0 B9R1.6 C(N)(=N)C1=NC=CC=N1 AK-33208 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.6 C1=C(C(=O)C)C=CN=C1 AK-65203 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 C1=C(C(C)=O)N=CC=C1 AK-53417 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 C1=C(C(N)=O)C=CN=C1 AK-47864 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.6 C1=C(C=CC=C1)B(O)O AK-50285 [0,0,0,0,0,0|1,0,1]=2 5 B9R1.6 C1=C(C=CN=C1)B(O)O AK-26762 [0,0,0,0,0,0|2,0,1]=3 6 B9R1.6 C1=C(N=CC=N1)C(=O)C AK-16901 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.6 C1=C(N=NC=C1)C(O)=O AK-28139 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 C1=CN=CN=C1C(=O)O AK-23926 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.6 C1=NC(=CC=C1)C(C)C AK-46532 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.6 C1=NC=C(B(O)O)C=N1 AK-25129 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.6 C1=NC=CN=C1C(N)=N AK-24427 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.6 C1=NC=CN=C1C(O)=O AK-47505 [0,0,0,0,0,0|2,0,0]=2 13 B9R1.6 C1=NC=NC=C1C(=O)O AK-24470 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 CC(=O)C1=CC=CN=N1 AK-83539 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.6 CC(=O)C1=CC=NN=C1 AK-30816 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.6 CC(=O)C1=NC=CC=N1 AK-35526 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.6 CC(C1=CN=CN=C1)=O AK-32388 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.6 CC(C1=NC=NC=C1)=O AK-40767 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.6 CC(N)C1=CC=CN=C1 AK-35649 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.6 CC(O)C1=NC=CC=C1 AK-53453 [0,0,0,0,0,0|2,0,1]=3 21 B9R1.6 CN(C)C1=NC=CC=C1 AK-78706 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AK668263 [0,0,0,0,0,0|2,0,1]=3 23 B9R1.6 C[C@@H](N)C1=CC=CN=C1 AK152012 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AK122419 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AK-79205 [0,0,0,0,0,0|1,0,1]=2 26 B9R1.6 C[C@@H](O)C1=CC=NC=C1 AK-45022 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.6 C[C@@H](O)C1=NC=CC=C1 AK-79201 [0,0,0,0,0,0|2,0,1]=3 28 B9R1.6 C[C@H](N)C1=CC=CN=C1 AK151271 [0,0,0,0,0,0|3,0,1]=4 29 B9R1.6 C[C@H](O)C1=CC=NC=C1 AK-79199 [0,0,0,0,0,0|2,0,1]=3 30 B9R1.6 N1=C(C=CC=C1)C(N)=S AK-65332 [0,0,0,0,0,0|2,1,0]=3 31 B9R1.6 N1=C(C=CC=C1)[C@@H](C)N AK-37082 [0,0,0,0,0,0|3,0,1]=4 32 B9R1.6 N1=C(N=CC=C1)C(=O)O AK-24353 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.6 N1=NC=C(C=C1)C(=O)O AK-26044 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.6 N=C(C1=NC=CC=N1)N AK164164 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.6 N=C(N)C1=CC=CC=C1 AK-47930 [0,0,0,0,0,0|2,0,0]=2 36 B9R1.6 N=C(N)C1=CC=NC=C1 AK-84875 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.6 N=C(N)C1=CC=NC=C1 AK546382 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.6 N=C(N)C1=CN=CC=C1 AK-76662 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.6 N=C(N)C1=NC=CC=C1 AK-26055 [0,0,0,0,0,0|3,0,0]=3 40 B9R1.6 NC(=N)C1=CC=CC=C1 AK-48017 [0,0,0,0,0,0|2,0,0]=2 41 B9R1.6 NC(=O)C1=CN=CC=N1 AK-94813 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.6 NC(C1=CC=CC=C1)=S AK-46849 [0,0,0,0,0,0|1,1,0]=2 43 B9R1.6 N[C@@H](C1=CC=NC=C1)C AK202973 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.6 N[C@H](C1=NC=CC=C1)C AK-37110 [0,0,0,0,0,0|3,0,1]=4 45 B9R1.6 O=C(C1=CCCCO1)O AK-78816 [0,0,0,0,0,0|1,0,3]=4 46 B9R1.6 O=C(Cl)C1=NC=CC=C1 AK-49118 [0,0,0,0,0,0|2,0,0]=2 47 B9R1.6 O=C(N)C1=CC=CC=C1 AK-77684 [0,0,0,0,0,0|1,0,0]=1 48 B9R1.6 O=C(N)C1=CN=CC=C1 AK112769 [0,0,0,0,0,0|2,0,0]=2 49 B9R1.6 O=C(N)C1=NC=CC=C1 AK106190 [0,0,0,0,0,0|2,0,0]=2 50 B9R1.6 O=C(O)C1=CN=CC=C1 AK-46486 [0,0,0,0,0,0|1,0,0]=1 51 B9R1.6 O=C(O)C1=NC=CC=C1 AK-50286 [0,0,0,0,0,0|1,0,0]=1 52 B9R1.6 O=C([C@@H]1CC=CCC1)O AK130960 [0,0,0,0,0,0|0,0,4]=4 53 B9R1.6 O=C([C@H]1CC=CCC1)O AK-77496 [0,0,0,0,0,0|0,0,4]=4 54 B9R1.6 O=S(C1=CC=CC=C1)[O-] AK162411 [0,0,0,0,0,0|1,0,1]=2 55 B9R1.6 OB(C1=CC=CN=C1)O AK-26799 [0,0,0,0,0,0|2,0,1]=3 56 B9R1.6 OB(C1=NC=CC=C1)O AK-26642 [0,0,0,0,0,0|2,0,1]=3 57 B9R1.6 OB(C1=NC=NC=C1)O AK187804 [0,0,0,0,0,0|3,0,1]=4 58 B9R1.6 OC(=O)C1=CC=NC=C1 AK-49896 [0,0,0,0,0,0|1,0,0]=1 59 B9R1.6 OC(=O)C1=CCCCC1 AK-48425 [0,0,0,0,0,0|0,0,4]=4 60 B9R1.6 OC(=O)C1CCC=CC1 AK-33140 [0,0,0,0,0,0|0,0,4]=4 61 B8R1.2 BrCC1=CC=CN=C1 AK-44682 [1,0,0,0,0,0|2,0,1]=4 62 B8R1.2 BrCC1=CC=NC=C1 AK-40271 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.2 BrCC1=NC=CC=C1 AK-78919 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.2 C#CC1=CC=CN=C1 AK-39524 [1,0,0,0,0,0|2,0,1]=4 65 B8R1.2 C#CC1=CC=NC=C1 AK-32285 [1,0,0,0,0,0|2,0,1]=4 66 B8R1.2 C#CC1=CC=NC=C1 AK-61719 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.2 C1=C(N=CC=C1)C#C AK-39840 [1,0,0,0,0,0|2,0,1]=4 68 B8R1.2 C1=CN=CC=C1OC AK-54547 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.2 C1=NC=C(N=C1)CO AK-45812 [1,0,0,0,0,0|2,0,1]=4 70 B8R1.2 CC[N+]1=CC=CC=C1 AK607939 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.2 CNC1=CC=CN=C1 AK-72893 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 COC1=CC=CN=C1 AK-76565 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.2 ICC1=CC=CC=C1 AK-54444 [1,0,0,0,0,0|1,0,1]=3 74 B8R1.2 N#CC1=CC=CC=C1 AK-49389 [1,0,0,0,0,0|1,0,1]=3 75 B8R1.2 N#CC1=CC=NC=C1 AK-76782 [1,0,0,0,0,0|2,0,1]=4 76 B8R1.2 N#CC1=CN=CC=C1 AK-76753 [1,0,0,0,0,0|2,0,1]=4 77 B8R1.2 N#CC1=NC=CC=C1 AK-76752 [1,0,0,0,0,0|2,0,1]=4 78 B8R1.2 N1=CN=C(C=C1)C=O AK-23925 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.2 N1=CN=CC(=C1)C=O AK-25240 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.2 NCC1=CC=NC=C1 AK-25866 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.2 NCC1=CC=NC=C1 AK-50006 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.2 NNC1=CC=CC=C1 AK114548 [1,0,0,0,0,0|2,0,0]=3 83 B8R1.2 NNC1=CC=CN=C1 AK-40869 [1,0,0,0,0,0|3,0,0]=4 84 B8R1.2 NNC1=CC=CN=C1 AK-75799 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.2 NNC1=CC=NC=C1 AK-51295 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.2 NNC1=NC=CC=C1 AK-26026 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.2 NOC1=CC=CC=C1 AK-77703 [1,0,0,0,0,0|2,0,0]=3 88 B8R1.2 O=CC1=CC=NC=C1 AK-50192 [1,0,0,0,0,0|1,0,0]=2 89 B8R1.2 OCC1=CC=CN=C1 AK-46173 [1,0,0,0,0,0|1,0,1]=3 90 B8R1.2 OCC1=CC=NC=C1 AK-44706 [1,0,0,0,0,0|1,0,1]=3 91 B8R1.2 OCC1=CC=NC=C1 AK175384 [1,0,0,0,0,0|1,0,1]=3 92 B8R1.2 OCC1=CN=CN=C1 AK-32022 [1,0,0,0,0,0|2,0,1]=4 93 B8R1.2 OCC1=NC=CC=C1 AK-53905 [1,0,0,0,0,0|1,0,1]=3 94 B8R1.2 OCC1=NC=CC=N1 AK-25156 [1,0,0,0,0,0|2,0,1]=4 95 B8R1.2 OCC1=NC=NC=C1 AK-31889 [1,0,0,0,0,0|2,0,1]=4 96 B8R1.2 ONC1=CC=CC=C1 AK139965 [1,0,0,0,0,0|1,0,0]=2 97 B10R1.13 BrC1=CN=C(C=N1)C(=O)O AK-24192 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.13 BrC1=CN=C(N=C1)C(=O)O AK-21808 [0,1,0,0,0,0|2,0,0]=3 99 B10R1.13 C(C)(=O)C1=CC=C(N=C1)Br AK-25404 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.13 C1=C(B(O)O)C=CC(=C1)C AK-39805 [0,1,0,0,0,0|1,0,1]=3 101 B10R1.13 C1=C(C(=N)N)C=CC(=C1)Cl AK-49053 [0,1,0,0,0,0|2,0,0]=3 102 B10R1.13 C1=C(C(C)C)C=CC(=C1)Br AK-47451 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.13 C1=C(C=CC(=C1)Br)B(O)O AK-44722 [0,1,0,0,0,0|1,0,1]=3 104 B10R1.13 C1=C(C=CC(=C1)F)B(O)O AK-46490 [0,1,0,0,0,0|1,0,1]=3 105 B10R1.13 C1=C(C=CC(=C1)O)B(O)O AK-44804 [0,1,0,0,0,0|1,0,1]=3 106 B10R1.13 C1=C(C=CC(=N1)Cl)B(O)O AK-29256 [0,1,0,0,0,0|2,0,1]=4 107 B10R1.13 C1=C(C=CC(=N1)F)B(O)O AK-29209 [0,1,0,0,0,0|2,0,1]=4 108 B10R1.13 C1=C(C=CC(=N1)F)[N+]([O-])=O AK-25997 [0,1,0,0,0,0|2,0,1]=4 109 B10R1.13 C1=C(C=CC(=N1)[N+]([O-])=O)Cl AK-47611 [0,1,0,0,0,0|2,0,1]=4 110 B10R1.13 C1=C(C=NC(=C1)N)C(=O)O AK-25111 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 C1=C(N(C)C)C=CC(=C1)Br AK-47628 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.13 C1=C(N=CC(=C1)C(C)=O)C AK-25853 [0,1,0,0,0,0|2,0,0]=3 113 B10R1.13 C1=C([N+](=O)[O-])N=CC(=C1)C AK-28721 [0,1,0,0,0,0|2,0,1]=4 114 B10R1.13 C1=CC(=CC=C1C(C)=O)F AK-41690 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.13 C1=CC(=CC=C1C(N)=O)F AK-47676 [0,1,0,0,0,0|1,0,0]=2 116 B10R1.13 C1=CC(=CC=C1C(O)=O)Br AK-50463 [0,1,0,0,0,0|0,0,0]=1 117 B10R1.13 C1=CC(=CC=C1C(O)=O)F AK-73077 [0,1,0,0,0,0|0,0,0]=1 118 B10R1.13 C1=CC(=CN=C1C(O)=O)C AK-27814 [0,1,0,0,0,0|1,0,0]=2 119 B10R1.13 C1=CC(=CN=C1[N+](=O)[O-])Br AK-25916 [0,1,0,0,0,0|2,0,1]=4 120 B10R1.13 C1=CC(=NC=C1C(N)=O)C AK-48877 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Br AK-35205 [0,1,0,0,0,0|2,0,1]=4 122 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])Cl AK-25992 [0,1,0,0,0,0|2,0,1]=4 123 B10R1.13 C1=CC(=NC=C1[N+](=O)[O-])N AK-30014 [0,1,0,0,0,0|2,0,1]=4 124 B10R1.13 C1=NC(=CC=C1C(=O)O)F AK-25936 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.13 C1=NC(=CN=C1C(=O)N)Cl AK-28055 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.13 C1=NC(=CN=C1C(=O)O)Cl AK-24710 [0,1,0,0,0,0|2,0,0]=3 127 B10R1.13 CC(=O)C1=CC=C(N)N=C1 AK-67650 [0,1,0,0,0,0|2,0,0]=3 128 B10R1.13 CC(Br)C1=CC=C(F)C=C1 AK-94758 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.13 CC(C1=CC=C(Br)C=C1)=O AK124422 [0,1,0,0,0,0|1,0,0]=2 130 B10R1.13 CC(C1=CC=C(C)C=C1)=O AK-41305 [0,1,0,0,0,0|1,0,0]=2 131 B10R1.13 CC(C1=CC=C(F)N=C1)=O AK-29672 [0,1,0,0,0,0|2,0,0]=3 132 B10R1.13 CC(C1=CC=C(N)C=C1)=O AK110424 [0,1,0,0,0,0|1,0,0]=2 133 B10R1.13 CC(C1=CC=C(O)C=C1)=O AK-86441 [0,1,0,0,0,0|1,0,0]=2 134 B10R1.13 CC(C1=CC=C(O)N=C1)=O AK-40333 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.13 CC(C1=CN=C(Cl)N=C1)=O AK135579 [0,1,0,0,0,0|3,0,0]=4 136 B10R1.13 CC(C1=NC=C(Br)C=C1)=O AK-28454 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.13 CC(C1=NC=C(Br)C=N1)=O AK129384 [0,1,0,0,0,0|3,0,0]=4 138 B10R1.13 CC(C1=NC=C(Cl)C=C1)=O AK-77099 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.13 CC(C1=NC=C(Cl)N=C1)=O AK-42149 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.13 CC(C1=NC=C(O)C=C1)=O AK116053 [0,1,0,0,0,0|2,0,0]=3 141 B10R1.13 CC(C1=NC=C(O)N=C1)=O AK134806 [0,1,0,0,0,0|3,0,0]=4 142 B10R1.13 CC(N)C1=CC=C(I)C=C1 AK-77292 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.13 CC(O)C1=CC=C(Br)C=C1 AK117026 [0,1,0,0,0,0|1,0,1]=3 144 B10R1.13 CC(O)C1=CC=C(N)C=C1 AK109742 [0,1,0,0,0,0|1,0,1]=3 145 B10R1.13 CC(O)C1=CN=C(C)C=C1 AK-32149 [0,1,0,0,0,0|2,0,1]=4 146 B10R1.13 CC1=CC=C(S(O)=O)C=C1 AK-46949 [0,1,0,0,0,0|1,0,0]=2 147 B10R1.13 CC1=NC=C(C=C1)B(O)O AK-27039 [0,1,0,0,0,0|2,0,1]=4 148 B10R1.13 CC1=NC=C(C=N1)C(=O)O AK-25207 [0,1,0,0,0,0|2,0,0]=3 149 B10R1.13 CN(C)C1=CC=C(C=C1)I AK101968 [0,1,0,0,0,0|3,0,0]=4 150 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 AK136579 [0,1,0,0,0,0|3,0,0]=4 151 B10R1.13 CN(C)C1=CC=C(O)C=C1 AK-64702 [0,1,0,0,0,0|3,0,0]=4 152 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-45030 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-89611 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 AK-43006 [0,1,0,0,0,0|2,0,1]=4 155 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 AK-79215 [0,1,0,0,0,0|1,0,1]=3 156 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AK-34471 [0,1,0,0,0,0|2,0,1]=4 157 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 AK548805 [0,1,0,0,0,0|2,0,1]=4 158 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 AK-79189 [0,1,0,0,0,0|1,0,1]=3 159 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 AK-79216 [0,1,0,0,0,0|1,0,1]=3 160 B10R1.13 ClC1=CC=C(B(O)O)C=C1 AK-26616 [0,1,0,0,0,0|1,0,1]=3 161 B10R1.13 ClC1=CC=C(C(C)=O)C=N1 AK-26129 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.13 ClC1=CC=C(N=C1)C(=O)O AK-26702 [0,1,0,0,0,0|1,0,0]=2 163 B10R1.13 ClC1=CC=C(N=N1)C(=O)N AK-28115 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.13 ClC1=CC=C(N=N1)C(=O)O AK-23862 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.13 ClC1=CN=C(C=C1)B(O)O AK-24785 [0,1,0,0,0,0|2,0,1]=4 166 B10R1.13 FC(C1=CC=C(Cl)C=C1)F AK-77798 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.13 FC1=CC=C(N=C1)C(=O)O AK-28724 [0,1,0,0,0,0|1,0,0]=2 168 B10R1.13 IC1=CC=C(B(O)O)C=C1 AK-24763 [0,1,0,0,0,0|1,0,1]=3 169 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 AK-89169 [0,1,0,0,0,0|2,0,0]=3 170 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 AK107083 [0,1,0,0,0,0|2,0,0]=3 171 B10R1.13 N=C(N)C1=CC=C(F)C=C1 AK-35244 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.13 N=C(N)C1=CC=C(N)C=C1 AK-34349 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.13 N=C(N)C1=CC=C(O)C=C1 AK-16801 [0,1,0,0,0,0|2,0,0]=3 174 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 AK-67868 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.13 N=C(N)C1=NC=C(F)C=C1 AK130362 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AK-76760 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.13 NC(=O)C1=NC=C(N)C=N1 AK-82639 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.13 NC(=O)C1=NC=C(N)N=C1 AK102768 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.13 NC1=CC=C(B(O)O)C=C1 AK-44817 [0,1,0,0,0,0|1,0,1]=3 180 B10R1.13 NC1=CC=C([N+]([O-])=O)C=C1 AK136006 [0,1,0,0,0,0|1,0,1]=3 181 B10R1.13 NC1=CN=C(C=C1)C(=O)O AK-25651 [0,1,0,0,0,0|1,0,0]=2 182 B10R1.13 NC1=CN=C(C=C1)[N+](=O)[O-] AK-23524 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.13 NC1=CN=C(N=C1)C(O)=O AK-29407 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.13 NC1=NC=C(C=C1)B(O)O AK-36570 [0,1,0,0,0,0|2,0,1]=4 185 B10R1.13 NC1=NC=C(N=C1)C(=O)O AK-24195 [0,1,0,0,0,0|2,0,0]=3 186 B10R1.13 N[C@@H](C1=CC=C(Br)C=C1)C AK-35249 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.13 N[C@@H](C1=CC=C(C)C=C1)C AK-45033 [0,1,0,0,0,0|2,0,1]=4 188 B10R1.13 N[C@H](C1=CC=C(F)C=C1)C AK-98664 [0,1,0,0,0,0|2,0,1]=4 189 B10R1.13 O=C(C1=CC=C(Cl)N=C1)N AK-44668 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.13 O=C(C1=CN=C(Cl)N=C1)O AK-25020 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.13 O=C(C1=CN=C(N)N=C1)O AK-17303 [0,1,0,0,0,0|2,0,0]=3 192 B10R1.13 O=C(C1=CN=C(O)N=C1)O AK-55017 [0,1,0,0,0,0|2,0,0]=3 193 B10R1.13 O=C(C1=CNC(C=N1)=O)O AK-24756 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.13 O=C(C1=NC=C(Br)C=C1)N AK-36812 [0,1,0,0,0,0|2,0,0]=3 195 B10R1.13 O=C(C1=NC=C(Br)C=C1)O AK-25747 [0,1,0,0,0,0|1,0,0]=2 196 B10R1.13 O=C(C1=NC=C(Br)C=N1)N AK-75832 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.13 O=C(C1=NC=C(Br)N=C1)N AK156282 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.13 O=C(C1=NC=C(C)C=N1)O AK-29650 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.13 O=C(C1=NC=C(N)C=C1)N AK-40127 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.13 O=C(C1=NC=C(O)C=N1)O AK-40704 [0,1,0,0,0,0|2,0,0]=3 201 B10R1.13 O=C(C1=NN=C(N)C=C1)O AK-26163 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.13 O=C(C1=NN=C(O)C=C1)O AK-25880 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.13 O=C(C1=NN=C(O)C=C1)O AK601861 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.13 O=C(N)C1=CC=C(Cl)C=C1 AK113058 [0,1,0,0,0,0|1,0,0]=2 205 B10R1.13 O=C(N)C1=CC=C(N)C=C1 AK151254 [0,1,0,0,0,0|1,0,0]=2 206 B10R1.13 O=C(N)C1=CC=C(O)C=C1 AK151255 [0,1,0,0,0,0|1,0,0]=2 207 B10R1.13 O=C(N)C1=CN=C(Br)C=C1 AK-41744 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.13 O=C(N)C1=CN=C(N)C=C1 AK161454 [0,1,0,0,0,0|2,0,0]=3 209 B10R1.13 O=C(N)C1=NC=C(Cl)C=C1 AK142780 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.13 O=C(N)C1=NC=C(F)C=C1 AK110171 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.13 O=C(O)C1=CC=C(C)C=C1 AK106262 [0,1,0,0,0,0|0,0,0]=1 212 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 AK-44086 [0,1,0,0,0,0|0,0,0]=1 213 B10R1.13 O=C(O)C1=CC=C(I)C=C1 AK-73094 [0,1,0,0,0,0|0,0,0]=1 214 B10R1.13 O=C(O)C1=CC=C(N)C=C1 AK-41178 [0,1,0,0,0,0|0,0,0]=1 215 B10R1.13 O=C(O)C1=CC=C(O)C=C1 AK106263 [0,1,0,0,0,0|0,0,0]=1 216 B10R1.13 O=C(O)C1=CN=C(C)C=C1 AK-29149 [0,1,0,0,0,0|1,0,0]=2 217 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 AK-26081 [0,1,0,0,0,0|1,0,0]=2 218 B10R1.13 O=C(O)C1=CNC(C=C1)=O AK-26034 [0,1,0,0,0,0|1,0,0]=2 219 B10R1.13 O=C(O)C1=NC=C(O)C=C1 AK-24769 [0,1,0,0,0,0|1,0,0]=2 220 B10R1.13 O=C([O-])C1=CC=C(N)C=C1 AK116649 [0,1,0,0,0,0|0,0,1]=2 221 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 AK306852 [0,1,0,0,0,0|0,0,1]=2 222 B10R1.13 O=C1C=CC(C(O)=O)=CO1 AK-46024 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.13 O=S(C1=CC=C(C)C=C1)O AK143296 [0,1,0,0,0,0|1,0,0]=2 224 B10R1.13 O=S(C1=CC=C(C)C=C1)[O-] AK106973 [0,1,0,0,0,0|1,0,1]=3 225 B10R1.13 O=S(C1=CC=C(F)C=C1)[O-] AK114760 [0,1,0,0,0,0|1,0,1]=3 226 B10R1.13 O=[N+](C1=CN=C(C)C=C1)[O-] AK-28977 [0,1,0,0,0,0|2,0,1]=4 227 B10R1.13 O=[N+](C1=NC=C(F)C=C1)[O-] AK-36376 [0,1,0,0,0,0|2,0,1]=4 228 B10R1.13 O=[N+]([O-])C1=CNC(=O)C=C1 AK-29363 [0,1,0,0,0,0|2,0,1]=4 229 B10R1.13 O=[S@@](C1=CC=C(C)C=C1)N AK-81446 [0,1,0,0,0,0|2,0,0]=3 230 B10R1.13 OB(C1=CC=C(O)N=C1)O AK-40749 [0,1,0,0,0,0|2,0,1]=4 231 B10R1.13 OB(C1=CC=C(S)C=C1)O AK-41540 [0,1,0,0,0,0|1,0,1]=3 232 B10R1.13 OB(C1=CN=C(Br)C=C1)O AK-27206 [0,1,0,0,0,0|2,0,1]=4 233 B10R1.13 OC(=O)C1=CC=C(Br)N=C1 AK-26208 [0,1,0,0,0,0|1,0,0]=2 234 B10R1.13 OC(=O)C1=NC=C(Cl)C=N1 AK-64297 [0,1,0,0,0,0|2,0,0]=3 235 B10R1.13 OC(=O)C1=NC=C(I)C=C1 AK-29144 [0,1,0,0,0,0|1,0,0]=2 236 B10R1.13 OC1=CC=C(C(=S)N)C=C1 AK-21819 [0,1,0,0,0,0|1,1,0]=3 237 B10R1.13 OC1=CC=C(C(C)=C)C=C1 AK117164 [0,1,0,0,0,0|2,0,0]=3 238 B10R1.13 OC1=CC=C(C(O)C)C=C1 AK-45202 [0,1,0,0,0,0|1,0,1]=3 239 B10R1.13 OC1=CC=C(C=C1)C(F)F AK-76781 [0,1,0,0,0,0|2,0,1]=4 240 B10R1.13 OC1=CC=C(N(C)C)C=C1 AK103764 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.13 OC1=CC=C([C@H](N)C)C=C1 AK608003 [0,1,0,0,0,0|2,0,1]=4 242 B10R1.13 OC1=CN=C(C=C1)[N+](=O)[O-] AK-23835 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.15 C1=C(C(OC)=O)C=CN=C1 AK-46755 [0,1,0,0,0,0|1,0,0]=2 244 B10R1.15 C1=C(C(OC)=O)N=CC=C1 AK-46574 [0,1,0,0,0,0|1,0,0]=2 245 B10R1.15 C1=CC=NC=C1C(OC)=O AK-47410 [0,1,0,0,0,0|1,0,0]=2 246 B10R1.15 C1=NC=CN=C1C(OC)=O AK-47365 [0,1,0,0,0,0|2,0,0]=3 247 B10R1.15 CC(C1=CC=CC=C1)CN AK-67959 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 AK-47624 [0,1,0,0,0,0|2,0,1]=4 249 B10R1.15 C[C@@H](NC)C1=CC=CC=C1 AK140531 [0,1,0,0,0,0|2,0,1]=4 250 B10R1.15 ClC(C=C)C1=CC=CC=C1 AK173991 [0,1,0,0,0,0|2,0,1]=4 251 B10R1.15 FC(C1=CC=CC=C1)CBr AK-93540 [0,1,0,0,0,0|2,0,1]=4 252 B10R1.15 N1=NC=C(C=C1)C(=O)OC AK-48857 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.15 NCC(C1=CC=CC=C1)=O AK-26107 [0,1,0,0,0,0|1,0,0]=2 254 B10R1.15 NCC(O)C1=NC=CC=C1 AK157200 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 AK-45230 [0,1,0,0,0,0|1,0,1]=3 256 B10R1.15 NC[C@@H](O)C1=CC=CN=C1 AK-96401 [0,1,0,0,0,0|2,0,1]=4 257 B10R1.15 NNC(=O)C1=CC=NC=C1 AK-46317 [0,1,0,0,0,0|2,0,0]=3 258 B10R1.15 NNC(C1=CC=CN=C1)=O AK-44810 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.15 N[C@H](C1=CC=CC=C1)CO AK-41249 [0,1,0,0,0,0|1,0,1]=3 260 B10R1.15 O=C(C1=NC=CC=C1)CBr AK-44981 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.15 O=C(C1=NC=CC=N1)OC AK-24352 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.15 O=C(C1=NC=NC=C1)NN AK-68698 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.15 O=C(C1=NN=CC=C1)OC AK-68100 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.15 O=C(NC)C1=CC=CC=C1 AK323662 [0,1,0,0,0,0|1,0,0]=2 265 B10R1.15 O=C(NN)C1=NC=CC=C1 AK117449 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.15 O=C(NN)C1=NC=CN=C1 AK-48495 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.15 O=CN(C)C1=CC=CC=C1 AK-48601 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.15 O=S(C1=CC=CC=C1)OC AK109245 [0,1,0,0,0,0|1,0,0]=2 269 B10R1.15 OC(C1=CC=CC=C1)CBr AK-76552 [0,1,0,0,0,0|1,0,1]=3 270 B10R1.15 OC(C1=CC=CC=C1)CO AK117070 [0,1,0,0,0,0|0,0,2]=3 271 B10R1.15 OCC(=O)C1=CC=CC=C1 AK-94786 [0,1,0,0,0,0|0,0,0]=1 272 B10R1.15 OCC(N)C1=CC=CC=C1 AK-47370 [0,1,0,0,0,0|1,0,1]=3 273 B10R1.15 O[C@@H](C1=CC=CC=C1)CO AK-45210 [0,1,0,0,0,0|0,0,2]=3 274 B10R1.15 O[C@H](C1=CC=CC=C1)CO AK-33573 [0,1,0,0,0,0|0,0,2]=3 275 B10R1.15 [C@H](N)(C1=CC=CC=C1)CO AK-41260 [0,1,0,0,0,0|1,0,1]=3 276 B10R1.28 C1=C([S](O)(=O)=O)C=CC=C1 AK-51336 [0,1,0,0,0,0|1,0,0]=2 277 B10R1.28 CC(C)(O)C1=NC=CC=C1 AK111321 [0,1,0,0,0,0|2,0,1]=4 278 B10R1.28 CC(N)(C1=CC=CC=C1)C AK116559 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 AK-59630 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.28 ClS(=O)(=O)C1=CC=NC=C1 AK-74325 [0,1,0,0,0,0|2,0,1]=4 281 B10R1.28 F[B-](F)(F)C1=CC=CC=C1 AK105337 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.28 N1=CC(=CC=C1)[S](=O)(=O)Cl AK-27033 [0,1,0,0,0,0|2,0,1]=4 283 B10R1.28 N1=CC(=CC=C1)[S](=O)(=O)Cl AK-27053 [0,1,0,0,0,0|2,0,1]=4 284 B10R1.28 O=S(C1=CC=CC=C1)(N)=O AK-77414 [0,1,0,0,0,0|1,0,1]=3 285 B10R1.28 O=S(C1=CC=CN=C1)(O)=O AK-47361 [0,1,0,0,0,0|2,0,0]=3 286 B10R1.28 O=S(C1=NC=CC=C1)(N)=O AK-67939 [0,1,0,0,0,0|2,0,1]=4 287 B10R1.61 BrC1=C(C(=O)N)C=CN=C1 AK-29834 [0,1,0,0,0,0|2,0,0]=3 288 B10R1.61 BrC1=C(C=CN=C1)C(=O)O AK-23517 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.61 BrC1=C(C=CN=C1)[N+](=O)[O-] AK-23685 [0,1,0,0,0,0|2,0,1]=4 290 B10R1.61 BrC1=CC=CN=C1C(=O)O AK-25745 [0,1,0,0,0,0|1,0,0]=2 291 B10R1.61 BrC1=CN=CN=C1C(=O)O AK-23815 [0,1,0,0,0,0|2,0,0]=3 292 B10R1.61 BrC1=NC=CN=C1C(=O)O AK-30736 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.61 C1=C(C(=CC=C1)B(O)O)O AK-45876 [0,1,0,0,0,0|1,0,1]=3 294 B10R1.61 C1=C(C(=NC=C1)Cl)C(N)=O AK-39181 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.61 C1=C(C(=NC=C1)Cl)C(O)=O AK-27015 [0,1,0,0,0,0|1,0,0]=2 296 B10R1.61 C1=C(C(=NC=C1)F)C(O)=O AK-25163 [0,1,0,0,0,0|1,0,0]=2 297 B10R1.61 C1=C(C(=NC=C1)N)[N+](=O)[O-] AK-25955 [0,1,0,0,0,0|2,0,1]=4 298 B10R1.61 C1=CC(=C(C=C1)N(C)C)N AK-65098 [0,1,0,0,0,0|3,0,0]=4 299 B10R1.61 C1=CC=CC(=C1B(O)O)Br AK-34317 [0,1,0,0,0,0|1,0,1]=3 300 B10R1.61 C1=CC=CC(=C1B(O)O)C AK-33581 [0,1,0,0,0,0|1,0,1]=3 301 B10R1.61 C1=CC=CC(=C1C(C)=O)Br AK-48030 [0,1,0,0,0,0|1,0,0]=2 302 B10R1.61 C1=CC=CC(=C1C(C)=O)N AK-27106 [0,1,0,0,0,0|1,0,0]=2 303 B10R1.61 C1=CC=CC(=C1C(O)=O)F AK-40433 [0,1,0,0,0,0|0,0,0]=1 304 B10R1.61 C1=CC=CC(=C1O)C(=O)C AK-44482 [0,1,0,0,0,0|1,0,0]=2 305 B10R1.61 C1=CC=NC(=C1C)C(O)=O AK-26613 [0,1,0,0,0,0|1,0,0]=2 306 B10R1.61 C1=CC=NC(=C1N)[N+](=O)[O-] AK-25367 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.61 C1=CC=NC(=C1[N+]([O-])=O)Br AK-33945 [0,1,0,0,0,0|2,0,1]=4 308 B10R1.61 C1=CN=C(C(=C1)C(=O)N)F AK-25200 [0,1,0,0,0,0|2,0,0]=3 309 B10R1.61 C1=CN=C(C(=C1)Cl)[N+]([O-])=O AK-26621 [0,1,0,0,0,0|2,0,1]=4 310 B10R1.61 C1=CN=C(C(=N1)C(O)=O)N AK-16902 [0,1,0,0,0,0|2,0,0]=3 311 B10R1.61 C1=CN=CC(=C1C(=O)O)F AK-25903 [0,1,0,0,0,0|1,0,0]=2 312 B10R1.61 C1=NC=CC(=C1C(O)=O)C AK-34679 [0,1,0,0,0,0|1,0,0]=2 313 B10R1.61 C1=NC=CC(=C1[N+]([O-])=O)Cl AK-25355 [0,1,0,0,0,0|2,0,1]=4 314 B10R1.61 CC(=O)C1=C(Br)C=NC=N1 AK-31153 [0,1,0,0,0,0|3,0,0]=4 315 B10R1.61 CC(=O)C1=C(C)N=CC=N1 AK-89662 [0,1,0,0,0,0|3,0,0]=4 316 B10R1.61 CC(=O)C1=C(I)C=CC=C1 AK-84650 [0,1,0,0,0,0|1,0,0]=2 317 B10R1.61 CC(=O)C1=CC=CN=C1F AK-36408 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.61 CC(=O)C1=CC=CN=C1N AK-61895 [0,1,0,0,0,0|2,0,0]=3 319 B10R1.61 CC(=O)C1=NC=CC=C1F AK-36671 [0,1,0,0,0,0|2,0,0]=3 320 B10R1.61 CC(C1=C(O)C=NC=C1)=O AK-68365 [0,1,0,0,0,0|2,0,0]=3 321 B10R1.61 CC(C1=CC=CC=C1Br)C AK-80369 [0,1,0,0,0,0|2,0,1]=4 322 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [0,1,0,0,0,0|1,0,0]=2 323 B10R1.61 CC(C1=CC=CC=C1F)=O AK-44672 [0,1,0,0,0,0|1,0,0]=2 324 B10R1.61 CC(C1=CC=CC=C1I)C AK113600 [0,1,0,0,0,0|2,0,1]=4 325 B10R1.61 CC(C1=CC=CN=C1C)=O AK-60286 [0,1,0,0,0,0|2,0,0]=3 326 B10R1.61 CC(C1=NC=CC=C1Br)=O AK-91392 [0,1,0,0,0,0|2,0,0]=3 327 B10R1.61 CC(C1=NC=CC=C1Cl)=O AK128527 [0,1,0,0,0,0|2,0,0]=3 328 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [0,1,0,0,0,0|2,0,0]=3 329 B10R1.61 CC(N)C1=CC=CC=C1Br AK548207 [0,1,0,0,0,0|2,0,1]=4 330 B10R1.61 CC(N)C1=CC=CC=C1Cl AK-78769 [0,1,0,0,0,0|2,0,1]=4 331 B10R1.61 CC(N)C1=CC=CC=C1Cl AK133214 [0,1,0,0,0,0|2,0,1]=4 332 B10R1.61 CC(N)C1=CC=CC=C1F AK-78757 [0,1,0,0,0,0|2,0,1]=4 333 B10R1.61 CC(O)C1=C(F)C=NC=C1 AK174609 [0,1,0,0,0,0|2,0,1]=4 334 B10R1.61 CC(O)C1=CC=CN=C1Cl AK118779 [0,1,0,0,0,0|2,0,1]=4 335 B10R1.61 CC1=C(C(=O)N)C=CC=N1 AK-39636 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.61 CC1=C(C(=O)O)C=CC=N1 AK-25768 [0,1,0,0,0,0|1,0,0]=2 337 B10R1.61 CC1=C(C=CN=C1)B(O)O AK-36777 [0,1,0,0,0,0|2,0,1]=4 338 B10R1.61 CC1=C(C=NC=C1)[N+]([O-])=O AK104739 [0,1,0,0,0,0|2,0,1]=4 339 B10R1.61 CC1=C(C=NC=N1)C(O)=O AK-32530 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.61 CC1=NC=CC=C1B(O)O AK142095 [0,1,0,0,0,0|2,0,1]=4 341 B10R1.61 CC1=NC=CC=C1N(=O)=O AK-26710 [0,1,0,0,0,0|2,0,1]=4 342 B10R1.61 CC1=NC=CN=C1C(=O)O AK-25946 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.61 CN(C)C1=C(O)C=CC=C1 AK-49738 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.61 CN(C)C1=CC=CC=C1Br AK-86039 [0,1,0,0,0,0|3,0,0]=4 345 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK114068 [0,1,0,0,0,0|2,0,1]=4 346 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK155333 [0,1,0,0,0,0|2,0,1]=4 347 B10R1.61 C[C@@H](N)C1=CC=CC=C1C AK-45079 [0,1,0,0,0,0|2,0,1]=4 348 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl AK-42131 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.61 C[C@@H](N)C1=CC=CC=C1F AK-33841 [0,1,0,0,0,0|2,0,1]=4 350 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl AK-49059 [0,1,0,0,0,0|1,0,1]=3 351 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK-59163 [0,1,0,0,0,0|2,0,1]=4 352 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK174547 [0,1,0,0,0,0|2,0,1]=4 353 B10R1.61 C[C@H](N)C1=CC=CC=C1C AK162902 [0,1,0,0,0,0|2,0,1]=4 354 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK-36100 [0,1,0,0,0,0|2,0,1]=4 355 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK162903 [0,1,0,0,0,0|2,0,1]=4 356 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl AK-57726 [0,1,0,0,0,0|1,0,1]=3 357 B10R1.61 C[C@H](O)C1=CC=CC=C1F AK114295 [0,1,0,0,0,0|1,0,1]=3 358 B10R1.61 ClC1=C(B(O)O)C=CN=C1 AK-93757 [0,1,0,0,0,0|2,0,1]=4 359 B10R1.61 ClC1=C(C(=O)O)C=CN=C1 AK-26411 [0,1,0,0,0,0|1,0,0]=2 360 B10R1.61 ClC1=C(C=CC=C1)B(O)O AK-34973 [0,1,0,0,0,0|1,0,1]=3 361 B10R1.61 ClC1=C(C=CN=C1)[N+](=O)[O-] AK-31573 [0,1,0,0,0,0|2,0,1]=4 362 B10R1.61 ClC1=CC=CN=C1C(=O)O AK-23699 [0,1,0,0,0,0|1,0,0]=2 363 B10R1.61 ClC1=CC=NC=C1C(=O)O AK-25252 [0,1,0,0,0,0|1,0,0]=2 364 B10R1.61 ClC1=NC=CC=C1B(O)O AK-29980 [0,1,0,0,0,0|2,0,1]=4 365 B10R1.61 ClC1=NC=CN=C1C(=O)O AK-24100 [0,1,0,0,0,0|2,0,0]=3 366 B10R1.61 FC1=C(C(=N)N)C=CC=C1 AK-16801-8 [0,1,0,0,0,0|2,0,0]=3 367 B10R1.61 FC1=C(C=CN=C1)C(C)=O AK-37142 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.61 FC1=C(N=CC=C1)C(=O)O AK-28801 [0,1,0,0,0,0|1,0,0]=2 369 B10R1.61 FC1=CC=CC=C1B(O)O AK-45733 [0,1,0,0,0,0|1,0,1]=3 370 B10R1.61 FC1=CC=CN=C1[N+](=O)[O-] AK-23503 [0,1,0,0,0,0|2,0,1]=4 371 B10R1.61 FC1=NC=CC=C1[N+](=O)[O-] AK-33351 [0,1,0,0,0,0|2,0,1]=4 372 B10R1.61 N=C(N)C1=NC=CC=C1C AK130359 [0,1,0,0,0,0|3,0,0]=4 373 B10R1.61 NC(C1=CC=CC=C1Br)C AK-50562 [0,1,0,0,0,0|2,0,1]=4 374 B10R1.61 NC1=C(C=CN=N1)C(=O)O AK-24603 [0,1,0,0,0,0|2,0,0]=3 375 B10R1.61 NC1=C(C=NC=C1)C(=O)N AK-29493 [0,1,0,0,0,0|2,0,0]=3 376 B10R1.61 NC1=C(C=NC=C1)C(O)=O AK-27731 [0,1,0,0,0,0|1,0,0]=2 377 B10R1.61 NC1=CC=CC=C1B(O)O AK-77788 [0,1,0,0,0,0|1,0,1]=3 378 B10R1.61 N[C@@H](C1=CC=CC=C1F)C AK-42098 [0,1,0,0,0,0|2,0,1]=4 379 B10R1.61 O=C(C1=CN=CN=C1N)O AK-34045 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.61 O=C(C1=CN=CN=C1O)N AK343645 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.61 O=C(C1=CN=CNC1=O)O AK-39341 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.61 O=C(C1=NC=CC=C1N)O AK-25432 [0,1,0,0,0,0|1,0,0]=2 383 B10R1.61 O=C(C1=NC=CN=C1Cl)N AK-80835 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.61 O=C(C1=NC=CN=C1I)O AK-30598 [0,1,0,0,0,0|2,0,0]=3 385 B10R1.61 O=C(C1=NC=CN=C1O)N AK-39215 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.61 O=C(C1=NC=CNC1=O)O AK-30536 [0,1,0,0,0,0|2,0,0]=3 387 B10R1.61 O=C(C1=NC=NC=C1C)O AK140920 [0,1,0,0,0,0|2,0,0]=3 388 B10R1.61 O=C(N)C1=CC=CC=C1Br AK-47071 [0,1,0,0,0,0|1,0,0]=2 389 B10R1.61 O=C(N)C1=CC=CC=C1Cl AK128986 [0,1,0,0,0,0|1,0,0]=2 390 B10R1.61 O=C(N)C1=CC=CC=C1F AK161780 [0,1,0,0,0,0|1,0,0]=2 391 B10R1.61 O=C(N)C1=CC=CC=C1I AK115884 [0,1,0,0,0,0|1,0,0]=2 392 B10R1.61 O=C(N)C1=CC=CC=C1N AK109256 [0,1,0,0,0,0|1,0,0]=2 393 B10R1.61 O=C(N)C1=CC=NC=C1C AK-29933 [0,1,0,0,0,0|2,0,0]=3 394 B10R1.61 O=C(N)C1=CC=NC=C1N AK-77290 [0,1,0,0,0,0|2,0,0]=3 395 B10R1.61 O=C(N)C1=NC=CC=C1C AK-48603 [0,1,0,0,0,0|2,0,0]=3 396 B10R1.61 O=C(N)C1=NC=CC=C1N AK-35369 [0,1,0,0,0,0|2,0,0]=3 397 B10R1.61 O=C(O)C1=C(N)N=CC=C1 AK-26982 [0,1,0,0,0,0|1,0,0]=2 398 B10R1.61 O=C(O)C1=C(S)N=CC=C1 AK-48961 [0,1,0,0,0,0|1,0,0]=2 399 B10R1.61 O=C(O)C1=CC=CC=C1Br AK-77301 [0,1,0,0,0,0|0,0,0]=1 400 B10R1.61 O=C(O)C1=CC=CC=C1C AK116916 [0,1,0,0,0,0|0,0,0]=1 401 B10R1.61 O=C(O)C1=CC=CC=C1Cl AK-44481 [0,1,0,0,0,0|0,0,0]=1 402 B10R1.61 O=C(O)C1=CC=CC=C1I AK-73132 [0,1,0,0,0,0|0,0,0]=1 403 B10R1.61 O=C(O)C1=CC=NC=C1C AK-30383 [0,1,0,0,0,0|1,0,0]=2 404 B10R1.61 O=C(O)C1=CC=NC=C1N AK-23678 [0,1,0,0,0,0|1,0,0]=2 405 B10R1.61 O=C(O)C1=CC=NC=C1O AK-23523 [0,1,0,0,0,0|1,0,0]=2 406 B10R1.61 O=C(O)C1=CN=CC=C1Br AK-25100 [0,1,0,0,0,0|1,0,0]=2 407 B10R1.61 O=C(O)C1=CN=CC=C1C AK-75600 [0,1,0,0,0,0|1,0,0]=2 408 B10R1.61 O=C(O)C1=NC=CC=C1I AK-29488 [0,1,0,0,0,0|1,0,0]=2 409 B10R1.61 O=C(O)C1=NC=CC=C1O AK-26380 [0,1,0,0,0,0|1,0,0]=2 410 B10R1.61 O=C1C(=CC=CN1)C(O)=O AK-47329 [0,1,0,0,0,0|1,0,0]=2 411 B10R1.61 O=C1C(=CNC=C1)C(=O)O AK-26174 [0,1,0,0,0,0|1,0,0]=2 412 B10R1.61 O=C1C(=CNC=C1)[N+](=O)[O-] AK-25459 [0,1,0,0,0,0|2,0,1]=4 413 B10R1.61 O=C1C(C(C)=O)=CC=CN1 AK-35911 [0,1,0,0,0,0|2,0,0]=3 414 B10R1.61 O=C1C(C(C)=O)=CNC=C1 AK501394 [0,1,0,0,0,0|2,0,0]=3 415 B10R1.61 O=[N+](C1=C(Br)C=CN=C1)[O-] AK-34243 [0,1,0,0,0,0|2,0,1]=4 416 B10R1.61 O=[N+](C1=C(C)C=CN=C1)[O-] AK-28081 [0,1,0,0,0,0|2,0,1]=4 417 B10R1.61 O=[N+](C1=C(F)C=NC=C1)[O-] AK-28774 [0,1,0,0,0,0|2,0,1]=4 418 B10R1.61 O=[N+](C1=C(I)C=NC=C1)[O-] AK-51426 [0,1,0,0,0,0|2,0,1]=4 419 B10R1.61 O=[N+](C1=C(N)C=CN=C1)[O-] AK-28863 [0,1,0,0,0,0|2,0,1]=4 420 B10R1.61 O=[N+](C1=C(N)C=NC=C1)[O-] AK-28775 [0,1,0,0,0,0|2,0,1]=4 421 B10R1.61 O=[N+](C1=CC=CN=C1C)[O-] AK-23642 [0,1,0,0,0,0|2,0,1]=4 422 B10R1.61 O=[N+](C1=CC=CN=C1Cl)[O-] AK-27005 [0,1,0,0,0,0|2,0,1]=4 423 B10R1.61 O=[N+](C1=NC=CC=C1Br)[O-] AK-26100 [0,1,0,0,0,0|2,0,1]=4 424 B10R1.61 O=[N+](C1=NC=CC=C1I)[O-] AK140224 [0,1,0,0,0,0|2,0,1]=4 425 B10R1.61 OB(C1=C(F)C=NC=C1)O AK-26936 [0,1,0,0,0,0|2,0,1]=4 426 B10R1.61 OB(C1=CC=CC=C1N)O AK-35638 [0,1,0,0,0,0|1,0,1]=3 427 B10R1.61 OB(C1=CC=CN=C1Br)O AK-27205 [0,1,0,0,0,0|2,0,1]=4 428 B10R1.61 OB(C1=CC=CN=C1F)O AK-27647 [0,1,0,0,0,0|2,0,1]=4 429 B10R1.61 OB(C1=NC=CC=C1C)O AK-36898 [0,1,0,0,0,0|2,0,1]=4 430 B10R1.61 OC(=O)C1=CC=CN=C1Br AK-25846 [0,1,0,0,0,0|1,0,0]=2 431 B10R1.61 OC(=O)C1=CC=NNC1=O AK-89567 [0,1,0,0,0,0|2,0,0]=3 432 B10R1.61 OC1=C([N+]([O-])=O)C=CN=C1 AK-28776 [0,1,0,0,0,0|2,0,1]=4 433 B10R1.61 OC1=CC=CC=C1C(N)=O AK-81394 [0,1,0,0,0,0|1,0,0]=2 434 B10R1.61 OC1=CC=CC=C1C(O)=O AK397674 [0,1,0,0,0,0|0,0,0]=1 435 B10R1.61 OC1=CC=CN=C1[N+]([O-])=O AK-28551 [0,1,0,0,0,0|2,0,1]=4 436 B10R1.61 SC1=NC=CC=C1[N+]([O-])=O AK-49743 [0,1,0,0,0,0|2,0,1]=4 437 B10R1.61 [O-]C1=CC=CC=C1[N+]([O-])=O AK135512 [0,1,0,0,0,0|1,0,1]=3 438 B10R1.113 BrC1=CC(=CC=C1)C(F)F AK-50673 [0,1,0,0,0,0|2,0,1]=4 439 B10R1.113 BrC1=CC(=CN=C1)C(=C)C AK-40102 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.113 BrC1=CC(=CN=C1)[N+](=O)[O-] AK-24340 [0,1,0,0,0,0|2,0,1]=4 441 B10R1.113 BrC1=NC(=CC=C1)[N+](=O)[O-] AK-25599 [0,1,0,0,0,0|2,0,1]=4 442 B10R1.113 C(C)(=O)C1=CC(=CN=C1)Br AK-25899 [0,1,0,0,0,0|2,0,0]=3 443 B10R1.113 C(C)(=O)C1=CC(=NC=C1)C AK-26955 [0,1,0,0,0,0|2,0,0]=3 444 B10R1.113 C(C)(=O)C1=NC(=CC=C1)Br AK-30565 [0,1,0,0,0,0|2,0,0]=3 445 B10R1.113 C1=C(C(C)=O)C=C(C=C1)O AK-46681 [0,1,0,0,0,0|1,0,0]=2 446 B10R1.113 C1=C(C=C(C=N1)B(O)O)C AK-27227 [0,1,0,0,0,0|2,0,1]=4 447 B10R1.113 C1=C(C=C(N=C1)N)C(=O)O AK-25375 [0,1,0,0,0,0|1,0,0]=2 448 B10R1.113 C1=C(C=CC=C1Br)B(O)O AK-23693 [0,1,0,0,0,0|1,0,1]=3 449 B10R1.113 C1=C(C=CC=C1Cl)C(O)=O AK-43975 [0,1,0,0,0,0|0,0,0]=1 450 B10R1.113 C1=C(C=CC=C1F)C(O)=O AK-53854 [0,1,0,0,0,0|0,0,0]=1 451 B10R1.113 C1=C(C=NC=C1Br)C(N)=O AK-34529 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.113 C1=C(C=NC=C1C(O)=O)F AK-25931 [0,1,0,0,0,0|1,0,0]=2 453 B10R1.113 C1=C(C=NC=C1C)C(O)=O AK-23837 [0,1,0,0,0,0|1,0,0]=2 454 B10R1.113 C1=C(C=NC=C1Cl)C(O)=O AK-25160 [0,1,0,0,0,0|1,0,0]=2 455 B10R1.113 C1=C(Cl)N=CC=C1B(O)O AK-26000 [0,1,0,0,0,0|2,0,1]=4 456 B10R1.113 C1=C(N=C(C=C1)Cl)[N+]([O-])=O AK-28534 [0,1,0,0,0,0|2,0,1]=4 457 B10R1.113 C1=CC=C(F)N=C1C(=O)O AK-30385 [0,1,0,0,0,0|1,0,0]=2 458 B10R1.113 C1=CC=C(N=C1C(O)=O)C AK-27736 [0,1,0,0,0,0|1,0,0]=2 459 B10R1.113 C1=CN=C(C=C1B(O)O)F AK-30379 [0,1,0,0,0,0|2,0,1]=4 460 B10R1.113 C1=NC=C(C=C1C(=O)N)N AK-26169 [0,1,0,0,0,0|2,0,0]=3 461 B10R1.113 C1=NC=C(Cl)N=C1C(=O)O AK-27777 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.113 C1=NC=C(N=C1C(=O)O)C AK-26120 [0,1,0,0,0,0|2,0,0]=3 463 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AK-34279 [0,1,0,0,0,0|2,0,0]=3 464 B10R1.113 CC(=O)C1=CC=NC(Cl)=N1 AK100632 [0,1,0,0,0,0|3,0,0]=4 465 B10R1.113 CC(C1=CC(Br)=CC=C1)C AK-61854 [0,1,0,0,0,0|2,0,1]=4 466 B10R1.113 CC(C1=CC(F)=CN=C1)=O AK101043 [0,1,0,0,0,0|2,0,0]=3 467 B10R1.113 CC(C1=CC(N)=NC=C1)=O AK134215 [0,1,0,0,0,0|2,0,0]=3 468 B10R1.113 CC(C1=CC=CC(Br)=C1)=O AK-44590 [0,1,0,0,0,0|1,0,0]=2 469 B10R1.113 CC(C1=CC=CC(C)=C1)=O AK143347 [0,1,0,0,0,0|1,0,0]=2 470 B10R1.113 CC(C1=NC(Cl)=CC=C1)=O AK-29671 [0,1,0,0,0,0|2,0,0]=3 471 B10R1.113 CC(C1=NC(F)=CC=C1)=O AK-74181 [0,1,0,0,0,0|2,0,0]=3 472 B10R1.113 CC(C1=NC=CC(C)=C1)=O AK-61872 [0,1,0,0,0,0|2,0,0]=3 473 B10R1.113 CC(C1=NC=CC(Cl)=C1)=O AK-30041 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.113 CC(C1=NC=NC(C)=C1)=O AK-78932 [0,1,0,0,0,0|3,0,0]=4 475 B10R1.113 CC(N)C1=CC=CC(C)=C1 AK-95787 [0,1,0,0,0,0|2,0,1]=4 476 B10R1.113 CC(O)C1=CC(N)=NC=C1 AK109512 [0,1,0,0,0,0|2,0,1]=4 477 B10R1.113 CC(O)C1=NC(Br)=CC=C1 AK-58995 [0,1,0,0,0,0|2,0,1]=4 478 B10R1.113 CC1=CC(=NC=C1)[N+]([O-])=O AK-33823 [0,1,0,0,0,0|2,0,1]=4 479 B10R1.113 CC1=CC(B(O)O)=CC=C1 AK-41078 [0,1,0,0,0,0|1,0,1]=3 480 B10R1.113 CC1=CC=CC(=C1)C(N)=N AK-45199 [0,1,0,0,0,0|2,0,0]=3 481 B10R1.113 CC1=CC=CC(B(O)O)=N1 AK-25864 [0,1,0,0,0,0|2,0,1]=4 482 B10R1.113 CC1=CC=CC(C(C)=O)=N1 AK-30134 [0,1,0,0,0,0|2,0,0]=3 483 B10R1.113 CC1=CC=NC(=C1)C(=O)O AK-30381 [0,1,0,0,0,0|1,0,0]=2 484 B10R1.113 CC1=CC=NC(=N1)C(O)=O AK-36910 [0,1,0,0,0,0|2,0,0]=3 485 B10R1.113 CC1=NC=CC(=N1)C(=O)O AK-23648 [0,1,0,0,0,0|2,0,0]=3 486 B10R1.113 CC1=NC=CC(B(O)O)=C1 AK-35728 [0,1,0,0,0,0|2,0,1]=4 487 B10R1.113 CN(C)C1=CC=CC(Br)=C1 AK-63444 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.113 C[C@@H](C1=CC=CC(N)=C1)N AK326677 [0,1,0,0,0,0|2,0,1]=4 489 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK-33750 [0,1,0,0,0,0|2,0,1]=4 490 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 AK338979 [0,1,0,0,0,0|2,0,1]=4 491 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK-45077 [0,1,0,0,0,0|2,0,1]=4 492 B10R1.113 C[C@@H](N)C1=CC=CC(C)=C1 AK133442 [0,1,0,0,0,0|2,0,1]=4 493 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 AK-29516 [0,1,0,0,0,0|2,0,1]=4 494 B10R1.113 C[C@@H](O)C1=CC=CC(Cl)=C1 AK103057 [0,1,0,0,0,0|1,0,1]=3 495 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK-33217 [0,1,0,0,0,0|2,0,1]=4 496 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 AK338984 [0,1,0,0,0,0|2,0,1]=4 497 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 AK-35182 [0,1,0,0,0,0|2,0,1]=4 498 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 AK-58281 [0,1,0,0,0,0|1,0,1]=3 499 B10R1.113 ClC1=CC(=CN=C1)N(=O)=O AK-23519 [0,1,0,0,0,0|2,0,1]=4 500 B10R1.113 ClC1=CC(=NC=C1)[N+](=O)[O-] AK-23757 [0,1,0,0,0,0|2,0,1]=4 501 B10R1.113 ClC1=CC(B(O)O)=NC=C1 AK-81399 [0,1,0,0,0,0|2,0,1]=4 502 B10R1.113 ClC1=CC=CC(=C1)B(O)O AK-47360 [0,1,0,0,0,0|1,0,1]=3 503 B10R1.113 ClC1=NC=CC(=C1)[N+](=O)[O-] AK-25623 [0,1,0,0,0,0|2,0,1]=4 504 B10R1.113 ClC1=NC=CC(=N1)C(=O)O AK-28365 [0,1,0,0,0,0|2,0,0]=3 505 B10R1.113 FC1=CC(B(O)O)=CC=C1 AK-45904 [0,1,0,0,0,0|1,0,1]=3 506 B10R1.113 IC1=CC=CC(=C1)B(O)O AK-45910 [0,1,0,0,0,0|1,0,1]=3 507 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 AK-16801-7 [0,1,0,0,0,0|2,0,0]=3 508 B10R1.113 N=C(N)C1=NC=CC(C)=C1 AK130218 [0,1,0,0,0,0|3,0,0]=4 509 B10R1.113 NC(=O)C1=CN=CC(Cl)=N1 AK-39096 [0,1,0,0,0,0|3,0,0]=4 510 B10R1.113 NC1=CC(C(C)=O)=CC=C1 AK-83273 [0,1,0,0,0,0|1,0,0]=2 511 B10R1.113 NC1=CC(N(C)C)=CC=C1 AK162007 [0,1,0,0,0,0|3,0,0]=4 512 B10R1.113 NC1=CC=NC(=C1)C(=O)O AK-72771 [0,1,0,0,0,0|1,0,0]=2 513 B10R1.113 NC1=CN=CC(=C1)B(O)O AK-75513 [0,1,0,0,0,0|2,0,1]=4 514 B10R1.113 NC1=CN=CC(=C1)C(O)=O AK-34306 [0,1,0,0,0,0|1,0,0]=2 515 B10R1.113 NC1=CN=CC(=N1)C(=O)O AK-30537 [0,1,0,0,0,0|2,0,0]=3 516 B10R1.113 NC1=CN=CC(B(O)O)=C1 AK-32936 [0,1,0,0,0,0|2,0,1]=4 517 B10R1.113 NC1=NC=CC([N+]([O-])=O)=C1 AK-29259 [0,1,0,0,0,0|2,0,1]=4 518 B10R1.113 N[C@@H](C1=CC=CC(F)=C1)C AK-45028 [0,1,0,0,0,0|2,0,1]=4 519 B10R1.113 N[C@H](C1=CC=CC(F)=C1)C AK-42995 [0,1,0,0,0,0|2,0,1]=4 520 B10R1.113 O=C(C1=CC(=O)N=CN1)O AK-24985 [0,1,0,0,0,0|2,0,0]=3 521 B10R1.113 O=C(C1=CC=CC(Cl)=N1)O AK-26005 [0,1,0,0,0,0|1,0,0]=2 522 B10R1.113 O=C(C1=CC=CC(N1)=O)O AK-25557 [0,1,0,0,0,0|1,0,0]=2 523 B10R1.113 O=C(C1=NC(Br)=CN=C1)O AK158200 [0,1,0,0,0,0|2,0,0]=3 524 B10R1.113 O=C(C1=NC(Br)=NC=C1)O AK145986 [0,1,0,0,0,0|2,0,0]=3 525 B10R1.113 O=C(C1=NC(Cl)=NC=C1)N AK107035 [0,1,0,0,0,0|3,0,0]=4 526 B10R1.113 O=C(C1=NC(N)=NC=C1)N AK145739 [0,1,0,0,0,0|3,0,0]=4 527 B10R1.113 O=C(C1=NC(N)=NC=C1)O AK-65335 [0,1,0,0,0,0|2,0,0]=3 528 B10R1.113 O=C(C1=NC=CC(Br)=C1)O AK-23753 [0,1,0,0,0,0|1,0,0]=2 529 B10R1.113 O=C(C1=NC=NC(C)=C1)O AK114394 [0,1,0,0,0,0|2,0,0]=3 530 B10R1.113 O=C(C1=NN=CC(Cl)=C1)O AK398901 [0,1,0,0,0,0|2,0,0]=3 531 B10R1.113 O=C(C=1C=CNC(C1)=O)O AK-75663 [0,1,0,0,0,0|1,0,0]=2 532 B10R1.113 O=C(C=1C=CNC(C1)=S)O AK161760 [0,1,0,0,0,0|1,0,0]=2 533 B10R1.113 O=C(N)C1=CC=CC(Br)=C1 AK-61366 [0,1,0,0,0,0|1,0,0]=2 534 B10R1.113 O=C(N)C1=NC=CC(N)=C1 AK103735 [0,1,0,0,0,0|2,0,0]=3 535 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 AK-77039 [0,1,0,0,0,0|0,0,0]=1 536 B10R1.113 O=C(O)C1=CC=CC(C)=C1 AK116994 [0,1,0,0,0,0|0,0,0]=1 537 B10R1.113 O=C(O)C1=CC=CC(I)=C1 AK-40488 [0,1,0,0,0,0|0,0,0]=1 538 B10R1.113 O=C(O)C1=CC=CC(N)=C1 AK-41177 [0,1,0,0,0,0|0,0,0]=1 539 B10R1.113 O=C(O)C1=CC=CC(O)=C1 AK-50288 [0,1,0,0,0,0|0,0,0]=1 540 B10R1.113 O=C(O)C1=CC=NC(Br)=C1 AK-26241 [0,1,0,0,0,0|1,0,0]=2 541 B10R1.113 O=C(O)C1=CC=NC(C)=C1 AK-23516 [0,1,0,0,0,0|1,0,0]=2 542 B10R1.113 O=C(O)C1=CC=NC(O)=C1 AK-27187 [0,1,0,0,0,0|1,0,0]=2 543 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 AK-25583 [0,1,0,0,0,0|1,0,0]=2 544 B10R1.113 O=C(O)C1=CN=CC(I)=C1 AK-28811 [0,1,0,0,0,0|1,0,0]=2 545 B10R1.113 O=C(O)C1=CN=CC(O)=C1 AK-25698 [0,1,0,0,0,0|1,0,0]=2 546 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 AK-23768 [0,1,0,0,0,0|1,0,0]=2 547 B10R1.113 O=C(O)C1=NC=CC(I)=C1 AK-30405 [0,1,0,0,0,0|1,0,0]=2 548 B10R1.113 O=C1NC(=CC=N1)C(=O)O AK-30175 [0,1,0,0,0,0|2,0,0]=3 549 B10R1.113 O=C1NN=CC(=C1)C(=O)O AK-26372 [0,1,0,0,0,0|2,0,0]=3 550 B10R1.113 O=[N+](C1=CC(Br)=NC=C1)[O-] AK-28278 [0,1,0,0,0,0|2,0,1]=4 551 B10R1.113 O=[N+](C1=CC(C)=NC=C1)[O-] AK-23785 [0,1,0,0,0,0|2,0,1]=4 552 B10R1.113 O=[N+](C1=NC=CC(Br)=C1)[O-] AK132918 [0,1,0,0,0,0|2,0,1]=4 553 B10R1.113 O=[N+](C1=NC=CC(N)=C1)[O-] AK-28786 [0,1,0,0,0,0|2,0,1]=4 554 B10R1.113 OB(C1=CC(F)=CN=C1)O AK-36635 [0,1,0,0,0,0|2,0,1]=4 555 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-27034 [0,1,0,0,0,0|1,0,1]=3 556 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-43360 [0,1,0,0,0,0|1,0,1]=3 557 B10R1.113 OB(C1=CC=CC(N)=C1)O AK-44816 [0,1,0,0,0,0|1,0,1]=3 558 B10R1.113 OB(C1=CC=CC(O)=C1)O AK-44803 [0,1,0,0,0,0|1,0,1]=3 559 B10R1.113 OB(O)C1=CC(Br)=NC=C1 AK-45672 [0,1,0,0,0,0|2,0,1]=4 560 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 AK-26378 [0,1,0,0,0,0|2,0,1]=4 561 B10R1.113 OC(=O)C1=CC(Cl)=NC=C1 AK-26209 [0,1,0,0,0,0|1,0,0]=2 562 B10R1.113 OC(=O)C1=CC(F)=NC=C1 AK-25930 [0,1,0,0,0,0|1,0,0]=2 563 B10R1.113 OC(=O)C1=NC(Br)=CC=C1 AK-25597 [0,1,0,0,0,0|1,0,0]=2 564 B10R1.113 OC(=O)C1=NC=NC(Cl)=C1 AK-29233 [0,1,0,0,0,0|2,0,0]=3 565 B10R1.113 OC1=CC([N+]([O-])=O)=CN=C1 AK-28936 [0,1,0,0,0,0|2,0,1]=4 566 B10R1.113 OC1=CC=CC(N(C)C)=C1 AK-51741 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.113 OC1=CC=CC([C@H](N)C)=C1 AK-77840 [0,1,0,0,0,0|2,0,1]=4 568 B10R1.113 [N+](=O)([O-])C1=CC=CC(=N1)N AK-28785 [0,1,0,0,0,0|2,0,1]=4 569 B10R1.113 [N+](=O)([O-])C1=CN=CC(=C1)N AK-29617 [0,1,0,0,0,0|2,0,1]=4 570 B10R1.113 [O-][N+](=O)C1=CN=CC(F)=C1 AK100223 [0,1,0,0,0,0|2,0,1]=4 571 B10R1.113 [O-][N+](=O)C1=NC=CC(F)=C1 AK-98164 [0,1,0,0,0,0|2,0,1]=4 572 B10R2.320 BrC1C2=CC=CC=C2C1 AK163275 [0,0,0,1,0,0|2,0,1]=4 573 B10R2.320 C1=CC=CC2=C1CC2=O AK-72898 [0,0,0,1,0,0|1,0,0]=2 574 B8R1.7 C1=C(B(O)O)OC=C1 AK-47548 [0,0,0,0,1,0|2,0,1]=4 575 B8R1.7 C1=C(C(=O)O)[NH]C=N1 AK-25282 [0,0,0,0,1,0|2,0,0]=3 576 B8R1.7 C1=COC=C1C(O)=O AK-32276 [0,0,0,0,1,0|1,0,0]=2 577 B8R1.7 C1=CSC(=N1)C(C)=O AK-46781 [0,0,0,0,1,0|3,0,0]=4 578 B8R1.7 C1=NC=C(S1)C(=O)O AK-27761 [0,0,0,0,1,0|2,0,0]=3 579 B8R1.7 C1=N[NH]C=C1C(O)=O AK-25877 [0,0,0,0,1,0|2,0,0]=3 580 B8R1.7 CC(=O)C1=CC=CN1 AK-53458 [0,0,0,0,1,0|2,0,0]=3 581 B8R1.7 CC(=O)C1=CC=NO1 AK-68495 [0,0,0,0,1,0|3,0,0]=4 582 B8R1.7 CC(=O)C1=CSC=C1 AK-44537 [0,0,0,0,1,0|2,0,0]=3 583 B8R1.7 NC(=O)C1=COC=N1 AK-99961 [0,0,0,0,1,0|3,0,0]=4 584 B8R1.7 O1C=CC(=N1)C(=O)O AK-27692 [0,0,0,0,1,0|2,0,0]=3 585 B8R1.7 O1N=CC(=N1)C(=O)O AK-32069 [0,0,0,0,1,0|3,0,0]=4 586 B8R1.7 O=C(C1=CC=CN1)O AK-44225 [0,0,0,0,1,0|1,0,0]=2 587 B8R1.7 O=C(C1=CC=CO1)O AK-72863 [0,0,0,0,1,0|1,0,0]=2 588 B8R1.7 O=C(C1=CC=CS1)[O-] AK110095 [0,0,0,0,1,0|1,0,1]=3 589 B8R1.7 O=C(C1=CC=NO1)O AK-25596 [0,0,0,0,1,0|2,0,0]=3 590 B8R1.7 O=C(C1=CC=NS1)O AK-94814 [0,0,0,0,1,0|2,0,0]=3 591 B8R1.7 O=C(C1=CCCC1)O AK-33463 [0,0,0,0,1,0|0,0,3]=4 592 B8R1.7 O=C(C1=CN=CO1)O AK-28732 [0,0,0,0,1,0|2,0,0]=3 593 B8R1.7 O=C(C1=CNC=C1)C AK-45953 [0,0,0,0,1,0|2,0,0]=3 594 B8R1.7 O=C(C1=CNC=N1)C AK-45163 [0,0,0,0,1,0|3,0,0]=4 595 B8R1.7 O=C(C1=COC=N1)O AK-29026 [0,0,0,0,1,0|2,0,0]=3 596 B8R1.7 O=C(C1=CSC=C1)O AK-46373 [0,0,0,0,1,0|1,0,0]=2 597 B8R1.7 O=C(C1=CSC=N1)O AK-23931 [0,0,0,0,1,0|2,0,0]=3 598 B8R1.7 O=C(C1=CSN=C1)O AK-84534 [0,0,0,0,1,0|2,0,0]=3 599 B8R1.7 O=C(C1=NC=CN1)N AK139797 [0,0,0,0,1,0|3,0,0]=4 600 B8R1.7 O=C(C1=NC=CO1)[O-] AK-93393 [0,0,0,0,1,0|2,0,1]=4 601 B8R1.7 O=C(C1=NNC=C1)N AK-27992 [0,0,0,0,1,0|3,0,0]=4 602 B8R1.7 O=C(C1=NNC=C1)O AK-29904 [0,0,0,0,1,0|2,0,0]=3 603 B8R1.7 O=C(C1CC=CC1)O AK-36334 [0,0,0,0,1,0|0,0,3]=4 604 B8R1.7 O=C([C@H]1NCC=C1)O AK-77612 [0,0,0,0,1,0|1,0,2]=4 605 B8R1.7 O=[N+](C1=CC=CN1)[O-] AK-77322 [0,0,0,0,1,0|2,0,1]=4 606 B8R1.7 OB(C1=CC=CS1)O AK-46314 [0,0,0,0,1,0|2,0,1]=4 607 B8R1.7 OB(C1=COC=C1)O AK-44100 [0,0,0,0,1,0|2,0,1]=4 608 B8R1.7 OB(C1=CSC=C1)O AK-26187 [0,0,0,0,1,0|2,0,1]=4 609 B8R1.7 OC(=O)C1=CNC=C1 AK-26450 [0,0,0,0,1,0|1,0,0]=2 610 B8R1.7 OC(=O)C1=CNN=N1 AK-28855 [0,0,0,0,1,0|3,0,0]=4 611 B8R1.7 S1C=C(N=C1)C(C)=O AK-39395 [0,0,0,0,1,0|3,0,0]=4 612 B8R1.7 S1C=CN=C1C(=O)O AK-21895 [0,0,0,0,1,0|2,0,0]=3 613 B8R1.7 S=C(C1=CC=CS1)N AK-40144 [0,0,0,0,1,0|2,1,0]=4 614 B8R1.7 [C@@H]1(NCC=C1)C(O)=O AK-45899 [0,0,0,0,1,0|1,0,2]=4 615 B8R1.7 [NH]1C=CN=C1C(=O)O AK-27693 [0,0,0,0,1,0|2,0,0]=3 616 B8R1.7 [O-]C(=O)C1=CC=CS1 AK111442 [0,0,0,0,1,0|1,0,1]=3 617 B8R1.7 [O-][N+](=O)C1=CNC=C1 AK-82340 [0,0,0,0,1,0|2,0,1]=4 618 B10R1.18 C1=C(C=CN=C1)CC(C)=O AK-47657 [0,0,0,0,0,1|2,0,0]=3 619 B10R1.18 C1=C(C=CN=C1)CC(O)=O AK-45111 [0,0,0,0,0,1|1,0,0]=2 620 B10R1.18 C1=NC=CC=C1CC(O)=O AK-26036 [0,0,0,0,0,1|1,0,0]=2 621 B10R1.18 CC(C)OC1=CC=CC=C1 AK110874 [0,0,0,0,0,1|2,0,1]=4 622 B10R1.18 CC(CC1=NC=CC=C1)=O AK-32596 [0,0,0,0,0,1|2,0,0]=3 623 B10R1.18 CC(NC1=NC=CC=N1)=O AK137493 [0,0,0,0,0,1|3,0,0]=4 624 B10R1.18 C\C(C)=C/C1=CC=CC=C1 AK113914 [0,0,0,0,0,1|2,0,0]=3 625 B10R1.18 FC(F)OC1=CC=CC=C1 AK161726 [0,0,0,0,0,1|2,0,1]=4 626 B10R1.18 N1=CN=CC(=C1)CC(=O)O AK-32588 [0,0,0,0,0,1|2,0,0]=3 627 B10R1.18 N=C(N)CC1=CC=CC=C1 AK-77604 [0,0,0,0,0,1|2,0,0]=3 628 B10R1.18 NC(NC1=CC=CC=C1)=N AK117130 [0,0,0,0,0,1|2,0,0]=3 629 B10R1.18 O=C(N)CC1=CC=CC=C1 AK-45803 [0,0,0,0,0,1|1,0,0]=2 630 B10R1.18 O=C(N)CC1=CC=CN=C1 AK-81612 [0,0,0,0,0,1|2,0,0]=3 631 B10R1.18 O=C(N)CC1=NC=CC=N1 AK133068 [0,0,0,0,0,1|3,0,0]=4 632 B10R1.18 O=C(N)NC1=NC=CN=C1 AK321494 [0,0,0,0,0,1|3,0,0]=4 633 B10R1.18 O=C(O)CC1=CC=CN=C1 AK-26773 [0,0,0,0,0,1|1,0,0]=2 634 B10R1.18 OC(=N)NC1=CC=CC=C1 AK-65147 [0,0,0,0,0,1|1,0,0]=2 635 B10R1.18 OC(=O)CC1=CC=CC=N1 AK-45110 [0,0,0,0,0,1|1,0,0]=2 636 B10R1.18 S=C(Cl)OC1=CC=CC=C1 AK163079 [0,0,0,0,0,1|1,1,0]=3 637 B10R1.18 S=C(N)NC1=CC=CC=C1 AK305328 [0,0,0,0,0,1|1,1,0]=3 638 B10R1.18 S=C(N)NC1=NC=CC=C1 AK158972 [0,0,0,0,0,1|2,1,0]=4 639 B7R0.4 C\C=C\C=C\C([O-])=O AK-47286 [1,0,1,0,0,0|0,0,2]=4 640 B7R1.3 BrC1=CC=NC=C1 AK-47562 [2,0,0,0,0,0|2,0,0]=4 641 B7R1.3 C1=C(Cl)C=CN=C1 AK-50078 [2,0,0,0,0,0|2,0,0]=4 642 B7R1.3 FC1=CC=NC=C1 AK-61793 [2,0,0,0,0,0|2,0,0]=4 643 B7R1.3 IC1=CC=CC=C1 AK-88660 [2,0,0,0,0,0|1,0,0]=3 644 B7R1.3 IC1=CC=CN=C1 AK-46371 [2,0,0,0,0,0|2,0,0]=4 645 B7R1.3 IC1=CC=NC=C1 AK-47904 [2,0,0,0,0,0|2,0,0]=4 646 B7R1.3 IC1=NC=CC=C1 AK-43060 [2,0,0,0,0,0|2,0,0]=4 647 B7R1.3 N1=CN=C(C=C1)O AK-25153 [2,0,0,0,0,0|2,0,0]=4 648 B7R1.3 O=C1C=CC=NN1 AK-29318 [2,0,0,0,0,0|2,0,0]=4 649 B7R1.3 O=C1C=COC=C1 AK110934 [2,0,0,0,0,0|1,0,0]=3 650 B7R1.3 O=C1NC=CN=C1 AK-24500 [2,0,0,0,0,0|2,0,0]=4 651 B7R1.3 O=C1NC=NC=C1 Ak-75843 [2,0,0,0,0,0|2,0,0]=4 652 B7R1.3 OC1=CC=CN=C1 AK-44238 [2,0,0,0,0,0|1,0,0]=3 653 B7R1.3 OC1=CC=NC=C1 AK110406 [2,0,0,0,0,0|1,0,0]=3 654 B7R1.3 OC1=CN=CN=C1 AK-28351 [2,0,0,0,0,0|2,0,0]=4 655 B7R1.3 OC1=CN=NC=C1 AK-28962 [2,0,0,0,0,0|2,0,0]=4 656 B7R1.3 OC1=NC=CC=N1 AK-41674 [2,0,0,0,0,0|2,0,0]=4 657 B7R1.3 OC1=NC=CC=N1 AK-49044 [2,0,0,0,0,0|2,0,0]=4 658 B7R1.3 [S-]C1=CC=CC=C1 AK316593 [2,0,0,0,0,0|0,1,0]=3 659 B9R0.15 C=CCC(CC=C)C(O)=O AK146124 [0,1,1,0,0,0|0,0,2]=4 660 B9R1.1 C1=C(C=CC(=C1)Br)C#C AK-39898 [1,1,0,0,0,0|1,0,1]=4 661 B9R1.1 C1=C(C=CC(=C1)CN)O AK-47356 [1,1,0,0,0,0|1,0,1]=4 662 B9R1.1 C1=C(C=CC(=C1)F)C#N AK-44484 [1,1,0,0,0,0|1,0,1]=4 663 B9R1.1 C1=C(C=CC(=C1)I)C=O AK-75599 [1,1,0,0,0,0|0,0,0]=2 664 B9R1.1 C1=C(C=NC(=C1)CO)Br AK-26386 [1,1,0,0,0,0|1,0,1]=4 665 B9R1.1 C1=C(NN)C=CC(=C1)C AK-47398 [1,1,0,0,0,0|2,0,0]=4 666 B9R1.1 C1=CC(=CC=C1Br)CC AK-47528 [1,1,0,0,0,0|1,0,1]=4 667 B9R1.1 C1=CC(=CC=C1CO)O AK-47325 [1,1,0,0,0,0|0,0,1]=3 668 B9R1.1 C1=CC(=CC=C1I)NC AK-39846 [1,1,0,0,0,0|2,0,0]=4 669 B9R1.1 C1=CC(=NC=C1CO)Cl AK-28987 [1,1,0,0,0,0|1,0,1]=4 670 B9R1.1 C1=NC(=CC=C1C=O)Br AK-25442 [1,1,0,0,0,0|1,0,0]=3 671 B9R1.1 C1=NC(=CC=C1C=O)Cl AK-25624 [1,1,0,0,0,0|1,0,0]=3 672 B9R1.1 C1=NC(=NC=C1C=O)N AK-28546 [1,1,0,0,0,0|2,0,0]=4 673 B9R1.1 CC1=CC=C(C=O)C=C1 AK-65210 [1,1,0,0,0,0|0,0,0]=2 674 B9R1.1 CC1=CC=C(CO)C=N1 AK-78311 [1,1,0,0,0,0|1,0,1]=4 675 B9R1.1 CC1=CN=C(C=C1)C=O AK-35332 [1,1,0,0,0,0|1,0,0]=3 676 B9R1.1 CC1=NC=C(C=C1)C=O AK-26076 [1,1,0,0,0,0|1,0,0]=3 677 B9R1.1 CNC1=CC=C(Cl)C=C1 AK129065 [1,1,0,0,0,0|2,0,0]=4 678 B9R1.1 CNC1=CC=C(F)C=C1 AK-87253 [1,1,0,0,0,0|2,0,0]=4 679 B9R1.1 COC1=CC=C(Cl)C=C1 AK116963 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.1 COC1=CC=C(I)C=C1 AK-44747 [1,1,0,0,0,0|2,0,0]=4 681 B9R1.1 COC1=CC=C(O)C=C1 AK-46469 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.1 ClC1=CC=C(C=C1)C#N AK-54448 [1,1,0,0,0,0|1,0,1]=4 683 B9R1.1 ClC1=CN=C(C=C1)C=O AK-44636 [1,1,0,0,0,0|1,0,0]=3 684 B9R1.1 ClC1=NC=C(C=O)C=N1 AK-29616 [1,1,0,0,0,0|2,0,0]=4 685 B9R1.1 ClC1=NC=C(C=O)N=C1 AK-87373 [1,1,0,0,0,0|2,0,0]=4 686 B9R1.1 FC1=NC=C(C=C1)C=O AK-25098 [1,1,0,0,0,0|1,0,0]=3 687 B9R1.1 IC1=CC=C(CBr)C=C1 AK-54650 [1,1,0,0,0,0|1,0,1]=4 688 B9R1.1 IC1=CC=C(CC)C=C1 AK121966 [1,1,0,0,0,0|1,0,1]=4 689 B9R1.1 N#CC1=CC=C(I)C=C1 AK-45950 [1,1,0,0,0,0|1,0,1]=4 690 B9R1.1 N#CC1=CC=C(N)C=C1 AK-41176 [1,1,0,0,0,0|1,0,1]=4 691 B9R1.1 NC1=CC=C(C#C)C=C1 AK-59413 [1,1,0,0,0,0|1,0,1]=4 692 B9R1.1 NC1=CC=C(C=N1)CO AK-29786 [1,1,0,0,0,0|1,0,1]=4 693 B9R1.1 NC1=CC=C(NC)C=C1 AK-86240 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.1 NCC1=CC=C(Br)C=C1 AK-46356 [1,1,0,0,0,0|1,0,1]=4 695 B9R1.1 NCC1=CC=C(Br)C=C1 AK-49170 [1,1,0,0,0,0|1,0,1]=4 696 B9R1.1 NCC1=CC=C(Cl)C=C1 AK-44456 [1,1,0,0,0,0|1,0,1]=4 697 B9R1.1 NCC1=CC=C(I)C=C1 AK-81624 [1,1,0,0,0,0|1,0,1]=4 698 B9R1.1 NNC1=CC=C(Br)C=C1 AK-26194 [1,1,0,0,0,0|2,0,0]=4 699 B9R1.1 NNC1=CC=C(Cl)C=C1 AK-41259 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.1 NNC1=CC=C(Cl)C=C1 AK132992 [1,1,0,0,0,0|2,0,0]=4 701 B9R1.1 NNC1=CC=C(F)C=C1 AK-85652 [1,1,0,0,0,0|2,0,0]=4 702 B9R1.1 NNC1=CC=C(I)C=C1 AK-64633 [1,1,0,0,0,0|2,0,0]=4 703 B9R1.1 O=C1C=CC(CO)=CN1 AK-29768 [1,1,0,0,0,0|1,0,1]=4 704 B9R1.1 O=CC1=CC=C(Br)C=C1 AK-80048 [1,1,0,0,0,0|0,0,0]=2 705 B9R1.1 O=CC1=CC=C(Cl)C=C1 AK-76679 [1,1,0,0,0,0|0,0,0]=2 706 B9R1.1 O=CC1=CC=C(F)C=C1 AK-84401 [1,1,0,0,0,0|0,0,0]=2 707 B9R1.1 O=CC1=CC=C(O)C=C1 AK-77323 [1,1,0,0,0,0|0,0,0]=2 708 B9R1.1 O=CC1=CN=C(C)N=C1 AK-36829 [1,1,0,0,0,0|2,0,0]=4 709 B9R1.1 O=CC1=CN=C(N)C=C1 AK114395 [1,1,0,0,0,0|1,0,0]=3 710 B9R1.1 O=CC1=CN=C(N)C=C1 AK125046 [1,1,0,0,0,0|1,0,0]=3 711 B9R1.1 O=CC1=CN=C(N)N=C1 AK118712 [1,1,0,0,0,0|2,0,0]=4 712 B9R1.1 O=CC1=CN=C(O)N=C1 AK199230 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.1 O=CC1=NC=C(Br)C=C1 AK-27944 [1,1,0,0,0,0|1,0,0]=3 714 B9R1.1 O=CC1=NC=C(C)N=C1 AK-40389 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.1 O=CC1=NC=C(F)C=C1 AK-34624 [1,1,0,0,0,0|1,0,0]=3 716 B9R1.1 O=CC1=NC=C(O)C=C1 AK-34625 [1,1,0,0,0,0|1,0,0]=3 717 B9R1.1 O=CC=1C=CC(NC1)=O AK-28718 [1,1,0,0,0,0|1,0,0]=3 718 B9R1.1 OC1=CC=C(C=C)C=C1 AK113778 [1,1,0,0,0,0|1,0,0]=3 719 B9R1.1 OC1=CC=C(C=C1)C#N AK-44095 [1,1,0,0,0,0|1,0,1]=4 720 B9R1.1 OC1=CC=C(CO)N=C1 AK-68040 [1,1,0,0,0,0|1,0,1]=4 721 B9R1.1 OCC1=CC=C(Br)C=C1 AK-93775 [1,1,0,0,0,0|0,0,1]=3 722 B9R1.1 OCC1=CC=C(Br)N=C1 AK-28751 [1,1,0,0,0,0|1,0,1]=4 723 B9R1.1 OCC1=CC=C(C)C=C1 AK-92302 [1,1,0,0,0,0|0,0,1]=3 724 B9R1.1 OCC1=CC=C(Cl)C=C1 AK-94754 [1,1,0,0,0,0|0,0,1]=3 725 B9R1.1 OCC1=CC=C(F)N=C1 AK-76831 [1,1,0,0,0,0|1,0,1]=4 726 B9R1.1 OCC1=CC=C(I)C=C1 AK-72872 [1,1,0,0,0,0|0,0,1]=3 727 B9R1.1 OCC1=CC=C(N)C=C1 AK-51503 [1,1,0,0,0,0|0,0,1]=3 728 B9R1.1 OCC1=NC=C(Cl)C=C1 AK136128 [1,1,0,0,0,0|1,0,1]=4 729 B9R1.1 OCC1=NC=C(F)C=C1 AK-36421 [1,1,0,0,0,0|1,0,1]=4 730 B9R1.2 BrC1=CC(C=C)=CC=C1 AK-76367 [1,1,0,0,0,0|1,0,0]=3 731 B9R1.2 BrC1=CN=CC(=C1)CO AK-29246 [1,1,0,0,0,0|1,0,1]=4 732 B9R1.2 BrC1=NC=CC(=C1)CO AK-25314 [1,1,0,0,0,0|1,0,1]=4 733 B9R1.2 BrCC1=CC(I)=CC=C1 AK-54649 [1,1,0,0,0,0|1,0,1]=4 734 B9R1.2 C#CC1=CC=CC(Br)=C1 AK-45287 [1,1,0,0,0,0|1,0,1]=4 735 B9R1.2 C1=C(C=CC=C1Br)C#N AK-47279 [1,1,0,0,0,0|1,0,1]=4 736 B9R1.2 C1=C(C=CC=C1C#C)N AK-27092 [1,1,0,0,0,0|1,0,1]=4 737 B9R1.2 C1=C(C=CC=C1C#N)O AK-47400 [1,1,0,0,0,0|1,0,1]=4 738 B9R1.2 C1=C(C=CC=C1Cl)C#C AK-47344 [1,1,0,0,0,0|1,0,1]=4 739 B9R1.2 C1=C(C=CC=C1F)NN AK-47492 [1,1,0,0,0,0|2,0,0]=4 740 B9R1.2 C1=C(CO)C=CC=C1N AK-50595 [1,1,0,0,0,0|0,0,1]=3 741 B9R1.2 C1=C(NN)C=CC=C1Br AK-25693 [1,1,0,0,0,0|2,0,0]=4 742 B9R1.2 C1=C(NN)C=CC=C1C AK-47381 [1,1,0,0,0,0|2,0,0]=4 743 B9R1.2 C1=CC=C(Br)N=C1C=O AK-25797 [1,1,0,0,0,0|1,0,0]=3 744 B9R1.2 C1=NC(=CC(=C1)C=O)Cl AK-32653 [1,1,0,0,0,0|1,0,0]=3 745 B9R1.2 CC1=CC(=CN=C1)C=O AK-28384 [1,1,0,0,0,0|1,0,0]=3 746 B9R1.2 CC1=CC(=NC=C1)C=O AK-24250 [1,1,0,0,0,0|1,0,0]=3 747 B9R1.2 CC1=CC(CO)=NC=C1 AK-74173 [1,1,0,0,0,0|1,0,1]=4 748 B9R1.2 CC1=NC=CC(=N1)C=O AK-23647 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.2 CCC1=CC=CC(Br)=C1 AK111102 [1,1,0,0,0,0|1,0,1]=4 750 B9R1.2 CNC1=CC=CC(Br)=C1 AK112706 [1,1,0,0,0,0|2,0,0]=4 751 B9R1.2 COC1=CC(Br)=CC=C1 AK-76817 [1,1,0,0,0,0|2,0,0]=4 752 B9R1.2 COC1=CC(Cl)=CC=C1 AK106212 [1,1,0,0,0,0|2,0,0]=4 753 B9R1.2 ClC1=CC(=NC=C1)CO AK-27991 [1,1,0,0,0,0|1,0,1]=4 754 B9R1.2 ClC1=CC(C=C)=NC=C1 AK100297 [1,1,0,0,0,0|2,0,0]=4 755 B9R1.2 ClC1=CC(CO)=CC=C1 AK-51231 [1,1,0,0,0,0|0,0,1]=3 756 B9R1.2 ClC1=CC=CC(=N1)CO AK-28428 [1,1,0,0,0,0|1,0,1]=4 757 B9R1.2 ClC1=CN=CC(=C1)CO AK-23534 [1,1,0,0,0,0|1,0,1]=4 758 B9R1.2 ClC1=NC(C=O)=CN=C1 AK-64725 [1,1,0,0,0,0|2,0,0]=4 759 B9R1.2 ClCC1=CC(I)=CC=C1 AK-94390 [1,1,0,0,0,0|1,0,1]=4 760 B9R1.2 FC1=CC(=CN=C1)C=O AK-30355 [1,1,0,0,0,0|1,0,0]=3 761 B9R1.2 FC1=CC(C=O)=NC=C1 AK-32767 [1,1,0,0,0,0|1,0,0]=3 762 B9R1.2 FC1=CC(CO)=CC=C1 AK-51232 [1,1,0,0,0,0|0,0,1]=3 763 B9R1.2 FC1=NC(=CC=C1)C=O AK-25580 [1,1,0,0,0,0|1,0,0]=3 764 B9R1.2 N#CC1=CC=CC(I)=C1 AK-76942 [1,1,0,0,0,0|1,0,1]=4 765 B9R1.2 NC1=CC=CC(C#C)=C1 AK119642 [1,1,0,0,0,0|1,0,1]=4 766 B9R1.2 NC1=CC=CC(CN)=C1 AK-76655 [1,1,0,0,0,0|1,0,1]=4 767 B9R1.2 NC1=CC=CC(CO)=N1 AK-85732 [1,1,0,0,0,0|1,0,1]=4 768 B9R1.2 NC1=CC=CC(OC)=C1 AK309398 [1,1,0,0,0,0|2,0,0]=4 769 B9R1.2 NC1=CC=CC(SC)=C1 AK162933 [1,1,0,0,0,0|2,0,0]=4 770 B9R1.2 NCC1=CC(F)=CC=C1 AK-80195 [1,1,0,0,0,0|1,0,1]=4 771 B9R1.2 NCC1=CC=CC(Br)=C1 AK-49144 [1,1,0,0,0,0|1,0,1]=4 772 B9R1.2 NCC1=CC=CC(C)=C1 AK-98167 [1,1,0,0,0,0|1,0,1]=4 773 B9R1.2 NCC1=CC=CC(Cl)=C1 AK-89641 [1,1,0,0,0,0|1,0,1]=4 774 B9R1.2 NCC1=CC=CC(I)=C1 AK-46127 [1,1,0,0,0,0|1,0,1]=4 775 B9R1.2 NNC1=CC=CC(Cl)=C1 AK-46617 [1,1,0,0,0,0|2,0,0]=4 776 B9R1.2 O=CC1=CC=CC(Br)=C1 AK-77027 [1,1,0,0,0,0|0,0,0]=2 777 B9R1.2 O=CC1=CC=CC(Cl)=C1 AK-68812 [1,1,0,0,0,0|0,0,0]=2 778 B9R1.2 O=CC1=CC=CC(F)=C1 AK112743 [1,1,0,0,0,0|0,0,0]=2 779 B9R1.2 O=CC1=CC=CC(I)=C1 AK-50045 [1,1,0,0,0,0|0,0,0]=2 780 B9R1.2 O=CC1=CC=CC(N)=C1 AK121859 [1,1,0,0,0,0|0,0,0]=2 781 B9R1.2 O=CC1=CC=CC(O)=C1 AK-77369 [1,1,0,0,0,0|0,0,0]=2 782 B9R1.2 O=CC1=CC=NC(C)=C1 AK-30085 [1,1,0,0,0,0|1,0,0]=3 783 B9R1.2 O=CC1=CC=NC(Cl)=C1 AK165004 [1,1,0,0,0,0|1,0,0]=3 784 B9R1.2 O=CC1=CC=NC(F)=C1 AK-29829 [1,1,0,0,0,0|1,0,0]=3 785 B9R1.2 O=CC1=CC=NC(O)=C1 AK-24042 [1,1,0,0,0,0|1,0,0]=3 786 B9R1.2 O=CC1=CN=CC(Br)=C1 AK-25300 [1,1,0,0,0,0|1,0,0]=3 787 B9R1.2 O=CC1=CN=CC(O)=C1 AK139755 [1,1,0,0,0,0|1,0,0]=3 788 B9R1.2 O=CC1=NC(C)=CC=C1 AK-45099 [1,1,0,0,0,0|1,0,0]=3 789 B9R1.2 O=CC1=NC(Cl)=CC=C1 AK-29361 [1,1,0,0,0,0|1,0,0]=3 790 B9R1.2 O=CC1=NC=CC(Br)=C1 AK-29828 [1,1,0,0,0,0|1,0,0]=3 791 B9R1.2 OC1=CC(=CC=C1)C#C AK111295 [1,1,0,0,0,0|1,0,1]=4 792 B9R1.2 OC1=CC(CBr)=CC=C1 AK-99880 [1,1,0,0,0,0|1,0,1]=4 793 B9R1.2 OCC1=CC(=O)NC=C1 AK-72519 [1,1,0,0,0,0|1,0,1]=4 794 B9R1.2 OCC1=CC(C)=CN=C1 AK130310 [1,1,0,0,0,0|1,0,1]=4 795 B9R1.2 OCC1=CC(C)=NC=C1 AK-32751 [1,1,0,0,0,0|1,0,1]=4 796 B9R1.2 OCC1=CC(Cl)=NC=C1 AK-32643 [1,1,0,0,0,0|1,0,1]=4 797 B9R1.2 OCC1=CC(F)=NC=C1 AK-57689 [1,1,0,0,0,0|1,0,1]=4 798 B9R1.2 OCC1=CC(N)=CN=C1 AK135137 [1,1,0,0,0,0|1,0,1]=4 799 B9R1.2 OCC1=CC(N)=NC=C1 AK-25275 [1,1,0,0,0,0|1,0,1]=4 800 B9R1.2 OCC1=CC=CC(Br)=C1 AK110441 [1,1,0,0,0,0|0,0,1]=3 801 B9R1.2 OCC1=CC=CC(Br)=N1 AK-34739 [1,1,0,0,0,0|1,0,1]=4 802 B9R1.2 OCC1=NC(C)=CC=C1 AK-47726 [1,1,0,0,0,0|1,0,1]=4 803 B9R1.2 OCC1=NC(Cl)=CC=C1 AK-29179 [1,1,0,0,0,0|1,0,1]=4 804 B9R1.2 OCC1=NC=CC(Br)=C1 AK-25360 [1,1,0,0,0,0|1,0,1]=4 805 B9R1.8 BrCCC1=CC=CC=C1 AK-54085 [1,1,0,0,0,0|1,0,1]=4 806 B9R1.8 C1=C(C=CC=C1)CON AK-49180 [1,1,0,0,0,0|0,0,1]=3 807 B9R1.8 C1=C(CNN)C=CC=C1 AK-72938 [1,1,0,0,0,0|1,0,1]=4 808 B9R1.8 C1=C(N=CC=C1)COC AK-32294 [1,1,0,0,0,0|1,0,1]=4 809 B9R1.8 CNNC1=CC=CC=C1 AK119038 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.8 NOCC1=CC=CC=C1 AK-82317 [1,1,0,0,0,0|0,0,1]=3 811 B9R1.8 ONCC1=CC=CC=C1 AK-49662 [1,1,0,0,0,0|0,0,1]=3 812 B9R1.8 ONCC1=CC=CC=C1 AK110567 [1,1,0,0,0,0|0,0,1]=3 813 B9R1.15 BrC1=NC=CC=C1C=O AK-33078 [1,1,0,0,0,0|1,0,0]=3 814 B9R1.15 BrCC1=C(I)C=CC=C1 AK-54648 [1,1,0,0,0,0|1,0,1]=4 815 B9R1.15 C#CC1=CC=CC=C1Br AK-45286 [1,1,0,0,0,0|1,0,1]=4 816 B9R1.15 C1=C(C(=CC=C1)Br)CC AK-46714 [1,1,0,0,0,0|1,0,1]=4 817 B9R1.15 C1=C(C(=CC=C1)Br)CN AK-73129 [1,1,0,0,0,0|1,0,1]=4 818 B9R1.15 C1=C(C(=CC=C1)Cl)CO AK-46748 [1,1,0,0,0,0|0,0,1]=3 819 B9R1.15 C1=C(C(=CN=C1)O)C=O AK-23522 [1,1,0,0,0,0|1,0,0]=3 820 B9R1.15 C1=CC=CC(=C1C#N)Br AK-46715 [1,1,0,0,0,0|1,0,1]=4 821 B9R1.15 C1=CC=CC(=C1C#N)O AK-47282 [1,1,0,0,0,0|1,0,1]=4 822 B9R1.15 C1=CC=CC(=C1CO)Br AK-51234 [1,1,0,0,0,0|0,0,1]=3 823 B9R1.15 C1=CC=CC(=C1NN)Br AK-35375 [1,1,0,0,0,0|2,0,0]=4 824 B9R1.15 C1=CC=CC(=C1NN)C AK-46554 [1,1,0,0,0,0|2,0,0]=4 825 B9R1.15 C1=CC=CC(=C1NN)Cl AK-37033 [1,1,0,0,0,0|2,0,0]=4 826 B9R1.15 C1=CC=CC(=C1O)CO AK-47595 [1,1,0,0,0,0|0,0,1]=3 827 B9R1.15 C1=CC=CC(=C1OC)F AK-46555 [1,1,0,0,0,0|2,0,0]=4 828 B9R1.15 C1=CC=NC(=C1C=O)Cl AK-25854 [1,1,0,0,0,0|1,0,0]=3 829 B9R1.15 C1=CC=NC(=C1C=O)F AK-29226 [1,1,0,0,0,0|1,0,0]=3 830 B9R1.15 C1=NC(=C(C=C1)CO)N AK-23581 [1,1,0,0,0,0|1,0,1]=4 831 B9R1.15 C=CC1=CC=CC=C1Cl AK114259 [1,1,0,0,0,0|1,0,0]=3 832 B9R1.15 CC1=CC=CC=C1CC AK-49977 [1,1,0,0,0,0|1,0,1]=4 833 B9R1.15 CNC1=CC=CC=C1Cl AK163346 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.15 CNC1=CC=CC=C1F AK-48931 [1,1,0,0,0,0|2,0,0]=4 835 B9R1.15 COC1=CC=CC=C1Br AK-76806 [1,1,0,0,0,0|2,0,0]=4 836 B9R1.15 ClC1=C(C=CC=C1)C#C AK-30160 [1,1,0,0,0,0|1,0,1]=4 837 B9R1.15 ClC1=C(C=CN=C1)C=O AK-25096 [1,1,0,0,0,0|1,0,0]=3 838 B9R1.15 FC1=CC=CN=C1C=O AK-25751 [1,1,0,0,0,0|1,0,0]=3 839 B9R1.15 FC1=CC=CN=C1CO AK-29127 [1,1,0,0,0,0|1,0,1]=4 840 B9R1.15 N#CC1=CC=CC=C1Cl AK-44438 [1,1,0,0,0,0|1,0,1]=4 841 B9R1.15 N#CC1=CC=CC=C1F AK-88419 [1,1,0,0,0,0|1,0,1]=4 842 B9R1.15 N#CC1=CC=CC=C1I AK-76636 [1,1,0,0,0,0|1,0,1]=4 843 B9R1.15 NC1=C(C=O)C=CC=C1 AK-45623 [1,1,0,0,0,0|0,0,0]=2 844 B9R1.15 NC1=CC=CC=C1C#C AK-45718 [1,1,0,0,0,0|1,0,1]=4 845 B9R1.15 NC1=CC=CC=C1C=C AK100084 [1,1,0,0,0,0|1,0,0]=3 846 B9R1.15 NC1=CC=CC=C1NC AK-35283 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.15 NC1=NC=CN=C1C=O AK-30729 [1,1,0,0,0,0|2,0,0]=4 848 B9R1.15 NCC1=CC=CC=C1C AK-89642 [1,1,0,0,0,0|1,0,1]=4 849 B9R1.15 NCC1=CC=CC=C1Cl AK-78184 [1,1,0,0,0,0|1,0,1]=4 850 B9R1.15 NCC1=CC=CC=C1F AK-88519 [1,1,0,0,0,0|1,0,1]=4 851 B9R1.15 NCC1=CC=CC=C1I AK-94126 [1,1,0,0,0,0|1,0,1]=4 852 B9R1.15 NNC1=CC=CC=C1Br AK-33609 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.15 NNC1=CC=CC=C1F AK-78527 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.15 NNC1=CC=CC=C1I AK198825 [1,1,0,0,0,0|2,0,0]=4 855 B9R1.15 O=CC1=C(C)N=CC=C1 AK-35801 [1,1,0,0,0,0|1,0,0]=3 856 B9R1.15 O=CC1=CC=CC=C1Br AK-50022 [1,1,0,0,0,0|0,0,0]=2 857 B9R1.15 O=CC1=CC=CC=C1F AK-88670 [1,1,0,0,0,0|0,0,0]=2 858 B9R1.15 O=CC1=CC=CC=C1I AK-94125 [1,1,0,0,0,0|0,0,0]=2 859 B9R1.15 O=CC1=CC=CC=C1N AK550048 [1,1,0,0,0,0|0,0,0]=2 860 B9R1.15 O=CC1=CC=CN=C1N AK-24791 [1,1,0,0,0,0|1,0,0]=3 861 B9R1.15 O=CC1=CC=CNC1=O AK-23653 [1,1,0,0,0,0|1,0,0]=3 862 B9R1.15 O=CC1=CC=NC=C1Br AK-32444 [1,1,0,0,0,0|1,0,0]=3 863 B9R1.15 O=CC1=CC=NC=C1Cl AK162974 [1,1,0,0,0,0|1,0,0]=3 864 B9R1.15 O=CC1=CC=NC=C1F AK-37427 [1,1,0,0,0,0|1,0,0]=3 865 B9R1.15 O=CC1=CN=CC=C1N AK-35124 [1,1,0,0,0,0|1,0,0]=3 866 B9R1.15 O=CC1=NC=CC=C1C AK-26127 [1,1,0,0,0,0|1,0,0]=3 867 B9R1.15 O=CC1=NC=CC=C1Cl AK-28957 [1,1,0,0,0,0|1,0,0]=3 868 B9R1.15 OC1=C(C=O)N=CC=C1 AK-47968 [1,1,0,0,0,0|1,0,0]=3 869 B9R1.15 OC1=CC=CC=C1CN AK-49022 [1,1,0,0,0,0|1,0,1]=4 870 B9R1.15 OC1=CC=CC=C1CN AK167666 [1,1,0,0,0,0|1,0,1]=4 871 B9R1.15 OC1=CC=CC=C1OC AK114448 [1,1,0,0,0,0|2,0,0]=4 872 B9R1.15 OCC1=C(Br)C=CN=C1 AK-86110 [1,1,0,0,0,0|1,0,1]=4 873 B9R1.15 OCC1=C(Br)C=NC=C1 AK-38288 [1,1,0,0,0,0|1,0,1]=4 874 B9R1.15 OCC1=C(Cl)C=CN=C1 AK124400 [1,1,0,0,0,0|1,0,1]=4 875 B9R1.15 OCC1=C(F)C=NC=C1 AK-90171 [1,1,0,0,0,0|1,0,1]=4 876 B9R1.15 OCC1=C(N)C=CN=C1 AK-58822 [1,1,0,0,0,0|1,0,1]=4 877 B9R1.15 OCC1=C(N)C=NC=C1 AK-74165 [1,1,0,0,0,0|1,0,1]=4 878 B9R1.15 OCC1=CC=CC=C1I AK-77177 [1,1,0,0,0,0|0,0,1]=3 879 B9R1.15 OCC1=CC=CC=C1N AK-49868 [1,1,0,0,0,0|0,0,1]=3 880 B9R1.15 OCC1=CC=CN=C1Cl AK-23619 [1,1,0,0,0,0|1,0,1]=4 881 B9R1.15 OCC1=CC=CN=C1F AK-33110 [1,1,0,0,0,0|1,0,1]=4 882 B9R1.15 OCC1=NC=CC=C1Cl AK133056 [1,1,0,0,0,0|1,0,1]=4 883 B9R1.11 BrCC(=O)C1=CC=CS1 AK-53454 [0,1,0,0,1,0|2,0,0]=4 884 B9R1.11 C1=C(C(=O)OC)SC=N1 AK-29865 [0,1,0,0,1,0|2,0,0]=4 885 B9R1.11 COC(=O)C1=CNC=C1 AK-39320 [0,1,0,0,1,0|1,0,0]=3 886 B9R1.11 COC(=O)C1=COC=N1 AK100835 [0,1,0,0,1,0|2,0,0]=4 887 B9R1.11 COC(=O)C1=NC=CO1 AK109950 [0,1,0,0,1,0|2,0,0]=4 888 B9R1.11 O=C(C1=CC=CN1)OC AK-27729 [0,1,0,0,1,0|1,0,0]=3 889 B9R1.11 O=C(C1=CC=CS1)OC AK-48323 [0,1,0,0,1,0|1,0,0]=3 890 B9R1.11 O=C(C1=CN=CN1)OC AK-25496 [0,1,0,0,1,0|2,0,0]=4 891 B9R1.11 O=C(C1=CN=CN1)OC AK-40808 [0,1,0,0,1,0|2,0,0]=4 892 B9R1.11 O=C(C1=CNN=C1)OC AK-65272 [0,1,0,0,1,0|2,0,0]=4 893 B9R1.11 O=C(C1=CSC=C1)OC AK-48045 [0,1,0,0,1,0|1,0,0]=3 894 B9R1.11 O=C(C1=CSC=N1)OC AK-21853 [0,1,0,0,1,0|2,0,0]=4 895 B9R1.11 O=C(C1=NC=CN1)OC AK-59662 [0,1,0,0,1,0|2,0,0]=4 896 B9R1.11 O=C(C1=NC=CS1)OC AK-50497 [0,1,0,0,1,0|2,0,0]=4 897 B9R1.11 O=C(C1=NNC=C1)OC AK-31981 [0,1,0,0,1,0|2,0,0]=4 898 B9R1.19 O=S(C1=CC=CS1)(O)=O AK-53556 [0,1,0,0,1,0|2,0,0]=4 899 B9R1.35 BrC1=CC(=CS1)C(=O)O AK-28622 [0,1,0,0,1,0|1,0,0]=3 900 B9R1.35 BrC1=CC(=CS1)C(C)=O AK-35777 [0,1,0,0,1,0|2,0,0]=4 901 B9R1.35 C1=C(C(=O)O)SC(=N1)N AK-24488 [0,1,0,0,1,0|2,0,0]=4 902 B9R1.35 C1=C(C)[NH]N=C1C(O)=O AK-27812 [0,1,0,0,1,0|2,0,0]=4 903 B9R1.35 C1=C(OC(=C1)Br)C(O)=O AK-35759 [0,1,0,0,1,0|1,0,0]=3 904 B9R1.35 C1=C(OC(=C1)C)C(O)=O AK-44799 [0,1,0,0,1,0|1,0,0]=3 905 B9R1.35 C1=C(ON=C1Br)C(=O)O AK-21783 [0,1,0,0,1,0|2,0,0]=4 906 B9R1.35 C1=C(SC(=C1)C(O)=O)Cl AK-29045 [0,1,0,0,1,0|1,0,0]=3 907 B9R1.35 C1=C(SC(=C1)C)C(=O)C AK-33183 [0,1,0,0,1,0|2,0,0]=4 908 B9R1.35 C1=C(SC(=C1)Cl)C(C)=O AK-47623 [0,1,0,0,1,0|2,0,0]=4 909 B9R1.35 C1=C(SC(=N1)C)C(=O)O AK-35030 [0,1,0,0,1,0|2,0,0]=4 910 B9R1.35 CC(=O)C1=CC=C(C)O1 AK-77189 [0,1,0,0,1,0|2,0,0]=4 911 B9R1.35 CC(C1=CC(Cl)=CS1)=O AK-77338 [0,1,0,0,1,0|2,0,0]=4 912 B9R1.35 CC1=CC=C(N1)C(O)=O AK100045 [0,1,0,0,1,0|1,0,0]=3 913 B9R1.35 CC1=CN=C(S1)C(=O)O AK-26650 [0,1,0,0,1,0|2,0,0]=4 914 B9R1.35 CN1C=CC(=C1)C(O)=O AK-28665 [0,1,0,0,1,0|1,0,0]=3 915 B9R1.35 ClC1=CC(=CS1)C(=O)O AK-29222 [0,1,0,0,1,0|1,0,0]=3 916 B9R1.35 O=C(C1=CC(Br)=CN1)N AK106602 [0,1,0,0,1,0|2,0,0]=4 917 B9R1.35 O=C(C1=CC(Br)=CO1)N AK120768 [0,1,0,0,1,0|2,0,0]=4 918 B9R1.35 O=C(C1=CC(Br)=CS1)N AK-90412 [0,1,0,0,1,0|2,0,0]=4 919 B9R1.35 O=C(C1=CC(Br)=CS1)O AK-24697 [0,1,0,0,1,0|1,0,0]=3 920 B9R1.35 O=C(C1=CC(C)=NO1)O AK-29291 [0,1,0,0,1,0|2,0,0]=4 921 B9R1.35 O=C(C1=CC(O)=NO1)O AK-58553 [0,1,0,0,1,0|2,0,0]=4 922 B9R1.35 O=C(C1=CC=C(Br)S1)O AK-26297 [0,1,0,0,1,0|1,0,0]=3 923 B9R1.35 O=C(C1=CC=C(C)S1)O AK-25546 [0,1,0,0,1,0|1,0,0]=3 924 B9R1.35 O=C(C1=CC=C(Cl)O1)O AK-94156 [0,1,0,0,1,0|1,0,0]=3 925 B9R1.35 O=C(C1=CC=C(F)S1)O AK-35162 [0,1,0,0,1,0|1,0,0]=3 926 B9R1.35 O=C(C1=CC=C(I)S1)O AK113691 [0,1,0,0,1,0|1,0,0]=3 927 B9R1.35 O=C(C1=CN(C)C=N1)O AK-30010 [0,1,0,0,1,0|2,0,0]=4 928 B9R1.35 O=C(C1=CN(C)N=C1)O AK-39751 [0,1,0,0,1,0|2,0,0]=4 929 B9R1.35 O=C(C1=CN=C(Br)S1)O AK-26941 [0,1,0,0,1,0|2,0,0]=4 930 B9R1.35 O=C(C1=CN=C(C)O1)O AK-43778 [0,1,0,0,1,0|2,0,0]=4 931 B9R1.35 O=C(C1=CNC(C)=C1)O AK-78330 [0,1,0,0,1,0|1,0,0]=3 932 B9R1.35 O=C(C1=CNC(C)=N1)O AK-78654 [0,1,0,0,1,0|2,0,0]=4 933 B9R1.35 O=C(C1=COC(Br)=N1)O AK-76031 [0,1,0,0,1,0|2,0,0]=4 934 B9R1.35 O=C(C1=COC(I)=N1)O AK-41227 [0,1,0,0,1,0|2,0,0]=4 935 B9R1.35 O=C(C1=CSC(Br)=C1)N AK138264 [0,1,0,0,1,0|2,0,0]=4 936 B9R1.35 O=C(C1=CSC(Br)=N1)O AK-23610 [0,1,0,0,1,0|2,0,0]=4 937 B9R1.35 O=C(C1=CSC(Cl)=N1)O AK-48303 [0,1,0,0,1,0|2,0,0]=4 938 B9R1.35 O=C(C1=NC(Br)=CS1)O AK-40795 [0,1,0,0,1,0|2,0,0]=4 939 B9R1.35 O=C(C1=NC(C)=CN1)O AK-29453 [0,1,0,0,1,0|2,0,0]=4 940 B9R1.35 O=C(C1=NC=C(Br)S1)O AK122038 [0,1,0,0,1,0|2,0,0]=4 941 B9R1.35 O=C(C1=NN(C)C=C1)O AK-79303 [0,1,0,0,1,0|2,0,0]=4 942 B9R1.35 O=C(C1=NNC(Br)=C1)O AK128451 [0,1,0,0,1,0|2,0,0]=4 943 B9R1.35 O=C(C1=NNC(Cl)=C1)O AK112708 [0,1,0,0,1,0|2,0,0]=4 944 B9R1.35 O=C(C1=NOC(C)=C1)O AK-25795 [0,1,0,0,1,0|2,0,0]=4 945 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 AK-48243 [0,1,0,0,1,0|2,0,0]=4 946 B9R1.35 O=C(O)C1=CC(Br)=CO1 AK-41331 [0,1,0,0,1,0|1,0,0]=3 947 B9R1.35 OC(=O)C1=CC(Br)=CN1 AK-27737 [0,1,0,0,1,0|1,0,0]=3 948 B9R1.35 OC(=O)C1=CC(Cl)=CS1 AK-89071 [0,1,0,0,1,0|1,0,0]=3 949 B9R1.35 OC(=O)C1=CC(F)=CS1 AK-29152 [0,1,0,0,1,0|1,0,0]=3 950 B9R1.35 OC(=O)C1=CC=C(Br)N1 AK100216 [0,1,0,0,1,0|1,0,0]=3 951 B9R1.35 OC(=O)C1=CNC(=O)N1 AK-68699 [0,1,0,0,1,0|2,0,0]=4 952 B9R1.35 OC(=O)C1=COC(Cl)=N1 AK-72648 [0,1,0,0,1,0|2,0,0]=4 953 B9R1.35 OC(=O)C1=NNC(O)=C1 AK-96196 [0,1,0,0,1,0|2,0,0]=4 954 B9R1.41 C1=CC(=C(S1)N)C(=O)N AK-50549 [0,1,0,0,1,0|2,0,0]=4 955 B9R1.41 C1=NC(=C(C(O)=O)O1)C AK-25663 [0,1,0,0,1,0|2,0,0]=4 956 B9R1.41 CC(C1=CC=CN1C)=O AK148515 [0,1,0,0,1,0|2,0,0]=4 957 B9R1.41 CC1=C(C=CN1)C(O)=O AK-77215 [0,1,0,0,1,0|1,0,0]=3 958 B9R1.41 CC1=C(OC=C1)C(O)=O AK-89342 [0,1,0,0,1,0|1,0,0]=3 959 B9R1.41 CC1=NOC=C1C(=O)O AK-33667 [0,1,0,0,1,0|2,0,0]=4 960 B9R1.41 ClC1=C(C=CS1)C(=O)O AK-29355 [0,1,0,0,1,0|1,0,0]=3 961 B9R1.41 FC1=C(SC=C1)C(=O)O AK-29153 [0,1,0,0,1,0|1,0,0]=3 962 B9R1.41 O=C(C1=C(Br)C=CS1)O AK-29480 [0,1,0,0,1,0|1,0,0]=3 963 B9R1.41 O=C(C1=C(Br)C=NN1)O AK-59621 [0,1,0,0,1,0|2,0,0]=4 964 B9R1.41 O=C(C1=C(Br)SC=C1)O AK-34310 [0,1,0,0,1,0|1,0,0]=3 965 B9R1.41 O=C(C1=C(Br)SC=N1)O AK-22047 [0,1,0,0,1,0|2,0,0]=4 966 B9R1.41 O=C(C1=C(C)C=CN1)O AK-36827 [0,1,0,0,1,0|1,0,0]=3 967 B9R1.41 O=C(C1=C(C)C=CS1)O AK-25644 [0,1,0,0,1,0|1,0,0]=3 968 B9R1.41 O=C(C1=C(C)C=NO1)O AK-25674 [0,1,0,0,1,0|2,0,0]=4 969 B9R1.41 O=C(C1=C(C)N=CS1)O AK-29930 [0,1,0,0,1,0|2,0,0]=4 970 B9R1.41 O=C(C1=C(C)OC=N1)O AK-24069 [0,1,0,0,1,0|2,0,0]=4 971 B9R1.41 O=C(C1=C(C)ON=C1)O AK-32464 [0,1,0,0,1,0|2,0,0]=4 972 B9R1.41 O=C(C1=C(C)SC=C1)O AK-33900 [0,1,0,0,1,0|1,0,0]=3 973 B9R1.41 O=C(C1=C(C)SC=N1)O AK-25323 [0,1,0,0,1,0|2,0,0]=4 974 B9R1.41 O=C(C1=C(Cl)C=NN1)O AK-75702 [0,1,0,0,1,0|2,0,0]=4 975 B9R1.41 O=C(C1=C(Cl)C=NS1)O AK314030 [0,1,0,0,1,0|2,0,0]=4 976 B9R1.41 O=C(C1=C(I)C=CS1)O AK167455 [0,1,0,0,1,0|1,0,0]=3 977 B9R1.41 O=C(C1=C(I)C=NN1)O AK-92905 [0,1,0,0,1,0|2,0,0]=4 978 B9R1.41 O=C(C1=CC=CN1N)N AK-45334 [0,1,0,0,1,0|2,0,0]=4 979 B9R1.41 O=C(C1=CC=NN1C)O AK-33521 [0,1,0,0,1,0|2,0,0]=4 980 B9R1.41 O=C(C1=CN=CN1C)O AK-35106 [0,1,0,0,1,0|2,0,0]=4 981 B9R1.41 O=C(C1=CNN=C1C)O AK-39586 [0,1,0,0,1,0|2,0,0]=4 982 B9R1.41 O=C(C1=CNN=C1N)O AK-46321 [0,1,0,0,1,0|2,0,0]=4 983 B9R1.41 O=C(C1=CSC=C1C)O AK-64461 [0,1,0,0,1,0|1,0,0]=3 984 B9R1.41 O=C(C1=NC=CN1C)O AK-28560 [0,1,0,0,1,0|2,0,0]=4 985 B9R1.41 O=C(C1=NNC=C1Br)O AK-46340 [0,1,0,0,1,0|2,0,0]=4 986 B9R1.41 O=C(C1=NOC=C1C)O AK101261 [0,1,0,0,1,0|2,0,0]=4 987 B9R1.41 OC(=O)C1=C(Br)C=CO1 AK110945 [0,1,0,0,1,0|1,0,0]=3 988 B9R1.41 OC(=O)C1=C(Cl)C=CS1 AK-48375 [0,1,0,0,1,0|1,0,0]=3 989 B9R1.41 OC(=O)C1=C(Cl)NN=C1 AK-99982 [0,1,0,0,1,0|2,0,0]=4 990 B11R1.20 BrC1=CN=C(C=C1)CC(=O)O AK-46600 [0,1,0,0,0,1|1,0,0]=3 991 B11R1.20 C1=C(C=CC(=C1)F)CC(O)=O AK-49121 [0,1,0,0,0,1|0,0,0]=2 992 B11R1.20 C1=CC(=CC=C1CC(C)=O)F AK-50578 [0,1,0,0,0,1|1,0,0]=3 993 B11R1.20 C1=CC(=CC=C1N)CC(O)=O AK-47573 [0,1,0,0,0,1|0,0,0]=2 994 B11R1.20 CC(NC1=CC=C(C)C=C1)=O AK208638 [0,1,0,0,0,1|1,0,0]=3 995 B11R1.20 CC(NC1=CC=C(I)C=C1)=O AK115722 [0,1,0,0,0,1|1,0,0]=3 996 B11R1.20 CC(NC1=CC=C(O)N=C1)=O AK152813 [0,1,0,0,0,1|2,0,0]=4 997 B11R1.20 CC(NC1=NC=C(Br)C=C1)=O AK-32386 [0,1,0,0,0,1|2,0,0]=4 998 B11R1.20 CC(NC1=NC=C(O)C=C1)=O AK114074 [0,1,0,0,0,1|2,0,0]=4 999 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 AK-59139 [0,1,0,0,0,1|1,0,0]=3 1000 B11R1.20 O=C(N)CC1=CC=C(Cl)C=C1 AK201413 [0,1,0,0,0,1|1,0,0]=3 1001 B11R1.20 O=C(N)CC1=NC=C(Br)C=C1 AK141365 [0,1,0,0,0,1|2,0,0]=4 1002 B11R1.20 O=C(O)CC1=CC=C(C)C=C1 AK-45538 [0,1,0,0,0,1|0,0,0]=2 1003 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 AK-48828 [0,1,0,0,0,1|1,0,0]=3 1004 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 AK-45403 [0,1,0,0,0,1|0,0,0]=2 1005 B11R1.20 O=C(O)CC1=CC=C(N)N=C1 AK112112 [0,1,0,0,0,1|1,0,0]=3 1006 B11R1.20 O=C(O)CC1=NC=C(C)C=C1 AK139129 [0,1,0,0,0,1|1,0,0]=3 1007 B11R1.20 O=C(O)CC1=NC=C(F)C=N1 AK-43706 [0,1,0,0,0,1|2,0,0]=4 1008 B11R1.20 OC(=O)CC1=CC=C(Br)C=C1 AK-45378 [0,1,0,0,0,1|0,0,0]=2 1009 B11R1.20 OC(=O)CC1=CC=C(Cl)C=C1 AK-76702 [0,1,0,0,0,1|0,0,0]=2 1010 B11R1.20 OC(=O)CC1=CC=C(O)C=C1 AK101098 [0,1,0,0,0,1|0,0,0]=2 1011 B11R1.20 S=C(N)NC1=CC=C(C)C=C1 AK161770 [0,1,0,0,0,1|1,1,0]=4 1012 B11R1.36 C1=C(C(C(O)=O)Br)C=CC=C1 AK-47433 [0,1,0,0,0,1|0,0,0]=2 1013 B11R1.36 C1=C(C(C(O)=O)C)C=CC=C1 AK-50598 [0,1,0,0,0,1|0,0,0]=2 1014 B11R1.36 C1=CC=CC=C1C(C(O)=O)O AK-54084 [0,1,0,0,0,1|0,0,0]=2 1015 B11R1.36 CC(C(C1=CC=CC=C1)=O)=O AK116651 [0,1,0,0,0,1|1,0,0]=3 1016 B11R1.36 C[C@@H](C1=CC=CC=C1)C(O)=O AK-42526 [0,1,0,0,0,1|0,0,0]=2 1017 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 AK608029 [0,1,0,0,0,1|1,0,1]=4 1018 B11R1.36 C[C@H](C1=CC=CC=C1)C(O)=O AK-42515 [0,1,0,0,0,1|0,0,0]=2 1019 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 AK608030 [0,1,0,0,0,1|1,0,1]=4 1020 B11R1.36 N[C@H](C(=O)N)C1=CC=CC=C1 AK-35984 [0,1,0,0,0,1|1,0,0]=3 1021 B11R1.36 O=C(Cl)[C@H](N)C1=CC=CC=C1 AK-48226 [0,1,0,0,0,1|1,0,0]=3 1022 B11R1.36 O=C(N)C(O)C1=CC=CC=C1 AK198609 [0,1,0,0,0,1|1,0,0]=3 1023 B11R1.36 O=C(N)[C@H](N)C1=CC=CC=C1 AK-70916 [0,1,0,0,0,1|1,0,0]=3 1024 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 AK107681 [0,1,0,0,0,1|0,0,0]=2 1025 B11R1.36 O=C(O)C(N)C1=CC=CC=C1 AK-46549 [0,1,0,0,0,1|0,0,0]=2 1026 B11R1.36 O=C(O)[C@@H](N)C1=CC=CC=C1 AK-48119 [0,1,0,0,0,1|0,0,0]=2 1027 B11R1.36 O=C(O)[C@H](N)C1=CC=CC=C1 AK-44130 [0,1,0,0,0,1|0,0,0]=2 1028 B11R1.36 O=C(O)[C@H](N)C1=CC=CC=C1 AK105883 [0,1,0,0,0,1|0,0,0]=2 1029 B11R1.36 [C@@H](O)(C1=CC=CC=C1)C(=O)O AK-47567 [0,1,0,0,0,1|0,0,0]=2 1030 B11R1.36 [C@H](C1=CC=CC=C1)(C(O)=O)O AK-42339 [0,1,0,0,0,1|0,0,0]=2 1031 B11R1.40 C=CC(NC1=CC=CC=C1)=O AK122185 [0,1,0,0,0,1|1,0,0]=3 1032 B11R1.40 ClCC(=O)NC1=CC=NC=C1 AK109595 [0,1,0,0,0,1|2,0,0]=4 1033 B11R1.40 NNC(=O)CC1=CC=CC=C1 AK-77117 [0,1,0,0,0,1|1,0,0]=3 1034 B11R1.40 O=C(NC)CC1=CC=CN=C1 AK175433 [0,1,0,0,0,1|2,0,0]=4 1035 B11R1.40 O=C(NC1=CC=CC=C1)CCl AK-95957 [0,1,0,0,0,1|1,0,0]=3 1036 B11R1.40 O=C(NC1=NC=CC=C1)CCl AK-32350 [0,1,0,0,0,1|2,0,0]=4 1037 B11R1.40 O=C(NN)CC1=CC=NC=C1 AK110454 [0,1,0,0,0,1|2,0,0]=4 1038 B11R1.40 O=C(OC)CC1=CC=CC=C1 AK163377 [0,1,0,0,0,1|0,0,0]=2 1039 B11R1.40 O=C(OC)CC1=NC=CN=C1 AK-45166 [0,1,0,0,0,1|2,0,0]=4 1040 B11R1.40 O=C(OC)CC1=NC=NC=C1 AK-47129 [0,1,0,0,0,1|2,0,0]=4 1041 B11R1.40 O=C(OC)OC1=CC=CC=C1 AK600729 [0,1,0,0,0,1|0,0,0]=2 1042 B11R1.40 O=C(OC1=CC=CC=C1)CBr AK105971 [0,1,0,0,0,1|1,0,0]=3 1043 B11R1.40 OCC(N)CC1=CC=CC=C1 AK-33528 [0,1,0,0,0,1|1,0,1]=4 1044 B11R1.40 OC[C@@H](N)CC1=CC=CC=C1 AK-46725 [0,1,0,0,0,1|1,0,1]=4 1045 B11R1.40 OC[C@H](N)CC1=CC=CC=C1 AK-45609 [0,1,0,0,0,1|1,0,1]=4 1046 B11R1.86 C1=C(CC(=O)C)C(=CC=C1)Br AK-47295 [0,1,0,0,0,1|1,0,0]=3 1047 B11R1.86 C1=CC=CC(=C1CC(O)=O)C AK-45537 [0,1,0,0,0,1|0,0,0]=2 1048 B11R1.86 C1=CC=CC(=C1CC(O)=O)O AK-47284 [0,1,0,0,0,1|0,0,0]=2 1049 B11R1.86 CC(CC1=CC=CC=C1F)=O AK117069 [0,1,0,0,0,1|1,0,0]=3 1050 B11R1.86 CC(NC1=CC=CC=C1N)=O AK112083 [0,1,0,0,0,1|1,0,0]=3 1051 B11R1.86 CC(NC1=CC=CC=C1O)=O AK116958 [0,1,0,0,0,1|1,0,0]=3 1052 B11R1.86 CC(NC1=NC=CC=C1O)=O AK124571 [0,1,0,0,0,1|2,0,0]=4 1053 B11R1.86 IC1=C(C=CC=C1)CC(=O)O AK-73107 [0,1,0,0,0,1|0,0,0]=2 1054 B11R1.86 NC1=NC=CC=C1CC(O)=O AK-68736 [0,1,0,0,0,1|1,0,0]=3 1055 B11R1.86 O=C(O)CC1=CC=CC=C1Br AK-45376 [0,1,0,0,0,1|0,0,0]=2 1056 B11R1.86 O=C(O)CC1=CC=CC=C1F AK-29262 [0,1,0,0,0,1|0,0,0]=2 1057 B11R1.86 O=C(O)CC1=CC=CN=C1Cl AK139178 [0,1,0,0,0,1|1,0,0]=3 1058 B11R1.86 O=C(O)CC1=NC=CC=C1Cl AK-88771 [0,1,0,0,0,1|1,0,0]=3 1059 B11R1.157 C1=C(C=CC=C1Cl)CC(O)=O AK-47464 [0,1,0,0,0,1|0,0,0]=2 1060 B11R1.157 C1=C(C=CC=C1F)CC(O)=O AK-72993 [0,1,0,0,0,1|0,0,0]=2 1061 B11R1.157 C1=C(C=CC=C1O)CC(O)=O AK-48396 [0,1,0,0,0,1|0,0,0]=2 1062 B11R1.157 CC(=O)CC1=CC(F)=CC=C1 AK-60937 [0,1,0,0,0,1|1,0,0]=3 1063 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 AK103372 [0,1,0,0,0,1|2,0,0]=4 1064 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 AK-41020 [0,1,0,0,0,1|2,0,0]=4 1065 B11R1.157 CC(CC1=CC=CC(Br)=C1)=O AK-94137 [0,1,0,0,0,1|1,0,0]=3 1066 B11R1.157 CC(NC1=CC=CC(N)=C1)=O AK-76549 [0,1,0,0,0,1|1,0,0]=3 1067 B11R1.157 CC(NC1=CC=CC(O)=C1)=O AK-84439 [0,1,0,0,0,1|1,0,0]=3 1068 B11R1.157 CC(NC1=NC(Br)=CC=C1)=O AK-92376 [0,1,0,0,0,1|2,0,0]=4 1069 B11R1.157 CC(NC1=NC=CC(Cl)=C1)=O AK-29058 [0,1,0,0,0,1|2,0,0]=4 1070 B11R1.157 CC(OC1=CC=CC(Br)=C1)=O AK-80146 [0,1,0,0,0,1|1,0,0]=3 1071 B11R1.157 CC(OC1=CC=CC(F)=C1)=O AK135677 [0,1,0,0,0,1|1,0,0]=3 1072 B11R1.157 ClC1=CN=CC(=N1)CC(=O)O AK-26671 [0,1,0,0,0,1|2,0,0]=4 1073 B11R1.157 ClC1=NC=CC(=C1)NC(C)=O AK-28783 [0,1,0,0,0,1|2,0,0]=4 1074 B11R1.157 O=C(N)CC1=CC=CC(Cl)=C1 AK-86174 [0,1,0,0,0,1|1,0,0]=3 1075 B11R1.157 O=C(N)CC1=CC=CC(N)=C1 AK124849 [0,1,0,0,0,1|1,0,0]=3 1076 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 AK113021 [0,1,0,0,0,1|1,0,0]=3 1077 B11R1.157 O=C(O)CC1=CC(N)=NC=C1 AK548242 [0,1,0,0,0,1|1,0,0]=3 1078 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 AK-42053 [0,1,0,0,0,1|0,0,0]=2 1079 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 AK-61642 [0,1,0,0,0,1|0,0,0]=2 1080 B11R1.157 O=C(O)CC1=NC(Br)=CC=C1 AK117142 [0,1,0,0,0,1|1,0,0]=3 1081 B11R1.157 O=C(O)CC1=NC(Cl)=CC=C1 AK117649 [0,1,0,0,0,1|1,0,0]=3 1082 B11R1.157 O=C(O)CC1=NC=CC(C)=C1 AK-68184 [0,1,0,0,0,1|1,0,0]=3 1083 B11R1.157 O=C(O)CC1=NC=CC(Cl)=C1 AK164883 [0,1,0,0,0,1|1,0,0]=3 1084 B11R1.157 O=C([O-])CC1=NC(C)=CC=C1 AK-91618 [0,1,0,0,0,1|1,0,1]=4 1085 B11R1.509 CS(=O)(NC1=CC=CC=C1)=O AK-51764 [0,1,0,0,0,1|1,0,1]=4 1086 B11R1.509 O=S(CC1=CC=CC=C1)(N)=O AK-32283 [0,1,0,0,0,1|1,0,1]=4 1087 B11R1.3 BrCC1=CC=C(C=C1)B(O)O AK-32249 [0,2,0,0,0,0|1,0,1]=4 1088 B11R1.3 C(#C)C1=CC=C(C(=O)O)C=C1 AK-44236 [0,2,0,0,0,0|0,0,0]=2 1089 B11R1.3 C1=C(C=CC(=C1)C#N)B(O)O AK-44971 [0,2,0,0,0,0|1,0,1]=4 1090 B11R1.3 C1=C(C=CC(=C1)C=O)C(O)=O AK-45367 [0,2,0,0,0,0|0,0,0]=2 1091 B11R1.3 C1=C(C=CC(=C1)CN)C(O)=O AK-35678 [0,2,0,0,0,0|0,0,0]=2 1092 B11R1.3 C1=C(C=CC(=C1)CO)B(O)O AK-47289 [0,2,0,0,0,0|1,0,1]=4 1093 B11R1.3 C1=C(C=CC(=C1)OC)B(O)O AK-39804 [0,2,0,0,0,0|1,0,1]=4 1094 B11R1.3 C1=CC(=CC=C1C(O)=O)CO AK-25734 [0,2,0,0,0,0|0,0,0]=2 1095 B11R1.3 C1=CC(=CC=C1[N+](=O)[O-])CO AK-46675 [0,2,0,0,0,0|1,0,1]=4 1096 B11R1.3 C1=CC(=NC=C1C(=O)O)NN AK-33131 [0,2,0,0,0,0|1,0,0]=3 1097 B11R1.3 C=CC1=CC=C([N+]([O-])=O)C=C1 AK135882 [0,2,0,0,0,0|1,0,1]=4 1098 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O AK-35404 [0,2,0,0,0,0|1,0,0]=3 1099 B11R1.3 CC(C1=CC=C(CN)C=C1)=O AK158889 [0,2,0,0,0,0|1,0,0]=3 1100 B11R1.3 CC(C1=CC=C(NC)C=C1)=O AK145581 [0,2,0,0,0,0|1,0,0]=3 1101 B11R1.3 CC(C1=CC=C(OC)N=C1)=O AK-76404 [0,2,0,0,0,0|2,0,0]=4 1102 B11R1.3 CC(C1=CC=C(SC)C=C1)=O AK164075 [0,2,0,0,0,0|1,0,0]=3 1103 B11R1.3 CCC1=CN=C(C=C1)C(O)=O AK-29521 [0,2,0,0,0,0|1,0,0]=3 1104 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O AK103062 [0,2,0,0,0,0|1,0,1]=4 1105 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O AK103063 [0,2,0,0,0,0|1,0,1]=4 1106 B11R1.3 COC1=CN=C(C=C1)C(=O)O AK-29097 [0,2,0,0,0,0|1,0,0]=3 1107 B11R1.3 COC1=CN=C(C=N1)C(=O)O AK-25141 [0,2,0,0,0,0|2,0,0]=4 1108 B11R1.3 N#CC1=CC=C(C(C)=O)C=C1 AK-44531 [0,2,0,0,0,0|1,0,0]=3 1109 B11R1.3 N=C(N)C1=CC=C(C#N)C=C1 AK209127 [0,2,0,0,0,0|2,0,0]=4 1110 B11R1.3 N=C(N)C1=CC=C(OC)C=C1 AK-98683 [0,2,0,0,0,0|2,0,0]=4 1111 B11R1.3 NNC1=CC=C(C=C1)N(=O)=O AK-72989 [0,2,0,0,0,0|1,0,1]=4 1112 B11R1.3 O=C(C1=CN=C(NC)N=C1)O AK115951 [0,2,0,0,0,0|2,0,0]=4 1113 B11R1.3 O=C(C1=CN=C(OC)C=C1)O AK-30103 [0,2,0,0,0,0|1,0,0]=3 1114 B11R1.3 O=C(C1=CN=C(SC)N=C1)O AK-26821 [0,2,0,0,0,0|2,0,0]=4 1115 B11R1.3 O=C(C1=NC=C(C#N)N=C1)O AK137311 [0,2,0,0,0,0|2,0,0]=4 1116 B11R1.3 O=C(N)C1=CC=C(CN)C=C1 AK155450 [0,2,0,0,0,0|1,0,0]=3 1117 B11R1.3 O=C(N)C1=CC=C(OC)C=C1 AK114264 [0,2,0,0,0,0|1,0,0]=3 1118 B11R1.3 O=C(O)C1=CC=C(C=C)C=C1 AK-45760 [0,2,0,0,0,0|0,0,0]=2 1119 B11R1.3 O=C(O)C1=CC=C(CC)C=C1 AK114313 [0,2,0,0,0,0|0,0,0]=2 1120 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 AK-79152 [0,2,0,0,0,0|0,0,0]=2 1121 B11R1.3 O=C(O)C1=CC=C(NN)C=C1 AK-88500 [0,2,0,0,0,0|0,0,0]=2 1122 B11R1.3 O=C(O)C1=CC=C(OC)C=C1 AK-41188 [0,2,0,0,0,0|0,0,0]=2 1123 B11R1.3 O=C(O)C1=CN=C(CO)C=C1 AK123526 [0,2,0,0,0,0|1,0,0]=3 1124 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 AK127091 [0,2,0,0,0,0|1,0,0]=3 1125 B11R1.3 O=CC1=CC=C([N+]([O-])=O)C=C1 AK-49906 [0,2,0,0,0,0|1,0,1]=4 1126 B11R1.3 O=[N+](C1=CC=C(C#C)C=C1)[O-] AK-85658 [0,2,0,0,0,0|1,0,1]=4 1127 B11R1.3 OB(C1=CC=C(C=C)C=C1)O AK-45734 [0,2,0,0,0,0|1,0,1]=4 1128 B11R1.3 OB(C1=CC=C(C=O)C=C1)O AK-45038 [0,2,0,0,0,0|1,0,1]=4 1129 B11R1.19 C1=C([S](C)(=O)=O)C=CC(=C1)Cl AK-50496 [0,2,0,0,0,0|1,0,1]=4 1130 B11R1.19 C1=C([S](C)(=O)=O)C=CC(=C1)O AK-73113 [0,2,0,0,0,0|1,0,1]=4 1131 B11R1.19 CC(O)(C1=CC=C(Br)C=C1)C AK-41776 [0,2,0,0,0,0|1,0,1]=4 1132 B11R1.19 CC1=CC=C(C=C1)P(=O)(O)O AK-80283 [0,2,0,0,0,0|1,0,0]=3 1133 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AK-93752 [0,2,0,0,0,0|1,0,0]=3 1134 B11R1.19 CC1=CC=C(S(=O)([O-])=O)C=C1 AK-48060 [0,2,0,0,0,0|1,0,1]=4 1135 B11R1.19 NC1=CC=C(S(=O)(C)=O)C=C1 AK-32256 [0,2,0,0,0,0|1,0,1]=4 1136 B11R1.19 NS(=O)(=O)C1=CC=C(Br)C=C1 AK-26275 [0,2,0,0,0,0|1,0,1]=4 1137 B11R1.19 O=S(C1=CC=C(Br)C=C1)(C)=O AK-76561 [0,2,0,0,0,0|1,0,1]=4 1138 B11R1.19 O=S(C1=CC=C(C)C=C1)(C)=O AK-94753 [0,2,0,0,0,0|1,0,1]=4 1139 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK-45062 [0,2,0,0,0,0|1,0,0]=3 1140 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK-77681 [0,2,0,0,0,0|1,0,0]=3 1141 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK101690 [0,2,0,0,0,0|1,0,0]=3 1142 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK150790 [0,2,0,0,0,0|1,0,0]=3 1143 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK164877 [0,2,0,0,0,0|1,0,0]=3 1144 B11R1.19 O=S(C1=CC=C(C)C=C1)(O)=O AK311262 [0,2,0,0,0,0|1,0,0]=3 1145 B11R1.19 O=S(C1=CC=C(C)C=C1)([O-])=O AK-54466 [0,2,0,0,0,0|1,0,1]=4 1146 B11R1.19 O=S(C1=CC=C(C)C=C1)([O-])=O AK126645 [0,2,0,0,0,0|1,0,1]=4 1147 B11R1.19 O=S(C1=CC=C(Cl)C=C1)(N)=O AK151256 [0,2,0,0,0,0|1,0,1]=4 1148 B11R1.19 O=S(C1=CC=C(N)C=C1)([O-])=O AK114546 [0,2,0,0,0,0|1,0,1]=4 1149 B11R1.19 O=S(C1=CC=C(N)N=C1)(O)=O AK-63658 [0,2,0,0,0,0|2,0,0]=4 1150 B11R1.19 O=S(C1=CC=C(O)C=C1)([O-])=O AK117280 [0,2,0,0,0,0|1,0,1]=4 1151 B11R1.21 BrC1=C(C=C(C(=O)O)C=C1)O AK-39977 [0,2,0,0,0,0|0,0,0]=2 1152 B11R1.21 BrC1=C(C=C(C=C1)C(C)=O)F AK-34604 [0,2,0,0,0,0|1,0,0]=3 1153 B11R1.21 BrC1=C(C=CC(=C1)C(=O)O)Cl AK-30019 [0,2,0,0,0,0|0,0,0]=2 1154 B11R1.21 BrC1=C(C=CC(=C1)[N+](=O)[O-])Cl AK-33593 [0,2,0,0,0,0|1,0,1]=4 1155 B11R1.21 BrC1=CN=C(C=C1C)C(=O)O AK-37510 [0,2,0,0,0,0|1,0,0]=3 1156 B11R1.21 C1=C(B(O)O)C=CC(=C1Cl)F AK-28494 [0,2,0,0,0,0|1,0,1]=4 1157 B11R1.21 C1=C(C(=CC(=C1)B(O)O)Cl)Cl AK-33407 [0,2,0,0,0,0|1,0,1]=4 1158 B11R1.21 C1=C(C(=CC=C1C(=O)C)F)C AK-48194 [0,2,0,0,0,0|1,0,0]=3 1159 B11R1.21 C1=C(C(=CC=C1C(=O)O)C)N AK-34321 [0,2,0,0,0,0|0,0,0]=2 1160 B11R1.21 C1=C(C(=CC=C1C(=O)O)N)C AK-34339 [0,2,0,0,0,0|0,0,0]=2 1161 B11R1.21 C1=C(C(=CC=C1C(C)=O)F)Br AK-50601 [0,2,0,0,0,0|1,0,0]=3 1162 B11R1.21 C1=C(C(=CC=C1C(O)=O)Cl)O AK-25796 [0,2,0,0,0,0|0,0,0]=2 1163 B11R1.21 C1=C(C(=CC=C1C(O)=O)O)C AK-46719 [0,2,0,0,0,0|0,0,0]=2 1164 B11R1.21 C1=C(C(=CC=C1[N+](=O)[O-])F)Br AK-26276 [0,2,0,0,0,0|1,0,1]=4 1165 B11R1.21 C1=C(C=CC(=C1Br)C)C(O)=O AK-36339 [0,2,0,0,0,0|0,0,0]=2 1166 B11R1.21 C1=C(C=CC(=C1C)Cl)C(O)=O AK-47580 [0,2,0,0,0,0|0,0,0]=2 1167 B11R1.21 C1=C(C=CC(=C1Cl)Cl)C(O)=O AK-46631 [0,2,0,0,0,0|0,0,0]=2 1168 B11R1.21 C1=C(C=CC(=C1F)C)C(O)=O AK-34796 [0,2,0,0,0,0|0,0,0]=2 1169 B11R1.21 C1=C(C=CC(=C1F)Cl)[N+](=O)[O-] AK-34799 [0,2,0,0,0,0|1,0,1]=4 1170 B11R1.21 C1=C(C=CC(=C1F)F)B(O)O AK-33624 [0,2,0,0,0,0|1,0,1]=4 1171 B11R1.21 C1=C(C=CC(=C1F)F)C(O)=O AK-47373 [0,2,0,0,0,0|0,0,0]=2 1172 B11R1.21 C1=C(C=CC(=C1F)F)[N+](=O)[O-] AK-46774 [0,2,0,0,0,0|1,0,1]=4 1173 B11R1.21 C1=C(C=CC(=C1F)O)C(C)=O AK-42173 [0,2,0,0,0,0|1,0,0]=3 1174 B11R1.21 C1=C(C=CC(=C1N)F)[N+](=O)[O-] AK-34890 [0,2,0,0,0,0|1,0,1]=4 1175 B11R1.21 C1=C(C=CC(=C1O)O)C(O)=O AK-47644 [0,2,0,0,0,0|0,0,0]=2 1176 B11R1.21 C1=C(Cl)C(=CC=C1[N+]([O-])=O)O AK-35873 [0,2,0,0,0,0|1,0,1]=4 1177 B11R1.21 C1=C(F)C(=CC=C1B(O)O)C AK-26865 [0,2,0,0,0,0|1,0,1]=4 1178 B11R1.21 C1=C(O)C(=CC=C1C(=O)O)N AK-34278 [0,2,0,0,0,0|0,0,0]=2 1179 B11R1.21 C1=C([N+]([O-])=O)C=CC(=C1Br)N AK-23608 [0,2,0,0,0,0|1,0,1]=4 1180 B11R1.21 C1=C([N+]([O-])=O)C=CC(=C1I)N AK-35920 [0,2,0,0,0,0|1,0,1]=4 1181 B11R1.21 C1=C([N+]([O-])=O)C=CC(=C1O)C AK-40855 [0,2,0,0,0,0|1,0,1]=4 1182 B11R1.21 C1=CC(=C(C=C1C(=O)O)I)F AK-35058 [0,2,0,0,0,0|0,0,0]=2 1183 B11R1.21 C1=CC(=C(C=C1C(O)=O)F)N AK-35239 [0,2,0,0,0,0|0,0,0]=2 1184 B11R1.21 C1=CC(=CC(=C1F)Cl)C(=O)C AK-49084 [0,2,0,0,0,0|1,0,0]=3 1185 B11R1.21 C1=CC(=CC(=C1O)Br)[N+]([O-])=O AK-29436 [0,2,0,0,0,0|1,0,1]=4 1186 B11R1.21 CC(C1=CC(C)=C(Cl)N=C1)=O AK139010 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.21 CC(C1=CC=C(Br)C(C)=C1)=O AK-65018 [0,2,0,0,0,0|1,0,0]=3 1188 B11R1.21 CC(C1=CC=C(Br)C(Cl)=C1)=O AK114290 [0,2,0,0,0,0|1,0,0]=3 1189 B11R1.21 CC(C1=CC=C(Cl)C(C)=C1)=O AK-51511 [0,2,0,0,0,0|1,0,0]=3 1190 B11R1.21 CC(C1=CC=C(Cl)C(Cl)=C1)=O AK-41915 [0,2,0,0,0,0|1,0,0]=3 1191 B11R1.21 CC(C1=CC=C(Cl)C(N)=C1)=O AK-45178 [0,2,0,0,0,0|1,0,0]=3 1192 B11R1.21 CC(C1=CC=C(F)C(F)=C1)=O AK-53703 [0,2,0,0,0,0|1,0,0]=3 1193 B11R1.21 CC(C1=CC=C(I)C(Br)=C1)=O AK482929 [0,2,0,0,0,0|1,0,0]=3 1194 B11R1.21 CC(C1=CC=C(N)C(F)=C1)=O AK-94340 [0,2,0,0,0,0|1,0,0]=3 1195 B11R1.21 CC(C1=CC=C(O)C(Br)=C1)=O AK201265 [0,2,0,0,0,0|1,0,0]=3 1196 B11R1.21 CC(C1=CC=C(O)C(C)=C1)=O AK-41189 [0,2,0,0,0,0|1,0,0]=3 1197 B11R1.21 CC(C1=CC=C(O)C(O)=C1)=O AK-42350 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.21 CC1=C(C)N=C(C=C1)C(O)=O AK-89986 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.21 CC1=C(F)C=CC(=N1)C(O)=O AK-38458 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.21 CC1=C(I)C=CC(=C1)[N+]([O-])=O AK-81676 [0,2,0,0,0,0|1,0,1]=4 1201 B11R1.21 CC1=CC(=CNC1=O)C(O)=O AK-78282 [0,2,0,0,0,0|1,0,0]=3 1202 B11R1.21 CC1=CC(B(O)O)=CC=C1O AK-85496 [0,2,0,0,0,0|1,0,1]=4 1203 B11R1.21 FC1=C(C=C(C=C1)B(O)O)O AK-36847 [0,2,0,0,0,0|1,0,1]=4 1204 B11R1.21 FC1=C(C=CC(=C1)C(=O)O)I AK-36475 [0,2,0,0,0,0|0,0,0]=2 1205 B11R1.21 FC1=CC([N+]([O-])=O)=CC=C1Br AK-46352 [0,2,0,0,0,0|1,0,1]=4 1206 B11R1.21 FC1=CC=C([N+]([O-])=O)C=C1Cl AK-34798 [0,2,0,0,0,0|1,0,1]=4 1207 B11R1.21 IC1=CC=C([N+]([O-])=O)C=C1F AK-34584 [0,2,0,0,0,0|1,0,1]=4 1208 B11R1.21 N=C(N)C1=CC=C(C)C(F)=C1 AK-63979 [0,2,0,0,0,0|2,0,0]=4 1209 B11R1.21 NC(=O)C1=CC(Br)=C(F)C=C1 AK-87520 [0,2,0,0,0,0|1,0,0]=3 1210 B11R1.21 NC1=C(F)C=CC(=C1)B(O)O AK-36640 [0,2,0,0,0,0|1,0,1]=4 1211 B11R1.21 NC1=C(I)C=CC(=C1)C(O)=O AK-82318 [0,2,0,0,0,0|0,0,0]=2 1212 B11R1.21 NC1=C(O)C=CC(=C1)C(O)=O AK-33476 [0,2,0,0,0,0|0,0,0]=2 1213 B11R1.21 NC1=CC(=CC=C1Cl)C(O)=O AK-73058 [0,2,0,0,0,0|0,0,0]=2 1214 B11R1.21 NC1=CC([N+]([O-])=O)=CC=C1Br AK-32717 [0,2,0,0,0,0|1,0,1]=4 1215 B11R1.21 NC1=CC([N+]([O-])=O)=CC=C1C AK-44165 [0,2,0,0,0,0|1,0,1]=4 1216 B11R1.21 NC1=CC=C([N+]([O-])=O)C=C1F AK-34889 [0,2,0,0,0,0|1,0,1]=4 1217 B11R1.21 NC1=CC=C([N+]([O-])=O)C=C1N AK-29652 [0,2,0,0,0,0|1,0,1]=4 1218 B11R1.21 O=C(C1=CC(Br)=C(Br)N=C1)O AK-29099 [0,2,0,0,0,0|1,0,0]=3 1219 B11R1.21 O=C(C1=CC(Cl)=C(Cl)N=C1)O AK-25953 [0,2,0,0,0,0|1,0,0]=3 1220 B11R1.21 O=C(C1=NC(Cl)=C(C)C=C1)O AK-76573 [0,2,0,0,0,0|1,0,0]=3 1221 B11R1.21 O=C(C1=NC(Cl)=C(Cl)N=C1)O AK133010 [0,2,0,0,0,0|2,0,0]=4 1222 B11R1.21 O=C(C=1C=CC(N(C1)C)=O)N AK145245 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.21 O=C(C=1C=CC(N(C1)C)=O)O AK-34900 [0,2,0,0,0,0|1,0,0]=3 1224 B11R1.21 O=C(C=1C=CN(C)C(C1)=O)O AK-34747 [0,2,0,0,0,0|1,0,0]=3 1225 B11R1.21 O=C(N)C1=CC=C(N)C(O)=C1 AK437623 [0,2,0,0,0,0|1,0,0]=3 1226 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 AK-64921 [0,2,0,0,0,0|0,0,0]=2 1227 B11R1.21 O=C(O)C1=CC=C(Br)C(C)=C1 AK-26325 [0,2,0,0,0,0|0,0,0]=2 1228 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 AK-86432 [0,2,0,0,0,0|0,0,0]=2 1229 B11R1.21 O=C(O)C1=CC=C(Br)C(F)=C1 AK-50383 [0,2,0,0,0,0|0,0,0]=2 1230 B11R1.21 O=C(O)C1=CC=C(Br)C(N)=C1 AK-34514 [0,2,0,0,0,0|0,0,0]=2 1231 B11R1.21 O=C(O)C1=CC=C(C)C(Cl)=C1 AK-73060 [0,2,0,0,0,0|0,0,0]=2 1232 B11R1.21 O=C(O)C1=CC=C(C)C(I)=C1 AK-51540 [0,2,0,0,0,0|0,0,0]=2 1233 B11R1.21 O=C(O)C1=CC=C(C)C(O)=C1 AK-61869 [0,2,0,0,0,0|0,0,0]=2 1234 B11R1.21 O=C(O)C1=CC=C(Cl)C(F)=C1 AK-35057 [0,2,0,0,0,0|0,0,0]=2 1235 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 AK-32644 [0,2,0,0,0,0|0,0,0]=2 1236 B11R1.21 O=C(O)C1=CC=C(F)C(C)=C1 AK-35056 [0,2,0,0,0,0|0,0,0]=2 1237 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 AK-53849 [0,2,0,0,0,0|0,0,0]=2 1238 B11R1.21 O=C(O)C1=CC=C(F)C(N)=C1 AK-34274 [0,2,0,0,0,0|0,0,0]=2 1239 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 AK-35418 [0,2,0,0,0,0|0,0,0]=2 1240 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 AK174208 [0,2,0,0,0,0|0,0,0]=2 1241 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 AK-44390 [0,2,0,0,0,0|0,0,0]=2 1242 B11R1.21 O=C(O)C1=CC=C(N)C(Br)=C1 AK-35930 [0,2,0,0,0,0|0,0,0]=2 1243 B11R1.21 O=C(O)C1=CC=C(N)C(Cl)=C1 AK-34340 [0,2,0,0,0,0|0,0,0]=2 1244 B11R1.21 O=C(O)C1=CC=C(N)C(N)=C1 AK-45165 [0,2,0,0,0,0|0,0,0]=2 1245 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 AK-34797 [0,2,0,0,0,0|0,0,0]=2 1246 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 AK-23816 [0,2,0,0,0,0|1,0,0]=3 1247 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 AK173995 [0,2,0,0,0,0|1,0,0]=3 1248 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 AK324930 [0,2,0,0,0,0|1,0,0]=3 1249 B11R1.21 O=C(O)C1=CN=C(F)C(Br)=C1 AK-49660 [0,2,0,0,0,0|1,0,0]=3 1250 B11R1.21 O=C(O)C1=CN=C(N)C(Br)=C1 AK-25059 [0,2,0,0,0,0|1,0,0]=3 1251 B11R1.21 O=C(O)C1=CN=C(N)C(N)=C1 AK126240 [0,2,0,0,0,0|1,0,0]=3 1252 B11R1.21 O=C(O)C1=NC(Br)=C(C)C=C1 AK138206 [0,2,0,0,0,0|1,0,0]=3 1253 B11R1.21 O=C(O)C1=NC(Br)=C(Cl)C=C1 AK-53664 [0,2,0,0,0,0|1,0,0]=3 1254 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 AK-53910 [0,2,0,0,0,0|1,0,0]=3 1255 B11R1.21 O=C(O)C1=NC(C)=C(Br)C=C1 AK-61563 [0,2,0,0,0,0|1,0,0]=3 1256 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 AK-53898 [0,2,0,0,0,0|1,0,0]=3 1257 B11R1.21 O=C(O)C1=NC(Cl)=C(F)C=C1 AK-53913 [0,2,0,0,0,0|1,0,0]=3 1258 B11R1.21 O=C(O)C1=NC(O)=C(Br)C=C1 AK-92903 [0,2,0,0,0,0|1,0,0]=3 1259 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 AK-55136 [0,2,0,0,0,0|1,0,0]=3 1260 B11R1.21 O=C(O)C1=NC=C(C)C(Br)=C1 AK137974 [0,2,0,0,0,0|1,0,0]=3 1261 B11R1.21 O=[N+](C1=CC=C(Br)C(Br)=C1)[O-] AK130574 [0,2,0,0,0,0|1,0,1]=4 1262 B11R1.21 O=[N+](C1=CC=C(Br)C(C)=C1)[O-] AK-54902 [0,2,0,0,0,0|1,0,1]=4 1263 B11R1.21 O=[N+](C1=CC=C(Br)C(Cl)=C1)[O-] AK-79128 [0,2,0,0,0,0|1,0,1]=4 1264 B11R1.21 O=[N+](C1=CC=C(C)C(Br)=C1)[O-] AK-36359 [0,2,0,0,0,0|1,0,1]=4 1265 B11R1.21 O=[N+](C1=CC=C(C)C(I)=C1)[O-] AK-36358 [0,2,0,0,0,0|1,0,1]=4 1266 B11R1.21 O=[N+](C1=CC=C(Cl)C(C)=C1)[O-] AK-54903 [0,2,0,0,0,0|1,0,1]=4 1267 B11R1.21 O=[N+](C1=CC=C(Cl)C(I)=C1)[O-] AK114426 [0,2,0,0,0,0|1,0,1]=4 1268 B11R1.21 O=[N+](C1=CC=C(F)C(C)=C1)[O-] AK-35240 [0,2,0,0,0,0|1,0,1]=4 1269 B11R1.21 O=[N+](C1=CC=C(F)C(I)=C1)[O-] AK136589 [0,2,0,0,0,0|1,0,1]=4 1270 B11R1.21 OB(C1=CC=C(C)C(C)=C1)O AK-45214 [0,2,0,0,0,0|1,0,1]=4 1271 B11R1.21 OB(C1=CC=C(Cl)C(C)=C1)O AK-33546 [0,2,0,0,0,0|1,0,1]=4 1272 B11R1.21 OB(C1=CC=C(F)C(C)=C1)O AK-33223 [0,2,0,0,0,0|1,0,1]=4 1273 B11R1.21 OB(C1=CC=C(O)C(F)=C1)O AK-33809 [0,2,0,0,0,0|1,0,1]=4 1274 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 AK-33192 [0,2,0,0,0,0|1,0,1]=4 1275 B11R1.21 OC(=O)C1=CC(=O)C(O)=CN1 AK-89588 [0,2,0,0,0,0|1,0,0]=3 1276 B11R1.21 OC(=O)C1=CC(Br)=C(I)C=C1 AK-80847 [0,2,0,0,0,0|0,0,0]=2 1277 B11R1.21 OC(=O)C1=CC(I)=C(Br)C=C1 AK-64714 [0,2,0,0,0,0|0,0,0]=2 1278 B11R1.21 OC(=O)C1=CC(I)=C(Cl)C=C1 AK-35135 [0,2,0,0,0,0|0,0,0]=2 1279 B11R1.21 OC(=O)C1=CC=C(Cl)C(=O)N1 AK100453 [0,2,0,0,0,0|1,0,0]=3 1280 B11R1.21 OC(=O)C1=NC=C(Cl)C(Cl)=C1 AK-67884 [0,2,0,0,0,0|1,0,0]=3 1281 B11R1.21 OC1=C(Br)C=CC(=C1)[N+]([O-])=O AK-80891 [0,2,0,0,0,0|1,0,1]=4 1282 B11R1.21 OC1=CC(=CC=C1Cl)N(=O)=O AK-26191 [0,2,0,0,0,0|1,0,1]=4 1283 B11R1.21 OC1=CC(B(O)O)=CC=C1Cl AK-93984 [0,2,0,0,0,0|1,0,1]=4 1284 B11R1.21 OC1=CC([N+]([O-])=O)=CC=C1F AK-34204 [0,2,0,0,0,0|1,0,1]=4 1285 B11R1.21 OC1=CC=C(B(O)O)C=C1Cl AK-61628 [0,2,0,0,0,0|1,0,1]=4 1286 B11R1.21 OC1=CC=C([N+]([O-])=O)C=C1F AK-30391 [0,2,0,0,0,0|1,0,1]=4 1287 B11R1.22 BrC1=CC=C(C(N)CO)C=C1 AK607944 [0,2,0,0,0,0|1,0,1]=4 1288 B11R1.22 BrC1=CC=C([C@@H](N)CO)C=C1 AK172682 [0,2,0,0,0,0|1,0,1]=4 1289 B11R1.22 BrC1=CN=C(C=N1)C(=O)OC AK-24801 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.22 C1=C(C=CC(=C1)Br)C(OC)=O AK-47340 [0,2,0,0,0,0|0,0,0]=2 1291 B11R1.22 C1=C(C=CC(=C1)C)C(CBr)=O AK-73063 [0,2,0,0,0,0|1,0,0]=3 1292 B11R1.22 C1=C(C=CC(=C1)Cl)C(CC)=O AK-47430 [0,2,0,0,0,0|1,0,0]=3 1293 B11R1.22 C1=C(C=CC(=C1)N)C(OC)=O AK-48394 [0,2,0,0,0,0|0,0,0]=2 1294 B11R1.22 C1=CC(=CN=C1C(OC)=O)Br AK-25721 [0,2,0,0,0,0|1,0,0]=3 1295 B11R1.22 C1=CC(=NC=C1C(OC)=O)Cl AK-32450 [0,2,0,0,0,0|1,0,0]=3 1296 B11R1.22 C1=NC(=CC=C1C(=O)OC)Br AK-27762 [0,2,0,0,0,0|1,0,0]=3 1297 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 AK544255 [0,2,0,0,0,0|1,0,1]=4 1298 B11R1.22 CCC(C1=CC=C(Br)C=C1)=O AK133038 [0,2,0,0,0,0|1,0,0]=3 1299 B11R1.22 CCC(C1=CC=C(F)C=C1)=O AK-77665 [0,2,0,0,0,0|1,0,0]=3 1300 B11R1.22 CCC(C1=CC=C(I)C=C1)=O AK149241 [0,2,0,0,0,0|1,0,0]=3 1301 B11R1.22 CCC(C1=CC=C(O)C=C1)=O AK-44068 [0,2,0,0,0,0|1,0,0]=3 1302 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 AK-42930 [0,2,0,0,0,0|1,0,0]=3 1303 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 AK-57163 [0,2,0,0,0,0|0,0,0]=2 1304 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 AK-25021 [0,2,0,0,0,0|2,0,0]=4 1305 B11R1.22 COC(C1=NC=C(C=N1)Br)=O AK-28412 [0,2,0,0,0,0|2,0,0]=4 1306 B11R1.22 ClC1=CC=C(C(CN)=O)C=C1 AK-27718 [0,2,0,0,0,0|1,0,0]=3 1307 B11R1.22 ClC1=CC=C(C=C1)C(=O)C=O AK-10005 [0,2,0,0,0,0|0,0,1]=3 1308 B11R1.22 ClC1=CC=C(N=N1)C(=O)OC AK-24016 [0,2,0,0,0,0|2,0,0]=4 1309 B11R1.22 ClC1=CC=C([C@@H](N)CO)C=C1 AK486779 [0,2,0,0,0,0|1,0,1]=4 1310 B11R1.22 ClC1=CC=C([C@H](N)CO)C=C1 AK607971 [0,2,0,0,0,0|1,0,1]=4 1311 B11R1.22 ClC1=CN=C(C=N1)C(=O)OC AK-23920 [0,2,0,0,0,0|2,0,0]=4 1312 B11R1.22 FC1=CC=C(C=N1)C(=O)OC AK-40001 [0,2,0,0,0,0|1,0,0]=3 1313 B11R1.22 FC1=CC=C([C@@H](N)CO)C=C1 AK117861 [0,2,0,0,0,0|1,0,1]=4 1314 B11R1.22 FC1=CC=C([C@H](N)CO)C=C1 AK117823 [0,2,0,0,0,0|1,0,1]=4 1315 B11R1.22 FC1=CC=C([C@H](N)CO)C=C1 AK117858 [0,2,0,0,0,0|1,0,1]=4 1316 B11R1.22 IC1=CC=C(C(CBr)=O)C=C1 AK-25760 [0,2,0,0,0,0|1,0,0]=3 1317 B11R1.22 N1C=C(C(=O)NN)C=CC1=O AK-25381 [0,2,0,0,0,0|2,0,0]=4 1318 B11R1.22 NC1=CN=C(C=C1)C(=O)OC AK-24592 [0,2,0,0,0,0|1,0,0]=3 1319 B11R1.22 NC1=NC=C(C=N1)C(=O)OC AK-21981 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.22 NCC(=O)C1=CC=C(C=C1)F AK-32227 [0,2,0,0,0,0|1,0,0]=3 1321 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 AK101127 [0,2,0,0,0,0|1,0,0]=3 1322 B11R1.22 NCC(C1=CC=C(Br)C=C1)=O AK-42272 [0,2,0,0,0,0|1,0,0]=3 1323 B11R1.22 NCC(O)C1=CC=C(O)C=C1 AK163650 [0,2,0,0,0,0|1,0,1]=4 1324 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 AK-76998 [0,2,0,0,0,0|1,0,0]=3 1325 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 AK101499 [0,2,0,0,0,0|1,0,1]=4 1326 B11R1.22 O=C(C1=CC=C(Br)C=C1)CCl AK-41703 [0,2,0,0,0,0|1,0,0]=3 1327 B11R1.22 O=C(C1=CC=C(F)C=C1)C=O AK-10004 [0,2,0,0,0,0|0,0,1]=3 1328 B11R1.22 O=C(C1=CNC(N=C1)=O)OC AK138906 [0,2,0,0,0,0|2,0,0]=4 1329 B11R1.22 O=C(C1=COC(C=C1)=O)OC AK-94193 [0,2,0,0,0,0|1,0,0]=3 1330 B11R1.22 O=C(C1=NC=C(Cl)C=C1)OC AK-33121 [0,2,0,0,0,0|1,0,0]=3 1331 B11R1.22 O=C(C1=NC=C(F)C=N1)OC AK128119 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.22 O=C(C1=NC=C(N)N=C1)OC AK-59002 [0,2,0,0,0,0|2,0,0]=4 1333 B11R1.22 O=C(C1=NC=C(O)C=C1)OC AK-48134 [0,2,0,0,0,0|1,0,0]=3 1334 B11R1.22 O=C(NC)C1=CC=C(Br)C=C1 AK-86242 [0,2,0,0,0,0|1,0,0]=3 1335 B11R1.22 O=C(NC)C1=CN=C(Cl)C=C1 AK-41767 [0,2,0,0,0,0|2,0,0]=4 1336 B11R1.22 O=C(NN)C1=NC=C(F)C=C1 AK-97226 [0,2,0,0,0,0|2,0,0]=4 1337 B11R1.22 O=C(OC)C1=CC=C(C)C=C1 AK110414 [0,2,0,0,0,0|0,0,0]=2 1338 B11R1.22 O=C(OC)C1=CC=C(F)C=C1 AK-45398 [0,2,0,0,0,0|0,0,0]=2 1339 B11R1.22 O=C(OC)C1=CC=C(I)C=C1 AK-45406 [0,2,0,0,0,0|0,0,0]=2 1340 B11R1.22 O=C(OC)C1=CC=C(O)C=C1 AK-54335 [0,2,0,0,0,0|0,0,0]=2 1341 B11R1.22 O=C(OC)C1=CN=C(C)C=C1 AK-28562 [0,2,0,0,0,0|1,0,0]=3 1342 B11R1.22 O=C(OC)C1=CN=C(N)C=C1 AK-25008 [0,2,0,0,0,0|1,0,0]=3 1343 B11R1.22 O=C(OC)C1=CN=C(O)C=C1 AK-26234 [0,2,0,0,0,0|1,0,0]=3 1344 B11R1.22 O=C(OC)C1=NC=C(C)C=C1 AK-76225 [0,2,0,0,0,0|1,0,0]=3 1345 B11R1.22 O=C1NN=C(C=C1)C(=O)OC AK-72777 [0,2,0,0,0,0|2,0,0]=4 1346 B11R1.22 OC1=CC=C(C=C1)C(=O)CBr AK-34343 [0,2,0,0,0,0|1,0,0]=3 1347 B11R1.22 OC1=CC=C([C@@H](N)CO)C=C1 AK544250 [0,2,0,0,0,0|1,0,1]=4 1348 B11R1.22 OC1=CC=C([C@H](N)CO)C=C1 AK608028 [0,2,0,0,0,0|1,0,1]=4 1349 B11R1.22 OC1=CN=C(C=N1)C(=O)OC AK-24812 [0,2,0,0,0,0|2,0,0]=4 1350 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 AK110007 [0,2,0,0,0,0|0,0,2]=4 1351 B11R1.22 OC[C@@H](N)C1=CC=C(Br)C=C1 AK338220 [0,2,0,0,0,0|1,0,1]=4 1352 B11R1.22 OC[C@H](N)C1=CC=C(Br)C=C1 AK202041 [0,2,0,0,0,0|1,0,1]=4 1353 B11R1.166 BrC1=C(C(=O)O)C=CC(=C1)Cl AK-36919 [0,2,0,0,0,0|0,0,0]=2 1354 B11R1.166 BrC1=C(C=CC(=C1)Cl)[N+](=O)[O-] AK-35960 [0,2,0,0,0,0|1,0,1]=4 1355 B11R1.166 BrC1=C(C=CC(=C1)F)[N+](=O)[O-] AK-32212 [0,2,0,0,0,0|1,0,1]=4 1356 B11R1.166 BrC1=C(C=CC(=C1)N)[N+](=O)[O-] AK-35079 [0,2,0,0,0,0|1,0,1]=4 1357 B11R1.166 BrC1=CC(=C(C=C1)[N+](=O)[O-])F AK-28435 [0,2,0,0,0,0|1,0,1]=4 1358 B11R1.166 BrC1=CC(=C(C=C1)[N+](=O)[O-])O AK-29073 [0,2,0,0,0,0|1,0,1]=4 1359 B11R1.166 BrC1=CN=C(C(=C1)C)C(=O)O AK-26400 [0,2,0,0,0,0|1,0,0]=3 1360 B11R1.166 C1=C(C(=CC(=C1)Br)N)C(=O)O AK-34046 [0,2,0,0,0,0|0,0,0]=2 1361 B11R1.166 C1=C(C(=CC(=C1)Cl)I)C(O)=O AK-46379 [0,2,0,0,0,0|0,0,0]=2 1362 B11R1.166 C1=C(C(=CC(=C1)Cl)N)C(O)=O AK-36798 [0,2,0,0,0,0|0,0,0]=2 1363 B11R1.166 C1=C(C(=CC(=C1)F)Cl)[N+]([O-])=O AK-31880 [0,2,0,0,0,0|1,0,1]=4 1364 B11R1.166 C1=C(C(=CC=C1C)B(O)O)Cl AK-39980 [0,2,0,0,0,0|1,0,1]=4 1365 B11R1.166 C1=C(C(=CC=C1C)C(=O)O)N AK-25621 [0,2,0,0,0,0|0,0,0]=2 1366 B11R1.166 C1=C(C(=CC=C1Cl)C(C)=O)Cl AK-47301 [0,2,0,0,0,0|1,0,0]=3 1367 B11R1.166 C1=C(C(=CC=C1N)C(=O)O)C AK-27038 [0,2,0,0,0,0|0,0,0]=2 1368 B11R1.166 C1=C(Cl)C=CC(=C1F)B(O)O AK-33526 [0,2,0,0,0,0|1,0,1]=4 1369 B11R1.166 C1=C(Cl)C=NC(=C1Cl)C(=O)O AK-24701 [0,2,0,0,0,0|1,0,0]=3 1370 B11R1.166 C1=C(F)C=CC(=C1F)B(O)O AK-33282 [0,2,0,0,0,0|1,0,1]=4 1371 B11R1.166 C1=C([N+]([O-])=O)C(=CC(=C1)C)Cl AK-53744 [0,2,0,0,0,0|1,0,1]=4 1372 B11R1.166 C1=C([N+]([O-])=O)C(=CC(=C1)F)N AK-32563 [0,2,0,0,0,0|1,0,1]=4 1373 B11R1.166 C1=C([N+]([O-])=O)C(=CC(=C1)O)C AK-49132 [0,2,0,0,0,0|1,0,1]=4 1374 B11R1.166 C1=CC(=C(C=C1N)Cl)C(O)=O AK-29059 [0,2,0,0,0,0|0,0,0]=2 1375 B11R1.166 C1=CC(=CC(=C1B(O)O)Cl)Cl AK-36109 [0,2,0,0,0,0|1,0,1]=4 1376 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)F AK-46615 [0,2,0,0,0,0|1,0,0]=3 1377 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)O AK-49094 [0,2,0,0,0,0|1,0,0]=3 1378 B11R1.166 C1=CC(=CC(=C1C(O)=O)Br)Br AK-45532 [0,2,0,0,0,0|0,0,0]=2 1379 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)Br AK-26260 [0,2,0,0,0,0|0,0,0]=2 1380 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)C AK-47303 [0,2,0,0,0,0|0,0,0]=2 1381 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)Cl AK-32606 [0,2,0,0,0,0|0,0,0]=2 1382 B11R1.166 C1=CC(=CC(=C1C(O)=O)Cl)Cl AK-46538 [0,2,0,0,0,0|0,0,0]=2 1383 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)C AK-26324 [0,2,0,0,0,0|0,0,0]=2 1384 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)F AK-49138 [0,2,0,0,0,0|0,0,0]=2 1385 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)N AK-25984 [0,2,0,0,0,0|0,0,0]=2 1386 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)C AK-73066 [0,2,0,0,0,0|0,0,0]=2 1387 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)Cl AK-47585 [0,2,0,0,0,0|0,0,0]=2 1388 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)F AK-29195 [0,2,0,0,0,0|0,0,0]=2 1389 B11R1.166 C1=CC(=CC(=C1[N+]([O-])=O)O)Cl AK-30056 [0,2,0,0,0,0|1,0,1]=4 1390 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 AK-75553 [0,2,0,0,0,0|1,0,0]=3 1391 B11R1.166 CC(C1=CC=C(Br)C=C1Cl)=O AK-77175 [0,2,0,0,0,0|1,0,0]=3 1392 B11R1.166 CC(C1=CC=C(Br)C=C1F)=O AK-46535 [0,2,0,0,0,0|1,0,0]=3 1393 B11R1.166 CC(C1=CC=C(Br)C=C1N)=O AK-38008 [0,2,0,0,0,0|1,0,0]=3 1394 B11R1.166 CC(C1=CC=C(Br)C=C1O)=O AK-40002 [0,2,0,0,0,0|1,0,0]=3 1395 B11R1.166 CC(C1=CC=C(C)C=C1F)=O AK115609 [0,2,0,0,0,0|1,0,0]=3 1396 B11R1.166 CC(C1=CC=C(Cl)C=C1Br)=O AK-75637 [0,2,0,0,0,0|1,0,0]=3 1397 B11R1.166 CC(C1=CC=C(Cl)N=C1Cl)=O AK-49093 [0,2,0,0,0,0|2,0,0]=4 1398 B11R1.166 CC(C1=CC=C(F)C=C1Cl)=O AK-53695 [0,2,0,0,0,0|1,0,0]=3 1399 B11R1.166 CC(C1=CC=C(O)C=C1Br)=O AK-75734 [0,2,0,0,0,0|1,0,0]=3 1400 B11R1.166 CC(C1=CC=C(O)C=C1C)=O AK-50197 [0,2,0,0,0,0|1,0,0]=3 1401 B11R1.166 CC(C1=CC=C(O)C=C1Cl)=O AK-36102 [0,2,0,0,0,0|1,0,0]=3 1402 B11R1.166 CC(C1=CC=C(O)C=C1O)=O AK-50224 [0,2,0,0,0,0|1,0,0]=3 1403 B11R1.166 CC1=C(C=CC(=C1)C)B(O)O AK-35632 [0,2,0,0,0,0|1,0,1]=4 1404 B11R1.166 CC1=C(C=NC(Cl)=C1)C(O)=O AK-42673 [0,2,0,0,0,0|1,0,0]=3 1405 B11R1.166 CC1=CC(F)=CC=C1[N+]([O-])=O AK-35196 [0,2,0,0,0,0|1,0,1]=4 1406 B11R1.166 CC1=CC=C([N+]([O-])=O)C(F)=C1 AK-23702 [0,2,0,0,0,0|1,0,1]=4 1407 B11R1.166 CC1=CC=C([N+]([O-])=O)C(N)=C1 AK-35723 [0,2,0,0,0,0|1,0,1]=4 1408 B11R1.166 CC1=NC(C)=C(C=N1)C(O)=O AK-36268 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.166 ClC1=C(C(=O)O)C=CC(=N1)O AK-25883 [0,2,0,0,0,0|1,0,0]=3 1410 B11R1.166 ClC1=CC(=C(C=C1)B(O)O)C AK-28971 [0,2,0,0,0,0|1,0,1]=4 1411 B11R1.166 ClC1=CC(=C(C=C1)C(C)=O)F AK-46375 [0,2,0,0,0,0|1,0,0]=3 1412 B11R1.166 ClC1=CN=C(C(=C1)C)C(=O)O AK-29698 [0,2,0,0,0,0|1,0,0]=3 1413 B11R1.166 ClC1=NC=C(C(=N1)Cl)C(=O)O AK-24354 [0,2,0,0,0,0|2,0,0]=4 1414 B11R1.166 FC1=C(C(=O)O)C=CC(=C1)I AK-33039 [0,2,0,0,0,0|0,0,0]=2 1415 B11R1.166 FC1=C(C=CC(=C1)C)B(O)O AK-27195 [0,2,0,0,0,0|1,0,1]=4 1416 B11R1.166 FC1=NC(=C(C(=O)O)C=C1)C AK-30364 [0,2,0,0,0,0|1,0,0]=3 1417 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 AK108398 [0,2,0,0,0,0|1,0,0]=3 1418 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 AK-77547 [0,2,0,0,0,0|1,0,0]=3 1419 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl AK-97072 [0,2,0,0,0,0|2,0,0]=4 1420 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N AK-64550 [0,2,0,0,0,0|2,0,0]=4 1421 B11R1.166 NC(=O)C1=NC=C(Cl)C=C1Cl AK100505 [0,2,0,0,0,0|2,0,0]=4 1422 B11R1.166 NC1=C(C(=O)O)C=CC(=N1)Cl AK-31140 [0,2,0,0,0,0|1,0,0]=3 1423 B11R1.166 NC1=CC(=C(C=C1)C(C)=O)O AK-34336 [0,2,0,0,0,0|1,0,0]=3 1424 B11R1.166 NC1=CC(Br)=CC=C1[N+]([O-])=O AK-67591 [0,2,0,0,0,0|1,0,1]=4 1425 B11R1.166 NC1=CC(Cl)=CC=C1N(=O)=O AK-26977 [0,2,0,0,0,0|1,0,1]=4 1426 B11R1.166 NC1=CC=C([N+]([O-])=O)C(C)=C1 AK-35841 [0,2,0,0,0,0|1,0,1]=4 1427 B11R1.166 NC1=CC=C([N+]([O-])=O)C(Cl)=C1 AK-61331 [0,2,0,0,0,0|1,0,1]=4 1428 B11R1.166 NC1=CC=C([N+]([O-])=O)C(F)=C1 AK-34276 [0,2,0,0,0,0|1,0,1]=4 1429 B11R1.166 NC1=CC=C([N+]([O-])=O)C(N)=C1 AK-93482 [0,2,0,0,0,0|1,0,1]=4 1430 B11R1.166 O=C(C1=NC=C(F)C=C1F)O AK-36274 [0,2,0,0,0,0|1,0,0]=3 1431 B11R1.166 O=C(C=1C(O)=CC(NC1)=O)O AK-27721 [0,2,0,0,0,0|1,0,0]=3 1432 B11R1.166 O=C(N)C1=CC=C(C)C=C1N AK-49754 [0,2,0,0,0,0|1,0,0]=3 1433 B11R1.166 O=C(N)C1=CC=C(Cl)C=C1N AK-43520 [0,2,0,0,0,0|1,0,0]=3 1434 B11R1.166 O=C(N)C1=CC=C(F)C=C1F AK-86226 [0,2,0,0,0,0|1,0,0]=3 1435 B11R1.166 O=C(N)C1=CC=C(I)C=C1Br AK349625 [0,2,0,0,0,0|1,0,0]=3 1436 B11R1.166 O=C(N)C1=CN=C(Cl)C=C1Cl AK-29452 [0,2,0,0,0,0|2,0,0]=4 1437 B11R1.166 O=C(N)C1=NC=C(Br)C=C1N AK-48703 [0,2,0,0,0,0|2,0,0]=4 1438 B11R1.166 O=C(O)C1=C(C)N=C(Br)C=C1 AK144236 [0,2,0,0,0,0|1,0,0]=3 1439 B11R1.166 O=C(O)C1=C(C)N=C(Cl)C=C1 AK-58691 [0,2,0,0,0,0|1,0,0]=3 1440 B11R1.166 O=C(O)C1=C(Cl)N=C(C)C=C1 AK-84877 [0,2,0,0,0,0|1,0,0]=3 1441 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)C=C1 AK-25090 [0,2,0,0,0,0|1,0,0]=3 1442 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 AK120480 [0,2,0,0,0,0|1,0,0]=3 1443 B11R1.166 O=C(O)C1=C(N)N=C(Br)C=C1 AK-77320 [0,2,0,0,0,0|1,0,0]=3 1444 B11R1.166 O=C(O)C1=C(O)N=C(Cl)C=C1 AK-68352 [0,2,0,0,0,0|1,0,0]=3 1445 B11R1.166 O=C(O)C1=CC=C(Br)C=C1Cl AK-40035 [0,2,0,0,0,0|0,0,0]=2 1446 B11R1.166 O=C(O)C1=CC=C(Br)C=C1F AK-45932 [0,2,0,0,0,0|0,0,0]=2 1447 B11R1.166 O=C(O)C1=CC=C(Br)C=C1I AK-73142 [0,2,0,0,0,0|0,0,0]=2 1448 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O AK-44937 [0,2,0,0,0,0|0,0,0]=2 1449 B11R1.166 O=C(O)C1=CC=C(C)C=C1Br AK-36340 [0,2,0,0,0,0|0,0,0]=2 1450 B11R1.166 O=C(O)C1=CC=C(C)C=C1Cl AK-36338 [0,2,0,0,0,0|0,0,0]=2 1451 B11R1.166 O=C(O)C1=CC=C(C)C=C1I AK201253 [0,2,0,0,0,0|0,0,0]=2 1452 B11R1.166 O=C(O)C1=CC=C(F)C=C1Br AK-32641 [0,2,0,0,0,0|0,0,0]=2 1453 B11R1.166 O=C(O)C1=CC=C(F)C=C1C AK-34672 [0,2,0,0,0,0|0,0,0]=2 1454 B11R1.166 O=C(O)C1=CC=C(F)C=C1I AK-29400 [0,2,0,0,0,0|0,0,0]=2 1455 B11R1.166 O=C(O)C1=CC=C(F)C=C1N AK-25985 [0,2,0,0,0,0|0,0,0]=2 1456 B11R1.166 O=C(O)C1=CC=C(I)C=C1N AK-34047 [0,2,0,0,0,0|0,0,0]=2 1457 B11R1.166 O=C(O)C1=CC=C(N)C=C1O AK-46320 [0,2,0,0,0,0|0,0,0]=2 1458 B11R1.166 O=C(O)C1=CC=C(O)C=C1C AK-40693 [0,2,0,0,0,0|0,0,0]=2 1459 B11R1.166 O=C(O)C1=CC=C(O)C=C1F AK-35989 [0,2,0,0,0,0|0,0,0]=2 1460 B11R1.166 O=C(O)C1=CC=C(O)C=C1O AK-88714 [0,2,0,0,0,0|0,0,0]=2 1461 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br AK-55073 [0,2,0,0,0,0|1,0,0]=3 1462 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl AK161047 [0,2,0,0,0,0|1,0,0]=3 1463 B11R1.166 O=C(O)C1=CN=C(C)C=C1C AK-29000 [0,2,0,0,0,0|1,0,0]=3 1464 B11R1.166 O=C(O)C1=CN=C(C)C=C1Cl AK-28459 [0,2,0,0,0,0|1,0,0]=3 1465 B11R1.166 O=C(O)C1=CN=C(C)C=C1N AK-29804 [0,2,0,0,0,0|1,0,0]=3 1466 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Br AK167576 [0,2,0,0,0,0|1,0,0]=3 1467 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl AK-26772 [0,2,0,0,0,0|1,0,0]=3 1468 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1N AK121862 [0,2,0,0,0,0|1,0,0]=3 1469 B11R1.166 O=C(O)C1=CN=C(F)C=C1C AK123501 [0,2,0,0,0,0|1,0,0]=3 1470 B11R1.166 O=C(O)C1=CN=C(F)C=C1F AK-26362 [0,2,0,0,0,0|1,0,0]=3 1471 B11R1.166 O=C(O)C1=CN=C(N)C=C1C AK-68341 [0,2,0,0,0,0|1,0,0]=3 1472 B11R1.166 O=C(O)C1=CN=C(N)C=C1Cl AK153190 [0,2,0,0,0,0|1,0,0]=3 1473 B11R1.166 O=C(O)C1=CN=C(O)C=C1Cl AK-55097 [0,2,0,0,0,0|1,0,0]=3 1474 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl AK-53906 [0,2,0,0,0,0|1,0,0]=3 1475 B11R1.166 O=C(O)C1=NC=C(C)C=C1Br AK-76925 [0,2,0,0,0,0|1,0,0]=3 1476 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1Br AK101091 [0,2,0,0,0,0|1,0,0]=3 1477 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1N AK120030 [0,2,0,0,0,0|1,0,0]=3 1478 B11R1.166 O=C(O)C1=NC=C(F)C=C1Br AK-53675 [0,2,0,0,0,0|1,0,0]=3 1479 B11R1.166 O=C([O-])C1=CC=C(N)C=C1O AK154081 [0,2,0,0,0,0|0,0,1]=3 1480 B11R1.166 O=C1C(=CNC(N1)=O)C(O)=O AK-25649 [0,2,0,0,0,0|2,0,0]=4 1481 B11R1.166 O=[N+](C1=CC=C(Br)C=C1Br)[O-] AK-51080 [0,2,0,0,0,0|1,0,1]=4 1482 B11R1.166 O=[N+](C1=CC=C(Br)C=C1C)[O-] AK-35477 [0,2,0,0,0,0|1,0,1]=4 1483 B11R1.166 O=[N+](C1=CC=C(Cl)C=C1F)[O-] AK-39807 [0,2,0,0,0,0|1,0,1]=4 1484 B11R1.166 OB(C1=CC=C(F)C=C1C)O AK-33224 [0,2,0,0,0,0|1,0,1]=4 1485 B11R1.166 OB(C1=CC=C(F)C=C1Cl)O AK-34635 [0,2,0,0,0,0|1,0,1]=4 1486 B11R1.166 OB(C1=CC=C(F)C=C1O)O AK-46419 [0,2,0,0,0,0|1,0,1]=4 1487 B11R1.166 OB(C1=CC=C(O)C=C1C)O AK-29297 [0,2,0,0,0,0|1,0,1]=4 1488 B11R1.166 OB(C1=CC=C(O)C=C1Cl)O AK-43746 [0,2,0,0,0,0|1,0,1]=4 1489 B11R1.166 OB(O)C1=C(F)C=C(I)C=C1 AK-25870 [0,2,0,0,0,0|1,0,1]=4 1490 B11R1.166 OC(=O)C1=C(Br)C=C(I)C=C1 AK-61744 [0,2,0,0,0,0|0,0,0]=2 1491 B11R1.166 OC(=O)C1=C(F)C=C(Br)C=N1 AK-53915 [0,2,0,0,0,0|1,0,0]=3 1492 B11R1.166 OC(=O)C1=NC=C(Br)C=C1Br AK-30252 [0,2,0,0,0,0|1,0,0]=3 1493 B11R1.166 OC(=O)C1=NC=C(Cl)N=C1Cl AK-51403 [0,2,0,0,0,0|2,0,0]=4 1494 B11R1.166 OC(=O)C1=NC=C(F)C=C1Cl AK109963 [0,2,0,0,0,0|1,0,0]=3 1495 B11R1.166 OC1=C(C=CC(I)=C1)[N+]([O-])=O AK-80852 [0,2,0,0,0,0|1,0,1]=4 1496 B11R1.166 OC1=CC(=NC=C1C(=O)O)C AK-25007 [0,2,0,0,0,0|1,0,0]=3 1497 B11R1.166 OC1=CC(C)=CC=C1[N+]([O-])=O AK-29443 [0,2,0,0,0,0|1,0,1]=4 1498 B11R1.166 OC1=CC(Cl)=C(C=C1)[N+]([O-])=O AK109849 [0,2,0,0,0,0|1,0,1]=4 1499 B11R1.166 OC1=CC=C(B(O)O)C(F)=C1 AK-62257 [0,2,0,0,0,0|1,0,1]=4 1500 B11R1.166 OC1=CC=C([N+]([O-])=O)C(Br)=C1 AK-76862 [0,2,0,0,0,0|1,0,1]=4 1501 B11R1.166 OC1=CC=C([N+]([O-])=O)C(F)=C1 AK-25905 [0,2,0,0,0,0|1,0,1]=4 1502 B11R1.166 OC1=CC=C([N+]([O-])=O)C(I)=C1 AK-39967 [0,2,0,0,0,0|1,0,1]=4 1503 B11R1.166 S=C1NC(C(=CN1)C(O)=O)=O AK327607 [0,2,0,0,0,0|2,0,0]=4 1504 B11R1.166 [O-][N+](=O)C1=C(F)C=C(I)C=C1 AK-64473 [0,2,0,0,0,0|1,0,1]=4 1505 B11R1.7 CC(O)(C1=CC=CC=C1)C#C AK305661 [0,2,0,0,0,0|1,0,1]=4 1506 B11R1.7 O=S(C1=CC=CC=C1)(C=C)=O AK-47603 [0,2,0,0,0,0|1,0,1]=4 1507 B11R1.7 O=S(C1=CC=CC=C1)(CCl)=O AK116676 [0,2,0,0,0,0|1,0,1]=4 1508 B11R1.12 COC(C1=CC=CC=C1)CO AK-49663 [0,2,0,0,0,0|0,0,2]=4 1509 B11R1.12 OCC(C1=CC=CC=C1)CO AK-39914 [0,2,0,0,0,0|0,0,2]=4 1510 B11R1.16 C1=C(C(OCC)=O)N=CC=C1 AK-48935 [0,2,0,0,0,0|1,0,0]=3 1511 B11R1.16 CCCC(C1=CC=CC=C1)=O AK164430 [0,2,0,0,0,0|1,0,0]=3 1512 B11R1.16 CCCC(C1=CC=CN=C1)=O AK123326 [0,2,0,0,0,0|2,0,0]=4 1513 B11R1.16 CCOC(=O)C1=NC=CC=N1 AK-85955 [0,2,0,0,0,0|2,0,0]=4 1514 B11R1.16 ClCCC(O)C1=CC=CC=C1 AK-40050 [0,2,0,0,0,0|1,0,1]=4 1515 B11R1.16 N#CCC(C1=CC=CC=C1)=O AK-43072 [0,2,0,0,0,0|1,0,0]=3 1516 B11R1.16 N#CCC(C1=CC=NC=C1)=O AK-34281 [0,2,0,0,0,0|2,0,0]=4 1517 B11R1.16 N#CCC(O)C1=CC=CC=C1 AK-63411 [0,2,0,0,0,0|1,0,1]=4 1518 B11R1.16 N[C@@H](C1=CC=CC=C1)CCO AK-33656 [0,2,0,0,0,0|1,0,1]=4 1519 B11R1.16 O=C(C1=NC=CN=C1)OCC AK-40036 [0,2,0,0,0,0|2,0,0]=4 1520 B11R1.16 O=C(OCC)C1=CC=NC=C1 AK-50699 [0,2,0,0,0,0|1,0,0]=3 1521 B11R1.16 O=C(OCC)C1=CN=CC=C1 AK-88428 [0,2,0,0,0,0|1,0,0]=3 1522 B11R1.16 O=C(OCCl)C1=CC=CC=C1 AK-86220 [0,2,0,0,0,0|0,0,0]=2 1523 B11R1.16 OC(C1=CC=CC=C1)CCN AK206233 [0,2,0,0,0,0|1,0,1]=4 1524 B11R1.16 OCCC(N)C1=CC=CC=C1 AK-33310 [0,2,0,0,0,0|1,0,1]=4 1525 B11R1.16 OCC[C@H](N)C1=CC=CC=C1 AK-36482 [0,2,0,0,0,0|1,0,1]=4 1526 B11R1.16 O[C@@H](C1=CC=CC=C1)CCCl AK-25234 [0,2,0,0,0,0|1,0,1]=4 1527 B11R1.16 O[C@H](C1=CC=CC=C1)CCCl AK-31989 [0,2,0,0,0,0|1,0,1]=4 1528 B11R1.23 BrC1=CC(=NC=C1)C(=O)OC AK-24538 [0,2,0,0,0,0|1,0,0]=3 1529 B11R1.23 BrC1=CC(C(N)CO)=CC=C1 AK321205 [0,2,0,0,0,0|1,0,1]=4 1530 B11R1.23 BrC1=CC([C@@H](N)CO)=CC=C1 AK160001 [0,2,0,0,0,0|1,0,1]=4 1531 B11R1.23 BrC1=CC([C@H](N)CO)=CC=C1 AK167556 [0,2,0,0,0,0|1,0,1]=4 1532 B11R1.23 C1=C(C=CC=C1C(OC)=O)O AK-47384 [0,2,0,0,0,0|0,0,0]=2 1533 B11R1.23 C1=C(C=CC=C1F)C(CBr)=O AK-45729 [0,2,0,0,0,0|1,0,0]=3 1534 B11R1.23 C1=C(C=NC=C1C(OC)=O)Br AK-25229 [0,2,0,0,0,0|1,0,0]=3 1535 B11R1.23 C1=C(C=NC=C1C)C(OC)=O AK-39649 [0,2,0,0,0,0|1,0,0]=3 1536 B11R1.23 C1=C(Cl)C=CN=C1C(OC)=O AK-16616 [0,2,0,0,0,0|1,0,0]=3 1537 B11R1.23 C1=C(Cl)N=CC=C1C(OC)=O AK-28605 [0,2,0,0,0,0|1,0,0]=3 1538 B11R1.23 C1=C(N=CC=C1C(OC)=O)N AK-25223 [0,2,0,0,0,0|1,0,0]=3 1539 B11R1.23 C1=CC=C(N=C1C(OC)=O)C AK-32150 [0,2,0,0,0,0|1,0,0]=3 1540 B11R1.23 CC1=CC(C(CBr)=O)=CC=C1 AK-43564 [0,2,0,0,0,0|1,0,0]=3 1541 B11R1.23 CC1=CC([C@H](N)CO)=CC=C1 AK548236 [0,2,0,0,0,0|1,0,1]=4 1542 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 AK101591 [0,2,0,0,0,0|1,0,0]=3 1543 B11R1.23 CCC(C1=CC=CC(F)=C1)=O AK548314 [0,2,0,0,0,0|1,0,0]=3 1544 B11R1.23 CCC(C1=CC=CC(O)=C1)=O AK-45536 [0,2,0,0,0,0|1,0,0]=3 1545 B11R1.23 CCC(C1=NC=CC(Cl)=C1)=O AK146218 [0,2,0,0,0,0|2,0,0]=4 1546 B11R1.23 COC(=O)C1=CC(=O)NC=C1 AK-30181 [0,2,0,0,0,0|1,0,0]=3 1547 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 AK-29954 [0,2,0,0,0,0|1,0,0]=3 1548 B11R1.23 COC(=O)C1=CC(C)=NC=C1 AK-33626 [0,2,0,0,0,0|1,0,0]=3 1549 B11R1.23 COC(=O)C1=CC=CC(=O)N1 AK-64715 [0,2,0,0,0,0|1,0,0]=3 1550 B11R1.23 COC(=O)C1=CC=NC(Br)=N1 AK-76962 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.23 COC(=O)C1=NC(Br)=CC=N1 AK110267 [0,2,0,0,0,0|2,0,0]=4 1552 B11R1.23 COC(=O)C1=NC(C)=CC=N1 AK100031 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.23 COC(=O)C1=NC=CC(C)=C1 AK-58362 [0,2,0,0,0,0|1,0,0]=3 1554 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 AK-25656 [0,2,0,0,0,0|1,0,0]=3 1555 B11R1.23 COC(C1=CC=CC(=N1)Br)=O AK-27818 [0,2,0,0,0,0|1,0,0]=3 1556 B11R1.23 ClC1=CC(=CN=N1)C(=O)OC AK-32830 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.23 ClC1=CC(C(CBr)=O)=CC=C1 AK-47073 [0,2,0,0,0,0|1,0,0]=3 1558 B11R1.23 ClC1=CC([C@@H](N)CO)=CC=C1 AK143424 [0,2,0,0,0,0|1,0,1]=4 1559 B11R1.23 ClC1=CC([C@H](N)CO)=CC=C1 AK143359 [0,2,0,0,0,0|1,0,1]=4 1560 B11R1.23 ClC1=CC([C@H](N)CO)=CC=C1 AK172770 [0,2,0,0,0,0|1,0,1]=4 1561 B11R1.23 ClC1=CC=NC(=C1)C(=O)NC AK-28999 [0,2,0,0,0,0|2,0,0]=4 1562 B11R1.23 ClC1=CN=CC(=N1)C(=O)OC AK-29037 [0,2,0,0,0,0|2,0,0]=4 1563 B11R1.23 ClC1=NC=CC(=N1)C(=O)OC AK-33388 [0,2,0,0,0,0|2,0,0]=4 1564 B11R1.23 FC1=CC([C@@H](N)CO)=CC=C1 AK607953 [0,2,0,0,0,0|1,0,1]=4 1565 B11R1.23 FC1=CC([C@H](N)CO)=CC=C1 AK159103 [0,2,0,0,0,0|1,0,1]=4 1566 B11R1.23 FC1=CC([C@H](N)CO)=CC=C1 AK548219 [0,2,0,0,0,0|1,0,1]=4 1567 B11R1.23 FC1=CC=CC(=C1)C(=O)OC AK-47674 [0,2,0,0,0,0|0,0,0]=2 1568 B11R1.23 NC1=CC(=CN=C1)C(=O)OC AK-28608 [0,2,0,0,0,0|1,0,0]=3 1569 B11R1.23 NC1=CN=CC(=N1)C(=O)OC AK-28731 [0,2,0,0,0,0|2,0,0]=4 1570 B11R1.23 NNC(=O)C1=CC(Br)=CC=C1 AK-39193 [0,2,0,0,0,0|1,0,0]=3 1571 B11R1.23 NNC(=O)C1=CC(Cl)=CC=C1 AK-60929 [0,2,0,0,0,0|1,0,0]=3 1572 B11R1.23 O=C(C1=CC=CC(Cl)=C1)C=O AK-10035 [0,2,0,0,0,0|0,0,1]=3 1573 B11R1.23 O=C(C1=NC(Br)=CN=C1)OC AK-39151 [0,2,0,0,0,0|2,0,0]=4 1574 B11R1.23 O=C(C1=NC(C)=CN=C1)OC AK130648 [0,2,0,0,0,0|2,0,0]=4 1575 B11R1.23 O=C(C1=NC(Cl)=CC=C1)OC AK-51763 [0,2,0,0,0,0|1,0,0]=3 1576 B11R1.23 O=C(C1=NC(N)=NC=C1)OC AK-76214 [0,2,0,0,0,0|2,0,0]=4 1577 B11R1.23 O=C(C1=NC=CC(N)=C1)OC AK-36192 [0,2,0,0,0,0|1,0,0]=3 1578 B11R1.23 O=C(C1=NC=NC(Br)=C1)OC AK152485 [0,2,0,0,0,0|2,0,0]=4 1579 B11R1.23 O=C(C1=NC=NC(Cl)=C1)OC AK-64323 [0,2,0,0,0,0|2,0,0]=4 1580 B11R1.23 O=C(C=1C=CNC(N1)=O)OC AK-76285 [0,2,0,0,0,0|2,0,0]=4 1581 B11R1.23 O=C(C=1NC=NC(C1)=O)OC AK-68874 [0,2,0,0,0,0|2,0,0]=4 1582 B11R1.23 O=C(NC)C1=CC=CC(N)=C1 AK-34399 [0,2,0,0,0,0|1,0,0]=3 1583 B11R1.23 O=C(NC)C1=NC=CC(Cl)=C1 AK-38402 [0,2,0,0,0,0|2,0,0]=4 1584 B11R1.23 O=C(NN)C1=NC(O)=CC=C1 AK467135 [0,2,0,0,0,0|2,0,0]=4 1585 B11R1.23 O=C(OC)C1=CC=CC(Br)=C1 AK-73031 [0,2,0,0,0,0|0,0,0]=2 1586 B11R1.23 O=C(OC)C1=CC=CC(Cl)=C1 AK117218 [0,2,0,0,0,0|0,0,0]=2 1587 B11R1.23 O=C(OC)C1=CC=CC(I)=C1 AK-81947 [0,2,0,0,0,0|0,0,0]=2 1588 B11R1.23 O=C(OC)C1=CC=CC(N)=C1 AK-43961 [0,2,0,0,0,0|0,0,0]=2 1589 B11R1.23 O=C(OC)C1=CC=NC(F)=C1 AK-86837 [0,2,0,0,0,0|1,0,0]=3 1590 B11R1.23 O=C(OC)C1=NC(F)=CC=C1 AK-87700 [0,2,0,0,0,0|1,0,0]=3 1591 B11R1.23 O=C(OC)C1=NC(N)=CC=C1 AK-37656 [0,2,0,0,0,0|1,0,0]=3 1592 B11R1.23 O=C(OC)C1=NC=CC(I)=C1 AK-29979 [0,2,0,0,0,0|1,0,0]=3 1593 B11R1.23 OC1=CC(=CN=C1)C(=O)OC AK-47062 [0,2,0,0,0,0|1,0,0]=3 1594 B11R1.23 OC1=CC=CC(C(N)CO)=C1 AK608024 [0,2,0,0,0,0|1,0,1]=4 1595 B11R1.23 OC[C@H](O)C1=CC(Cl)=CC=C1 AK-45027 [0,2,0,0,0,0|0,0,2]=4 1596 B11R1.23 O[C@@H](CCl)C1=CC(Cl)=CC=C1 AK-79203 [0,2,0,0,0,0|1,0,1]=4 1597 B11R1.222 BrC1=CN=CN=C1C(=O)OC AK-25053 [0,2,0,0,0,0|2,0,0]=4 1598 B11R1.222 BrC1=NC=CN=C1C(=O)OC AK-30735 [0,2,0,0,0,0|2,0,0]=4 1599 B11R1.222 C1=C(C(=O)OC)C(=NC=C1)F AK-25162 [0,2,0,0,0,0|1,0,0]=3 1600 B11R1.222 C1=CC=CC(=C1C(OC)=O)Br AK-72980 [0,2,0,0,0,0|0,0,0]=2 1601 B11R1.222 C1=CC=NC(=C1C(OC)=O)Cl AK-44999 [0,2,0,0,0,0|1,0,0]=3 1602 B11R1.222 C1=CC=NC(=C1C(OC)=O)N AK-27747 [0,2,0,0,0,0|1,0,0]=3 1603 B11R1.222 C1=CN=C(C(=N1)C(OC)=O)N AK-29912 [0,2,0,0,0,0|2,0,0]=4 1604 B11R1.222 CC1=C(C(=O)OC)C=CC=N1 AK-27990 [0,2,0,0,0,0|1,0,0]=3 1605 B11R1.222 CCC(C1=CC=CC=C1Cl)=O AK-86142 [0,2,0,0,0,0|1,0,0]=3 1606 B11R1.222 COC(=O)C1=C(C)N=CC=N1 AK-97091 [0,2,0,0,0,0|2,0,0]=4 1607 B11R1.222 COC(=O)C1=C(C=NC=C1)I AK-23705 [0,2,0,0,0,0|1,0,0]=3 1608 B11R1.222 COC(=O)C1=C(N)C=CC=C1 AK-41339 [0,2,0,0,0,0|0,0,0]=2 1609 B11R1.222 COC(=O)C1=CC=NNC1=O AK100226 [0,2,0,0,0,0|2,0,0]=4 1610 B11R1.222 COC(=O)C1=CN=CN=C1O AK-26014 [0,2,0,0,0,0|2,0,0]=4 1611 B11R1.222 COC(=O)C1=NC=CC=C1C AK-61199 [0,2,0,0,0,0|1,0,0]=3 1612 B11R1.222 ClC1=C(N=CC=C1)C(=O)OC AK-23912 [0,2,0,0,0,0|1,0,0]=3 1613 B11R1.222 ClC1=CC=CC=C1[C@H](N)CO AK548235 [0,2,0,0,0,0|1,0,1]=4 1614 B11R1.222 ClC1=NC=CN=C1C(=O)OC AK-39173 [0,2,0,0,0,0|2,0,0]=4 1615 B11R1.222 FC1=CC=CC=C1C(CF)=O AK198962 [0,2,0,0,0,0|1,0,0]=3 1616 B11R1.222 NC1=NC=NC=C1C(=O)OC AK-30806 [0,2,0,0,0,0|2,0,0]=4 1617 B11R1.222 NCC(=O)C1=C(C=CC=C1)F AK-70904 [0,2,0,0,0,0|1,0,0]=3 1618 B11R1.222 O=C(C#N)C1=CC=CC=C1F AK154692 [0,2,0,0,0,0|1,0,0]=3 1619 B11R1.222 O=C(C1=CC=CNC1=O)OC AK-28355 [0,2,0,0,0,0|1,0,0]=3 1620 B11R1.222 O=C(C1=NC=CC=C1Br)OC AK-28556 [0,2,0,0,0,0|1,0,0]=3 1621 B11R1.222 O=C(C1=NC=CC=C1F)OC AK-30151 [0,2,0,0,0,0|1,0,0]=3 1622 B11R1.222 O=C(C1=NC=CC=C1O)OC AK-26201 [0,2,0,0,0,0|1,0,0]=3 1623 B11R1.222 O=C(C1=NC=CN=C1I)OC AK-30597 [0,2,0,0,0,0|2,0,0]=4 1624 B11R1.222 O=C(NC)C1=CC=CC=C1N AK-26614 [0,2,0,0,0,0|1,0,0]=3 1625 B11R1.222 O=C(NN)C1=CC=CC=C1O AK167835 [0,2,0,0,0,0|1,0,0]=3 1626 B11R1.222 O=C(OC)C1=C(O)N=CC=C1 AK-54451 [0,2,0,0,0,0|1,0,0]=3 1627 B11R1.222 O=C(OC)C1=CC=CC=C1C AK174020 [0,2,0,0,0,0|0,0,0]=2 1628 B11R1.222 O=C(OC)C1=CC=CC=C1Cl AK161838 [0,2,0,0,0,0|0,0,0]=2 1629 B11R1.222 O=C(OC)C1=CC=CC=C1I AK-76653 [0,2,0,0,0,0|0,0,0]=2 1630 B11R1.222 O=C(OC)C1=CC=CC=C1S AK554462 [0,2,0,0,0,0|0,0,0]=2 1631 B11R1.222 O=C(OC)C1=CC=NC=C1Br AK-46004 [0,2,0,0,0,0|1,0,0]=3 1632 B11R1.222 O=C(OC)C1=CC=NC=C1N AK-28029 [0,2,0,0,0,0|1,0,0]=3 1633 B11R1.222 O=C(OC)C1=CC=NC=C1O AK-49202 [0,2,0,0,0,0|1,0,0]=3 1634 B11R1.222 O=C(OC)C1=CN=CC=C1C AK-39773 [0,2,0,0,0,0|1,0,0]=3 1635 B11R1.222 O=C(OC)C1=CN=CC=C1N AK-25475 [0,2,0,0,0,0|1,0,0]=3 1636 B11R1.222 O=C(OC)C1=NC=CC=C1N AK-29219 [0,2,0,0,0,0|1,0,0]=3 1637 B11R1.222 OC1=CC=CC=C1C(NO)=O AK-48843 [0,2,0,0,0,0|0,0,0]=2 1638 B11R1.222 OC1=NC=CN=C1C(=O)OC AK-39232 [0,2,0,0,0,0|2,0,0]=4 1639 B11R1.222 O[C@@H](C1=CC=CC=C1Cl)CO AK-44949 [0,2,0,0,0,0|0,0,2]=4 1640 B11R1.87 C1(=CC=CC=C1[S](=O)(=O)O)C AK-37104 [0,2,0,0,0,0|1,0,0]=3 1641 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 AK-38217 [0,2,0,0,0,0|1,0,1]=4 1642 B11R1.87 CC(O)(C1=CC=CC=C1N)C AK125202 [0,2,0,0,0,0|1,0,1]=4 1643 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 AK103382 [0,2,0,0,0,0|2,0,0]=4 1644 B11R1.87 NC1=C(C=CC=C1)S(O)(=O)=O AK-53459 [0,2,0,0,0,0|1,0,0]=3 1645 B11R1.87 NS(=O)(=O)C1=C(F)C=CC=C1 AK-87258 [0,2,0,0,0,0|1,0,1]=4 1646 B11R1.87 O=S(C1=C(C)C=CN=C1)(O)=O AK-46481 [0,2,0,0,0,0|2,0,0]=4 1647 B11R1.87 O=S(C1=CC=CC=C1C)(O)=O AK305179 [0,2,0,0,0,0|1,0,0]=3 1648 B11R1.87 O=S(C1=CC=CC=C1F)(Cl)=O AK-51787 [0,2,0,0,0,0|1,0,1]=4 1649 B11R1.87 O=S(C1=CC=CC=C1N)(Cl)=O AK146260 [0,2,0,0,0,0|1,0,1]=4 1650 B11R1.155 C1=C(C=CC=C1Br)[S](=O)(=O)Cl AK-51785 [0,2,0,0,0,0|1,0,1]=4 1651 B11R1.155 CC(O)(C1=CC=CC(Br)=C1)C AK-41777 [0,2,0,0,0,0|1,0,1]=4 1652 B11R1.155 NC1=CC=CC(=C1)S(N)(=O)=O AK-76708 [0,2,0,0,0,0|1,0,1]=4 1653 B11R1.155 NS(=O)(=O)C1=CC(F)=CC=C1 AK-87259 [0,2,0,0,0,0|1,0,1]=4 1654 B11R1.155 O=S(C1=CC(Br)=CC=C1)(C)=O AK-49145 [0,2,0,0,0,0|1,0,1]=4 1655 B11R1.155 O=S(C1=CC(C)=CN=C1)(O)=O AK-29286 [0,2,0,0,0,0|2,0,0]=4 1656 B11R1.155 O=S(C1=CC=CC(Br)=C1)(N)=O AK-51262 [0,2,0,0,0,0|1,0,1]=4 1657 B11R1.155 O=S(C1=CC=CC(C)=C1)(N)=O AK-59822 [0,2,0,0,0,0|1,0,1]=4 1658 B11R1.155 O=S(C1=CC=CC(Cl)=C1)(Cl)=O AK-51784 [0,2,0,0,0,0|1,0,1]=4 1659 B11R1.155 OC1=CC=CC(C(C)(O)C)=C1 AK116134 [0,2,0,0,0,0|1,0,1]=4 1660 B11R1.53 C1=C(C(=CC=C1)CBr)B(O)O AK-32248 [0,2,0,0,0,0|1,0,1]=4 1661 B11R1.53 C1=CC=CC(=C1C#N)C(C)=O AK-50565 [0,2,0,0,0,0|1,0,0]=3 1662 B11R1.53 C1=CC=CC(=C1C=O)C(O)=O AK-46701 [0,2,0,0,0,0|0,0,0]=2 1663 B11R1.53 C1=CC=CC(=C1CBr)[N+](=O)[O-] AK-48220 [0,2,0,0,0,0|1,0,1]=4 1664 B11R1.53 C1=CC=CC(=C1CCl)C(O)=O AK-44122 [0,2,0,0,0,0|0,0,0]=2 1665 B11R1.53 C1=CC=CC(=C1CO)[N+](=O)[O-] AK-47358 [0,2,0,0,0,0|1,0,1]=4 1666 B11R1.53 CC(C1=CC=CC=C1NC)=O AK135397 [0,2,0,0,0,0|1,0,0]=3 1667 B11R1.53 CCC1=NC=CC=C1C(O)=O AK111206 [0,2,0,0,0,0|1,0,0]=3 1668 B11R1.53 COC1=C(C(=O)O)C=CN=C1 AK-30272 [0,2,0,0,0,0|1,0,0]=3 1669 B11R1.53 COC1=C(C=CN=C1)C(C)=O AK-99909 [0,2,0,0,0,0|2,0,0]=4 1670 B11R1.53 COC1=C(N=CC=N1)C(O)=O AK102764 [0,2,0,0,0,0|2,0,0]=4 1671 B11R1.53 COC1=CC=CN=C1C(=O)O AK-63990 [0,2,0,0,0,0|1,0,0]=3 1672 B11R1.53 COC1=CC=CN=C1C(C)=O AK-80679 [0,2,0,0,0,0|2,0,0]=4 1673 B11R1.53 COC1=NC=CC=C1C(C)=O AK110016 [0,2,0,0,0,0|2,0,0]=4 1674 B11R1.53 N#CC1=CC=CC=C1C(O)C AK144989 [0,2,0,0,0,0|1,0,1]=4 1675 B11R1.53 N#CC1=CC=CC=C1[N+]([O-])=O AK-76839 [0,2,0,0,0,0|1,0,1]=4 1676 B11R1.53 N=C(N)C1=CC=CC=C1OC AK156708 [0,2,0,0,0,0|2,0,0]=4 1677 B11R1.53 NCC1=CC=CC=C1B(O)O AK115627 [0,2,0,0,0,0|1,0,1]=4 1678 B11R1.53 O=C(O)C1=C(OC)N=CC=C1 AK-45121 [0,2,0,0,0,0|1,0,0]=3 1679 B11R1.53 O=C(O)C1=CC=CC=C1C#C AK129466 [0,2,0,0,0,0|0,0,0]=2 1680 B11R1.53 O=C(O)C1=CC=CC=C1CC AK-77452 [0,2,0,0,0,0|0,0,0]=2 1681 B11R1.53 O=C(O)C1=CC=CC=C1CO AK-35845 [0,2,0,0,0,0|0,0,0]=2 1682 B11R1.53 O=C(O)C1=CC=CC=C1OC AK-77451 [0,2,0,0,0,0|0,0,0]=2 1683 B11R1.53 O=C(O)C1=CN=CC=C1CC AK452545 [0,2,0,0,0,0|1,0,0]=3 1684 B11R1.53 O=CC1=CC=CC=C1B(O)O AK-40715 [0,2,0,0,0,0|1,0,1]=4 1685 B11R1.53 O=CC1=CC=CC=C1N(=O)=O AK-49899 [0,2,0,0,0,0|1,0,1]=4 1686 B11R1.53 O=[N+](C1=CC=CC=C1C#C)[O-] AK-60568 [0,2,0,0,0,0|1,0,1]=4 1687 B11R1.53 O=[N+](C1=CC=CC=C1SC)[O-] AK-39306 [0,2,0,0,0,0|1,0,1]=4 1688 B11R1.53 OB(C1=CC=CC=C1CC)O AK-48806 [0,2,0,0,0,0|1,0,1]=4 1689 B11R1.53 OB(C1=CC=CC=C1OC)O AK-25218 [0,2,0,0,0,0|1,0,1]=4 1690 B11R1.53 OB(C1=CC=CC=C1SC)O AK-47931 [0,2,0,0,0,0|1,0,1]=4 1691 B11R1.53 OB(O)C1=C(C=C)C=CC=C1 AK-45480 [0,2,0,0,0,0|1,0,1]=4 1692 B11R1.53 OCC1=CC=CC=C1B(O)O AK-36634 [0,2,0,0,0,0|1,0,1]=4 1693 B11R1.156 BrC1=C(C(=O)O)C(=CC=C1)C AK-29573 [0,2,0,0,0,0|0,0,0]=2 1694 B11R1.156 BrC1=CC=CC(=C1[N+](=O)[O-])N AK-36189 [0,2,0,0,0,0|1,0,1]=4 1695 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)C AK-24771 [0,2,0,0,0,0|0,0,0]=2 1696 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)F AK-27185 [0,2,0,0,0,0|0,0,0]=2 1697 B11R1.156 C1=C(C(=C(C=C1)Cl)C(O)=O)O AK-39316 [0,2,0,0,0,0|0,0,0]=2 1698 B11R1.156 C1=C(C(=C(C=C1)O)[N+](=O)[O-])C AK-35313 [0,2,0,0,0,0|1,0,1]=4 1699 B11R1.156 C1=CC(=C(C(=O)O)C(=C1)C)O AK-35673 [0,2,0,0,0,0|0,0,0]=2 1700 B11R1.156 C1=CC=C(C(=C1C)[N+](=O)[O-])N AK-35806 [0,2,0,0,0,0|1,0,1]=4 1701 B11R1.156 C1=CC=C(C(=C1F)[N+](=O)[O-])F AK-27352 [0,2,0,0,0,0|1,0,1]=4 1702 B11R1.156 C1=CC=C(C(=C1N)[N+](=O)[O-])Cl AK-26161 [0,2,0,0,0,0|1,0,1]=4 1703 B11R1.156 C1=CC=C(F)C(=C1Cl)[N+]([O-])=O AK-30470 [0,2,0,0,0,0|1,0,1]=4 1704 B11R1.156 C1=CN=C(C(=C1Cl)C(=O)O)Cl AK-25677 [0,2,0,0,0,0|1,0,0]=3 1705 B11R1.156 CC(=O)C1=C(C)C=CC=C1C AK110169 [0,2,0,0,0,0|1,0,0]=3 1706 B11R1.156 CC(=O)C1=C(N)C=CC=C1Br AK-99977 [0,2,0,0,0,0|1,0,0]=3 1707 B11R1.156 CC(C1=C(C)C=CC=C1O)=O AK-64408 [0,2,0,0,0,0|1,0,0]=3 1708 B11R1.156 CC(C1=C(Cl)C=CC=C1Cl)=O AK-51041 [0,2,0,0,0,0|1,0,0]=3 1709 B11R1.156 CC(C1=C(F)C=CC=C1Br)=O AK-31670 [0,2,0,0,0,0|1,0,0]=3 1710 B11R1.156 CC(C1=C(F)C=CC=C1Cl)=O AK-77336 [0,2,0,0,0,0|1,0,0]=3 1711 B11R1.156 CC(C1=C(F)C=CC=C1F)=O AK-33179 [0,2,0,0,0,0|1,0,0]=3 1712 B11R1.156 CC(C1=C(F)C=CC=C1N)=O AK145194 [0,2,0,0,0,0|1,0,0]=3 1713 B11R1.156 CC(C1=C(O)C=CC=C1Br)=O AK-31671 [0,2,0,0,0,0|1,0,0]=3 1714 B11R1.156 CC(C1=C(O)C=CC=C1Cl)=O AK-29397 [0,2,0,0,0,0|1,0,0]=3 1715 B11R1.156 CC(C1=C(O)C=CC=C1F)=O AK-86499 [0,2,0,0,0,0|1,0,0]=3 1716 B11R1.156 CC(C1=C(O)C=CC=C1O)=O AK-47368 [0,2,0,0,0,0|1,0,0]=3 1717 B11R1.156 CC(O)C1=C(F)C=CC=C1Br AK144493 [0,2,0,0,0,0|1,0,1]=4 1718 B11R1.156 CC1=C(B(O)O)C(C)=CC=C1 AK-32626 [0,2,0,0,0,0|1,0,1]=4 1719 B11R1.156 CC1=CC=CC(Cl)=C1[N+]([O-])=O AK-26088 [0,2,0,0,0,0|1,0,1]=4 1720 B11R1.156 CC1=NC=NC(=C1C(=O)O)C AK-24036 [0,2,0,0,0,0|2,0,0]=4 1721 B11R1.156 ClC1=NC=NC(=C1C(=O)O)Cl AK-28552 [0,2,0,0,0,0|2,0,0]=4 1722 B11R1.156 FC1=C(B(O)O)C(Br)=CC=C1 AK-62111 [0,2,0,0,0,0|1,0,1]=4 1723 B11R1.156 FC1=C(C(=O)O)C(=CC=C1)C AK-23633 [0,2,0,0,0,0|0,0,0]=2 1724 B11R1.156 FC1=C(C(=O)O)C(=CC=N1)I AK-30567 [0,2,0,0,0,0|1,0,0]=3 1725 B11R1.156 FC1=CC=CC(=C1[N+](=O)[O-])C AK-39918 [0,2,0,0,0,0|1,0,1]=4 1726 B11R1.156 FC1=CC=CC(=C1[N+](=O)[O-])N AK-35674 [0,2,0,0,0,0|1,0,1]=4 1727 B11R1.156 FC1=CC=CC(=C1[N+](=O)[O-])O AK-25894 [0,2,0,0,0,0|1,0,1]=4 1728 B11R1.156 NC1=C(C(=O)O)C(=CC=C1)Br AK-30472 [0,2,0,0,0,0|0,0,0]=2 1729 B11R1.156 NC1=C(C(O)=O)C(Cl)=CC=C1 AK-34098 [0,2,0,0,0,0|0,0,0]=2 1730 B11R1.156 NC1=NC=CC(Cl)=C1C(O)=O AK-54996 [0,2,0,0,0,0|1,0,0]=3 1731 B11R1.156 O=C(C1=C(F)C=NC=C1F)O AK-37386 [0,2,0,0,0,0|1,0,0]=3 1732 B11R1.156 O=C(N)C1=C(C)C=CC=C1F AK145173 [0,2,0,0,0,0|1,0,0]=3 1733 B11R1.156 O=C(N)C1=C(F)C=CC=C1F AK-72781 [0,2,0,0,0,0|1,0,0]=3 1734 B11R1.156 O=C(N)C1=C(F)C=NC=C1Br AK132934 [0,2,0,0,0,0|2,0,0]=4 1735 B11R1.156 O=C(O)C1=C(C)C=CC=C1C AK-26211 [0,2,0,0,0,0|0,0,0]=2 1736 B11R1.156 O=C(O)C1=C(C)C=CC=C1N AK-35168 [0,2,0,0,0,0|0,0,0]=2 1737 B11R1.156 O=C(O)C1=C(C)C=NC=C1F AK100803 [0,2,0,0,0,0|1,0,0]=3 1738 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Br AK-26454 [0,2,0,0,0,0|0,0,0]=2 1739 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl AK-57133 [0,2,0,0,0,0|0,0,0]=2 1740 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1F AK130207 [0,2,0,0,0,0|1,0,0]=3 1741 B11R1.156 O=C(O)C1=C(F)C=CC=C1Br AK-25617 [0,2,0,0,0,0|0,0,0]=2 1742 B11R1.156 O=C(O)C1=C(F)C=CC=C1F AK-25893 [0,2,0,0,0,0|0,0,0]=2 1743 B11R1.156 O=C(O)C1=C(F)C=CC=C1N AK-35156 [0,2,0,0,0,0|0,0,0]=2 1744 B11R1.156 O=C(O)C1=C(F)C=NC=C1Br AK-62157 [0,2,0,0,0,0|1,0,0]=3 1745 B11R1.156 O=C(O)C1=C(I)C=CC=C1Cl AK128439 [0,2,0,0,0,0|0,0,0]=2 1746 B11R1.156 O=C(O)C1=C(I)C=CC=C1F AK-73092 [0,2,0,0,0,0|0,0,0]=2 1747 B11R1.156 O=C(O)C1=C(I)C=CC=C1N AK-79473 [0,2,0,0,0,0|0,0,0]=2 1748 B11R1.156 O=C(O)C1=C(O)C=CC=C1F AK-36077 [0,2,0,0,0,0|0,0,0]=2 1749 B11R1.156 O=C(O)C1=C(O)C=CC=C1N AK-76027 [0,2,0,0,0,0|0,0,0]=2 1750 B11R1.156 O=C(O)C1=C(O)N=CC=C1F AK280470 [0,2,0,0,0,0|1,0,0]=3 1751 B11R1.156 O=C([O-])C1=C(Cl)C=CC=C1Cl AK202901 [0,2,0,0,0,0|0,0,1]=3 1752 B11R1.156 O=C([O-])C1=C(F)C=CC=C1F AK112379 [0,2,0,0,0,0|0,0,1]=3 1753 B11R1.156 O=[N+](C1=C(C)C=CC=C1Br)[O-] AK-35476 [0,2,0,0,0,0|1,0,1]=4 1754 B11R1.156 O=[N+](C1=C(F)C=CC=C1Br)[O-] AK-26408 [0,2,0,0,0,0|1,0,1]=4 1755 B11R1.156 O=[N+](C1=C(I)C=CC=C1F)[O-] AK-67610 [0,2,0,0,0,0|1,0,1]=4 1756 B11R1.156 OB(C1=C(F)C=CC=C1Cl)O AK-34633 [0,2,0,0,0,0|1,0,1]=4 1757 B11R1.156 OB(C1=C(F)C=CC=C1F)O AK-33551 [0,2,0,0,0,0|1,0,1]=4 1758 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Cl AK-36251 [0,2,0,0,0,0|1,0,1]=4 1759 B11R1.156 OC(=O)C1=C(Br)C=CC=C1Br AK-86840 [0,2,0,0,0,0|0,0,0]=2 1760 B11R1.156 OC(=O)C1=C(Br)C=NC=C1Br AK-59054 [0,2,0,0,0,0|1,0,0]=3 1761 B11R1.156 OC(=O)C1=C(Cl)C=NC=C1Cl AK-39396 [0,2,0,0,0,0|1,0,0]=3 1762 B11R1.156 OC1=CC=CC(Br)=C1[N+]([O-])=O AK-36320 [0,2,0,0,0,0|1,0,1]=4 1763 B11R1.156 OC1=CC=CC(O)=C1[N+]([O-])=O AK-72878 [0,2,0,0,0,0|1,0,1]=4 1764 B11R1.156 [O-][N+](=O)C1=C(Br)C=CC=C1Br AK-50334 [0,2,0,0,0,0|1,0,1]=4 1765 B11R1.156 [O-][N+](=O)C1=C(Cl)C=CC=C1Cl AK-77251 [0,2,0,0,0,0|1,0,1]=4 1766 B11R1.159 BrC1=C(C(=CC=C1)[N+](=O)[O-])Cl AK-35017 [0,2,0,0,0,0|1,0,1]=4 1767 B11R1.159 BrC1=C(C(=O)O)C=CC=C1C AK-28470 [0,2,0,0,0,0|0,0,0]=2 1768 B11R1.159 BrC1=C(C(=O)O)C=CC=C1F AK-25368 [0,2,0,0,0,0|0,0,0]=2 1769 B11R1.159 BrC1=CC=CC(=C1Cl)C(=O)O AK-41763 [0,2,0,0,0,0|0,0,0]=2 1770 B11R1.159 BrC1=CC=CC(=C1F)C(C)=O AK-33547 [0,2,0,0,0,0|1,0,0]=3 1771 B11R1.159 BrC1=CC=CC(=C1F)[N+](=O)[O-] AK-35754 [0,2,0,0,0,0|1,0,1]=4 1772 B11R1.159 BrC1=CC=CC(=C1O)C(=O)O AK-24666 [0,2,0,0,0,0|0,0,0]=2 1773 B11R1.159 C1=C(C(=C(C=C1)C)N)C(O)=O AK-35167 [0,2,0,0,0,0|0,0,0]=2 1774 B11R1.159 C1=C(C(=C(C=C1)C)N)[N+](=O)[O-] AK-35684 [0,2,0,0,0,0|1,0,1]=4 1775 B11R1.159 C1=C(C(=C(C=C1)F)C)C(O)=O AK-26272 [0,2,0,0,0,0|0,0,0]=2 1776 B11R1.159 C1=C(C(=C(C=C1)O)N)C(O)=O AK-35611 [0,2,0,0,0,0|0,0,0]=2 1777 B11R1.159 C1=C(C(=C(Cl)C=C1)F)[N+]([O-])=O AK-27027 [0,2,0,0,0,0|1,0,1]=4 1778 B11R1.159 C1=C([N+]([O-])=O)C(=C(Br)C=C1)O AK-25354 [0,2,0,0,0,0|1,0,1]=4 1779 B11R1.159 C1=C([N+]([O-])=O)C(=C(O)C=C1)Cl AK-24861 [0,2,0,0,0,0|1,0,1]=4 1780 B11R1.159 C1=CC=C(C(=C1C(O)=O)C)C AK-26167 [0,2,0,0,0,0|0,0,0]=2 1781 B11R1.159 C1=CC=C(C(=C1C(O)=O)C)Cl AK-29499 [0,2,0,0,0,0|0,0,0]=2 1782 B11R1.159 C1=CC=C(C(=C1C(O)=O)N)F AK-29556 [0,2,0,0,0,0|0,0,0]=2 1783 B11R1.159 C1=CC=C(C(=C1C(O)=O)O)F AK-34755 [0,2,0,0,0,0|0,0,0]=2 1784 B11R1.159 C1=CC=C(C(=C1[N+](=O)[O-])Br)C AK-23605 [0,2,0,0,0,0|1,0,1]=4 1785 B11R1.159 C1=CC=C(C(=C1[N+](=O)[O-])C)Br AK-26983 [0,2,0,0,0,0|1,0,1]=4 1786 B11R1.159 C1=CC=C(C(=C1[N+](=O)[O-])C)F AK-26322 [0,2,0,0,0,0|1,0,1]=4 1787 B11R1.159 C1=CC=C(C(=C1[N+](=O)[O-])Cl)C AK-47309 [0,2,0,0,0,0|1,0,1]=4 1788 B11R1.159 C1=CC=C(C(=C1[N+](=O)[O-])N)Cl AK-26323 [0,2,0,0,0,0|1,0,1]=4 1789 B11R1.159 C1=CC=C(C(=C1[N+]([O-])=O)N)F AK-33770 [0,2,0,0,0,0|1,0,1]=4 1790 B11R1.159 C1=CC=C(C(=C1[N+]([O-])=O)O)C AK-40877 [0,2,0,0,0,0|1,0,1]=4 1791 B11R1.159 C1=CC=C(F)C(=C1[N+]([O-])=O)Cl AK-34086 [0,2,0,0,0,0|1,0,1]=4 1792 B11R1.159 C1=CC=C(F)C(=C1[N+]([O-])=O)F AK-46575 [0,2,0,0,0,0|1,0,1]=4 1793 B11R1.159 CC(C1=CC=CC(Br)=C1O)=O AK-33819 [0,2,0,0,0,0|1,0,0]=3 1794 B11R1.159 CC(C1=CC=CC(C)=C1F)=O AK327202 [0,2,0,0,0,0|1,0,0]=3 1795 B11R1.159 CC(C1=CC=CC(Cl)=C1Cl)=O AK-75733 [0,2,0,0,0,0|1,0,0]=3 1796 B11R1.159 CC(C1=CC=CC(Cl)=C1O)=O AK-34682 [0,2,0,0,0,0|1,0,0]=3 1797 B11R1.159 CC(C1=CC=CC(F)=C1Br)=O AK145989 [0,2,0,0,0,0|1,0,0]=3 1798 B11R1.159 CC(C1=CC=CC(F)=C1Cl)=O AK-94336 [0,2,0,0,0,0|1,0,0]=3 1799 B11R1.159 CC(C1=CC=CC(N)=C1O)=O AK-26283 [0,2,0,0,0,0|1,0,0]=3 1800 B11R1.159 CC(C1=CC=CC(O)=C1N)=O AK-80116 [0,2,0,0,0,0|1,0,0]=3 1801 B11R1.159 CC(C1=CC=CC(O)=C1O)=O AK-33157 [0,2,0,0,0,0|1,0,0]=3 1802 B11R1.159 CC1=C(C=CC=C1F)B(O)O AK-33571 [0,2,0,0,0,0|1,0,1]=4 1803 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O AK-61755 [0,2,0,0,0,0|1,0,1]=4 1804 B11R1.159 CC1=C(I)C=CC=C1[N+]([O-])=O AK-28623 [0,2,0,0,0,0|1,0,1]=4 1805 B11R1.159 CC1=C(N)C=CC=C1B(O)O AK607675 [0,2,0,0,0,0|1,0,1]=4 1806 B11R1.159 CC1=C(O)C=CC=C1C(O)=O AK-45470 [0,2,0,0,0,0|0,0,0]=2 1807 B11R1.159 CC1=CC=CC(C(O)=O)=C1I AK-61437 [0,2,0,0,0,0|0,0,0]=2 1808 B11R1.159 CN1C(=O)C=CC=C1C(O)=O AK-84571 [0,2,0,0,0,0|1,0,0]=3 1809 B11R1.159 ClC1=NC=CC(=C1F)C(=O)O AK-35914 [0,2,0,0,0,0|1,0,0]=3 1810 B11R1.159 FC1=C(Br)C=CC=C1B(O)O AK-54283 [0,2,0,0,0,0|1,0,1]=4 1811 B11R1.159 FC1=C(C(=O)O)C=CC=C1I AK-35201 [0,2,0,0,0,0|0,0,0]=2 1812 B11R1.159 FC1=C(C=CC=C1I)B(O)O AK-54284 [0,2,0,0,0,0|1,0,1]=4 1813 B11R1.159 FC1=C(C=CC=C1[N+](=O)[O-])O AK-28239 [0,2,0,0,0,0|1,0,1]=4 1814 B11R1.159 FC1=C(Cl)C(B(O)O)=CC=C1 AK-62022 [0,2,0,0,0,0|1,0,1]=4 1815 B11R1.159 FC1=C(Cl)C=CC=C1B(O)O AK-44630 [0,2,0,0,0,0|1,0,1]=4 1816 B11R1.159 FC1=CC=CC(=C1I)C(=O)O AK-34964 [0,2,0,0,0,0|0,0,0]=2 1817 B11R1.159 FC1=NC=CC(=C1F)C(=O)O AK-36566 [0,2,0,0,0,0|1,0,0]=3 1818 B11R1.159 NC(=O)C1=C(N)C(Br)=CC=C1 AK109579 [0,2,0,0,0,0|1,0,0]=3 1819 B11R1.159 NC1=C(Br)C(=CC=C1)[N+]([O-])=O AK-74201 [0,2,0,0,0,0|1,0,1]=4 1820 B11R1.159 NC1=C(C=CN=C1Cl)C(O)=O AK-55039 [0,2,0,0,0,0|1,0,0]=3 1821 B11R1.159 NC1=C(Cl)C=CC=C1C(O)=O AK-31072 [0,2,0,0,0,0|0,0,0]=2 1822 B11R1.159 NC1=C(O)C(=CC=C1)[N+]([O-])=O AK-67577 [0,2,0,0,0,0|1,0,1]=4 1823 B11R1.159 NC1=C(O)C=CC=C1N(=O)=O AK-26168 [0,2,0,0,0,0|1,0,1]=4 1824 B11R1.159 NC1=C([N+]([O-])=O)C=CC=C1Br AK-35779 [0,2,0,0,0,0|1,0,1]=4 1825 B11R1.159 NC1=CC=CC(=C1Cl)C(=O)O AK-32822 [0,2,0,0,0,0|0,0,0]=2 1826 B11R1.159 NC1=CC=CC([N+]([O-])=O)=C1Cl AK-74206 [0,2,0,0,0,0|1,0,1]=4 1827 B11R1.159 NC1=CC=CC([N+]([O-])=O)=C1N AK-72554 [0,2,0,0,0,0|1,0,1]=4 1828 B11R1.159 O=C(C1=CC=CC(N1O)=O)O AK-88861 [0,2,0,0,0,0|1,0,0]=3 1829 B11R1.159 O=C(C1=NC=NC(Cl)=C1Cl)O AK101579 [0,2,0,0,0,0|2,0,0]=4 1830 B11R1.159 O=C(C1=NC=NC(N)=C1Cl)O AK-51545 [0,2,0,0,0,0|2,0,0]=4 1831 B11R1.159 O=C(N)C1=CC=CC(C)=C1N AK113423 [0,2,0,0,0,0|1,0,0]=3 1832 B11R1.159 O=C(N)C1=CC=CC(Cl)=C1F AK305347 [0,2,0,0,0,0|1,0,0]=3 1833 B11R1.159 O=C(N)C1=CC=CC(N)=C1N AK-32166 [0,2,0,0,0,0|1,0,0]=3 1834 B11R1.159 O=C(O)C1=CC=CC(Br)=C1C AK-27090 [0,2,0,0,0,0|0,0,0]=2 1835 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F AK-23680 [0,2,0,0,0,0|0,0,0]=2 1836 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I AK-73145 [0,2,0,0,0,0|0,0,0]=2 1837 B11R1.159 O=C(O)C1=CC=CC(Br)=C1N AK-28094 [0,2,0,0,0,0|0,0,0]=2 1838 B11R1.159 O=C(O)C1=CC=CC(C)=C1F AK-34640 [0,2,0,0,0,0|0,0,0]=2 1839 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Cl AK-48292 [0,2,0,0,0,0|0,0,0]=2 1840 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F AK-29899 [0,2,0,0,0,0|0,0,0]=2 1841 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I AK-68531 [0,2,0,0,0,0|0,0,0]=2 1842 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O AK-75898 [0,2,0,0,0,0|0,0,0]=2 1843 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl AK-32695 [0,2,0,0,0,0|0,0,0]=2 1844 B11R1.159 O=C(O)C1=CC=CC(F)=C1F AK-48902 [0,2,0,0,0,0|0,0,0]=2 1845 B11R1.159 O=C(O)C1=CC=CC(I)=C1N AK-64570 [0,2,0,0,0,0|0,0,0]=2 1846 B11R1.159 O=C(O)C1=CC=CC(N)=C1C AK-45495 [0,2,0,0,0,0|0,0,0]=2 1847 B11R1.159 O=C(O)C1=CC=CC(N)=C1F AK-36851 [0,2,0,0,0,0|0,0,0]=2 1848 B11R1.159 O=C(O)C1=CC=CC(O)=C1O AK-24541 [0,2,0,0,0,0|0,0,0]=2 1849 B11R1.159 O=C(O)C1=CC=NC(Br)=C1Br AK-86977 [0,2,0,0,0,0|1,0,0]=3 1850 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1C AK-81020 [0,2,0,0,0,0|1,0,0]=3 1851 B11R1.159 O=C(O)C1=CC=NC(Cl)=C1Cl AK-28927 [0,2,0,0,0,0|1,0,0]=3 1852 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Br AK127033 [0,2,0,0,0,0|1,0,0]=3 1853 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Cl AK144516 [0,2,0,0,0,0|1,0,0]=3 1854 B11R1.159 O=C(O)C1=CN=CC(Br)=C1N AK112514 [0,2,0,0,0,0|1,0,0]=3 1855 B11R1.159 O=C(O)C1=CN=CC(Br)=C1O AK-84818 [0,2,0,0,0,0|1,0,0]=3 1856 B11R1.159 O=[N+](C1=C(F)C(C)=CC=C1)[O-] AK-35165 [0,2,0,0,0,0|1,0,1]=4 1857 B11R1.159 O=[N+](C1=C(I)C(Br)=CC=C1)[O-] AK105096 [0,2,0,0,0,0|1,0,1]=4 1858 B11R1.159 O=[N+](C1=C(I)C(C)=CC=C1)[O-] AK115865 [0,2,0,0,0,0|1,0,1]=4 1859 B11R1.159 O=[N+](C1=C(I)C(Cl)=CC=C1)[O-] AK167207 [0,2,0,0,0,0|1,0,1]=4 1860 B11R1.159 OB(C1=CC=CC(C)=C1C)O AK-33817 [0,2,0,0,0,0|1,0,1]=4 1861 B11R1.159 OB(C1=CC=CC(Cl)=C1Cl)O AK-33406 [0,2,0,0,0,0|1,0,1]=4 1862 B11R1.159 OC(=O)C1=C(Br)C(Cl)=CC=C1 AK-35679 [0,2,0,0,0,0|0,0,0]=2 1863 B11R1.159 OC(=O)C1=C(Br)C(I)=CC=C1 AK-28155 [0,2,0,0,0,0|0,0,0]=2 1864 B11R1.159 OC1=C(F)C(B(O)O)=CC=C1 AK-93591 [0,2,0,0,0,0|1,0,1]=4 1865 B11R1.159 OC1=C([N+]([O-])=O)C=CC=C1Cl AK-35809 [0,2,0,0,0,0|1,0,1]=4 1866 B11R1.159 OC1=CC=CC([N+]([O-])=O)=C1C AK-23641 [0,2,0,0,0,0|1,0,1]=4 1867 B11R1.159 [O-][N+](=O)C1=CC=CC(Cl)=C1Br AK-79417 [0,2,0,0,0,0|1,0,1]=4 1868 B11R1.167 BrC1=C(C(=O)O)C=C(C=N1)Br AK-34554 [0,2,0,0,0,0|1,0,0]=3 1869 B11R1.167 BrC1=C(C=C(C=C1)Br)B(O)O AK-45824 [0,2,0,0,0,0|1,0,1]=4 1870 B11R1.167 BrC1=C(C=C(C=C1)O)[N+](=O)[O-] AK-24863 [0,2,0,0,0,0|1,0,1]=4 1871 B11R1.167 BrC1=CC(=C(C=C1)Cl)[N+](=O)[O-] AK-33592 [0,2,0,0,0,0|1,0,1]=4 1872 B11R1.167 BrC1=CC(=C(N=C1)Cl)C(=O)O AK-23807 [0,2,0,0,0,0|1,0,0]=3 1873 B11R1.167 BrC1=CC(=C(N=C1)F)C(=O)O AK-26870 [0,2,0,0,0,0|1,0,0]=3 1874 B11R1.167 BrC1=NC=C(C(=C1)C(=O)O)Br AK-62144 [0,2,0,0,0,0|1,0,0]=3 1875 B11R1.167 BrC1=NC=C(N=C1C(=O)O)Br AK-31824 [0,2,0,0,0,0|2,0,0]=4 1876 B11R1.167 C1=C(Br)C=CC(=C1C(=O)C)O AK-47862 [0,2,0,0,0,0|1,0,0]=3 1877 B11R1.167 C1=C(Br)C=CC(=C1C(O)=O)Br AK-26176 [0,2,0,0,0,0|0,0,0]=2 1878 B11R1.167 C1=C(Br)C=CC(=C1[N+](=O)[O-])N AK-26381 [0,2,0,0,0,0|1,0,1]=4 1879 B11R1.167 C1=C(C(=CC=C1Br)C)C(O)=O AK-26338 [0,2,0,0,0,0|0,0,0]=2 1880 B11R1.167 C1=C(C(=CC=C1Br)F)[N+](=O)[O-] AK-25855 [0,2,0,0,0,0|1,0,1]=4 1881 B11R1.167 C1=C(C(=CC=C1C)Br)C(O)=O AK-30136 [0,2,0,0,0,0|0,0,0]=2 1882 B11R1.167 C1=C(C(=CC=C1C)F)C(O)=O AK-34671 [0,2,0,0,0,0|0,0,0]=2 1883 B11R1.167 C1=C(C(=CC=C1Cl)Br)C(O)=O AK-28994 [0,2,0,0,0,0|0,0,0]=2 1884 B11R1.167 C1=C(C(=CC=C1Cl)C)C(O)=O AK-32605 [0,2,0,0,0,0|0,0,0]=2 1885 B11R1.167 C1=C(C(=CC=C1Cl)F)[N+](=O)[O-] AK-25813 [0,2,0,0,0,0|1,0,1]=4 1886 B11R1.167 C1=C(C(=CC=C1F)Br)[N+](=O)[O-] AK-35194 [0,2,0,0,0,0|1,0,1]=4 1887 B11R1.167 C1=C(C(=CC=C1F)C)[N+](=O)[O-] AK-39500 [0,2,0,0,0,0|1,0,1]=4 1888 B11R1.167 C1=C(C(=CC=C1F)N)C(O)=O AK-35193 [0,2,0,0,0,0|0,0,0]=2 1889 B11R1.167 C1=C(C(=CC=C1I)C)[N+](=O)[O-] AK-47575 [0,2,0,0,0,0|1,0,1]=4 1890 B11R1.167 C1=C(C(=CC=C1O)C)C(=O)O AK-40532 [0,2,0,0,0,0|0,0,0]=2 1891 B11R1.167 C1=C(C(=NC=C1Br)N)C(=O)O AK-23512 [0,2,0,0,0,0|1,0,0]=3 1892 B11R1.167 C1=C(C)C=CC(=C1C(O)=O)C AK-48911 [0,2,0,0,0,0|0,0,0]=2 1893 B11R1.167 C1=C(C)C=CC(=C1C(O)=O)N AK-34555 [0,2,0,0,0,0|0,0,0]=2 1894 B11R1.167 C1=C(C)C=CC(=C1[N+](=O)[O-])C AK-47450 [0,2,0,0,0,0|1,0,1]=4 1895 B11R1.167 C1=C(C)C=CC(=C1[N+](=O)[O-])F AK-39501 [0,2,0,0,0,0|1,0,1]=4 1896 B11R1.167 C1=C(C=CC(=C1B(O)O)C)C AK-36572 [0,2,0,0,0,0|1,0,1]=4 1897 B11R1.167 C1=C(C=CC(=C1B(O)O)F)F AK-25550 [0,2,0,0,0,0|1,0,1]=4 1898 B11R1.167 C1=C(Cl)C=CC(=C1C(C)=O)Cl AK-73074 [0,2,0,0,0,0|1,0,0]=3 1899 B11R1.167 C1=C(Cl)C=CC(=C1C(N)=O)O AK-44071 [0,2,0,0,0,0|1,0,0]=3 1900 B11R1.167 C1=C(Cl)C=CC(=C1C(O)=O)Cl AK-47665 [0,2,0,0,0,0|0,0,0]=2 1901 B11R1.167 C1=C(Cl)C=CC(=C1C(O)=O)N AK-26989 [0,2,0,0,0,0|0,0,0]=2 1902 B11R1.167 C1=C(F)C=CC(=C1[N+](=O)[O-])Cl AK-34771 [0,2,0,0,0,0|1,0,1]=4 1903 B11R1.167 C1=C(F)C=CC(=C1[N+](=O)[O-])F AK-45560 [0,2,0,0,0,0|1,0,1]=4 1904 B11R1.167 C1=C(I)C=CC(=C1C(O)=O)N AK-35517 [0,2,0,0,0,0|0,0,0]=2 1905 B11R1.167 C1=C(N)C=CC(=C1C(O)=O)Cl AK-36786 [0,2,0,0,0,0|0,0,0]=2 1906 B11R1.167 C1=C(N)C=CC(=C1C(O)=O)O AK-72925 [0,2,0,0,0,0|0,0,0]=2 1907 B11R1.167 C1=C(N)C=CC(=C1[N+](=O)[O-])Br AK-50522 [0,2,0,0,0,0|1,0,1]=4 1908 B11R1.167 C1=C(N)C=CC(=C1[N+](=O)[O-])N AK-47270 [0,2,0,0,0,0|1,0,1]=4 1909 B11R1.167 C1=C(O)C=CC(=C1[N+]([O-])=O)C AK-34018 [0,2,0,0,0,0|1,0,1]=4 1910 B11R1.167 C1=C(O)C=CC(=C1[N+]([O-])=O)N AK-46587 [0,2,0,0,0,0|1,0,1]=4 1911 B11R1.167 C1=C([N+]([O-])=O)C(=CC=C1Br)C AK-26173 [0,2,0,0,0,0|1,0,1]=4 1912 B11R1.167 C1=C([N+]([O-])=O)C(=CC=C1C)Br AK-48908 [0,2,0,0,0,0|1,0,1]=4 1913 B11R1.167 C1=C([N+]([O-])=O)C(=CC=C1F)N AK-48191 [0,2,0,0,0,0|1,0,1]=4 1914 B11R1.167 C1=C([N+]([O-])=O)C(=CC=C1N)F AK-34857 [0,2,0,0,0,0|1,0,1]=4 1915 B11R1.167 C1=CC(=NC(=C1Cl)C(O)=O)Cl AK-25485 [0,2,0,0,0,0|1,0,0]=3 1916 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 AK-68014 [0,2,0,0,0,0|1,0,0]=3 1917 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 AK-28102 [0,2,0,0,0,0|1,0,0]=3 1918 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 AK109676 [0,2,0,0,0,0|1,0,0]=3 1919 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 AK-30761 [0,2,0,0,0,0|1,0,0]=3 1920 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 AK-30762 [0,2,0,0,0,0|1,0,0]=3 1921 B11R1.167 CC(C1=C(C=CC(=C1)F)Cl)=O AK-48949 [0,2,0,0,0,0|1,0,0]=3 1922 B11R1.167 CC(C1=CC(Br)=CC=C1C)=O AK147547 [0,2,0,0,0,0|1,0,0]=3 1923 B11R1.167 CC(C1=CC(Br)=CC=C1Cl)=O AK109534 [0,2,0,0,0,0|1,0,0]=3 1924 B11R1.167 CC(C1=CC(Br)=CC=C1F)=O AK-28059 [0,2,0,0,0,0|1,0,0]=3 1925 B11R1.167 CC(C1=CC(Br)=CC=C1N)=O AK-28616 [0,2,0,0,0,0|1,0,0]=3 1926 B11R1.167 CC(C1=CC(Br)=CN=C1F)=O AK-30697 [0,2,0,0,0,0|2,0,0]=4 1927 B11R1.167 CC(C1=CC(Cl)=CC=C1Br)=O AK-51654 [0,2,0,0,0,0|1,0,0]=3 1928 B11R1.167 CC(C1=CC(Cl)=CC=C1F)=O AK-76691 [0,2,0,0,0,0|1,0,0]=3 1929 B11R1.167 CC(C1=CC(F)=CC=C1Br)=O AK-45663 [0,2,0,0,0,0|1,0,0]=3 1930 B11R1.167 CC(C1=CC(F)=CC=C1I)=O AK136027 [0,2,0,0,0,0|1,0,0]=3 1931 B11R1.167 CC(C1=CC(F)=CC=C1O)=O AK-45396 [0,2,0,0,0,0|1,0,0]=3 1932 B11R1.167 CC(C1=CC(N)=CC=C1O)=O AK116395 [0,2,0,0,0,0|1,0,0]=3 1933 B11R1.167 CC(C1=CC(O)=CC=C1O)=O AK-51301 [0,2,0,0,0,0|1,0,0]=3 1934 B11R1.167 CC(C1=NC(Br)=CC=C1F)=O AK372267 [0,2,0,0,0,0|2,0,0]=4 1935 B11R1.167 CC(O)C1=C(C)C=CC(Cl)=C1 AK425566 [0,2,0,0,0,0|1,0,1]=4 1936 B11R1.167 CC(O)C1=CC(Br)=CC=C1F AK-28060 [0,2,0,0,0,0|1,0,1]=4 1937 B11R1.167 CC1=C(N=C(Cl)N=C1)C(O)=O AK-31572 [0,2,0,0,0,0|2,0,0]=4 1938 B11R1.167 CC1=CC(=C(Cl)C=C1)[N+]([O-])=O AK-54912 [0,2,0,0,0,0|1,0,1]=4 1939 B11R1.167 CC1=CC=C(C)C(=N1)C(O)=O AK-76881 [0,2,0,0,0,0|1,0,0]=3 1940 B11R1.167 CC1=CC=C(O)C(B(O)O)=C1 AK-61725 [0,2,0,0,0,0|1,0,1]=4 1941 B11R1.167 CC1=NC(C(O)=O)=C(C)N=C1 AK-80652 [0,2,0,0,0,0|2,0,0]=4 1942 B11R1.167 CC1=NC(C(O)=O)=C(Cl)C=N1 AK100033 [0,2,0,0,0,0|2,0,0]=4 1943 B11R1.167 CC1=NC=C(C(=N1)C(=O)O)Br AK-23643 [0,2,0,0,0,0|2,0,0]=4 1944 B11R1.167 CC1=NC=C(N)C(=C1)C(O)=O AK-55124 [0,2,0,0,0,0|1,0,0]=3 1945 B11R1.167 ClC1=C(C(=O)O)C=C(C=N1)Cl AK-27047 [0,2,0,0,0,0|1,0,0]=3 1946 B11R1.167 ClC1=C(C=C(N=N1)Cl)C(=O)O AK-35400 [0,2,0,0,0,0|2,0,0]=4 1947 B11R1.167 ClC1=NC=C(C=C1C(=O)O)C AK-39746 [0,2,0,0,0,0|1,0,0]=3 1948 B11R1.167 FC1=C(C=C(I)C=C1)N(=O)=O AK-34856 [0,2,0,0,0,0|1,0,1]=4 1949 B11R1.167 FC1=CC(=C(C=C1)I)C(=O)O AK-26068 [0,2,0,0,0,0|0,0,0]=2 1950 B11R1.167 IC1=CC(=C(C=C1)C)C(=O)O AK-23836 [0,2,0,0,0,0|0,0,0]=2 1951 B11R1.167 NC(=O)C1=C(I)C=CC(Br)=C1 AK103162 [0,2,0,0,0,0|1,0,0]=3 1952 B11R1.167 NC(=O)C1=C(N)C=CC(F)=C1 AK-35926 [0,2,0,0,0,0|1,0,0]=3 1953 B11R1.167 NC1=CC(=C(C=C1)Br)C(=O)O AK-34512 [0,2,0,0,0,0|0,0,0]=2 1954 B11R1.167 NC1=CC(=C(C=C1)C)C(=O)O AK-24895 [0,2,0,0,0,0|0,0,0]=2 1955 B11R1.167 NC1=CC=C(Cl)N=C1C(O)=O AK-39553 [0,2,0,0,0,0|1,0,0]=3 1956 B11R1.167 NC1=CC=C(I)C=C1[N+]([O-])=O AK-28961 [0,2,0,0,0,0|1,0,1]=4 1957 B11R1.167 NC1=CC=C(O)C=C1C(O)=O AK-45120 [0,2,0,0,0,0|0,0,0]=2 1958 B11R1.167 NC1=CN=C(C=C1C(=O)O)Cl AK-26155 [0,2,0,0,0,0|1,0,0]=3 1959 B11R1.167 NC1=NC=C(C(=C1)C(=O)O)Br AK-76920 [0,2,0,0,0,0|1,0,0]=3 1960 B11R1.167 NC1=NC=C(C=C1C(=O)O)Cl AK-50594 [0,2,0,0,0,0|1,0,0]=3 1961 B11R1.167 NC1=NC=C(N=C1C(=O)O)Br AK-21914 [0,2,0,0,0,0|2,0,0]=4 1962 B11R1.167 NC1=NC=C(N=C1C(=O)O)Cl AK-30466 [0,2,0,0,0,0|2,0,0]=4 1963 B11R1.167 O=C(C1=CC(Br)=CNC1=O)O AK-27746 [0,2,0,0,0,0|1,0,0]=3 1964 B11R1.167 O=C(C1=CC(Cl)=CN=C1C)O AK-41038 [0,2,0,0,0,0|1,0,0]=3 1965 B11R1.167 O=C(C1=CC(Cl)=NN=C1O)O AK-48296 [0,2,0,0,0,0|2,0,0]=4 1966 B11R1.167 O=C(C1=NC(Br)=CN=C1O)O AK-93166 [0,2,0,0,0,0|2,0,0]=4 1967 B11R1.167 O=C(C1=NC(Cl)=CC=C1Br)O AK-39554 [0,2,0,0,0,0|1,0,0]=3 1968 B11R1.167 O=C(C1=NC(Cl)=CN=C1Br)O AK-31823 [0,2,0,0,0,0|2,0,0]=4 1969 B11R1.167 O=C(C1=NC(Cl)=CN=C1Cl)O AK128606 [0,2,0,0,0,0|2,0,0]=4 1970 B11R1.167 O=C(C1=NC(N)=NC=C1Cl)O AK138229 [0,2,0,0,0,0|2,0,0]=4 1971 B11R1.167 O=C(N)C1=CC(Br)=CC=C1N AK-63650 [0,2,0,0,0,0|1,0,0]=3 1972 B11R1.167 O=C(N)C1=CC(Br)=CC=C1O AK-25187 [0,2,0,0,0,0|1,0,0]=3 1973 B11R1.167 O=C(N)C1=CC(C)=CC=C1N AK-41693 [0,2,0,0,0,0|1,0,0]=3 1974 B11R1.167 O=C(N)C1=CC(Cl)=CC=C1Cl AK-88605 [0,2,0,0,0,0|1,0,0]=3 1975 B11R1.167 O=C(N)C1=CC(F)=CC=C1F AK162940 [0,2,0,0,0,0|1,0,0]=3 1976 B11R1.167 O=C(N)C1=CC(N)=CC=C1F AK125480 [0,2,0,0,0,0|1,0,0]=3 1977 B11R1.167 O=C(O)C1=C(Br)C=NC(Cl)=C1 AK-30394 [0,2,0,0,0,0|1,0,0]=3 1978 B11R1.167 O=C(O)C1=C(Br)C=NC(O)=C1 AK-29593 [0,2,0,0,0,0|1,0,0]=3 1979 B11R1.167 O=C(O)C1=C(Br)N=CC(Cl)=C1 AK-36007 [0,2,0,0,0,0|1,0,0]=3 1980 B11R1.167 O=C(O)C1=C(Cl)C=NC(C)=C1 AK123459 [0,2,0,0,0,0|1,0,0]=3 1981 B11R1.167 O=C(O)C1=C(Cl)C=NC(Cl)=C1 AK-26410 [0,2,0,0,0,0|1,0,0]=3 1982 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 AK-25888 [0,2,0,0,0,0|1,0,0]=3 1983 B11R1.167 O=C(O)C1=C(Cl)N=CC(O)=C1 AK112903 [0,2,0,0,0,0|1,0,0]=3 1984 B11R1.167 O=C(O)C1=C(F)C=NC(C)=C1 AK148000 [0,2,0,0,0,0|1,0,0]=3 1985 B11R1.167 O=C(O)C1=C(F)C=NC(Cl)=C1 AK-26942 [0,2,0,0,0,0|1,0,0]=3 1986 B11R1.167 O=C(O)C1=C(F)N=CC(C)=C1 AK-61406 [0,2,0,0,0,0|1,0,0]=3 1987 B11R1.167 O=C(O)C1=C(N)C=NC(Br)=C1 AK-42019 [0,2,0,0,0,0|1,0,0]=3 1988 B11R1.167 O=C(O)C1=C(N)C=NC(F)=C1 AK-28881 [0,2,0,0,0,0|1,0,0]=3 1989 B11R1.167 O=C(O)C1=C(N)N=CC(C)=C1 AK-29345 [0,2,0,0,0,0|1,0,0]=3 1990 B11R1.167 O=C(O)C1=C(N)N=CC(I)=C1 AK-68339 [0,2,0,0,0,0|1,0,0]=3 1991 B11R1.167 O=C(O)C1=C(O)C=NC(Cl)=C1 AK-51287 [0,2,0,0,0,0|1,0,0]=3 1992 B11R1.167 O=C(O)C1=CC(Br)=CC=C1Cl AK-28993 [0,2,0,0,0,0|0,0,0]=2 1993 B11R1.167 O=C(O)C1=CC(Br)=CC=C1F AK-33317 [0,2,0,0,0,0|0,0,0]=2 1994 B11R1.167 O=C(O)C1=CC(Br)=CC=C1I AK-25605 [0,2,0,0,0,0|0,0,0]=2 1995 B11R1.167 O=C(O)C1=CC(Br)=CC=C1N AK-25578 [0,2,0,0,0,0|0,0,0]=2 1996 B11R1.167 O=C(O)C1=CC(Br)=CC=C1O AK-44136 [0,2,0,0,0,0|0,0,0]=2 1997 B11R1.167 O=C(O)C1=CC(Br)=CC=C1S AK116283 [0,2,0,0,0,0|0,0,0]=2 1998 B11R1.167 O=C(O)C1=CC(C)=CC=C1Cl AK-35943 [0,2,0,0,0,0|0,0,0]=2 1999 B11R1.167 O=C(O)C1=CC(C)=CC=C1I AK-35485 [0,2,0,0,0,0|0,0,0]=2 2000 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1F AK-30325 [0,2,0,0,0,0|0,0,0]=2 2001 B11R1.167 O=C(O)C1=CC(F)=CC=C1Br AK-35001 [0,2,0,0,0,0|0,0,0]=2 2002 B11R1.167 O=C(O)C1=CC(F)=CC=C1C AK-34724 [0,2,0,0,0,0|0,0,0]=2 2003 B11R1.167 O=C(O)C1=CC(F)=CC=C1F AK-29107 [0,2,0,0,0,0|0,0,0]=2 2004 B11R1.167 O=C(O)C1=CC(F)=CC=C1O AK-49710 [0,2,0,0,0,0|0,0,0]=2 2005 B11R1.167 O=C(O)C1=CC(I)=CC=C1Br AK-40149 [0,2,0,0,0,0|0,0,0]=2 2006 B11R1.167 O=C(O)C1=CC(I)=CC=C1Cl AK-33887 [0,2,0,0,0,0|0,0,0]=2 2007 B11R1.167 O=C(O)C1=CC(I)=CC=C1F AK-28758 [0,2,0,0,0,0|0,0,0]=2 2008 B11R1.167 O=C(O)C1=CC(N)=CC=C1F AK-35670 [0,2,0,0,0,0|0,0,0]=2 2009 B11R1.167 O=C(O)C1=CC(O)=CC=C1Br AK-77223 [0,2,0,0,0,0|0,0,0]=2 2010 B11R1.167 O=C(O)C1=CC(O)=CC=C1Cl AK-35680 [0,2,0,0,0,0|0,0,0]=2 2011 B11R1.167 O=C(O)C1=CC(O)=CC=C1F AK-35417 [0,2,0,0,0,0|0,0,0]=2 2012 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Br AK-92200 [0,2,0,0,0,0|1,0,0]=3 2013 B11R1.167 O=C(O)C1=NC(C)=CC=C1O AK123475 [0,2,0,0,0,0|1,0,0]=3 2014 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1C AK-47252 [0,2,0,0,0,0|1,0,0]=3 2015 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1F AK113170 [0,2,0,0,0,0|1,0,0]=3 2016 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1N AK157328 [0,2,0,0,0,0|1,0,0]=3 2017 B11R1.167 O=C(O)C1=NC(F)=CC=C1Br AK-89900 [0,2,0,0,0,0|1,0,0]=3 2018 B11R1.167 O=C(O)C1=NC(O)=CC=C1C AK-68364 [0,2,0,0,0,0|1,0,0]=3 2019 B11R1.167 O=C(O)C1=NC(O)=CC=C1Cl AK101774 [0,2,0,0,0,0|1,0,0]=3 2020 B11R1.167 O=C([O-])C1=CC(N)=CC=C1O AK-88387 [0,2,0,0,0,0|0,0,1]=3 2021 B11R1.167 O=[N+](C1=CC(Br)=CC=C1I)[O-] AK-32863 [0,2,0,0,0,0|1,0,1]=4 2022 B11R1.167 O=[N+](C1=CC(C)=CC=C1I)[O-] AK-76997 [0,2,0,0,0,0|1,0,1]=4 2023 B11R1.167 O=[N+](C1=CC(Cl)=CC=C1Br)[O-] AK-35101 [0,2,0,0,0,0|1,0,1]=4 2024 B11R1.167 O=[N+](C1=CC(Cl)=CC=C1I)[O-] AK-90485 [0,2,0,0,0,0|1,0,1]=4 2025 B11R1.167 O=[N+](C1=CC(I)=CC=C1I)[O-] AK156861 [0,2,0,0,0,0|1,0,1]=4 2026 B11R1.167 OB(C1=CC(C)=CC=C1F)O AK-27198 [0,2,0,0,0,0|1,0,1]=4 2027 B11R1.167 OB(C1=CC(Cl)=CC=C1F)O AK-34816 [0,2,0,0,0,0|1,0,1]=4 2028 B11R1.167 OB(C1=CC(F)=CC=C1Cl)O AK-35183 [0,2,0,0,0,0|1,0,1]=4 2029 B11R1.167 OC(=O)C1=C(O)C=CC(O)=C1 AK-49825 [0,2,0,0,0,0|0,0,0]=2 2030 B11R1.167 OC(=O)C1=CC(Br)=NC=C1F AK-53677 [0,2,0,0,0,0|1,0,0]=3 2031 B11R1.167 OC1=CC=C(C)C=C1C(O)=O AK-48577 [0,2,0,0,0,0|0,0,0]=2 2032 B11R1.167 OC1=CC=C(Cl)C(B(O)O)=C1 AK-93982 [0,2,0,0,0,0|1,0,1]=4 2033 B11R1.167 OC1=CC=C(F)C(B(O)O)=C1 AK-93592 [0,2,0,0,0,0|1,0,1]=4 2034 B11R1.167 OC1=CC=C(F)C([N+]([O-])=O)=C1 AK-25593 [0,2,0,0,0,0|1,0,1]=4 2035 B11R1.167 OC1=CC=C(F)C=C1B(O)O AK-34401 [0,2,0,0,0,0|1,0,1]=4 2036 B11R1.167 OC1=CC=C(F)C=C1N(=O)=O AK-46467 [0,2,0,0,0,0|1,0,1]=4 2037 B11R1.167 [O-][N+](=O)C1=C(Br)C=CC(Br)=C1 AK-54897 [0,2,0,0,0,0|1,0,1]=4 2038 B11R1.167 [O-][N+](=O)C1=C(Cl)C=CC(I)=C1 AK-64545 [0,2,0,0,0,0|1,0,1]=4 2039 B11R1.74 BrC1=CC(=CC(=C1)C(=O)O)C AK-35753 [0,2,0,0,0,0|0,0,0]=2 2040 B11R1.74 BrC1=CC(=CC(=C1)[N+](=O)[O-])Cl AK-22019 [0,2,0,0,0,0|1,0,1]=4 2041 B11R1.74 BrC1=CC(=CC(=C1)[N+](=O)[O-])F AK-37426 [0,2,0,0,0,0|1,0,1]=4 2042 B11R1.74 BrC1=NC(=CC(=C1)C(=O)O)Br AK-25563 [0,2,0,0,0,0|1,0,0]=3 2043 B11R1.74 C1=C(C=C(C=C1C(O)=O)C)C AK-45888 [0,2,0,0,0,0|0,0,0]=2 2044 B11R1.74 C1=C(C=C(C=C1C(O)=O)Cl)Cl AK-47334 [0,2,0,0,0,0|0,0,0]=2 2045 B11R1.74 C1=C(C=C(C=C1C(O)=O)F)C AK-35437 [0,2,0,0,0,0|0,0,0]=2 2046 B11R1.74 C1=C(C=C(C=C1C(O)=O)F)F AK-29265 [0,2,0,0,0,0|0,0,0]=2 2047 B11R1.74 C1=C(C=C(C=C1C)C)B(O)O AK-33683 [0,2,0,0,0,0|1,0,1]=4 2048 B11R1.74 C1=C(C=C(Cl)C=C1Cl)B(O)O AK-36073 [0,2,0,0,0,0|1,0,1]=4 2049 B11R1.74 C1=C(C=C(F)C=C1F)B(O)O AK-33468 [0,2,0,0,0,0|1,0,1]=4 2050 B11R1.74 CC(=O)C1=CC(Br)=CC(Cl)=C1 AK-88050 [0,2,0,0,0,0|1,0,0]=3 2051 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 AK-43858 [0,2,0,0,0,0|1,0,0]=3 2052 B11R1.74 CC(C1=CC(Br)=CC(Br)=C1)=O AK-87691 [0,2,0,0,0,0|1,0,0]=3 2053 B11R1.74 CC(C1=CC(C)=CC(Br)=C1)=O AK143673 [0,2,0,0,0,0|1,0,0]=3 2054 B11R1.74 CC(C1=CC(Cl)=CC(Cl)=C1)=O AK-86403 [0,2,0,0,0,0|1,0,0]=3 2055 B11R1.74 CC(C1=CC(F)=CC(F)=C1)=O AK-44507 [0,2,0,0,0,0|1,0,0]=3 2056 B11R1.74 CC(C1=CC(O)=CC(O)=C1)=O AK-45934 [0,2,0,0,0,0|1,0,0]=3 2057 B11R1.74 CC1=CC(=CC(=C1)N)[N+](=O)[O-] AK-35871 [0,2,0,0,0,0|1,0,1]=4 2058 B11R1.74 CC1=CC(=CC(C)=N1)C(O)=O AK-29366 [0,2,0,0,0,0|1,0,0]=3 2059 B11R1.74 CC1=CC(=CC(N)=C1)C(O)=O AK-34242 [0,2,0,0,0,0|0,0,0]=2 2060 B11R1.74 CC1=CC(Cl)=CC(B(O)O)=C1 AK-78611 [0,2,0,0,0,0|1,0,1]=4 2061 B11R1.74 CC1=CC(F)=CC(B(O)O)=C1 AK-26364 [0,2,0,0,0,0|1,0,1]=4 2062 B11R1.74 ClC1=CC(=CC(=C1)B(O)O)F AK-34716 [0,2,0,0,0,0|1,0,1]=4 2063 B11R1.74 ClC1=CC(=CC(=N1)C(=O)O)C AK-23860 [0,2,0,0,0,0|1,0,0]=3 2064 B11R1.74 ClC1=CC(=NC(=C1)C(=O)O)Cl AK-32490 [0,2,0,0,0,0|1,0,0]=3 2065 B11R1.74 FC1=CC(=CC(=C1)C)[N+](=O)[O-] AK-35334 [0,2,0,0,0,0|1,0,1]=4 2066 B11R1.74 NC1=CC(=CC(=C1)C(=O)O)F AK-37396 [0,2,0,0,0,0|0,0,0]=2 2067 B11R1.74 NC1=CC(Cl)=CC(=C1)C(O)=O AK-45965 [0,2,0,0,0,0|0,0,0]=2 2068 B11R1.74 NC1=CC(Cl)=CC(=C1)[N+]([O-])=O AK-81008 [0,2,0,0,0,0|1,0,1]=4 2069 B11R1.74 NC1=CC(O)=CC(=C1)C(O)=O AK-59360 [0,2,0,0,0,0|0,0,0]=2 2070 B11R1.74 NC1=CC([N+]([O-])=O)=CC(F)=C1 AK-24964 [0,2,0,0,0,0|1,0,1]=4 2071 B11R1.74 O=C(C=1C=C(Cl)NC(C1)=O)O AK151344 [0,2,0,0,0,0|1,0,0]=3 2072 B11R1.74 O=C(C=1NC(=O)NC(C1)=O)O AK-30280 [0,2,0,0,0,0|2,0,0]=4 2073 B11R1.74 O=C(Cl)C1=CC(Cl)=NC(Cl)=C1 AK113177 [0,2,0,0,0,0|2,0,0]=4 2074 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 AK-73084 [0,2,0,0,0,0|0,0,0]=2 2075 B11R1.74 O=C(O)C1=CC(Br)=CC(N)=C1 AK-61316 [0,2,0,0,0,0|0,0,0]=2 2076 B11R1.74 O=C(O)C1=CC(C)=CC(Cl)=C1 AK-75961 [0,2,0,0,0,0|0,0,0]=2 2077 B11R1.74 O=C(O)C1=CC(C)=CC(O)=C1 AK-47209 [0,2,0,0,0,0|0,0,0]=2 2078 B11R1.74 O=C(O)C1=CC(C)=NC(Cl)=C1 AK-25667 [0,2,0,0,0,0|1,0,0]=3 2079 B11R1.74 O=C(O)C1=CC(C)=NC(O)=C1 AK-48984 [0,2,0,0,0,0|1,0,0]=3 2080 B11R1.74 O=C(O)C1=CC(Cl)=CC(Br)=C1 AK-76578 [0,2,0,0,0,0|0,0,0]=2 2081 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 AK-29357 [0,2,0,0,0,0|1,0,0]=3 2082 B11R1.74 O=C(O)C1=CC(F)=NC(F)=C1 AK115966 [0,2,0,0,0,0|1,0,0]=3 2083 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 AK-33873 [0,2,0,0,0,0|0,0,0]=2 2084 B11R1.74 O=C(O)C1=CC(N)=CC(N)=C1 AK-41179 [0,2,0,0,0,0|0,0,0]=2 2085 B11R1.74 O=C(O)C1=CC(O)=CC(Cl)=C1 AK107678 [0,2,0,0,0,0|0,0,0]=2 2086 B11R1.74 O=C(O)C1=CC(O)=CC(F)=C1 AK-67889 [0,2,0,0,0,0|0,0,0]=2 2087 B11R1.74 O=C(O)C1=CC(O)=CC(N)=C1 AK-36312 [0,2,0,0,0,0|0,0,0]=2 2088 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 AK-44160 [0,2,0,0,0,0|0,0,0]=2 2089 B11R1.74 O=C(O)C1=NC(C)=CC(C)=C1 AK-33798 [0,2,0,0,0,0|1,0,0]=3 2090 B11R1.74 O=C(O)C1=NC(C)=CC(Cl)=C1 AK174217 [0,2,0,0,0,0|1,0,0]=3 2091 B11R1.74 O=C1NC(C=C(N1)C(O)=O)=O AK-94167 [0,2,0,0,0,0|2,0,0]=4 2092 B11R1.74 O=[N+](C1=CC(C)=CC(Br)=C1)[O-] AK-40030 [0,2,0,0,0,0|1,0,1]=4 2093 B11R1.74 O=[N+](C1=CC(C)=CC(Cl)=C1)[O-] AK-46829 [0,2,0,0,0,0|1,0,1]=4 2094 B11R1.74 O=[N+](C1=CC(F)=CC(Cl)=C1)[O-] AK167221 [0,2,0,0,0,0|1,0,1]=4 2095 B11R1.74 O=[N+](C1=CC(I)=CC(F)=C1)[O-] AK-51516 [0,2,0,0,0,0|1,0,1]=4 2096 B11R1.74 OB(C1=CC(O)=CC(F)=C1)O AK-36629 [0,2,0,0,0,0|1,0,1]=4 2097 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 AK-44622 [0,2,0,0,0,0|1,0,1]=4 2098 B11R1.74 OC(=O)C1=CC(Cl)=CC(I)=C1 AK-34536 [0,2,0,0,0,0|0,0,0]=2 2099 B11R1.74 OC(=O)C1=CC(I)=CC(F)=C1 AK-36219 [0,2,0,0,0,0|0,0,0]=2 2100 B11R1.74 OC(=O)C1=CC(I)=CC(I)=C1 AK-79041 [0,2,0,0,0,0|0,0,0]=2 2101 B11R1.74 OC1=CC(Br)=CC(=C1)[N+]([O-])=O AK-77058 [0,2,0,0,0,0|1,0,1]=4 2102 B11R1.74 OC1=CC([N+]([O-])=O)=CC(C)=C1 AK-33072 [0,2,0,0,0,0|1,0,1]=4 2103 B11R1.74 OC1=CC([N+]([O-])=O)=CC(Cl)=C1 AK158594 [0,2,0,0,0,0|1,0,1]=4 2104 B11R1.266 C(#N)C1=NC=CC(=C1)C(=O)O AK-29893 [0,2,0,0,0,0|1,0,0]=3 2105 B11R1.266 C1=C(C(=O)O)C=CC=C1CCl AK-34651 [0,2,0,0,0,0|0,0,0]=2 2106 B11R1.266 C1=C(C=CC=C1C(O)=O)C=O AK-45897 [0,2,0,0,0,0|0,0,0]=2 2107 B11R1.266 C1=C(C=CC=C1C=O)B(O)O AK-45037 [0,2,0,0,0,0|1,0,1]=4 2108 B11R1.266 C1=C(C=CC=C1CBr)B(O)O AK-32247 [0,2,0,0,0,0|1,0,1]=4 2109 B11R1.266 C1=C(C=CC=C1CO)B(O)O AK-39213 [0,2,0,0,0,0|1,0,1]=4 2110 B11R1.266 C1=C(C=CC=C1OC)B(O)O AK-45174 [0,2,0,0,0,0|1,0,1]=4 2111 B11R1.266 C1=C(C=CC=C1[N+]([O-])=O)C#C AK-29115 [0,2,0,0,0,0|1,0,1]=4 2112 B11R1.266 C1=CC(=NC(=N1)SC)C(=O)O AK-23650 [0,2,0,0,0,0|2,0,0]=4 2113 B11R1.266 C=CC1=CC(B(O)O)=CC=C1 AK101141 [0,2,0,0,0,0|1,0,1]=4 2114 B11R1.266 CC(C1=CC=CC(CCl)=C1)=O AK-86175 [0,2,0,0,0,0|1,0,0]=3 2115 B11R1.266 CCC1=CC=CC(=N1)C(O)=O AK-65227 [0,2,0,0,0,0|1,0,0]=3 2116 B11R1.266 COC1=CC(=CN=C1)C(=O)O AK-40655 [0,2,0,0,0,0|1,0,0]=3 2117 B11R1.266 COC1=CC=CC(=C1)C(=N)N AK-16801-12 [0,2,0,0,0,0|2,0,0]=4 2118 B11R1.266 COC1=CC=CC(=N1)C(C)=O AK-27739 [0,2,0,0,0,0|2,0,0]=4 2119 B11R1.266 COC1=NC(=CN=C1)C(O)=O AK-66990 [0,2,0,0,0,0|2,0,0]=4 2120 B11R1.266 COC1=NC=NC(=C1)C(O)=O AK-86070 [0,2,0,0,0,0|2,0,0]=4 2121 B11R1.266 N#CC1=CC=NC(C(C)=O)=C1 AK126179 [0,2,0,0,0,0|2,0,0]=4 2122 B11R1.266 NCC1=CC=CC(=C1)C(=O)O AK-36663 [0,2,0,0,0,0|0,0,0]=2 2123 B11R1.266 NCC1=CC=CC([N+]([O-])=O)=C1 AK-89556 [0,2,0,0,0,0|1,0,1]=4 2124 B11R1.266 O=C(C1=NC(CO)=CC=C1)O AK-40085 [0,2,0,0,0,0|1,0,0]=3 2125 B11R1.266 O=C(C1=NC(NC)=CN=C1)O AK-35586 [0,2,0,0,0,0|2,0,0]=4 2126 B11R1.266 O=C(C1=NC=CC(OC)=N1)O AK-37494 [0,2,0,0,0,0|2,0,0]=4 2127 B11R1.266 O=C(N)C1=CC=CC(C=O)=C1 AK-65110 [0,2,0,0,0,0|1,0,0]=3 2128 B11R1.266 O=C(N)C1=CC=CC(CBr)=C1 AK100650 [0,2,0,0,0,0|1,0,0]=3 2129 B11R1.266 O=C(N)C1=NC(C#N)=CC=C1 AK150478 [0,2,0,0,0,0|2,0,0]=4 2130 B11R1.266 O=C(O)C1=CC=CC(C#N)=C1 AK-68392 [0,2,0,0,0,0|0,0,0]=2 2131 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 AK-35991 [0,2,0,0,0,0|0,0,0]=2 2132 B11R1.266 O=C(O)C1=CC=CC(NC)=C1 AK164024 [0,2,0,0,0,0|0,0,0]=2 2133 B11R1.266 O=C(O)C1=CC=CC(OC)=C1 AK159192 [0,2,0,0,0,0|0,0,0]=2 2134 B11R1.266 O=C(O)C1=CC=NC(C=O)=C1 AK-77221 [0,2,0,0,0,0|1,0,0]=3 2135 B11R1.266 O=C(O)C1=CC=NC(OC)=C1 AK-26853 [0,2,0,0,0,0|1,0,0]=3 2136 B11R1.266 O=C(O)C1=NC(C=O)=CC=C1 AK145136 [0,2,0,0,0,0|1,0,0]=3 2137 B11R1.266 O=C(O)C1=NC(CN)=CC=C1 AK152008 [0,2,0,0,0,0|1,0,0]=3 2138 B11R1.266 O=C(O)C1=NC(OC)=CC=C1 AK-29968 [0,2,0,0,0,0|1,0,0]=3 2139 B11R1.266 O=C(O)C1=NC=CC(OC)=C1 AK-29096 [0,2,0,0,0,0|1,0,0]=3 2140 B11R1.266 O=CC1=CC=CC([N+]([O-])=O)=C1 AK-76706 [0,2,0,0,0,0|1,0,1]=4 2141 B11R1.266 OB(C1=CC=CC(CC)=C1)O AK-38410 [0,2,0,0,0,0|1,0,1]=4 2142 B11R1.266 OB(O)C1=CC(=CC=C1)C#N AK-44970 [0,2,0,0,0,0|1,0,1]=4 2143 B11R1.266 OC(=O)C1=NC(=CC=C1)C#N AK-68141 [0,2,0,0,0,0|1,0,0]=3 2144 B11R1.266 OCC1=CC=CC(=C1)C(O)=O AK-34506 [0,2,0,0,0,0|0,0,0]=2 2145 B9R1.13 O=C(O)CC1=CC=CO1 AK126664 [0,0,1,1,0,0|1,0,1]=4 2146 B9R1.5 O=C1C(O)=CC=CC=C1 AK164435 [0,0,1,1,0,0|2,0,0]=4 2147 B9R2.50 C1CC2=CC=CC=C12 AK109544 [1,0,0,1,0,0|1,0,1]=4 2148 B11R2.10 BrC1=CC2=C(S1)C=CC=C2 AK-35557 [0,0,0,1,0,1|1,1,0]=4 2149 B11R2.10 BrC1=NC2=C(N1)C=CC=C2 AK-35600 [0,0,0,1,0,1|2,0,0]=4 2150 B11R2.10 C1=C([NH]C2=CC=CC=C12)C AK-44448 [0,0,0,1,0,1|2,0,0]=4 2151 B11R2.10 C1=C2NC(=O)NC2=CC=C1 AK-45018 [0,0,0,1,0,1|1,0,0]=3 2152 B11R2.10 C1=CC=CC2=C1C=C(Br)C2 AK-47275 [0,0,0,1,0,1|2,0,0]=4 2153 B11R2.10 C1=CC=CC2=C1N=C(Cl)S2 AK-44922 [0,0,0,1,0,1|1,1,0]=4 2154 B11R2.10 C1=CC=CC2=C1NC(S2)=O AK-49174 [0,0,0,1,0,1|0,1,0]=3 2155 B11R2.10 C1=CC=CC2=C1SC(=N2)Br AK-27048 [0,0,0,1,0,1|1,1,0]=4 2156 B11R2.10 C1=CC=NC2=C1OC(N2)=O AK-28047 [0,0,0,1,0,1|1,0,0]=3 2157 B11R2.10 CC1=CC2=C(S1)C=CC=C2 AK110745 [0,0,0,1,0,1|1,1,0]=4 2158 B11R2.10 CC1=CC2=CC=CC=C2C1 AK-79371 [0,0,0,1,0,1|2,0,0]=4 2159 B11R2.10 CC1=NC2=C(S1)C=CC=C2 AK-45781 [0,0,0,1,0,1|1,1,0]=4 2160 B11R2.10 CC1=NC2=CC=CC=C2N1 AK-44028 [0,0,0,1,0,1|2,0,0]=4 2161 B11R2.10 CC1=NC2=CC=CC=C2O1 AK161761 [0,0,0,1,0,1|1,0,0]=3 2162 B11R2.10 CC1=NC2=NC=CC=C2O1 AK-30675 [0,0,0,1,0,1|2,0,0]=4 2163 B11R2.10 ClC1=NC2=CC=CC=C2N1 AK-26782 [0,0,0,1,0,1|2,0,0]=4 2164 B11R2.10 ClC1=NC2=NC=CC=C2O1 AK170313 [0,0,0,1,0,1|2,0,0]=4 2165 B11R2.10 ClC=1NC2=C(C1)C=CC=C2 AK-48803 [0,0,0,1,0,1|2,0,0]=4 2166 B11R2.10 IC1=CC2=C(N1)C=CC=C2 AK110346 [0,0,0,1,0,1|2,0,0]=4 2167 B11R2.10 IC1=NC2=C(S1)C=CC=C2 AK-24182 [0,0,0,1,0,1|1,1,0]=4 2168 B11R2.10 N1C2=CC=CN=C2NC1=O AK-24800 [0,0,0,1,0,1|2,0,0]=4 2169 B11R2.10 N1C2=NC=CC=C2CC1=O AK-23546 [0,0,0,1,0,1|2,0,0]=4 2170 B11R2.10 NC1=CC2=C(S1)C=CC=C2 AK-51344 [0,0,0,1,0,1|1,1,0]=4 2171 B11R2.10 NC1=NC2=C(O1)C=CN=C2 AK-80598 [0,0,0,1,0,1|2,0,0]=4 2172 B11R2.10 NC1=NC2=CC=CC=C2N1 AK-54965 [0,0,0,1,0,1|2,0,0]=4 2173 B11R2.10 NC1=NC2=CC=CC=C2O1 AK-35247 [0,0,0,1,0,1|1,0,0]=3 2174 B11R2.10 NC1=NC2=CC=CC=C2S1 AK-41354 [0,0,0,1,0,1|1,1,0]=4 2175 B11R2.10 O=C1CC2=NC=CC=C2N1 AK-39930 [0,0,0,1,0,1|2,0,0]=4 2176 B11R2.10 O=C1N=C2C=CC=CN2C1 AK-80162 [0,0,0,1,0,1|2,0,0]=4 2177 B11R2.10 O=C1NC2=C(C1)C=CN=C2 AK-90208 [0,0,0,1,0,1|2,0,0]=4 2178 B11R2.10 O=C1NC2=C(C=CC=C2)C1 AK-49964 [0,0,0,1,0,1|1,0,0]=3 2179 B11R2.10 O=C1NC2=C(N1)C=NC=C2 AK161520 [0,0,0,1,0,1|2,0,0]=4 2180 B11R2.10 O=C1NN2C=CC=CC2=C1 AK-89755 [0,0,0,1,0,1|2,0,0]=4 2181 B11R2.10 O=C1OC2=CC=CC=C2C1 AK-77806 [0,0,0,1,0,1|0,0,0]=2 2182 B11R2.10 O=C1SC2=CC=CN=C2N1 AK438250 [0,0,0,1,0,1|1,1,0]=4 2183 B11R2.10 OC1=CC2=C(N1)N=CC=C2 AK103904 [0,0,0,1,0,1|2,0,0]=4 2184 B11R2.10 OC1=CN2C=CC=CC2=N1 AK-88442 [0,0,0,1,0,1|2,0,0]=4 2185 B11R2.10 OC1=NC2=CC=CC=C2O1 AK-35787 [0,0,0,1,0,1|0,0,1]=3 2186 B11R2.10 OC1CC2=C(C=CC=C2)C1 AK-94248 [0,0,0,1,0,1|1,0,1]=4 2187 B11R2.10 S=C1OC2=CC=CN=C2N1 AK-32376 [0,0,0,1,0,1|1,1,0]=4 2188 B11R2.10 S=C1SC2=CC=CC=C2N1 AK-47877 [0,0,0,1,0,1|0,2,0]=4 2189 B11R2.10 SC1=NC2=CC=CC=C2O1 AK161762 [0,0,0,1,0,1|0,1,0]=3 2190 B11R2.10 SC1=NC2=NC=CC=C2O1 AK-49565 [0,0,0,1,0,1|1,1,0]=4 2191 B11R2.1 BrC1=COC2=C1C=CC=C2 AK-90311 [0,1,0,1,0,0|1,0,0]=3 2192 B11R2.1 BrC1=CSC2=C1C=CC=C2 AK-27164 [0,1,0,1,0,0|1,1,0]=4 2193 B11R2.1 BrC1=NNC2=C1C=CC=C2 AK-23691 [0,1,0,1,0,0|2,0,0]=4 2194 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C AK-68243 [0,1,0,1,0,0|2,0,0]=4 2195 B11R2.1 C1=CC=CC2=C([NH]N=C12)Cl AK-25715 [0,1,0,1,0,0|2,0,0]=4 2196 B11R2.1 C1=CC=CC2=C1C(=NS2)N AK-26866 [0,1,0,1,0,0|1,1,0]=4 2197 B11R2.1 C1=CC=CC2=C1C(=N[NH]2)N AK-26928 [0,1,0,1,0,0|2,0,0]=4 2198 B11R2.1 C1=CC=CC2=C1C(CC2)=O AK-44115 [0,1,0,1,0,0|1,0,0]=3 2199 B11R2.1 C1=CC=CC2=C1C(CO2)=O AK-45365 [0,1,0,1,0,0|0,0,0]=2 2200 B11R2.1 CC1=CCC2=CC=CC=C12 AK-79878 [0,1,0,1,0,0|2,0,0]=4 2201 B11R2.1 CC1=N[NH]C2=CC=CC=C12 AK-24403 [0,1,0,1,0,0|2,0,0]=4 2202 B11R2.1 ClC1=NOC2=C1C=CC=C2 AK-24058 [0,1,0,1,0,0|1,0,0]=3 2203 B11R2.1 ClC1=NSC2=CC=CC=C12 AK-37779 [0,1,0,1,0,0|1,1,0]=4 2204 B11R2.1 IC1=NNC2=C1C=CC=C2 AK-24807 [0,1,0,1,0,0|2,0,0]=4 2205 B11R2.1 NC1=NCC2=C1C=CC=C2 AK166973 [0,1,0,1,0,0|2,0,0]=4 2206 B11R2.1 NC1=NOC2=C1C=CN=C2 AK-30699 [0,1,0,1,0,0|2,0,0]=4 2207 B11R2.1 NC1=NOC2=CC=CN=C21 AK-30698 [0,1,0,1,0,0|2,0,0]=4 2208 B11R2.1 N[C@H]1COC2=CC=CC=C12 AK172653 [0,1,0,1,0,0|1,0,1]=4 2209 B11R2.1 O1C2=C(C(=N1)N)C=CC=C2 AK-23544 [0,1,0,1,0,0|1,0,0]=3 2210 B11R2.1 O=C1C2=CC=CC=C2SC1 AK-29817 [0,1,0,1,0,0|0,1,0]=3 2211 B11R2.1 O=C1CCC2=CC=CN=C21 AK-29125 [0,1,0,1,0,0|2,0,0]=4 2212 B11R2.1 O=C1NCC2=C1C=CC=C2 AK-68456 [0,1,0,1,0,0|1,0,0]=3 2213 B11R2.1 O=C1NCC2=C1C=CC=N2 AK103949 [0,1,0,1,0,0|2,0,0]=4 2214 B11R2.1 O=C1NCC2=C1C=CN=C2 AK173131 [0,1,0,1,0,0|2,0,0]=4 2215 B11R2.1 O=C1NNC2=C1C=CC=N2 AK-30879 [0,1,0,1,0,0|2,0,0]=4 2216 B11R2.1 O=C1NNC2=C1C=CN=C2 AK100133 [0,1,0,1,0,0|2,0,0]=4 2217 B11R2.1 O=C1OCC2=C1C=CC=C2 AK-78719 [0,1,0,1,0,0|0,0,0]=2 2218 B11R2.1 O=C1OCC2=NC=CC=C12 AK-45766 [0,1,0,1,0,0|1,0,0]=3 2219 B11R2.1 OC1=NNC2=C1C=CC=C2 AK136349 [0,1,0,1,0,0|1,0,0]=3 2220 B11R2.1 OC1CCC2=C1C=CC=C2 AK151987 [0,1,0,1,0,0|1,0,1]=4 2221 B11R2.1 S1C=C(C2=C1C=CC=C2)N AK-28603 [0,1,0,1,0,0|1,1,0]=4 2222 B11R2.988 OCC1C2=CC=CC=C2C1 AK550201 [0,1,0,1,0,0|1,0,1]=4 2223 B7R1.1 C1=C(N=CS1)C=O AK-23930 [1,0,0,0,1,0|2,0,0]=4 2224 B7R1.1 C1=C(SC=C1)C=O AK-26482 [1,0,0,0,1,0|1,0,0]=3 2225 B7R1.1 C1=C([NH]C=N1)C=O AK-41612 [1,0,0,0,1,0|2,0,0]=4 2226 B7R1.1 C1=CN=C(C=O)[NH]1 AK-49186 [1,0,0,0,1,0|2,0,0]=4 2227 B7R1.1 C1=CSC(=N1)C=O AK-46309 [1,0,0,0,1,0|2,0,0]=4 2228 B7R1.1 O=CC1=CC=CN1 AK-25235 [1,0,0,0,1,0|1,0,0]=3 2229 B7R1.1 O=CC1=CN=CS1 AK-39378 [1,0,0,0,1,0|2,0,0]=4 2230 B7R1.1 O=CC1=CNC=C1 AK-36182 [1,0,0,0,1,0|1,0,0]=3 2231 B7R1.1 O=CC1=CNN=C1 AK-25836 [1,0,0,0,1,0|2,0,0]=4 2232 B7R1.1 O=CC1=CNN=C1 AK158761 [1,0,0,0,1,0|2,0,0]=4 2233 B7R1.1 O=CC1=CSC=C1 AK-42964 [1,0,0,0,1,0|1,0,0]=3 2234 B7R1.1 OCC1=CC=CS1 AK-93468 [1,0,0,0,1,0|1,0,1]=4 2235 B7R1.1 OCC1=COC=C1 AK-46116 [1,0,0,0,1,0|1,0,1]=4 2236 B7R1.1 OCC1=CSC=C1 AK-36199 [1,0,0,0,1,0|1,0,1]=4 2237 B7R1.1 [NH]1C=CC(=N1)C=O AK-25900 [1,0,0,0,1,0|2,0,0]=4 2238 B11R1.91 CC(\C=C\C1=CC=CC=C1)=O AK107621 [0,0,0,0,0,2|1,0,0]=3 2239 B11R1.91 N=C(N)SCC1=CC=CC=C1 AK307386 [0,0,0,0,0,2|2,0,0]=4 2240 B11R1.91 NC(OCC1=CC=CC=C1)=O AK-77001 [0,0,0,0,0,2|1,0,0]=3 2241 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 AK109324 [0,0,0,0,0,2|1,0,0]=3 2242 B11R1.91 O=C(N)CCC1=CC=CC=C1 AK392491 [0,0,0,0,0,2|1,0,0]=3 2243 B11R1.91 O=C(N)\C=C\C1=CC=CC=C1 AK112937 [0,0,0,0,0,2|1,0,0]=3 2244 B11R1.91 O=C(O)C#CC1=CC=CC=C1 AK-86834 [0,0,0,0,0,2|0,0,0]=2 2245 B11R1.91 O=C(O)CCC1=CC=CC=C1 AK-94756 [0,0,0,0,0,2|0,0,0]=2 2246 B11R1.91 O=C(O)CNC1=CC=CN=C1 AK449228 [0,0,0,0,0,2|1,0,0]=3 2247 B11R1.91 O=C(O)COC1=CC=NC=C1 AK312175 [0,0,0,0,0,2|1,0,0]=3 2248 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 AK114507 [0,0,0,0,0,2|0,0,0]=2 2249 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 AK-32864 [0,0,0,0,0,2|1,0,0]=3 2250 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 AK-35529 [0,0,0,0,0,2|1,0,0]=3 2251 B11R1.91 O=C([O-])COC1=CC=CC=C1 AK-96067 [0,0,0,0,0,2|0,0,1]=3 2252 B11R1.91 OB(CCC1=CC=CC=C1)O AK-61775 [0,0,0,0,0,2|1,0,1]=4 2253 B11R1.91 OC(=O)COC1=CC=CC=C1 AK-76874 [0,0,0,0,0,2|0,0,0]=2 2254 B11R1.91 OC(=O)COC1=NC=CC=C1 AK-78666 [0,0,0,0,0,2|1,0,0]=3 2255 B11R1.91 [O-]C(=O)C=CC1=CC=CC=C1 AK104134 [0,0,0,0,0,2|0,0,1]=3 2256 B11R1.91 [O-][N+](=O)/C=C/C1=CC=CC=C1 AK111240 [0,0,0,0,0,2|1,0,1]=4