AK-82618 [0,2,0,0,0,0|2,0,0]=4 1602 B12R1.1703 O=C(OC)C1=CC=C(Br)C=C1Cl AK107560 [0,2,0,0,0,0|1,0,0]=3 1603 B12R1.1703 O=C(OC)C1=CC=C(Br)C=C1N AK-53857 [0,2,0,0,0,0|1,0,0]=3 1604 B12R1.1703 O=C(OC)C1=CC=C(Br)C=C1O AK-88441 [0,2,0,0,0,0|1,0,0]=3 1605 B12R1.1703 O=C(OC)C1=CC=C(C)C=C1C AK140642 [0,2,0,0,0,0|1,0,0]=3 1606 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1Br AK-64354 [0,2,0,0,0,0|1,0,0]=3 1607 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1I AK201245 [0,2,0,0,0,0|1,0,0]=3 1608 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1N AK-72924 [0,2,0,0,0,0|1,0,0]=3 1609 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1O AK-46989 [0,2,0,0,0,0|1,0,0]=3 1610 B12R1.1703 O=C(OC)C1=CC=C(F)C=C1C AK-63369 [0,2,0,0,0,0|1,0,0]=3 1611 B12R1.1703 O=C(OC)C1=CC=C(F)C=C1F AK-39185 [0,2,0,0,0,0|1,0,0]=3 1612 B12R1.1703 O=C(OC)C1=CC=C(I)C=C1F AK174064 [0,2,0,0,0,0|1,0,0]=3 1613 B12R1.1703 O=C(OC)C1=CC=C(I)C=C1O AK144550 [0,2,0,0,0,0|1,0,0]=3 1614 B12R1.1703 O=C(OC)C1=CN=C(Br)C=C1Cl AK157951 [0,2,0,0,0,0|2,0,0]=4 1615 B12R1.1703 O=C(OC)C1=CN=C(C)C=C1N AK321488 [0,2,0,0,0,0|2,0,0]=4 1616 B12R1.1703 O=C(OC)C1=CN=C(N)C=C1Cl AK543110 [0,2,0,0,0,0|1,0,0]=3 1617 B12R1.1703 O=C(OC)C1=CN=C(O)C=C1O AK-65278 [0,2,0,0,0,0|2,0,0]=4 1618 B12R1.1703 O=C(OC)C1=NC=C(Br)C=C1Cl AK128538 [0,2,0,0,0,0|2,0,0]=4 1619 B12R1.1703 O=C(OC)C1=NC=C(F)C=C1C AK146488 [0,2,0,0,0,0|2,0,0]=4 1620 B12R1.1703 ONC(=N)C1=C(F)C=C(O)C=C1 AK-79609 [0,2,0,0,0,0|2,0,0]=4 1621 B12R1.57 C1=C(F)C=CC(=C1OC)C(O)=O AK-35011 [0,2,0,0,0,0|1,0,0]=3 1622 B12R1.57 CC(C1=CC=C(Br)C=C1OC)=O AK104826 [0,2,0,0,0,0|2,0,0]=4 1623 B12R1.57 COC1=C(C=CC(Br)=C1)C(O)=O AK-28153 [0,2,0,0,0,0|1,0,0]=3 1624 B12R1.57 COC1=C(C=CC(Cl)=N1)C(O)=O AK-67843 [0,2,0,0,0,0|2,0,0]=4 1625 B12R1.57 COC1=C(C=CC(N)=C1)C(C)=O AK-86813 [0,2,0,0,0,0|1,0,0]=3 1626 B12R1.57 COC1=C(C=CC(N)=C1)[N+]([O-])=O AK-79735 [0,2,0,0,0,0|1,0,1]=4 1627 B12R1.57 ClC1=NC=C(C(=O)O)C(=C1)OC AK-47449 [0,2,0,0,0,0|2,0,0]=4 1628 B12R1.57 O=C(O)C1=C(OC)N=C(Br)C=C1 AK121840 [0,2,0,0,0,0|2,0,0]=4 1629 B12R1.57 O=C(O)C1=C(OC)N=C(N)C=C1 AK550297 [0,2,0,0,0,0|1,0,0]=3 1630 B12R1.57 O=C(O)C1=CC=C(Br)C=C1CO AK141775 [0,2,0,0,0,0|1,0,0]=3 1631 B12R1.57 O=C(O)C1=CC=C(Br)C=C1NN AK601795 [0,2,0,0,0,0|1,0,0]=3 1632 B12R1.57 O=C(O)C1=CC=C(Cl)C=C1OC AK-35706 [0,2,0,0,0,0|1,0,0]=3 1633 B12R1.1000 BrC1=CC(=C(C(=O)O)C(=C1)C)C AK-49009 [0,2,0,0,0,0|1,0,0]=3 1634 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O AK-96677 [0,2,0,0,0,0|2,0,0]=4 1635 B12R1.1000 CC(C1=C(F)C=C(Br)C=C1F)=O AK132920 [0,2,0,0,0,0|2,0,0]=4 1636 B12R1.1000 CC(C1=C(F)C=C(F)C=C1N)=O AK145719 [0,2,0,0,0,0|2,0,0]=4 1637 B12R1.1000 CC1=CC(F)=C(C(O)=O)C(F)=C1 AK-53650 [0,2,0,0,0,0|1,0,0]=3 1638 B12R1.1000 CC1=CC(F)=CC(Br)=C1C(O)=O AK-32621 [0,2,0,0,0,0|1,0,0]=3 1639 B12R1.1000 ClC1=NC(=CC(=C1C(=O)O)C)Cl AK-35904 [0,2,0,0,0,0|2,0,0]=4 1640 B12R1.1000 NC1=C(C(O)=O)C(Br)=CC(Br)=C1 AK-40868 [0,2,0,0,0,0|1,0,0]=3 1641 B12R1.1000 NC1=CC(Cl)=CC(Cl)=C1C(O)=O AK-87870 [0,2,0,0,0,0|1,0,0]=3 1642 B12R1.1000 O=C(O)C1=C(C)C=C(C)C=C1C AK-50732 [0,2,0,0,0,0|1,0,0]=3 1643 B12R1.1000 O=C(O)C1=C(C)C=C(F)C=C1C AK-33599 [0,2,0,0,0,0|1,0,0]=3 1644 B12R1.1000 O=C(O)C1=C(C)C=C(O)C=C1O AK-77256 [0,2,0,0,0,0|1,0,0]=3 1645 B12R1.1000 O=C(O)C1=C(Cl)C=C(Br)C=C1Cl AK-76858 [0,2,0,0,0,0|1,0,0]=3 1646 B12R1.1000 O=C(O)C1=C(Cl)C=C(I)C=C1Cl AK161218 [0,2,0,0,0,0|1,0,0]=3 1647 B12R1.1000 O=C(O)C1=C(Cl)N=C(C)C=C1C AK-84419 [0,2,0,0,0,0|2,0,0]=4 1648 B12R1.1000 O=C(O)C1=C(Cl)N=C(Cl)C=C1Cl AK-82835 [0,2,0,0,0,0|2,0,0]=4 1649 B12R1.1000 O=C(O)C1=C(Cl)N=C(Cl)C=C1N AK110482 [0,2,0,0,0,0|2,0,0]=4 1650 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1Cl AK191616 [0,2,0,0,0,0|1,0,0]=3 1651 B12R1.1000 O=C(O)C1=C(F)C=C(Br)C=C1F AK-47965 [0,2,0,0,0,0|1,0,0]=3 1652 B12R1.1000 O=C(O)C1=C(F)C=C(Cl)C=C1Cl AK135723 [0,2,0,0,0,0|1,0,0]=3 1653 B12R1.1000 O=C(O)C1=C(F)C=C(F)C=C1N AK-38433 [0,2,0,0,0,0|1,0,0]=3 1654 B12R1.1000 O=C(O)C1=C(F)C=C(N)C=C1F AK271408 [0,2,0,0,0,0|0,0,0]=2 1655 B12R1.1000 O=C(O)C1=C(O)C=C(O)C=C1O AK-94120 [0,2,0,0,0,0|1,0,0]=3 1656 B10R2.320 C1=CC=CC2=C1CC2=O AK-72898 [1,0,0,1,0,0|1,0,0]=3 1657 B12R2.606 BrC1=CC2=C(NC(=O)O2)C=C1 AK-33961 [0,0,0,1,0,1|1,0,0]=3 1658 B12R2.606 BrC1=CC2=C(NC(N2)=O)C=C1 AK-22228 [0,0,0,1,0,1|2,0,0]=4 1659 B12R2.606 BrC1=CC2=C(OC(=O)N2)C=C1 AK-86848 [0,0,0,1,0,1|2,0,0]=4 1660 B12R2.606 BrC1=CC2=C(SC(=O)N2)C=C1 AK-87034 [0,0,0,1,0,1|2,0,0]=4 1661 B12R2.606 BrC1=CC=C2CC(=O)CC2=C1 AK-32489 [0,0,0,1,0,1|2,0,0]=4 1662 B12R2.606 BrC1=CN=C2C(=C1)OC(N2)=O AK-24539 [0,0,0,1,0,1|2,0,0]=4 1663 B12R2.606 C1=C(C=CC2=C1NC(N2)=O)N AK-27188 [0,0,0,1,0,1|1,0,0]=3 1664 B12R2.606 C1=C2C(=CC=C1N)N=C([NH]2)C AK-26727 [0,0,0,1,0,1|2,0,0]=4 1665 B12R2.606 C1=CC(=CC2=C1NC(=O)S2)Br AK-35883 [0,0,0,1,0,1|1,1,0]=4 1666 B12R2.606 CC1=NC2=C(O1)C=C(Cl)C=C2 AK-85814 [0,0,0,1,0,1|2,0,0]=4 1667 B12R2.606 CC1=NC2=C(O1)C=C(N)C=C2 AK-29411 [0,0,0,1,0,1|1,0,0]=3 1668 B12R2.606 ClC1=CC2=C(NC(=O)S2)C=C1 AK-30262 [0,0,0,1,0,1|1,1,0]=4 1669 B12R2.606 FC1=CC=C2NC(=O)SC2=C1 AK-30083 [0,0,0,1,0,1|1,1,0]=4 1670 B12R2.606 NC1=CC2=C(C=C1)SC(=N2)Cl AK-29546 [0,0,0,1,0,1|2,0,0]=4 1671 B12R2.606 NC1=CC2=C(NC(=O)S2)C=C1 AK-86990 [0,0,0,1,0,1|0,1,0]=3 1672 B12R2.606 NC1=CC=C2N=C(Cl)SC2=C1 AK-27954 [0,0,0,1,0,1|1,1,0]=4 1673 B12R2.606 NC1=CC=C2NC(C)=NC2=C1 AK-28192 [0,0,0,1,0,1|2,0,0]=4 1674 B12R2.606 NC1=NC2=C(O1)C=C(Br)C=C2 AK-35461 [0,0,0,1,0,1|2,0,0]=4 1675 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)C1 AK154493 [0,0,0,1,0,1|2,0,0]=4 1676 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)C1 AK-39225 [0,0,0,1,0,1|2,0,0]=4 1677 B12R2.606 O=C1NC2=C(C=C(F)C=C2)C1 AK-23028 [0,0,0,1,0,1|2,0,0]=4 1678 B12R2.606 O=C1NC2=C(C=C(N)C=C2)C1 AK-37753 [0,0,0,1,0,1|1,0,0]=3 1679 B12R2.606 O=C1NC2=C(C=CC(Br)=C2)C1 AK-26491 [0,0,0,1,0,1|2,0,0]=4 1680 B12R2.606 O=C1NC2=C(C=CC(C)=C2)C1 AK-79359 [0,0,0,1,0,1|2,0,0]=4 1681 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)C1 AK-29404 [0,0,0,1,0,1|2,0,0]=4 1682 B12R2.606 O=C1NC2=C(C=CC(N)=C2)C1 AK-28791 [0,0,0,1,0,1|1,0,0]=3 1683 B12R2.606 O=C1NC2=CC=C(C)C=C2N1 AK-92933 [0,0,0,1,0,1|2,0,0]=4 1684 B12R2.606 O=C1NC2=CC=C(Cl)C=C2N1 AK-22225 [0,0,0,1,0,1|2,0,0]=4 1685 B12R2.606 O=C1NC2=CC=C(F)C=C2N1 AK-22224 [0,0,0,1,0,1|2,0,0]=4 1686 B12R2.606 O=C1OC2=CC(Cl)=CN=C2N1 AK-32208 [0,0,0,1,0,1|2,0,0]=4 1687 B12R2.606 O=C1OC2=CC=C(F)C=C2N1 AK157798 [0,0,0,1,0,1|2,0,0]=4 1688 B12R2.1384 O=C(C1=CC=C2CCC2=C1)O AK549131 [0,1,0,1,0,0|1,0,0]=3 1689 B12R2.612 BrC1=CC=C2C(=C1)[NH]N=C2O AK-36726 [0,1,0,1,0,0|2,0,0]=4 1690 B12R2.612 BrC1=CC=C2C(=O)NOC2=C1 AK-76119 [0,1,0,1,0,0|1,0,0]=3 1691 B12R2.612 BrC1=CC=C2C(NCC2=C1)=O AK-29385 [0,1,0,1,0,0|2,0,0]=4 1692 B12R2.612 C1=C(C=CC2=C1CCC2=O)Cl AK-31971 [0,1,0,1,0,0|2,0,0]=4 1693 B12R2.612 CC1=NOC2=C1C=CC(=C2)O AK-24401 [0,1,0,1,0,0|2,0,0]=4 1694 B12R2.612 CC1=NOC2=CC(Br)=CC=C12 AK-80171 [0,1,0,1,0,0|2,0,0]=4 1695 B12R2.612 ClC1=NOC2=C1C=CC(Cl)=C2 AK-59821 [0,1,0,1,0,0|2,0,0]=4 1696 B12R2.612 ClC1=NOC2=CC(Br)=CC=C12 AK-28215 [0,1,0,1,0,0|2,0,0]=4 1697 B12R2.612 FC1=CC2=C(C(=NO2)N)C=C1 AK-24372 [0,1,0,1,0,0|2,0,0]=4 1698 B12R2.612 FC1=CC=C2C(=O)NOC2=C1 AK100150 [0,1,0,1,0,0|1,0,0]=3 1699 B12R2.612 FC1=CC=C2C(Cl)=NOC2=C1 AK-67876 [0,1,0,1,0,0|2,0,0]=4 1700 B12R2.612 NC1=CC2=C(C=C1)C(C)=NN2 AK-40879 [0,1,0,1,0,0|2,0,0]=4 1701 B12R2.612 NC1=CC=C2C(NCC2=C1)=O AK-34184 [0,1,0,1,0,0|1,0,0]=3 1702 B12R2.612 NC1=CC=C2C(NN=C2Cl)=C1 AK-28981 [0,1,0,1,0,0|2,0,0]=4 1703 B12R2.612 NC1=NOC2=CC(Br)=CC=C12 AK-23852 [0,1,0,1,0,0|2,0,0]=4 1704 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 AK-25818 [0,1,0,1,0,0|2,0,0]=4 1705 B12R2.612 O=C1CCC2=C1C=CC(C)=C2 AK-41812 [0,1,0,1,0,0|2,0,0]=4 1706 B12R2.612 O=C1CCC2=C1C=CC(F)=C2 AK-26274 [0,1,0,1,0,0|2,0,0]=4 1707 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 AK-29326 [0,1,0,1,0,0|2,0,0]=4 1708 B12R2.612 O=C1CCC2=C1C=CC(N)=C2 AK-34777 [0,1,0,1,0,0|1,0,0]=3 1709 B12R2.612 O=C1COC2=CC(Br)=CC=C12 AK-33982 [0,1,0,1,0,0|1,0,0]=3 1710 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 AK-25773 [0,1,0,1,0,0|1,0,0]=3 1711 B12R2.612 O=C1COC2=CC(O)=CC=C12 AK-27229 [0,1,0,1,0,0|1,0,0]=3 1712 B12R2.612 O=C1NNC2=C1C=CC(F)=C2 AK-99888 [0,1,0,1,0,0|2,0,0]=4 1713 B12R2.612 O=C1NOC2=CC(C)=CC=C12 AK-67760 [0,1,0,1,0,0|1,0,0]=3 1714 B12R2.612 O=C1NSC2=CC(F)=CC=C12 AK126238 [0,1,0,1,0,0|1,1,0]=4 1715 B12R2.612 O=C1OCC2=C1C=CC(Br)=C2 AK-35968 [0,1,0,1,0,0|1,0,0]=3 1716 B12R2.612 O=C1OCC2=C1C=CC(Cl)=C2 AK161984 [0,1,0,1,0,0|1,0,0]=3 1717 B12R2.612 OC1=CC2=C(C=C1)C(=O)N=C2 AK-64733 [0,1,0,1,0,0|2,0,0]=4 1718 B8R1.1 C1=C(SC(=C1)Br)C=O AK-35268 [1,0,0,0,1,0|2,0,0]=4 1719 B8R1.1 C1=C(SC(=N1)N)C=O AK-21788 [1,0,0,0,1,0|2,0,0]=4 1720 B8R1.1 CC1=CC=C(S1)C=O AK-30245 [1,0,0,0,1,0|2,0,0]=4 1721 B8R1.1 IC1=CNC(C=O)=C1 AK-76715 [1,0,0,0,1,0|2,0,0]=4 1722 B8R1.1 IC1=CSC(C=O)=C1 AK-82084 [1,0,0,0,1,0|2,0,0]=4 1723 B8R1.1 O=CC1=CC(Br)=CO1 AK-79028 [1,0,0,0,1,0|2,0,0]=4 1724 B8R1.1 O=CC1=CC(Br)=CS1 AK-33867 [1,0,0,0,1,0|2,0,0]=4 1725 B8R1.1 O=CC1=CC=C(Br)O1 AK-32379 [1,0,0,0,1,0|2,0,0]=4 1726 B8R1.1 O=CC1=CC=C(C)O1 AK-94177 [1,0,0,0,1,0|2,0,0]=4 1727 B8R1.1 O=CC1=CC=C(Cl)O1 AK158080 [1,0,0,0,1,0|2,0,0]=4 1728 B8R1.1 O=CC1=CC=C(Cl)S1 AK-48469 [1,0,0,0,1,0|2,0,0]=4 1729 B8R1.1 O=CC1=CN=C(N)S1 AK-94752 [1,0,0,0,1,0|2,0,0]=4 1730 B8R1.1 O=CC1=CSC(C)=C1 AK138065 [1,0,0,0,1,0|2,0,0]=4 1731 B8R1.1 O=CC1=CSC(Cl)=C1 AK-50469 [1,0,0,0,1,0|2,0,0]=4 1732 B8R1.7 C1=C(C(=O)O)[NH]C=N1 AK-25282 [1,0,0,0,1,0|2,0,0]=4 1733 B8R1.7 C1=COC=C1C(O)=O AK-32276 [1,0,0,0,1,0|1,0,0]=3 1734 B8R1.7 C1=NC=C(S1)C(=O)O AK-27761 [1,0,0,0,1,0|2,0,0]=4 1735 B8R1.7 C1=N[NH]C=C1C(O)=O AK-25877 [1,0,0,0,1,0|2,0,0]=4 1736 B8R1.7 CC(=O)C1=CC=CN1 AK-53458 [1,0,0,0,1,0|2,0,0]=4 1737 B8R1.7 CC(=O)C1=CSC=C1 AK-44537 [1,0,0,0,1,0|2,0,0]=4 1738 B8R1.7 O1C=CC(=N1)C(=O)O AK-27692 [1,0,0,0,1,0|2,0,0]=4 1739 B8R1.7 O=C(C1=CC=CN1)O AK-44225 [1,0,0,0,1,0|1,0,0]=3 1740 B8R1.7 O=C(C1=CC=CO1)O AK-72863 [1,0,0,0,1,0|1,0,0]=3 1741 B8R1.7 O=C(C1=CC=CS1)[O-] AK110095 [1,0,0,0,1,0|1,0,1]=4 1742 B8R1.7 O=C(C1=CC=NO1)O AK-25596 [1,0,0,0,1,0|2,0,0]=4 1743 B8R1.7 O=C(C1=CC=NS1)O AK-94814 [1,0,0,0,1,0|2,0,0]=4 1744 B8R1.7 O=C(C1=CN=CO1)O AK-28732 [1,0,0,0,1,0|2,0,0]=4 1745 B8R1.7 O=C(C1=CNC=C1)C AK-45953 [1,0,0,0,1,0|2,0,0]=4 1746 B8R1.7 O=C(C1=COC=N1)O AK-29026 [1,0,0,0,1,0|2,0,0]=4 1747 B8R1.7 O=C(C1=CSC=C1)O AK-46373 [1,0,0,0,1,0|1,0,0]=3 1748 B8R1.7 O=C(C1=CSC=N1)O AK-23931 [1,0,0,0,1,0|2,0,0]=4 1749 B8R1.7 O=C(C1=CSN=C1)O AK-84534 [1,0,0,0,1,0|2,0,0]=4 1750 B8R1.7 O=C(C1=NNC=C1)O AK-29904 [1,0,0,0,1,0|2,0,0]=4 1751 B8R1.7 OC(=O)C1=CNC=C1 AK-26450 [1,0,0,0,1,0|1,0,0]=3 1752 B8R1.7 S1C=CN=C1C(=O)O AK-21895 [1,0,0,0,1,0|2,0,0]=4 1753 B8R1.7 [NH]1C=CN=C1C(=O)O AK-27693 [1,0,0,0,1,0|2,0,0]=4 1754 B8R1.7 [O-]C(=O)C1=CC=CS1 AK111442 [1,0,0,0,1,0|1,0,1]=4 1755 B10R1.18 C1=C(C=CN=C1)CC(C)=O AK-47657 [1,0,0,0,0,1|2,0,0]=4 1756 B10R1.18 C1=C(C=CN=C1)CC(O)=O AK-45111 [1,0,0,0,0,1|1,0,0]=3 1757 B10R1.18 C1=NC=CC=C1CC(O)=O AK-26036 [1,0,0,0,0,1|1,0,0]=3 1758 B10R1.18 CC(CC1=NC=CC=C1)=O AK-32596 [1,0,0,0,0,1|2,0,0]=4 1759 B10R1.18 C\C(C)=C/C1=CC=CC=C1 AK113914 [1,0,0,0,0,1|2,0,0]=4 1760 B10R1.18 N1=CN=CC(=C1)CC(=O)O AK-32588 [1,0,0,0,0,1|2,0,0]=4 1761 B10R1.18 N=C(N)CC1=CC=CC=C1 AK-77604 [1,0,0,0,0,1|2,0,0]=4 1762 B10R1.18 NC(NC1=CC=CC=C1)=N AK117130 [1,0,0,0,0,1|2,0,0]=4 1763 B10R1.18 O=C(N)CC1=CC=CC=C1 AK-45803 [1,0,0,0,0,1|1,0,0]=3 1764 B10R1.18 O=C(N)CC1=CC=CN=C1 AK-81612 [1,0,0,0,0,1|2,0,0]=4 1765 B10R1.18 O=C(O)CC1=CC=CN=C1 AK-26773 [1,0,0,0,0,1|1,0,0]=3 1766 B10R1.18 OC(=N)NC1=CC=CC=C1 AK-65147 [1,0,0,0,0,1|1,0,0]=3 1767 B10R1.18 OC(=O)CC1=CC=CC=N1 AK-45110 [1,0,0,0,0,1|1,0,0]=3 1768 B10R1.18 S=C(Cl)OC1=CC=CC=C1 AK163079 [1,0,0,0,0,1|1,1,0]=4 1769 B10R1.18 S=C(N)NC1=CC=CC=C1 AK305328 [1,0,0,0,0,1|1,1,0]=4 1770 B12R1.21 C1=C(C=CC(=C1)O)C=CC(O)=O AK-26304 [0,0,0,0,0,2|1,0,0]=3 1771 B12R1.21 C1=C(C=CC(=C1)O)CCC(O)=O AK-46638 [0,0,0,0,0,2|1,0,0]=3 1772 B12R1.21 CC(CCC1=CC=C(O)C=C1)=O AK114178 [0,0,0,0,0,2|2,0,0]=4 1773 B12R1.21 CC(NNC1=CC=C(Br)C=C1)=O AK668231 [0,0,0,0,0,2|2,0,0]=4 1774 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 AK-98680 [0,0,0,0,0,2|1,0,0]=3 1775 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 AK-24764 [0,0,0,0,0,2|1,0,0]=3 1776 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 AK-25565 [0,0,0,0,0,2|1,0,0]=3 1777 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 AK-33583 [0,0,0,0,0,2|1,0,0]=3 1778 B12R1.21 O=C(O)CCC1=CC=C(N)N=C1 AK-80996 [0,0,0,0,0,2|1,0,0]=3 1779 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 AK163273 [0,0,0,0,0,2|1,0,0]=3 1780 B12R1.21 O=C(O)COC1=CC=C(I)C=C1 AK-88701 [0,0,0,0,0,2|1,0,0]=3 1781 B12R1.21 O=C(O)\C=C\C1=CC=C(N)N=C1 AK-86690 [0,0,0,0,0,2|1,0,0]=3 1782 B12R1.21 O=C([O-])COC1=CC=C(Cl)C=C1 AK117329 [0,0,0,0,0,2|1,0,1]=4 1783 B12R1.21 OC(=O)C=CC1=CC=C(Br)C=C1 AK-45694 [0,0,0,0,0,2|1,0,0]=3 1784 B12R1.21 OC(=O)C=CC1=CC=C(Br)N=C1 AK-80564 [0,0,0,0,0,2|2,0,0]=4 1785 B12R1.21 OC(=O)C=CC1=CC=C(Cl)C=C1 AK-60979 [0,0,0,0,0,2|1,0,0]=3 1786 B12R1.21 OC(=O)C=CC1=NC=C(F)C=C1 AK103268 [0,0,0,0,0,2|2,0,0]=4