0 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 B8981 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 A11417 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.113 CC(=O)C1=CC=CC(F)=C1 F0654 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.113 CC(=O)C1=CC=CC(N)=C1 A0078 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 A11415 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.113 CC(=O)C1=NC=CC(C)=C1 A11428 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.113 CC(=O)C1=NC=NC(C)=C1 M14187 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.113 CC(=O)C1=NC=NC(C)=C1 M14187 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.113 CC1=CC(B(O)O)=CC=C1 T0344 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.113 CC1=CC(B(O)O)=CN=C1 M4041 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.113 CC1=CC(C(=N)N)=CC=C1 M13856 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.113 CC1=CC(C(=N)N)=CC=C1 M19426 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.113 CC1=CC(C(=O)Cl)=CC=C1 M18897 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.113 CC1=CC(C(=O)O)=CN=C1 M11540 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.113 CC1=CC(C(=O)O)=CN=C1 M11540 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.113 CC1=CC(C(=O)O)=NC=C1 M17497 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.113 CC1=CC=CC(C(=O)O)=N1 M17496 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.113 CN(C)C1=CC(O)=CC=C1 D1674 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.113 C[C@@H](N)C1=CC(N)=CC=C1 A7282 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.113 C[C@@H](N)C1=CC=CC(O)=C1 A7283 [0,0,0,0,0,0|2,0,1]=3 20 B10R1.113 C[C@H](N)C1=CC(O)=CC=C1 A12640 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.113 FC(F)C1=CC(Br)=CC=C1 B9307 [0,0,0,0,0,0|3,0,1]=4 22 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 B13675 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 C13735 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.113 N=C(N)C1=CC=CC(F)=C1 F14047 [0,0,0,0,0,0|3,0,0]=3 25 B10R1.113 NC(=O)C1=CC(N)=CC=C1 A0175 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.113 NC(=S)C1=CC(Cl)=CC=C1 C7888 [0,0,0,0,0,0|2,1,0]=3 27 B10R1.113 NC1=CC(C(=O)O)=CC=C1 A11244 [0,0,0,0,0,0|1,0,0]=1 28 B10R1.113 NC1=CC=CC(B(O)O)=C1 A5500 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 N1381 [0,0,0,0,0,0|2,0,1]=3 30 B10R1.113 NC1=CN=CC(C(=O)O)=C1 A2778 [0,0,0,0,0,0|2,0,0]=2 31 B10R1.113 NC1=CN=CC(C(=O)O)=C1 A2778 [0,0,0,0,0,0|2,0,0]=2 32 B10R1.113 NC1=NC(C(=O)O)=CC=C1 A11777 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.113 NC1=NC=CC(C(=O)O)=C1 A11776 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 B9883 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 C18856 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 F7470 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 B9063 [0,0,0,0,0,0|1,0,0]=1 38 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 B5429 [0,0,0,0,0,0|2,0,0]=2 39 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 B2652 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 C7453 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 C3228 [0,0,0,0,0,0|2,0,0]=2 42 B10R1.113 O=C(O)C1=CC(F)=CN=C1 F17488 [0,0,0,0,0,0|2,0,0]=2 43 B10R1.113 O=C(O)C1=CC(F)=NC=C1 F17489 [0,0,0,0,0,0|2,0,0]=2 44 B10R1.113 O=C(O)C1=CC(O)=CC=C1 H16582 [0,0,0,0,0,0|0,0,0]=0 45 B10R1.113 O=C(O)C1=CC(O)=NC=C1 H11542 [0,0,0,0,0,0|1,0,0]=1 46 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 C7454 [0,0,0,0,0,0|2,0,0]=2 47 B10R1.113 O=C(O)C1=CC=CC(F)=C1 F0060 [0,0,0,0,0,0|1,0,0]=1 48 B10R1.113 O=C(O)C1=CC=CC(I)=C1 I4018 [0,0,0,0,0,0|1,0,0]=1 49 B10R1.113 O=C(O)C1=CC=CC(S)=C1 M11264 [0,0,0,0,0,0|0,1,0]=1 50 B10R1.113 O=C(O)C1=CN=CC(O)=C1 H2614 [0,0,0,0,0,0|1,0,0]=1 51 B10R1.113 O=C(O)C1=CN=CC(O)=C1 H2614 [0,0,0,0,0,0|1,0,0]=1 52 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 B2833 [0,0,0,0,0,0|2,0,0]=2 53 B10R1.113 O=C(O)C1=NC(F)=CC=C1 F17487 [0,0,0,0,0,0|2,0,0]=2 54 B10R1.113 O=C(O)C1=NC(O)=CC=C1 H4016 [0,0,0,0,0,0|1,0,0]=1 55 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B2851 [0,0,0,0,0,0|2,0,0]=2 56 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B2851 [0,0,0,0,0,0|2,0,0]=2 57 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 C12505 [0,0,0,0,0,0|2,0,0]=2 58 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 C12505 [0,0,0,0,0,0|2,0,0]=2 59 B10R1.113 O=C(O)C1=NC=CC(I)=C1 I12208 [0,0,0,0,0,0|2,0,0]=2 60 B10R1.113 O=C(O)C1=NC=CC(O)=C1 H17493 [0,0,0,0,0,0|1,0,0]=1 61 B10R1.113 O=[N+]([O-])C1=CC(Cl)=CC=C1 C1350 [0,0,0,0,0,0|2,0,1]=3 62 B10R1.113 O=[N+]([O-])C1=CC(Cl)=NC=C1 C6654 [0,0,0,0,0,0|3,0,1]=4 63 B10R1.113 O=[N+]([O-])C1=CC(O)=CC=C1 N0309 [0,0,0,0,0,0|1,0,1]=2 64 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 B0312 [0,0,0,0,0,0|2,0,1]=3 65 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 F11153 [0,0,0,0,0,0|2,0,1]=3 66 B10R1.113 O=[N+]([O-])C1=CN=CC(Cl)=C1 C17293 [0,0,0,0,0,0|3,0,1]=4 67 B10R1.113 OB(O)C1=CC(Br)=CC=C1 B5439 [0,0,0,0,0,0|2,0,1]=3 68 B10R1.113 OB(O)C1=CC(Br)=CN=C1 B11649 [0,0,0,0,0,0|3,0,1]=4 69 B10R1.113 OB(O)C1=CC(Cl)=NC=C1 C11645 [0,0,0,0,0,0|3,0,1]=4 70 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 C2120 [0,0,0,0,0,0|2,0,1]=3 71 B10R1.113 OB(O)C1=CC=CC(F)=C1 F3995 [0,0,0,0,0,0|2,0,1]=3 72 B9R1.2 BrCC1=CC=CC(Br)=C1 B1306 [1,0,0,0,0,0|2,0,1]=4 73 B9R1.2 C#CC1=CC=CC(N)=C1 A0235 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.2 C(=O)C1=CC(Br)=CN=C1 B11418 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.2 C(=O)C1=CC=CC(Br)=C1 B4204 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.2 C(=O)C1=CC=CC(C)=C1 T4219 [1,0,0,0,0,0|1,0,0]=2 77 B9R1.2 C(=O)C1=CC=CC(F)=C1 F3982 [1,0,0,0,0,0|1,0,0]=2 78 B9R1.2 C(=O)C1=CC=CC(O)=C1 H0367 [1,0,0,0,0,0|0,0,0]=1 79 B9R1.2 C(=O)C1=CC=NC(Cl)=C1 C3153 [1,0,0,0,0,0|2,0,0]=3 80 B9R1.2 C=CC1=CC(C)=CN=C1 M13360 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.2 C=CC1=CC=CC(Br)=C1 B8314 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.2 CC1=CC(C#N)=CC=C1 T5026 [1,0,0,0,0,0|2,0,1]=4 83 B9R1.2 CC1=CC(CN)=CC=C1 M4304 [1,0,0,0,0,0|2,0,1]=4 84 B9R1.2 CC1=CC=CC(CO)=N1 M11438 [1,0,0,0,0,0|2,0,1]=4 85 B9R1.2 CCC1=CC(O)=CC=C1 E18807 [1,0,0,0,0,0|1,0,1]=3 86 B9R1.2 CCC1=CC=CC(Br)=C1 B8399 [1,0,0,0,0,0|2,0,1]=4 87 B9R1.2 CNC1=CC(Br)=CC=C1 B18336 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.2 COC1=CC=CC(Br)=C1 B8466 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.2 COC1=CC=CC(F)=C1 F0055 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.2 COC1=CC=CC(N)=C1 M18773 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.2 CSC1=CC(I)=CC=C1 I3898 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.2 CSC1=CC(N)=CC=C1 M0686 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.2 CSC1=CC=CC(Br)=C1 B0981 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.2 CSC1=CC=CC(Cl)=C1 C3887 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.2 CSC1=CC=CC(F)=C1 F3895 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.2 ClC1=CC(CBr)=CC=C1 C9245 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.2 FC1=CC(CBr)=CC=C1 F0983 [1,0,0,0,0,0|2,0,1]=4 98 B9R1.2 FC1=CC(CBr)=CC=C1 F0983 [1,0,0,0,0,0|2,0,1]=4 99 B9R1.2 N#CC1=CC(Br)=CC=C1 B4223 [1,0,0,0,0,0|2,0,1]=4 100 B9R1.2 N#CC1=CC(Cl)=CC=C1 C3461 [1,0,0,0,0,0|2,0,1]=4 101 B9R1.2 N#CC1=CC(O)=CC=C1 H1345 [1,0,0,0,0,0|1,0,1]=3 102 B9R1.2 N#CC1=CC=CC(F)=C1 F4221 [1,0,0,0,0,0|2,0,1]=4 103 B9R1.2 N#CC1=CC=CC(I)=C1 I4222 [1,0,0,0,0,0|2,0,1]=4 104 B9R1.2 N#CC1=CC=CC(N)=C1 A0959 [1,0,0,0,0,0|2,0,1]=4 105 B9R1.2 NC1=CC=CC(C=O)=C1 A14455 [1,0,0,0,0,0|1,0,0]=2 106 B9R1.2 NC1=NC=CC(CO)=C1 A13817 [1,0,0,0,0,0|2,0,1]=4 107 B9R1.2 NCC1=CC=CC(Br)=C1 B9995 [1,0,0,0,0,0|2,0,1]=4 108 B9R1.2 NCC1=CC=CC(Cl)=C1 C4293 [1,0,0,0,0,0|2,0,1]=4 109 B9R1.2 O=CC1=CC(Br)=NC=C1 B2189 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.2 O=CC1=CC(O)=NC=C1 H13246 [1,0,0,0,0,0|1,0,0]=2 111 B9R1.2 O=CC1=CC=CC(Br)=N1 B8433 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.2 OCC1=CC(Br)=CN=C1 B2855 [1,0,0,0,0,0|2,0,1]=4 113 B9R1.2 OCC1=CC(Cl)=NC=C1 C14253 [1,0,0,0,0,0|2,0,1]=4 114 B9R1.2 OCC1=CC=CC(F)=C1 F0982 [1,0,0,0,0,0|1,0,1]=3 115 B9R1.2 OCC1=NC(Br)=CC=C1 B8506 [1,0,0,0,0,0|2,0,1]=4 116 B9R1.2 SCC1=CC=CC(Br)=C1 B9154 [1,0,0,0,0,0|1,1,1]=4 117 B9R1.2 [C-]#[N+]C1=CC(Br)=CC=C1 B8267 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.6 CC(=O)C1=CN=CC=C1 P2763 [1,0,0,0,0,0|2,0,0]=3 119 B9R1.6 CC(=O)C1=CN=CC=N1 A0581 [1,0,0,0,0,0|3,0,0]=4 120 B9R1.6 CC(=O)C1=NC=CC=C1 A1164 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.6 C[C@@H](N)C1=CC=CC=C1 M5022 [1,0,0,0,0,0|2,0,1]=4 122 B9R1.6 C[C@H](N)C1=CC=CC=C1 M5997 [1,0,0,0,0,0|2,0,1]=4 123 B9R1.6 N=C(N)C1=CC=CC=C1 B11293 [1,0,0,0,0,0|2,0,0]=3 124 B9R1.6 N=C(N)C1=CC=CC=C1 B13002 [1,0,0,0,0,0|2,0,0]=3 125 B9R1.6 N=C(N)C1=CC=CC=C1 T1538 [1,0,0,0,0,0|2,0,0]=3 126 B9R1.6 N=C(N)C1=CC=CN=C1 P13006 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.6 N=C(N)C1=NC=CC=C1 P13904 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.6 N=C(\C1=CC=NC=C1)N P13011 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.6 NC(=O)C1=CC=NC=C1 P1409 [1,0,0,0,0,0|2,0,0]=3 130 B9R1.6 NC(=O)C1=CN=CN=C1 P17598 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.6 NC(=O)C1=NC=CN=C1 P1326 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.6 O=C(Cl)C1=CN=CC=N1 P12749 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.6 O=C(O)C1=CC=CN=C1 N0837 [1,0,0,0,0,0|1,0,0]=2 134 B9R1.6 O=C(O)C1=CC=CN=C1 N0837 [1,0,0,0,0,0|1,0,0]=2 135 B9R1.6 O=C(O)C1=CC=NN=C1 P12249 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.6 O=C(O)C1=CN=CN=C1 P12245 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.6 O=C(O)C1=NC=CC=C1 P0843 [1,0,0,0,0,0|1,0,0]=2 138 B9R1.6 O=C(O)C1=NC=CC=C1 P0843 [1,0,0,0,0,0|1,0,0]=2 139 B9R1.6 O=C(O)C1=NC=CC=N1 P12246 [1,0,0,0,0,0|2,0,0]=3 140 B9R1.6 O=C(O)C1=NC=CN=C1 P4976 [1,0,0,0,0,0|2,0,0]=3 141 B9R1.6 O=C(O)C1=NC=NC=C1 P12243 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.6 OB(O)C1=CC=CC=C1 N2145 [1,0,0,0,0,0|1,0,1]=3 143 B9R1.6 OB(O)C1=CC=CC=N1 P4048 [1,0,0,0,0,0|2,0,1]=4 144 B9R1.6 OB(O)C1=CC=CN=C1 P4049 [1,0,0,0,0,0|2,0,1]=4 145 B9R1.6 OB(O)C1=CC=CN=C1 P4049 [1,0,0,0,0,0|2,0,1]=4 146 B9R1.6 OB(O)C1=CC=NC=C1 P2873 [1,0,0,0,0,0|2,0,1]=4 147 B11R1.21 CC(=O)C1=CC(N)=C(F)C=C1 F3312 [0,1,0,0,0,0|2,0,0]=3 148 B11R1.21 CC(=O)C1=CC=C(Cl)C(F)=C1 F11485 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.21 CC(=O)C1=CC=C(F)C(Br)=C1 B3799 [0,1,0,0,0,0|2,0,0]=3 150 B11R1.21 CC(=O)C1=CC=C(F)C(Cl)=C1 C7923 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.21 CC(=O)C1=CC=C(F)C(F)=C1 D5207 [0,1,0,0,0,0|2,0,0]=3 152 B11R1.21 CC(=O)C1=CC=C(F)C(F)=C1 D5207 [0,1,0,0,0,0|2,0,0]=3 153 B11R1.21 CC1=C(Br)C=C(C(=O)Cl)C=C1 B10456 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 B1485 [0,1,0,0,0,0|1,0,0]=2 155 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=C1 B9717 [0,1,0,0,0,0|2,0,1]=4 156 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 B9672 [0,1,0,0,0,0|1,0,0]=2 157 B11R1.21 CC1=C(Br)C=CC([N+](=O)[O-])=C1 B9718 [0,1,0,0,0,0|2,0,1]=4 158 B11R1.21 CC1=C(C)C=C(C(=O)Cl)C=C1 D7786 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 F3990 [0,1,0,0,0,0|2,0,1]=4 160 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 I2764 [0,1,0,0,0,0|1,0,0]=2 161 B11R1.21 CC1=C(N)C=C([N+](=O)[O-])C=C1 M0308 [0,1,0,0,0,0|2,0,1]=4 162 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 H0169 [0,1,0,0,0,0|0,0,0]=1 163 B11R1.21 CC1=C(O)C=C([N+](=O)[O-])C=C1 N11347 [0,1,0,0,0,0|1,0,1]=3 164 B11R1.21 CC1=CC(B(O)O)=CC=C1Cl C7838 [0,1,0,0,0,0|2,0,1]=4 165 B11R1.21 CC1=CC(C(=O)O)=CC=C1N A0463 [0,1,0,0,0,0|1,0,0]=2 166 B11R1.21 CC1=CC([N+](=O)[O-])=CC=C1F F5238 [0,1,0,0,0,0|2,0,1]=4 167 B11R1.21 CC1=CC=C(C(=O)O)C=C1F F11495 [0,1,0,0,0,0|1,0,0]=2 168 B11R1.21 CC1=CC=C(C(=O)O)C=C1F F11495 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.21 CC1=CC=C(C(=O)O)C=C1N A11350 [0,1,0,0,0,0|1,0,0]=2 170 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1Cl C11470 [0,1,0,0,0,0|2,0,1]=4 171 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1F F2553 [0,1,0,0,0,0|2,0,1]=4 172 B11R1.21 CC1=CN=C(C(=O)O)C=[N+]1[O-] A4922 [0,1,0,0,0,0|2,0,1]=4 173 B11R1.21 CC1=CN=C(C(=O)O)C=[N+]1[O-] A4922 [0,1,0,0,0,0|2,0,1]=4 174 B11R1.21 N=C(N)C1=CC(F)=C(F)C=C1 D13625 [0,1,0,0,0,0|3,0,0]=4 175 B11R1.21 NC(=O)C1=CC(N)=C(Cl)C=C1 A3763 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.21 NC1=C(Br)C=C([N+](=O)[O-])C=C1 B13712 [0,1,0,0,0,0|2,0,1]=4 177 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 A0182 [0,1,0,0,0,0|1,0,0]=2 178 B11R1.21 NC1=C(Cl)C=CC([N+](=O)[O-])=C1 C0612 [0,1,0,0,0,0|2,0,1]=4 179 B11R1.21 NC1=C(F)C=CC([N+](=O)[O-])=C1 F7405 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 D3852 [0,1,0,0,0,0|1,0,0]=2 181 B11R1.21 NC1=C(O)C=C([N+](=O)[O-])C=C1 A0925 [0,1,0,0,0,0|1,0,1]=3 182 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 A18835 [0,1,0,0,0,0|1,0,0]=2 183 B11R1.21 NC1=CC(C(=O)O)=CC=C1F A3775 [0,1,0,0,0,0|1,0,0]=2 184 B11R1.21 NC1=CC(C(=O)O)=CC=C1O A6851 [0,1,0,0,0,0|1,0,0]=2 185 B11R1.21 NC1=CC([N+](=O)[O-])=CC=C1Br B11082 [0,1,0,0,0,0|2,0,1]=4 186 B11R1.21 NC1=CC=C(C(=O)O)C=C1Br A4246 [0,1,0,0,0,0|1,0,0]=2 187 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl A4245 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.21 NC1=CC=C(C(=O)O)C=C1O A12477 [0,1,0,0,0,0|0,0,0]=1 189 B11R1.21 NC1=CC=C(C(=O)O)C=C1O A12477 [0,1,0,0,0,0|0,0,0]=1 190 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1Cl C1172 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1F F5271 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.21 O=C(Cl)C1=CC(Br)=C(F)C=C1 B4270 [0,1,0,0,0,0|2,0,0]=3 193 B11R1.21 O=C(Cl)C1=CC=C(F)C(Cl)=C1 C4266 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.21 O=C(Cl)C1=CC=C(F)C(F)=C1 D4264 [0,1,0,0,0,0|2,0,0]=3 195 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 B17454 [0,1,0,0,0,0|2,0,0]=3 196 B11R1.21 O=C(O)C1=CC(Br)=C(O)C=C1 B9779 [0,1,0,0,0,0|1,0,0]=2 197 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 D5516 [0,1,0,0,0,0|2,0,0]=3 198 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 F7403 [0,1,0,0,0,0|0,0,0]=1 199 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 D5019 [0,1,0,0,0,0|0,0,0]=1 200 B11R1.21 O=C(O)C1=CC=C(Br)C(Cl)=C1 C11362 [0,1,0,0,0,0|1,0,0]=2 201 B11R1.21 O=C(O)C1=CC=C(Br)C(F)=C1 B5254 [0,1,0,0,0,0|1,0,0]=2 202 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=C1 B10505 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.21 O=C(O)C1=CC=C(Cl)C(F)=C1 C5199 [0,1,0,0,0,0|1,0,0]=2 204 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 B0692 [0,1,0,0,0,0|1,0,0]=2 205 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 C0249 [0,1,0,0,0,0|1,0,0]=2 206 B11R1.21 O=C(O)C1=CC=C(F)C(F)=C1 D0996 [0,1,0,0,0,0|1,0,0]=2 207 B11R1.21 O=C(O)C1=CC=C(I)C(F)=C1 I6660 [0,1,0,0,0,0|1,0,0]=2 208 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 F7401 [0,1,0,0,0,0|1,0,0]=2 209 B11R1.21 O=C(O)C1=CN=C(O)C(Cl)=C1 C7963 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(F)C=C1 C8037 [0,1,0,0,0,0|2,0,1]=4 211 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(O)C=C1 C0609 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.21 O=[N+]([O-])C1=CC(F)=C(Br)C=C1 B5508 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Cl)C=C1 C7964 [0,1,0,0,0,0|1,0,1]=3 214 B11R1.21 O=[N+]([O-])C1=CC=C(Cl)C(Br)=C1 B10535 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.21 O=[N+]([O-])C1=CC=C(Cl)C(F)=C1 F6668 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.21 O=[N+]([O-])C1=CC=C(F)C(Br)=C1 B9895 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.21 O=[N+]([O-])C1=CC=C(F)C(F)=C1 D5005 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.21 O=[N+]([O-])C1=CC=C(I)C(F)=C1 F6661 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.21 O=[N+]([O-])C1=CC=C(O)C(F)=C1 F5234 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 C4575 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.21 OB(O)C1=CC(F)=C(Br)C=C1 B9855 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.21 OB(O)C1=CC=C(Cl)C(Cl)=C1 D8629 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.21 OB(O)C1=CC=C(Cl)C(F)=C1 C8002 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.21 OB(O)C1=CC=C(F)C(F)=C1 D3868 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.21 OC(=O)C1=CC=C(N)C(F)=C1 A5094 [0,1,0,0,0,0|1,0,0]=2 226 B11R1.23 CCC(=O)C1=CC=CC(Cl)=C1 C7784 [0,1,0,0,0,0|2,0,0]=3 227 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 F3998 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.23 CCC(=O)C1=CC=CC(O)=C1 H4015 [0,1,0,0,0,0|1,0,0]=2 229 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 A18209 [0,1,0,0,0,0|2,0,0]=3 230 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 M2719 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.23 COC(=O)C1=CC(N)=CN=C1 M13513 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.23 COC(=O)C1=CC(O)=CN=C1 M17193 [0,1,0,0,0,0|1,0,0]=2 233 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 M7840 [0,1,0,0,0,0|1,0,0]=2 234 B11R1.23 COC(=O)C1=CC=CC(N)=N1 P17221 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 C17462 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.23 NC1=CC(\C(N)=N\O)=CC=C1 A18062 [0,1,0,0,0,0|2,0,0]=3 237 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 A3766 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.23 NNC(=O)C1=CC(Br)=CC=C1 B9680 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.23 NNC(=O)C1=CC=CC(F)=C1 F4422 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.23 N\C(=N\O)C1=CC=CC(F)=C1 F14046 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 C10453 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 D0328 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 D4704 [0,1,0,0,0,0|1,0,0]=2 244 B11R1.74 CC1=CC(C(=O)Cl)=CC(Cl)=N1 C8587 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 D3971 [0,1,0,0,0,0|2,0,1]=4 246 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 D3971 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.74 CC1=CC(C)=CC(C(=O)Cl)=C1 D3213 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 D0285 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 H19415 [0,1,0,0,0,0|0,0,0]=1 250 B11R1.74 CC1=CC([N+](=O)[O-])=CC(F)=C1 N6662 [0,1,0,0,0,0|2,0,1]=4 251 B11R1.74 CC1=CC([N+](=O)[O-])=CC(F)=C1 N6662 [0,1,0,0,0,0|2,0,1]=4 252 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 D13679 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.74 NC(=O)C1=CC(Cl)=CC(Cl)=C1 D8588 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.74 NC(=O)C1=CC(F)=CC(F)=C1 D7440 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 D11348 [0,1,0,0,0,0|1,0,0]=2 256 B11R1.74 NC1=CC(N)=CC([N+](=O)[O-])=C1 D7318 [0,1,0,0,0,0|2,0,1]=4 257 B11R1.74 NC1=CC(O)=CC(C(=O)O)=C1 A11838 [0,1,0,0,0,0|0,0,0]=1 258 B11R1.74 NC1=CC([N+](=O)[O-])=CC(F)=C1 F7406 [0,1,0,0,0,0|2,0,1]=4 259 B11R1.74 NC1=CC([N+](=O)[O-])=CC(F)=C1 F7406 [0,1,0,0,0,0|2,0,1]=4 260 B11R1.74 O=C(Cl)C1=CC(Cl)=CC(Cl)=C1 D9433 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.74 O=C(Cl)C1=CC(F)=CC(F)=C1 D4261 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 D1343 [0,1,0,0,0,0|1,0,0]=2 263 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 D17472 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 D1065 [0,1,0,0,0,0|1,0,0]=2 265 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 D2831 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 D2831 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.74 O=C(O)C1=CC(F)=CC(Br)=C1 B5253 [0,1,0,0,0,0|1,0,0]=2 268 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 D0993 [0,1,0,0,0,0|1,0,0]=2 269 B11R1.74 O=C(O)C1=CC(F)=CC(I)=C1 F6669 [0,1,0,0,0,0|1,0,0]=2 270 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 D12655 [0,1,0,0,0,0|1,0,0]=2 271 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 D0168 [0,1,0,0,0,0|0,0,0]=1 272 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 O1279 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.74 O=[N+]([O-])C1=CC(Cl)=CC(Cl)=C1 D8662 [0,1,0,0,0,0|2,0,1]=4 274 B11R1.74 O=[N+]([O-])C1=CC(F)=CC(F)=C1 D4292 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.74 OB(O)C1=CC(Cl)=CC(Cl)=C1 D3856 [0,1,0,0,0,0|2,0,1]=4 276 B11R1.74 OB(O)C1=CC(F)=CC(F)=C1 D3869 [0,1,0,0,0,0|2,0,1]=4 277 B11R1.155 CS(=O)(=O)C1=CC(Br)=CC=C1 B0617 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.155 NS(=O)(=O)C1=CC(F)=CC=C1 F8017 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.155 O=S(=O)(Cl)C1=CC(Cl)=CC=C1 C9486 [0,1,0,0,0,0|2,0,1]=4 280 B11R1.155 O=S(=O)(Cl)C1=CC(F)=CC=C1 F8789 [0,1,0,0,0,0|2,0,1]=4 281 B11R1.155 OC1=CC(C(F)(F)F)=CC=C1 H0709 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.159 CC(=O)C1=C(F)C(F)=CC=C1 D7407 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl D8551 [0,1,0,0,0,0|2,0,0]=3 284 B11R1.159 CC(=O)C1=CC=CC(N)=C1O A18065 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.159 CC(=O)C1=CC=CC(N)=C1O A8497 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.159 CC1=C(Br)C(C(=O)O)=CC=C1 B9675 [0,1,0,0,0,0|1,0,0]=2 287 B11R1.159 CC1=C(Br)C=CC=C1C(=O)O B9677 [0,1,0,0,0,0|1,0,0]=2 288 B11R1.159 CC1=C(C(=O)O)C=CC=C1F F2540 [0,1,0,0,0,0|1,0,0]=2 289 B11R1.159 CC1=C(C(=O)O)C=CC=C1N M0155 [0,1,0,0,0,0|1,0,0]=2 290 B11R1.159 CC1=C(C(=O)O)C=CC=C1O H0902 [0,1,0,0,0,0|0,0,0]=1 291 B11R1.159 CC1=C(C(=O)O)C=CC=C1O H0902 [0,1,0,0,0,0|0,0,0]=1 292 B11R1.159 CC1=C(C)C(C(=N)N)=CC=C1 D14100 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.159 CC1=C(C)C(C(=O)O)=CC=C1 D1268 [0,1,0,0,0,0|1,0,0]=2 294 B11R1.159 CC1=C(Cl)C(C(=O)O)=CC=C1 C12384 [0,1,0,0,0,0|1,0,0]=2 295 B11R1.159 CC1=C(Cl)C=CC=C1C(=O)O C4102 [0,1,0,0,0,0|1,0,0]=2 296 B11R1.159 CC1=C(Cl)C=CC=C1[N+](=O)[O-] C5050 [0,1,0,0,0,0|2,0,1]=4 297 B11R1.159 CC1=C(F)C([N+](=O)[O-])=CC=C1 F2559 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.159 CC1=C(F)C([N+](=O)[O-])=CC=C1 F2559 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.159 CC1=C(N)C(C(=O)O)=CC=C1 A3783 [0,1,0,0,0,0|1,0,0]=2 300 B11R1.159 CC1=C(N)C([N+](=O)[O-])=CC=C1 M5438 [0,1,0,0,0,0|2,0,1]=4 301 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1Br B3240 [0,1,0,0,0,0|2,0,1]=4 302 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1F F1493 [0,1,0,0,0,0|2,0,1]=4 303 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1N M2509 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.159 CC1=CC=CC(B(O)O)=C1C D3968 [0,1,0,0,0,0|2,0,1]=4 305 B11R1.159 CC1=CC=CC(C(=O)Cl)=C1C D7785 [0,1,0,0,0,0|2,0,0]=3 306 B11R1.159 CC1=CC=CC(C(=O)O)=C1F F5228 [0,1,0,0,0,0|1,0,0]=2 307 B11R1.159 N=C(N)C1=CC=CC(Cl)=C1Cl D15699 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.159 NC(=O)C1=CC=CC(F)=C1F D7439 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O A12075 [0,1,0,0,0,0|1,0,0]=2 310 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O A12075 [0,1,0,0,0,0|1,0,0]=2 311 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl A1074 [0,1,0,0,0,0|1,0,0]=2 312 B11R1.159 NC1=C(F)C=CC=C1C(=O)O A2549 [0,1,0,0,0,0|1,0,0]=2 313 B11R1.159 NC1=C(F)C=CC=C1C(=O)O A2549 [0,1,0,0,0,0|1,0,0]=2 314 B11R1.159 NC1=C(I)C=CC=C1C(=O)O A12065 [0,1,0,0,0,0|1,0,0]=2 315 B11R1.159 NC1=C(I)C=CC=C1C(=O)O A12065 [0,1,0,0,0,0|1,0,0]=2 316 B11R1.159 NC1=C(N)C(C(=O)O)=CC=C1 D12473 [0,1,0,0,0,0|1,0,0]=2 317 B11R1.159 NC1=C(O)C=CC=C1[N+](=O)[O-] A5462 [0,1,0,0,0,0|1,0,1]=3 318 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1Cl C4446 [0,1,0,0,0,0|2,0,1]=4 319 B11R1.159 O=C(Cl)C1=C(Cl)C(Cl)=CC=C1 D9435 [0,1,0,0,0,0|2,0,0]=3 320 B11R1.159 O=C(Cl)C1=C(F)C(Cl)=CC=C1 C8713 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 F14813 [0,1,0,0,0,0|0,0,0]=1 322 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 F7402 [0,1,0,0,0,0|1,0,0]=2 323 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 D0529 [0,1,0,0,0,0|0,0,0]=1 324 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F B5190 [0,1,0,0,0,0|1,0,0]=2 325 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F B5190 [0,1,0,0,0,0|1,0,0]=2 326 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Cl D2048 [0,1,0,0,0,0|1,0,0]=2 327 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F C2562 [0,1,0,0,0,0|1,0,0]=2 328 B11R1.159 O=C(O)C1=CC=CC(F)=C1Br B5251 [0,1,0,0,0,0|1,0,0]=2 329 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl C5259 [0,1,0,0,0,0|1,0,0]=2 330 B11R1.159 O=C(O)C1=CC=CC(F)=C1F D0338 [0,1,0,0,0,0|1,0,0]=2 331 B11R1.159 O=C(O)C1=CC=CC(F)=C1I B6645 [0,1,0,0,0,0|1,0,0]=2 332 B11R1.159 O=C(O)C1=CC=CC(I)=C1F F6649 [0,1,0,0,0,0|1,0,0]=2 333 B11R1.159 O=C(O)C1=CC=CC(I)=C1F F6649 [0,1,0,0,0,0|1,0,0]=2 334 B11R1.159 O=[N+]([O-])C1=C(F)C(F)=CC=C1 D5316 [0,1,0,0,0,0|2,0,1]=4 335 B11R1.159 O=[N+]([O-])C1=C(F)C(F)=CC=C1 D5316 [0,1,0,0,0,0|2,0,1]=4 336 B11R1.159 O=[N+]([O-])C1=C(O)C(Br)=CC=C1 B11503 [0,1,0,0,0,0|2,0,1]=4 337 B11R1.159 O=[N+]([O-])C1=C(O)C(Br)=CC=C1 B11503 [0,1,0,0,0,0|2,0,1]=4 338 B11R1.159 O=[N+]([O-])C1=C(O)C(Cl)=CC=C1 C7962 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.159 O=[N+]([O-])C1=C(O)C(F)=CC=C1 F5235 [0,1,0,0,0,0|2,0,1]=4 340 B11R1.159 O=[N+]([O-])C1=C(O)C(F)=CC=C1 F5235 [0,1,0,0,0,0|2,0,1]=4 341 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1Cl D0348 [0,1,0,0,0,0|2,0,1]=4 342 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1F C8038 [0,1,0,0,0,0|2,0,1]=4 343 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1F C8038 [0,1,0,0,0,0|2,0,1]=4 344 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1Br F6657 [0,1,0,0,0,0|2,0,1]=4 345 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1Br F6657 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1Cl F6653 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1I F6646 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.159 OB(O)C1=CC=CC(F)=C1F D3865 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 D0509 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O B4788 [0,1,0,0,0,0|2,0,0]=3 351 B11R1.167 CC(=O)C1=CC(F)=CC=C1F D2678 [0,1,0,0,0,0|2,0,0]=3 352 B11R1.167 CC(=O)C1=CC(F)=CC=C1O F4692 [0,1,0,0,0,0|2,0,0]=3 353 B11R1.167 CC1=CC(B(O)O)=C(C)C=C1 D3969 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.167 CC1=CC(B(O)O)=C(F)C=C1 F3989 [0,1,0,0,0,0|2,0,1]=4 355 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 F5311 [0,1,0,0,0,0|1,0,0]=2 356 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 A1076 [0,1,0,0,0,0|1,0,0]=2 357 B11R1.167 CC1=CC=C(Br)C(C(=O)O)=C1 B9676 [0,1,0,0,0,0|1,0,0]=2 358 B11R1.167 CC1=CC=C(Br)C([N+](=O)[O-])=C1 B2635 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.167 CC1=CC=C(Br)C=C1C(=O)O B12383 [0,1,0,0,0,0|1,0,0]=2 360 B11R1.167 CC1=CC=C(Br)C=C1C(=O)O B12383 [0,1,0,0,0,0|1,0,0]=2 361 B11R1.167 CC1=CC=C(Br)C=C1[N+](=O)[O-] B2634 [0,1,0,0,0,0|2,0,1]=4 362 B11R1.167 CC1=CC=C(C)C(C(=N)N)=C1 D13640 [0,1,0,0,0,0|3,0,0]=4 363 B11R1.167 CC1=CC=C(F)C(C(=N)N)=C1 F14043 [0,1,0,0,0,0|3,0,0]=4 364 B11R1.167 CC1=CC=C(F)C([N+](=O)[O-])=C1 N0672 [0,1,0,0,0,0|2,0,1]=4 365 B11R1.167 CC1=CC=C(F)C=C1C(=O)O F0174 [0,1,0,0,0,0|1,0,0]=2 366 B11R1.167 CC1=CC=C(F)C=C1[N+](=O)[O-] F0671 [0,1,0,0,0,0|2,0,1]=4 367 B11R1.167 CC1=CC=C(I)C=C1[N+](=O)[O-] B3641 [0,1,0,0,0,0|2,0,1]=4 368 B11R1.167 CC1=CC=C(N)C(C(N)=O)=C1 A3784 [0,1,0,0,0,0|2,0,0]=3 369 B11R1.167 CC1=NC=C(Br)C(C(=O)O)=N1 B14139 [0,1,0,0,0,0|3,0,0]=4 370 B11R1.167 CC1=NC=C(Cl)C(C(=O)O)=N1 C14140 [0,1,0,0,0,0|3,0,0]=4 371 B11R1.167 N=C(N)C1=CC(Cl)=CC=C1Cl D16853 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.167 NC(=O)C1=C(F)C=CC(Cl)=C1 C7969 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.167 NC(=O)C1=C(F)C=CC(F)=C1 D7438 [0,1,0,0,0,0|2,0,0]=3 374 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 A3764 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.167 NC(=O)C1=CC(F)=CC=C1N A3774 [0,1,0,0,0,0|2,0,0]=3 376 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 C1075 [0,1,0,0,0,0|1,0,0]=2 377 B11R1.167 NC1=C([N+](=O)[O-])C=C(Cl)C=C1 C1355 [0,1,0,0,0,0|2,0,1]=4 378 B11R1.167 NC1=C([N+](=O)[O-])C=C(O)C=C1 A3682 [0,1,0,0,0,0|1,0,1]=3 379 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 A0773 [0,1,0,0,0,0|1,0,0]=2 380 B11R1.167 NC1=CC(C(=O)O)=C(O)C=C1 A0310 [0,1,0,0,0,0|1,0,0]=2 381 B11R1.167 NC1=CC([N+](=O)[O-])=C(N)C=C1 N1424 [0,1,0,0,0,0|2,0,1]=4 382 B11R1.167 NC1=CC=C(Br)C=C1C(=O)O A3760 [0,1,0,0,0,0|1,0,0]=2 383 B11R1.167 NC1=CC=C(Br)C=C1C(=O)O A3760 [0,1,0,0,0,0|1,0,0]=2 384 B11R1.167 NC1=CC=C(Br)C=C1[N+](=O)[O-] B5336 [0,1,0,0,0,0|2,0,1]=4 385 B11R1.167 NC1=CC=C(F)C(C(=O)O)=C1 A4244 [0,1,0,0,0,0|1,0,0]=2 386 B11R1.167 NC1=CC=C(F)C([N+](=O)[O-])=C1 F0415 [0,1,0,0,0,0|2,0,1]=4 387 B11R1.167 NC1=CC=C(F)C=C1C(=O)O A1077 [0,1,0,0,0,0|1,0,0]=2 388 B11R1.167 NC1=CC=C(F)C=C1[N+](=O)[O-] F1373 [0,1,0,0,0,0|2,0,1]=4 389 B11R1.167 NC1=CC=C(I)C=C1C(=O)O A3779 [0,1,0,0,0,0|1,0,0]=2 390 B11R1.167 NC1=CC=C(O)C=C1C(=O)O H17759 [0,1,0,0,0,0|0,0,0]=1 391 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O A9781 [0,1,0,0,0,0|2,0,0]=3 392 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O A9781 [0,1,0,0,0,0|2,0,0]=3 393 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 A12578 [0,1,0,0,0,0|3,0,0]=4 394 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 A12578 [0,1,0,0,0,0|3,0,0]=4 395 B11R1.167 NC1=NC=C(Cl)C(C(=O)O)=N1 A19417 [0,1,0,0,0,0|3,0,0]=4 396 B11R1.167 O=C(Cl)C1=C(Br)C=CC(F)=C1 B4269 [0,1,0,0,0,0|2,0,0]=3 397 B11R1.167 O=C(Cl)C1=C(Cl)C=CC(Cl)=C1 D9434 [0,1,0,0,0,0|2,0,0]=3 398 B11R1.167 O=C(Cl)C1=C(Cl)C=CC(F)=C1 C4265 [0,1,0,0,0,0|2,0,0]=3 399 B11R1.167 O=C(Cl)C1=CC(Cl)=CC=C1F C4271 [0,1,0,0,0,0|2,0,0]=3 400 B11R1.167 O=C(Cl)C1=CC(F)=CC=C1F D4262 [0,1,0,0,0,0|2,0,0]=3 401 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 B10503 [0,1,0,0,0,0|1,0,0]=2 402 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 D0554 [0,1,0,0,0,0|1,0,0]=2 403 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 F5302 [0,1,0,0,0,0|1,0,0]=2 404 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 D0557 [0,1,0,0,0,0|0,0,0]=1 405 B11R1.167 O=C(O)C1=CC(Br)=CC=C1Cl B5330 [0,1,0,0,0,0|1,0,0]=2 406 B11R1.167 O=C(O)C1=CC(Br)=CC=C1Cl B5330 [0,1,0,0,0,0|1,0,0]=2 407 B11R1.167 O=C(O)C1=CC(Br)=CC=C1F B2381 [0,1,0,0,0,0|1,0,0]=2 408 B11R1.167 O=C(O)C1=CC(Br)=CC=C1F B2381 [0,1,0,0,0,0|1,0,0]=2 409 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl B15340 [0,1,0,0,0,0|2,0,0]=3 410 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl B15340 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O B3226 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O B3226 [0,1,0,0,0,0|2,0,0]=3 413 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1F C2692 [0,1,0,0,0,0|1,0,0]=2 414 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1Cl D15727 [0,1,0,0,0,0|2,0,0]=3 415 B11R1.167 O=C(O)C1=CC(F)=CC=C1Br B2379 [0,1,0,0,0,0|1,0,0]=2 416 B11R1.167 O=C(O)C1=CC(F)=CC=C1Cl C2124 [0,1,0,0,0,0|1,0,0]=2 417 B11R1.167 O=C(O)C1=CC(F)=CC=C1F D4241 [0,1,0,0,0,0|1,0,0]=2 418 B11R1.167 O=C(O)C1=CC(F)=CC=C1I I6648 [0,1,0,0,0,0|1,0,0]=2 419 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl C7253 [0,1,0,0,0,0|2,0,0]=3 420 B11R1.167 O=C(O)C1=CC(O)=CC=C1F F7404 [0,1,0,0,0,0|0,0,0]=1 421 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl D3861 [0,1,0,0,0,0|2,0,0]=3 422 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(Cl)=C1 C2561 [0,1,0,0,0,0|2,0,1]=4 423 B11R1.167 O=[N+]([O-])C1=CC(Br)=CC=C1F B5192 [0,1,0,0,0,0|2,0,1]=4 424 B11R1.167 O=[N+]([O-])C1=CC(Br)=CC=C1O B9817 [0,1,0,0,0,0|2,0,1]=4 425 B11R1.167 O=[N+]([O-])C1=CC(F)=CC=C1Br B5257 [0,1,0,0,0,0|2,0,1]=4 426 B11R1.167 O=[N+]([O-])C1=CC(F)=CC=C1Cl C5200 [0,1,0,0,0,0|2,0,1]=4 427 B11R1.167 O=[N+]([O-])C1=CC(F)=CC=C1F D2433 [0,1,0,0,0,0|2,0,1]=4 428 B11R1.167 O=[N+]([O-])C1=CC(F)=CC=C1I F5219 [0,1,0,0,0,0|2,0,1]=4 429 B11R1.167 O=[N+]([O-])C1=CC(F)=CC=C1O F5236 [0,1,0,0,0,0|2,0,1]=4 430 B11R1.167 O=[N+]([O-])C1=CC(O)=CC=C1F F7435 [0,1,0,0,0,0|1,0,1]=3 431 B11R1.167 O=[N+]([O-])C1=CC(O)=CC=C1F F7435 [0,1,0,0,0,0|1,0,1]=3 432 B11R1.167 OB(O)C1=C(Cl)C=CC(Cl)=C1 D8630 [0,1,0,0,0,0|2,0,1]=4 433 B11R1.167 OB(O)C1=C(O)C=CC(F)=C1 F3983 [0,1,0,0,0,0|2,0,1]=4 434 B11R1.167 OB(O)C1=CC(F)=CC=C1F D3866 [0,1,0,0,0,0|2,0,1]=4 435 B11R1.266 C(=O)C1=CC(B(O)O)=CC=C1 F4004 [0,1,0,0,0,0|1,0,2]=4 436 B11R1.266 CC(=O)C1=CC(CCl)=CC=C1 C7787 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.266 COC1=CC(B(O)O)=CC=C1 M4029 [0,1,0,0,0,0|1,0,1]=3 438 B11R1.266 COC1=CC(C(=N)N)=CC=C1 M13855 [0,1,0,0,0,0|2,0,0]=3 439 B11R1.266 COC1=CC(C(C)=O)=CC=C1 M11367 [0,1,0,0,0,0|1,0,0]=2 440 B11R1.266 COC1=CC([C@@H](C)N)=CC=C1 M12651 [0,1,0,0,0,0|2,0,1]=4 441 B11R1.266 COC1=CC([C@H](C)N)=CC=C1 M12652 [0,1,0,0,0,0|2,0,1]=4 442 B11R1.266 COC1=CC=CC(C(=O)O)=C1 M0712 [0,1,0,0,0,0|0,0,0]=1 443 B11R1.266 COC1=CC=CC(C(C)N)=C1 M18909 [0,1,0,0,0,0|2,0,1]=4 444 B11R1.266 COC1=CC=CC([C@H](C)N)=C1 M18910 [0,1,0,0,0,0|2,0,1]=4 445 B11R1.266 CSC1=CC(B(O)O)=CC=C1 T0958 [0,1,0,0,0,0|1,1,1]=4 446 B11R1.266 CSC1=CC=CC([N+](=O)[O-])=C1 N3894 [0,1,0,0,0,0|1,1,1]=4 447 B11R1.266 CSC1=NC=CC(C(=O)O)=N1 M12946 [0,1,0,0,0,0|2,1,0]=4 448 B11R1.266 N#CC1=CC(B(O)O)=CC=C1 C2121 [0,1,0,0,0,0|2,0,1]=4 449 B11R1.266 N#CC1=CC([N+](=O)[O-])=CC=C1 N18891 [0,1,0,0,0,0|2,0,1]=4 450 B11R1.266 N=C(N)C1=CC=CC(CN)=C1 A15345 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.266 NCC1=CC(B(O)O)=CC=C1 A8492 [0,1,0,0,0,0|2,0,1]=4 452 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 A12843 [0,1,0,0,0,0|1,0,0]=2 453 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 A12843 [0,1,0,0,0,0|1,0,0]=2 454 B11R1.266 O=C(O)C1=CC=CC(CCl)=C1 C4256 [0,1,0,0,0,0|1,0,0]=2 455 B11R1.266 O=[N+]([O-])C1=CC(CBr)=CC=C1 N0261 [0,1,0,0,0,0|2,0,1]=4 456 B11R1.266 OB(O)C1=CC(CBr)=CC=C1 B9669 [0,1,0,0,0,0|2,0,1]=4 457 B11R2.35 ClC1=CC(C2CO2)=CC=C1 C19156 [0,0,0,1,0,0|2,0,1]=4 458 B9R1.35 CC(=O)C1=CC=C(Br)S1 A3938 [0,0,0,0,1,0|3,0,0]=4 459 B9R1.35 CC1=CC(C(=O)O)=CN1 M16417 [0,0,0,0,1,0|2,0,0]=3 460 B9R1.35 CC1=CC(C(=O)O)=CN1 M16417 [0,0,0,0,1,0|2,0,0]=3 461 B9R1.35 CC1=NC=C(C(=O)O)S1 M15609 [0,0,0,0,1,0|3,0,0]=4 462 B9R1.35 CC1=NNC(C(=O)O)=C1 M12250 [0,0,0,0,1,0|3,0,0]=4 463 B9R1.35 NC1=NC(C(=O)O)=CS1 A1501 [0,0,0,0,1,0|3,0,0]=4 464 B9R1.35 O=C(Cl)C1=CC=C(Br)O1 B9426 [0,0,0,0,1,0|3,0,0]=4 465 B9R1.35 O=C(O)C1=CC(Br)=CN1 B15071 [0,0,0,0,1,0|2,0,0]=3 466 B9R1.35 O=C(O)C1=CC(Br)=CS1 B18451 [0,0,0,0,1,0|2,0,0]=3 467 B9R1.35 O=C(O)C1=CC=C(Br)O1 B8631 [0,0,0,0,1,0|2,0,0]=3 468 B9R1.35 O=C(O)C1=CC=C(Br)S1 B9313 [0,0,0,0,1,0|2,0,0]=3 469 B9R1.35 O=C(O)C1=CN=C(Br)S1 B14465 [0,0,0,0,1,0|3,0,0]=4 470 B9R1.35 O=C(O)C1=CSC(Br)=N1 B14412 [0,0,0,0,1,0|3,0,0]=4 471 B9R1.35 O=C(O)C1=CSC(I)=N1 I15531 [0,0,0,0,1,0|3,0,0]=4 472 B9R1.35 [NH3+]C1=NC(C(=O)O)=CS1 A12716 [0,0,0,0,1,0|3,0,0]=4 473 B9R1.41 CC1=C(C(=O)O)C=NO1 M1417 [0,0,0,0,1,0|3,0,0]=4 474 B9R1.41 CC1=C(C(=O)O)SC=C1 M0715 [0,0,0,0,1,0|2,0,0]=3 475 B9R1.41 CC1=C(C(=O)O)SC=N1 M15610 [0,0,0,0,1,0|3,0,0]=4 476 B9R1.41 CN1C=CC=C1C(=O)O M16979 [0,0,0,0,1,0|2,0,0]=3 477 B9R1.41 CN1N=CC=C1C(=O)O M17588 [0,0,0,0,1,0|3,0,0]=4 478 B9R1.41 NC(=O)C1=C(O)NC=N1 H19077 [0,0,0,0,1,0|3,0,0]=4 479 B9R1.41 NC1=NNC=C1C(=O)O A12248 [0,0,0,0,1,0|3,0,0]=4 480 B9R1.41 O=C(Cl)C1=C(Cl)C=CS1 C8239 [0,0,0,0,1,0|3,0,0]=4 481 B9R1.41 O=C(O)C1=C(Br)C=CS1 B9312 [0,0,0,0,1,0|2,0,0]=3 482 B9R1.41 O=C(O)C1=C(Br)C=CS1 B9312 [0,0,0,0,1,0|2,0,0]=3 483 B9R1.41 O=C(O)C1=C(Cl)C=CS1 C7552 [0,0,0,0,1,0|2,0,0]=3 484 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 A1578 [0,0,0,0,0,1|2,0,0]=3 485 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 A0689 [0,0,0,0,0,1|2,0,0]=3 486 B11R1.157 CC(=O)NC1=NC(Br)=CC=C1 B15302 [0,0,0,0,0,1|3,0,0]=4 487 B11R1.157 CC1=CC=CC(CC(=N)N)=C1 T13941 [0,0,0,0,0,1|3,0,0]=4 488 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 C16713 [0,0,0,0,0,1|3,0,0]=4 489 B11R1.157 N=C(N)CC1=CC(F)=CC=C1 F14030 [0,0,0,0,0,1|3,0,0]=4 490 B11R1.157 NC(=S)NC1=CC(Br)=CC=C1 B10340 [0,0,0,0,0,1|2,1,0]=4 491 B11R1.157 NC(=S)NC1=CC(O)=CC=C1 H7774 [0,0,0,0,0,1|1,1,0]=3 492 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 A5096 [0,0,0,0,0,1|1,0,0]=2 493 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 B3814 [0,0,0,0,0,1|1,0,0]=2 494 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 C0700 [0,0,0,0,0,1|1,0,0]=2 495 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F1337 [0,0,0,0,0,1|1,0,0]=2 496 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F1337 [0,0,0,0,0,1|1,0,0]=2 497 B8R0.23 C=C(CC(=O)O)C(=O)O I18874 [1,0,1,0,0,0|1,0,1]=4 498 B8R1.2 C#CC1=CC=CC=C1 P18887 [2,0,0,0,0,0|1,0,1]=4 499 B8R1.2 C(=O)C1=CC=CN=C1 P11581 [2,0,0,0,0,0|1,0,0]=3 500 B8R1.2 C(=O)C1=CC=NC=C1 P11582 [2,0,0,0,0,0|1,0,0]=3 501 B8R1.2 OCC1=NC=CC=C1 P1495 [2,0,0,0,0,0|1,0,1]=4 502 B8R1.4 BrC1=CC=CC(Br)=C1 D10509 [2,0,0,0,0,0|2,0,0]=4 503 B8R1.4 CC1=CC(O)=NC=C1 H11433 [2,0,0,0,0,0|1,0,1]=4 504 B8R1.4 CC1=CC=CC(I)=C1 I9818 [2,0,0,0,0,0|1,0,1]=4 505 B8R1.4 CC1=CC=CC(O)=N1 H2705 [2,0,0,0,0,0|1,0,1]=4 506 B8R1.4 CC1=CC=CC(O)=N1 H2705 [2,0,0,0,0,0|1,0,1]=4 507 B8R1.4 FC1=CC(Cl)=CC=C1 C11140 [2,0,0,0,0,0|2,0,0]=4 508 B8R1.4 FC1=CC(S)=CC=C1 F5243 [2,0,0,0,0,0|1,1,0]=4 509 B8R1.4 FC1=CC=CC(Br)=C1 B11138 [2,0,0,0,0,0|2,0,0]=4 510 B8R1.4 FC1=CC=CC(F)=C1 D11159 [2,0,0,0,0,0|2,0,0]=4 511 B8R1.4 FC1=CC=CC(I)=C1 F9963 [2,0,0,0,0,0|2,0,0]=4 512 B8R1.4 NC1=CC(O)=CC=N1 A14644 [2,0,0,0,0,0|2,0,0]=4 513 B8R1.4 NC1=CC(O)=CC=N1 A14644 [2,0,0,0,0,0|2,0,0]=4 514 B8R1.4 NC1=CC(O)=NC=C1 A14552 [2,0,0,0,0,0|2,0,0]=4 515 B8R1.4 NC1=CC=CC(Br)=C1 B11592 [2,0,0,0,0,0|2,0,0]=4 516 B8R1.4 NC1=CC=CC(F)=C1 F0703 [2,0,0,0,0,0|2,0,0]=4 517 B8R1.4 NC1=CC=CC(O)=N1 A14451 [2,0,0,0,0,0|2,0,0]=4 518 B8R1.4 OC1=CC(I)=CC=C1 I9898 [2,0,0,0,0,0|1,0,0]=3 519 B8R1.4 OC1=CC(O)=NC=N1 D1169 [2,0,0,0,0,0|2,0,0]=4 520 B8R1.4 OC1=CC(S)=CC=C1 H4937 [2,0,0,0,0,0|0,1,0]=3 521 B8R1.4 OC1=CC=CC(Br)=C1 B0311 [2,0,0,0,0,0|1,0,0]=3 522 B8R1.4 OC1=CC=CC(Br)=N1 B11447 [2,0,0,0,0,0|2,0,0]=4 523 B8R1.4 OC1=CC=CC(Cl)=C1 C1354 [2,0,0,0,0,0|1,0,0]=3 524 B8R1.4 OC1=CC=CC(F)=C1 F11146 [2,0,0,0,0,0|1,0,0]=3 525 B8R1.4 OC1=CC=CC(O)=N1 D14168 [2,0,0,0,0,0|1,0,0]=3 526 B8R1.4 OC1=CC=NC(Cl)=C1 C2931 [2,0,0,0,0,0|2,0,0]=4 527 B8R1.4 OC1=CC=NC(Cl)=C1 C2931 [2,0,0,0,0,0|2,0,0]=4 528 B8R1.4 OC1=CN=CC(Br)=C1 B11445 [2,0,0,0,0,0|2,0,0]=4 529 B8R1.4 OC1=NC(O)=NC=C1 D17728 [2,0,0,0,0,0|2,0,0]=4 530 B8R1.4 ON1=CC(Cl)=CC=C1 C17292 [2,0,0,0,0,0|2,0,0]=4 531 B8R1.4 SC1=CC=CC(Br)=C1 B0695 [2,0,0,0,0,0|1,1,0]=4 532 B8R1.4 SC1=CC=CC(Cl)=C1 C0701 [2,0,0,0,0,0|1,1,0]=4 533 B10R1.2 C(=O)C1=C(F)C(C)=CC=C1 F5315 [1,1,0,0,0,0|1,0,0]=3 534 B10R1.2 C(=O)C1=CC=CC(Br)=C1F B12563 [1,1,0,0,0,0|1,0,0]=3 535 B10R1.2 C(=O)C1=CC=CC(Cl)=C1F C5258 [1,1,0,0,0,0|1,0,0]=3 536 B10R1.2 C(=O)C1=CC=CC(F)=C1I F6644 [1,1,0,0,0,0|1,0,0]=3 537 B10R1.2 CC1=C(C=O)C=CN=C1Cl C17458 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.2 NC1=C(Br)C=CC=C1C=O A19285 [1,1,0,0,0,0|1,0,0]=3 539 B10R1.2 NC1=C(Br)C=CC=C1CO A19289 [1,1,0,0,0,0|1,0,1]=4 540 B10R1.2 NC1=CC=CC(CO)=C1N D13345 [1,1,0,0,0,0|1,0,1]=4 541 B10R1.2 O=CC1=C(Cl)C(Cl)=CC=C1 D0527 [1,1,0,0,0,0|1,0,0]=3 542 B10R1.2 O=CC1=C(F)C(Cl)=NC=C1 C17457 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.2 O=CC1=CC=CC(F)=C1Br F6656 [1,1,0,0,0,0|1,0,0]=3 544 B10R1.2 O=CC1=CC=CC(F)=C1Cl C6652 [1,1,0,0,0,0|1,0,0]=3 545 B10R1.8 C(=O)C1=CC(C)=CC(C)=C1 D5519 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.8 C(=O)C1=CC(Cl)=CC(Cl)=C1 D1081 [1,1,0,0,0,0|1,0,0]=3 547 B10R1.8 C(=O)C1=CC(F)=CC(F)=C1 D0994 [1,1,0,0,0,0|1,0,0]=3 548 B10R1.8 C(=O)C1=CC(O)=CC(O)=C1 D0673 [1,1,0,0,0,0|0,0,0]=2 549 B10R1.8 CC1=CC(C=O)=CC(F)=C1 F5299 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.8 N#CC1=CC(O)=CC(O)=C1 D3872 [1,1,0,0,0,0|1,0,1]=4 551 B10R1.8 O=CC1=CC(Cl)=NC(Cl)=C1 D17471 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.8 O=CC1=CC(F)=CC(Br)=C1 B6663 [1,1,0,0,0,0|1,0,0]=3 553 B10R1.8 OCC1=CC(F)=CC(F)=C1 D0990 [1,1,0,0,0,0|1,0,1]=4 554 B10R1.8 OCC1=CC(O)=CC(O)=C1 D11753 [1,1,0,0,0,0|0,0,1]=3 555 B10R1.8 OCC1=CC(O)=CC(O)=C1 D11753 [1,1,0,0,0,0|0,0,1]=3 556 B10R1.10 NCCC1=CC=CC(O)=C1 H7973 [1,1,0,0,0,0|1,0,1]=4 557 B10R1.30 C(=O)C1=C(Cl)C=CC(Cl)=C1 D0946 [1,1,0,0,0,0|1,0,0]=3 558 B10R1.30 C(=O)C1=C(Cl)C=CC(Cl)=C1 D0946 [1,1,0,0,0,0|1,0,0]=3 559 B10R1.30 C(=O)C1=C(F)C=CC(I)=C1 F12559 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.30 C(=O)C1=C(O)C=CC(Cl)=C1 C0924 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.30 C(=O)C1=CC(Br)=CC=C1F B4545 [1,1,0,0,0,0|1,0,0]=3 562 B10R1.30 C(=O)C1=CC(Br)=CC=C1F B4545 [1,1,0,0,0,0|1,0,0]=3 563 B10R1.30 C(=O)C1=CC(F)=CC=C1Cl C4549 [1,1,0,0,0,0|1,0,0]=3 564 B10R1.30 C(=O)C1=CC(F)=CC=C1F D4209 [1,1,0,0,0,0|1,0,0]=3 565 B10R1.30 C(=O)C1=CC(F)=CC=C1I I6647 [1,1,0,0,0,0|1,0,0]=3 566 B10R1.30 C(=O)C1=CC(F)=CC=C1I I6647 [1,1,0,0,0,0|1,0,0]=3 567 B10R1.30 CC1=CC=C(F)C(C=O)=C1 F4546 [1,1,0,0,0,0|1,0,0]=3 568 B10R1.30 COC1=C(Br)C=CC(O)=C1 B3002 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 B5250 [1,1,0,0,0,0|1,0,0]=3 570 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 B5250 [1,1,0,0,0,0|1,0,0]=3 571 B10R1.30 O=CC1=C(O)C=CC(Br)=C1 B0927 [1,1,0,0,0,0|1,0,0]=3 572 B10R1.30 O=CC1=CC(Cl)=CC=C1F C4550 [1,1,0,0,0,0|1,0,0]=3 573 B10R1.30 O=CC1=CC(Cl)=CC=C1F C4550 [1,1,0,0,0,0|1,0,0]=3 574 B10R1.30 O=CC1=CC(O)=CC=C1Br B11536 [1,1,0,0,0,0|0,0,0]=2 575 B10R1.30 O=CC1=CC(O)=CC=C1O D1787 [1,1,0,0,0,0|0,0,0]=2 576 B10R1.30 OCC1=C(O)C=CC(Br)=C1 B9144 [1,1,0,0,0,0|1,0,1]=4 577 B10R1.30 OCC1=CC(Br)=CC=C1F B9228 [1,1,0,0,0,0|1,0,1]=4 578 B10R1.30 OCC1=CC(Cl)=CC=C1O C7473 [1,1,0,0,0,0|1,0,1]=4 579 B10R1.172 C(=O)C1=CC=CC(C=O)=N1 P11420 [1,1,0,0,0,0|1,0,1]=4 580 B10R1.172 C(=O)C1=CC=CC(OC)=C1 M0860 [1,1,0,0,0,0|0,0,0]=2 581 B10R1.172 C(=O)C1=CC=CC(OC)=N1 M11441 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.172 C(=O)C1=CN=CC(OC)=C1 M11446 [1,1,0,0,0,0|1,0,0]=3 583 B10R1.172 COC1=CC=CC(CO)=C1 M0713 [1,1,0,0,0,0|0,0,1]=3 584 B10R1.172 COC1=CC=CC(NN)=C1 M11083 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.172 N#CC1=CC=CC(C=O)=C1 C2423 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.172 O=CC1=CC=CC(C=O)=C1 I0820 [1,1,0,0,0,0|0,0,1]=3 587 B10R1.172 OCC1=CC=CC(CBr)=C1 B9071 [1,1,0,0,0,0|1,0,1]=4 588 B10R1.172 OCC1=CC=CC(CO)=N1 D11421 [1,1,0,0,0,0|1,0,1]=4 589 B10R1.176 C(=O)C1=CC(Cl)=C(Cl)C=C1 D0947 [1,1,0,0,0,0|1,0,0]=3 590 B10R1.176 C(=O)C1=CC=C(C)C(F)=C1 F5269 [1,1,0,0,0,0|1,0,0]=3 591 B10R1.176 C(=O)C1=CC=C(Cl)C(F)=C1 C2543 [1,1,0,0,0,0|1,0,0]=3 592 B10R1.176 C(=O)C1=CC=C(F)C(Br)=C1 B0343 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.176 C(=O)C1=CC=C(F)C(C)=C1 F0677 [1,1,0,0,0,0|1,0,0]=3 594 B10R1.176 C(=O)C1=CC=C(F)C(F)=C1 D0907 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.176 CC1=C(O)C=C(C#N)C=C1 H19112 [1,1,0,0,0,0|1,0,1]=4 596 B10R1.176 CC1=CC=C(C=O)C=C1C D3200 [1,1,0,0,0,0|1,0,0]=3 597 B10R1.176 N#CC1=CC(O)=C(O)C=C1 D5448 [1,1,0,0,0,0|1,0,1]=4 598 B10R1.176 NC1=C(F)C=C(CO)C=C1 A14567 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 C7472 [1,1,0,0,0,0|1,0,0]=3 600 B10R1.176 O=CC1=CC(Cl)=C(O)C=C1 C7429 [1,1,0,0,0,0|1,0,0]=3 601 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 B5319 [1,1,0,0,0,0|1,0,0]=3 602 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 B5319 [1,1,0,0,0,0|1,0,0]=3 603 B10R1.176 O=CC1=CC(O)=C(O)C=C1 D0664 [1,1,0,0,0,0|0,0,0]=2 604 B10R1.176 OCC1=CC=C(Cl)C(Cl)=C1 D4310 [1,1,0,0,0,0|1,0,1]=4 605 B10R1.176 OCC1=CC=C(F)C(Br)=C1 B9226 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.176 OCC1=CC=C(F)C(F)=C1 D4312 [1,1,0,0,0,0|1,0,1]=4 607 B10R1.176 OCC1=CC=C(O)C(Br)=C1 B14684 [1,1,0,0,0,0|1,0,1]=4 608 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F1700 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.13 CC(=O)C1=CC=C(N)C=C1 A18848 [1,1,0,0,0,0|1,0,0]=3 610 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 B11426 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 C1062 [1,1,0,0,0,0|1,0,1]=4 612 B10R1.13 CC1=CC=C(B(O)O)C=C1 T4039 [1,1,0,0,0,0|1,0,1]=4 613 B10R1.13 CC1=CC=C(C(=N)N)C=C1 M13863 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 M18854 [1,1,0,0,0,0|1,0,0]=3 615 B10R1.13 CC1=CC=C(C(=O)O)C=N1 M5526 [1,1,0,0,0,0|1,0,0]=3 616 B10R1.13 CC1=CC=C(C(=O)O)C=N1 M5526 [1,1,0,0,0,0|1,0,0]=3 617 B10R1.13 CC1=CN=C(C(=O)O)C=N1 M0470 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.13 CC1=NC=C(C(=O)O)C=N1 M12568 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 B13676 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C13004 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F12780 [1,1,0,0,0,0|2,0,0]=4 622 B10R1.13 N=C(N)C1=CC=C(I)C=C1 I16414 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.13 N=C(N)C1=CC=C(N)C=C1 A18192 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.13 N=C(N)C1=CC=C(N)C=C1 A9362 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.13 N=C(N)C1=CC=C(O)C=C1 C7930 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.13 N=C(N)C1=CC=C(O)C=C1 H13795 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 C18869 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.13 NC(=O)C1=CC=C(N)C=C1 A0176 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.13 NC(=S)C1=CC=C(Br)C=C1 B9721 [1,1,0,0,0,0|1,1,0]=4 630 B10R1.13 NC(=S)C1=CC=C(N)C=C1 A5434 [1,1,0,0,0,0|1,1,0]=4 631 B10R1.13 NC1=CC=C(C(=O)O)C=C1 A11243 [1,1,0,0,0,0|0,0,0]=2 632 B10R1.13 NC1=CC=C(C(=O)O)C=C1 A11243 [1,1,0,0,0,0|0,0,0]=2 633 B10R1.13 NC1=CC=C(C(=O)O)C=N1 A7302 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 A19387 [1,1,0,0,0,0|0,0,1]=3 635 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A14646 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A4099 [1,1,0,0,0,0|1,0,0]=3 637 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A4099 [1,1,0,0,0,0|1,0,0]=3 638 B10R1.13 NC1=CN=C(C(=O)O)N=C1 A15426 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.13 NC1=NC=C(C(=O)O)C=C1 A14647 [1,1,0,0,0,0|1,0,0]=3 640 B10R1.13 NC1=NC=C(C(=O)O)C=N1 A14683 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.13 NC1=NN=C(C(=O)O)C=C1 A15424 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 B2712 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 C18851 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 F7471 [1,1,0,0,0,0|1,0,0]=3 645 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 B0745 [1,1,0,0,0,0|0,0,0]=2 646 B10R1.13 O=C(O)C1=CC=C(Br)C=N1 B9108 [1,1,0,0,0,0|1,0,0]=3 647 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 C2910 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.13 O=C(O)C1=CC=C(Cl)N=C1 C2910 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.13 O=C(O)C1=CC=C(F)C=C1 F0172 [1,1,0,0,0,0|0,0,0]=2 650 B10R1.13 O=C(O)C1=CC=C(I)C=C1 I4019 [1,1,0,0,0,0|0,0,0]=2 651 B10R1.13 O=C(O)C1=CC=C(O)C=N1 H14882 [1,1,0,0,0,0|1,0,0]=3 652 B10R1.13 O=C(O)C1=CC=C(O)N=C1 H5358 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M3209 [1,1,0,0,0,0|0,0,0]=2 654 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M3209 [1,1,0,0,0,0|0,0,0]=2 655 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 B2892 [1,1,0,0,0,0|1,0,0]=3 656 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 B14545 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 C17460 [1,1,0,0,0,0|1,0,0]=3 658 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 C14005 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 S7517 [1,1,0,0,0,0|0,0,1]=3 660 B10R1.13 O=S([O-])C1=CC=C(Cl)C=C1 C8973 [1,1,0,0,0,0|1,0,1]=4 661 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 C1352 [1,1,0,0,0,0|1,0,1]=4 662 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 F11154 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.13 OB(O)C1=CC=C(Br)C=C1 B5337 [1,1,0,0,0,0|1,0,1]=4 664 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 C0706 [1,1,0,0,0,0|1,0,1]=4 665 B10R1.13 OB(O)C1=CC=C(F)C=C1 F0294 [1,1,0,0,0,0|1,0,1]=4 666 B10R1.13 OB(O)C1=CC=C(O)C=C1 H12503 [1,1,0,0,0,0|1,0,1]=4 667 B10R1.15 CCC(=O)C1=CC=CC=C1 P18860 [1,1,0,0,0,0|1,0,0]=3 668 B10R1.15 COC(=O)C1=CC=CN=C1 M0305 [1,1,0,0,0,0|1,0,0]=3 669 B10R1.15 COC(=O)C1=NC=CC=N1 M12247 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.15 COC(=O)C1=NC=CN=C1 P2313 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.15 C\C(=N/O)C1=CC=CN=C1 P17578 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.15 C\C(=N\O)C1=NC=CC=C1 P13970 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.15 NCC(=O)C1=CC=CC=C1 A17693 [1,1,0,0,0,0|1,0,0]=3 674 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 A14785 [1,1,0,0,0,0|1,0,1]=4 675 B10R1.15 NC[C@H](O)C1=CC=CC=C1 A18262 [1,1,0,0,0,0|1,0,1]=4 676 B10R1.15 NNC(=O)C1=CC=NC=C1 I1876 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.15 N\C(=N/O)C1=CC=CN=C1 P13005 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.15 N\C(=N\O)C1=CC=CC=C1 B13505 [1,1,0,0,0,0|1,0,0]=3 679 B10R1.15 N\C(=N\O)C1=CC=NC=C1 H13808 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.15 N\C(=N\O)C1=NC=CC=C1 H13805 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.15 O=C(CBr)C1=CC=CC=C1 B17692 [1,1,0,0,0,0|1,0,0]=3 682 B10R1.15 O=C(CBr)C1=CC=CN=C1 B18473 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.15 O=C(O[Na])C1=NC=NC=C1 P14937 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 P4802 [1,1,0,0,0,0|0,0,2]=4 685 B10R1.15 OC[C@H](O)C1=CC=CC=C1 P4801 [1,1,0,0,0,0|0,0,2]=4 686 B10R1.15 OC[C@H](O)C1=CC=CC=C1 P4801 [1,1,0,0,0,0|0,0,2]=4 687 B10R1.15 [C@@H](N)(CO)C1=CC=CC=C1 P5892 [1,1,0,0,0,0|1,0,1]=4 688 B10R1.15 [C@@H](N)(CO)C1=CC=CC=C1 P5892 [1,1,0,0,0,0|1,0,1]=4 689 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 P1975 [1,1,0,0,0,0|1,0,1]=4 690 B10R1.61 CC(=O)C1=CC=CC=C1Br B8980 [1,1,0,0,0,0|1,0,0]=3 691 B10R1.61 CC(=O)C1=CC=CC=C1F F0912 [1,1,0,0,0,0|1,0,0]=3 692 B10R1.61 CC(=O)C1=CC=CC=C1N A0266 [1,1,0,0,0,0|1,0,0]=3 693 B10R1.61 CC(=O)C1=CC=CN=C1N A7312 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.61 CC(=O)C1=NC=CC=C1N A12969 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.61 CC1=C(C(=O)O)C=CN=C1 M12881 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.61 CC1=CC=CC=C1B(O)O T4038 [1,1,0,0,0,0|1,0,1]=4 697 B10R1.61 CC1=CC=CC=C1C(=N)N M13850 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.61 CC1=CC=CC=C1C(=O)Cl M18896 [1,1,0,0,0,0|1,0,0]=3 699 B10R1.61 CC1=CC=CN=C1C(=O)O M17500 [1,1,0,0,0,0|1,0,0]=3 700 B10R1.61 CC1=NC=CC=C1C(=O)O M17501 [1,1,0,0,0,0|1,0,0]=3 701 B10R1.61 N=C(N)C1=C(O)C=CC=C1 H13821 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.61 N=C(N)C1=CC=CC=C1Br B13674 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.61 N=C(N)C1=CC=CC=C1Cl C13733 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.61 N=C(N)C1=CC=CC=C1F F14049 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 B9015 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.61 NC(=O)C1=C(Cl)C=CC=C1 C18868 [1,1,0,0,0,0|1,0,0]=3 707 B10R1.61 NC(=O)C1=C(O)C=CC=C1 S1278 [1,1,0,0,0,0|1,0,0]=3 708 B10R1.61 NC(=O)C1=CC=CC=C1N A16466 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.61 NC(=O)C1=NC=CC=C1N A16469 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.61 NC(=O)C1=NC=CC=C1O H17175 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.61 NC(=S)C1=C(Br)C=CC=C1 B9723 [1,1,0,0,0,0|1,1,0]=4 712 B10R1.61 NC1=C(C(=O)O)C=CN=C1 A13797 [1,1,0,0,0,0|1,0,0]=3 713 B10R1.61 NC1=C(C(=O)O)C=NC=N1 A12837 [1,1,0,0,0,0|2,0,0]=4 714 B10R1.61 NC1=CC=CC=C1B(O)O A18186 [1,1,0,0,0,0|1,0,1]=4 715 B10R1.61 NC1=CC=CN=C1C(=O)O A11570 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.61 NC1=NC=CC=C1C(=O)O A2326 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.61 NC1=NC=CC=C1C(=O)O A2326 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.61 NC1=NC=CN=C1C(=O)O A2119 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 B9882 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 C2477 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 F7469 [1,1,0,0,0,0|1,0,0]=3 722 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 B9109 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 B9110 [1,1,0,0,0,0|1,0,0]=3 724 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 C5345 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 C17301 [1,1,0,0,0,0|1,0,0]=3 726 B10R1.61 O=C(O)C1=C(O)C=CC=C1 S1290 [1,1,0,0,0,0|0,0,0]=2 727 B10R1.61 O=C(O)C1=CC=CC=C1F F1796 [1,1,0,0,0,0|0,0,0]=2 728 B10R1.61 O=C(O)C1=CC=CC=C1I I1314 [1,1,0,0,0,0|0,0,0]=2 729 B10R1.61 O=C(O)C1=CC=CN=C1Cl C4998 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.61 O=C(O)C1=CC=CN=C1F F11719 [1,1,0,0,0,0|1,0,0]=3 731 B10R1.61 O=C(O)C1=CC=CN=C1O H2508 [1,1,0,0,0,0|1,0,0]=3 732 B10R1.61 O=C(O)C1=CC=CN=C1S M5419 [1,1,0,0,0,0|1,0,0]=3 733 B10R1.61 O=C(O)C1=CC=NC=C1Br B9107 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.61 O=C(O)C1=N(O)C=CC=C1 P17505 [1,1,0,0,0,0|1,0,0]=3 735 B10R1.61 O=C(O)C1=NC=CC=C1Cl C17308 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.61 O=C(O)C1=NC=CC=C1O H5458 [1,1,0,0,0,0|1,0,0]=3 737 B10R1.61 O=C(O)C1=NC=CN=C1Cl C12255 [1,1,0,0,0,0|2,0,0]=4 738 B10R1.61 O=C(O)C1=NC=CN=C1O H7209 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 S7518 [1,1,0,0,0,0|0,0,1]=3 740 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 C1351 [1,1,0,0,0,0|1,0,1]=4 741 B10R1.61 O=[N+]([O-])C1=CC=CC=C1F F11152 [1,1,0,0,0,0|1,0,1]=4 742 B10R1.61 OB(O)C1=C(Br)C=CC=C1 B5382 [1,1,0,0,0,0|1,0,1]=4 743 B10R1.61 OB(O)C1=CC=CC=C1Cl C3844 [1,1,0,0,0,0|1,0,1]=4 744 B10R1.61 OB(O)C1=CC=CC=C1F F3994 [1,1,0,0,0,0|1,0,1]=4 745 B10R1.14 COC(=O)C1=CC(Br)=CN1 M15180 [0,1,0,0,1,0|2,0,0]=4 746 B10R1.14 COC(=O)C1=CC(O)=NO1 M17092 [0,1,0,0,1,0|2,0,0]=4 747 B10R1.31 N#CC1=CNC(C(=O)O)=C1 C14750 [0,1,0,0,1,0|2,0,0]=4 748 B10R1.31 O=CC1=CC=C(C(=O)O)N1 F15336 [0,1,0,0,1,0|1,0,1]=4 749 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 D15082 [0,1,0,0,1,0|2,0,0]=4 750 B10R1.59 CC1=CC(C)=C(C(=O)O)N1 D15080 [0,1,0,0,1,0|2,0,0]=4 751 B10R1.194 CC1=C(C(=O)O)SC=C1Br B9931 [0,1,0,0,1,0|2,0,0]=4 752 B10R1.149 COC(=O)C1=C(C)C=CO1 M4783 [0,1,0,0,1,0|2,0,0]=4 753 B10R1.149 COC(=O)C1=C(N)C=CS1 A4697 [0,1,0,0,1,0|2,0,0]=4 754 B10R1.149 COC(=O)C1=C(N)SC=C1 M7445 [0,1,0,0,1,0|2,0,0]=4 755 B10R1.149 NC1=C(C(=O)O[K])C=CS1 A13030 [0,1,0,0,1,0|2,0,0]=4 756 B12R1.19 CC(=O)NC1=CC(N)=C(Cl)C=C1 A8391 [0,1,0,0,0,1|2,0,0]=4 757 B12R1.19 CC(=O)NC1=CC=C(C)C(C)=C1 A18038 [0,1,0,0,0,1|2,0,0]=4 758 B12R1.19 NC1=C(Cl)C=CC(CC(=O)O)=C1 A12846 [0,1,0,0,0,1|1,0,0]=3 759 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 B10333 [0,1,0,0,0,1|1,0,0]=3 760 B12R1.19 O=C(O)CC1=CC(Cl)=C(Cl)C=C1 D9231 [0,1,0,0,0,1|1,0,0]=3 761 B12R1.19 O=C(O)CC1=CC(Cl)=C(F)C=C1 C8542 [0,1,0,0,0,1|1,0,0]=3 762 B12R1.19 O=C(O)CC1=CC=C(F)C(F)=C1 D0997 [0,1,0,0,0,1|1,0,0]=3 763 B12R1.19 O=C(O)CC1=CC=C(O)C(Cl)=C1 C2432 [0,1,0,0,0,1|1,0,0]=3 764 B12R1.50 C=CC(=O)CC1=CC(F)=CC=C1 F15736 [0,1,0,0,0,1|2,0,0]=4 765 B12R1.50 CCC(=O)NC1=CC=CC(N)=C1 A1583 [0,1,0,0,0,1|2,0,0]=4 766 B12R1.50 CNC(=O)OC1=CC(C)=CC=C1 M2025 [0,1,0,0,0,1|2,0,0]=4 767 B12R1.50 CNC(=O)OC1=CC(C)=CC=C1 M2025 [0,1,0,0,0,1|2,0,0]=4 768 B12R1.50 COC(=O)CC1=CC(Br)=CC=C1 B14248 [0,1,0,0,0,1|1,0,0]=3 769 B12R1.50 O=C(CCl)NC1=CC(F)=CC=C1 C8495 [0,1,0,0,0,1|2,0,0]=4 770 B12R1.101 O=C(O)CC1=CC(Br)=CC(Br)=C1 D4789 [0,1,0,0,0,1|1,0,0]=3 771 B12R1.101 O=C(O)CC1=CC(F)=CC(F)=C1 D1085 [0,1,0,0,0,1|1,0,0]=3 772 B12R1.101 O=C(O)CC1=CC(O)=CC(O)=C1 D5876 [0,1,0,0,0,1|0,0,0]=2 773 B12R1.127 NC1=CC(CC(=O)O)=C(F)C=C1 A14571 [0,1,0,0,0,1|1,0,0]=3 774 B12R1.127 O=C(O)CC1=C(F)C=CC(F)=C1 D7898 [0,1,0,0,0,1|1,0,0]=3 775 B12R1.224 CC1=C(C)C(CC(=O)O)=CC=C1 D7646 [0,1,0,0,0,1|1,0,0]=3 776 B12R1.224 CC1=C(C)C(CC(=O)O)=CC=C1 D7646 [0,1,0,0,0,1|1,0,0]=3 777 B12R1.224 O=C(O)CC1=CC=CC(Cl)=C1Cl D5546 [0,1,0,0,0,1|1,0,0]=3 778 B12R1.224 O=C(O)CC1=CC=CC(F)=C1F D2156 [0,1,0,0,0,1|1,0,0]=3 779 B12R1.225 CC(C(=O)O)C1=CC=CC(Cl)=C1 C8387 [0,1,0,0,0,1|1,0,0]=3 780 B12R1.225 CC1=CC=CC(C(N)C(=O)O)=C1 A15379 [0,1,0,0,0,1|1,0,0]=3 781 B12R1.225 NC(C(=O)O)C1=CC(Cl)=CC=C1 A13598 [0,1,0,0,0,1|1,0,0]=3 782 B12R1.225 NC(C(=O)O)C1=CC=CC(Cl)=C1 A15382 [0,1,0,0,0,1|1,0,0]=3 783 B12R1.225 NC(C(=O)O)C1=CC=CC(O)=C1 A13194 [0,1,0,0,0,1|0,0,0]=2 784 B12R1.225 N[C@H](C(=O)O)C1=CC(F)=CC=C1 A12800 [0,1,0,0,0,1|1,0,0]=3 785 B12R1.225 O=C(O)C(O)C1=CC(Br)=CC=C1 B10335 [0,1,0,0,0,1|1,0,0]=3 786 B12R1.438 COC1=CC(CC(=N)N)=CC=C1 M13859 [0,1,0,0,0,1|2,0,0]=4 787 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 M0114 [0,1,0,0,0,1|0,0,0]=2 788 B12R1.438 CSC1=CC=CC(NC(C)=O)=C1 A3896 [0,1,0,0,0,1|1,1,0]=4 789 B12R1.438 O=C(O)CC1=CC=CC(CCl)=C1 C4257 [0,1,0,0,0,1|1,0,0]=3 790 B12R1.23 CC1=C(N)C=C(S(=O)(=O)O)C=C1 A1439 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.23 NC1=C(Cl)C=CC(S(=O)(=O)O)=C1 C1440 [0,2,0,0,0,0|2,0,0]=4 792 B12R1.23 NC1=C(O)C=CC(S(=O)(=O)O)=C1 A0597 [0,2,0,0,0,0|2,0,0]=4 793 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 F7764 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.48 COC1=C(N)C=C(C(N)=O)C=C1 A7714 [0,2,0,0,0,0|2,0,0]=4 795 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 H1463 [0,2,0,0,0,0|0,0,0]=2 796 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 H1463 [0,2,0,0,0,0|0,0,0]=2 797 B12R1.48 COC1=CC=C(C(=O)O)C=C1C M19248 [0,2,0,0,0,0|1,0,0]=3 798 B12R1.48 COC1=CC=C(C(=O)O)C=C1F F5225 [0,2,0,0,0,0|1,0,0]=3 799 B12R1.48 COC1=CC=C(C(=O)O)C=C1N A3782 [0,2,0,0,0,0|1,0,0]=3 800 B12R1.48 COC1=CC=C(C(C)=O)C=C1Br B10267 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.48 COC1=CC=C([N+](=O)[O-])C=C1O M0051 [0,2,0,0,0,0|1,0,1]=4 802 B12R1.56 CC(=O)C1=CC=C(O)C(CCl)=C1 C8388 [0,2,0,0,0,0|2,0,0]=4 803 B12R1.56 CC1=CC=C(C(=O)O)C=C1NN H14867 [0,2,0,0,0,0|1,0,0]=3 804 B12R1.56 CCC1=C(N)C=CC(C(=O)O)=C1 A14640 [0,2,0,0,0,0|1,0,0]=3 805 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 M4997 [0,2,0,0,0,0|0,0,0]=2 806 B12R1.56 COC1=C(C)C=CC([N+](=O)[O-])=C1 N7744 [0,2,0,0,0,0|1,0,1]=4 807 B12R1.56 COC1=C(O)C=CC(C(=N)N)=C1 H13824 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 H1465 [0,2,0,0,0,0|0,0,0]=2 809 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 M0420 [0,2,0,0,0,0|1,0,1]=4 810 B12R1.56 COC1=CC(C(=O)O)=CC=C1F F5226 [0,2,0,0,0,0|0,0,0]=2 811 B12R1.56 COC1=CC(C(=O)O)=CC=C1N A11531 [0,2,0,0,0,0|0,0,0]=2 812 B12R1.56 COC1=CC(C(C)=O)=CC=C1O M4699 [0,2,0,0,0,0|1,0,0]=3 813 B12R1.56 COC1=CC(C(C)O)=CC=C1O H13091 [0,2,0,0,0,0|1,0,1]=4 814 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1Cl C8493 [0,2,0,0,0,0|1,0,1]=4 815 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1F F6713 [0,2,0,0,0,0|1,0,1]=4 816 B12R1.56 NNC1=CC(C(=O)O)=CC=C1Cl C14738 [0,2,0,0,0,0|1,0,0]=3 817 B12R1.232 CC(=O)C1=CC(C)=C(C)C=C1O H7632 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.232 CC1=C(Br)C=C(F)C(C(=O)O)=C1 B6759 [0,2,0,0,0,0|1,0,0]=3 819 B12R1.232 NC1=C(O)C=C([N+](=O)[O-])C(Cl)=C1 A0587 [0,2,0,0,0,0|1,0,1]=4 820 B12R1.232 NC1=CC(F)=C(F)C=C1C(=O)O A2683 [0,2,0,0,0,0|1,0,0]=3 821 B12R1.232 O=C(Cl)C1=C(F)C=C(Cl)C(F)=C1 C9479 [0,2,0,0,0,0|2,0,0]=4 822 B12R1.232 O=C(Cl)C1=CC(F)=C(Cl)C=C1Cl D4279 [0,2,0,0,0,0|2,0,0]=4 823 B12R1.232 O=C(Cl)C1=CC(F)=C(F)C=C1F T4274 [0,2,0,0,0,0|2,0,0]=4 824 B12R1.232 O=C(O)C1=C(O)C=C(O)C(O)=C1 T7819 [0,2,0,0,0,0|0,0,0]=2 825 B12R1.232 O=C(O)C1=CC(Cl)=C(F)C=C1F D6742 [0,2,0,0,0,0|1,0,0]=3 826 B12R1.232 O=C(O)C1=CC(F)=C(Cl)C=C1Cl D0917 [0,2,0,0,0,0|1,0,0]=3 827 B12R1.232 O=C(O)C1=CC(F)=C(Cl)C=C1F C5196 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.232 O=C(O)C1=CC(F)=C(Cl)N=C1Cl D0562 [0,2,0,0,0,0|2,0,0]=4 829 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1Cl C5195 [0,2,0,0,0,0|1,0,0]=3 830 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1F T0535 [0,2,0,0,0,0|1,0,0]=3 831 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1I D3863 [0,2,0,0,0,0|1,0,0]=3 832 B12R1.232 O=[N+]([O-])C1=C(F)C=C(Cl)C(O)=C1 C1626 [0,2,0,0,0,0|1,0,1]=4 833 B12R1.232 O=[N+]([O-])C1=C(F)C=C(Cl)C(O)=C1 C1626 [0,2,0,0,0,0|1,0,1]=4 834 B12R1.367 COC(=O)C1=CC(Br)=C(N)C=C1 A13593 [0,2,0,0,0,0|1,0,0]=3 835 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=C1 M10263 [0,2,0,0,0,0|1,0,0]=3 836 B12R1.367 COC(=O)C1=CC(C)=C(N)C=C1 M5361 [0,2,0,0,0,0|1,0,0]=3 837 B12R1.367 COC(=O)C1=CC(O)=C(O)C=C1 M1208 [0,2,0,0,0,0|0,0,0]=2 838 B12R1.367 COC(=O)C1=CC=C(C)C(Cl)=C1 M12385 [0,2,0,0,0,0|1,0,0]=3 839 B12R1.367 COC(=O)C1=CC=C(C)C(N)=C1 M7672 [0,2,0,0,0,0|1,0,0]=3 840 B12R1.367 COC(=O)C1=CC=C(C)C(N)=C1 M7672 [0,2,0,0,0,0|1,0,0]=3 841 B12R1.367 COC(=O)C1=CC=C(Cl)C(N)=C1 A2510 [0,2,0,0,0,0|1,0,0]=3 842 B12R1.367 COC(=O)C1=CC=C(Cl)C(N)=C1 A2510 [0,2,0,0,0,0|1,0,0]=3 843 B12R1.367 COC(=O)C1=CC=C(N)C(N)=C1 M11313 [0,2,0,0,0,0|1,0,0]=3 844 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 H14900 [0,2,0,0,0,0|1,0,0]=3 845 B12R1.367 COC(=O)C1=CC=C(O)C(C)=C1 H14900 [0,2,0,0,0,0|1,0,0]=3 846 B12R1.367 COC(=O)C1=CN=C(Cl)C(N)=C1 A15286 [0,2,0,0,0,0|2,0,0]=4 847 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 N7803 [0,2,0,0,0,0|1,0,1]=4 848 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 N4951 [0,2,0,0,0,0|1,0,1]=4 849 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 N4951 [0,2,0,0,0,0|1,0,1]=4 850 B12R1.367 NNC(=O)C1=CC(O)=C(N)C=C1 A14441 [0,2,0,0,0,0|1,0,0]=3 851 B12R1.367 N\C(=N\O)C1=CC(F)=C(F)C=C1 D13626 [0,2,0,0,0,0|2,0,0]=4 852 B12R1.367 N\C(=N\O)C1=CC=C(F)C(Br)=C1 B10429 [0,2,0,0,0,0|2,0,0]=4 853 B12R1.367 O=C(CBr)C1=CC=C(F)C(F)=C1 D10487 [0,2,0,0,0,0|2,0,0]=4 854 B12R1.367 O=C(CCl)C1=CC=C(O)C(O)=C1 D4702 [0,2,0,0,0,0|1,0,0]=3 855 B12R1.893 CC(=O)C1=C(Cl)C(Cl)=C(Cl)C=C1 T10046 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.893 CC1=C(F)C(F)=C(C(=O)Cl)C=C1 D8623 [0,2,0,0,0,0|2,0,0]=4 857 B12R1.893 CC1=CC=C(C(=O)O)C(N)=C1C A11504 [0,2,0,0,0,0|1,0,0]=3 858 B12R1.893 CC1=CC=C([N+](=O)[O-])C(Cl)=C1O C6932 [0,2,0,0,0,0|1,0,1]=4 859 B12R1.893 NC1=C(F)C(F)=C(C(=O)O)C=C1 A14638 [0,2,0,0,0,0|1,0,0]=3 860 B12R1.893 O=C(Cl)C1=C(F)C(Cl)=C(F)C=C1 C9481 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.893 O=C(Cl)C1=CC=C(F)C(F)=C1F T4273 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.893 O=C(O)C1=C(F)C(Cl)=C(F)C=C1 C8708 [0,2,0,0,0,0|1,0,0]=3 863 B12R1.893 O=C(O)C1=C(O)C(O)=C(O)C=C1 T0918 [0,2,0,0,0,0|0,0,0]=2 864 B12R1.893 O=C(O)C1=CC=C(F)C(F)=C1F T4249 [0,2,0,0,0,0|1,0,0]=3 865 B12R1.1005 CC(=O)C1=CC(Cl)=C(N)C(Cl)=C1 A1227 [0,2,0,0,0,0|2,0,0]=4 866 B12R1.1005 CC(=O)C1=CC(F)=C(F)C(F)=C1 T5283 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1Br B10205 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1N A18112 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.1005 NC1=C(Cl)C=C(C(=O)O)C=C1Cl A9262 [0,2,0,0,0,0|1,0,0]=3 870 B12R1.1005 O=C(Cl)C1=CC(F)=C(F)C(F)=C1 T4275 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.1005 O=C(O)C1=CC(Br)=C(O)C(Br)=C1 D3306 [0,2,0,0,0,0|1,0,0]=3 872 B12R1.1005 O=C(O)C1=CC(Cl)=C(O)C(Cl)=C1 D9302 [0,2,0,0,0,0|1,0,0]=3 873 B12R1.1005 O=C(O)C1=CC(F)=C(F)C(F)=C1 T2113 [0,2,0,0,0,0|1,0,0]=3 874 B12R1.1005 O=C(O)C1=CC(O)=C(Br)C(O)=C1 B2436 [0,2,0,0,0,0|0,0,0]=2 875 B12R1.1005 O=C(O)C1=CC(O)=C(O)C(O)=C1 G4995 [0,2,0,0,0,0|0,0,0]=2 876 B12R1.17 CCOC(=O)C1=CC(Br)=CN=C1 E2895 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.17 CCOC(=O)C1=CC=CC(F)=C1 E11148 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.17 CCOC(=O)C1=CC=CC(N)=C1 E7671 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.17 CCOC(=O)C1=CC=CC(N)=N1 A14715 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.17 CCOC(=O)C1=CN=CC(Cl)=C1 E17359 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.17 CCOC(=O)C1=CN=CC(N)=C1 A15168 [0,2,0,0,0,0|2,0,0]=4 882 B12R1.17 N#CCC(=O)C1=CC(F)=CC=C1 F7575 [0,2,0,0,0,0|2,0,0]=4 883 B12R1.17 O=C(N=C=S)C1=CC(Cl)=CC=C1 C8920 [0,2,0,0,0,0|1,1,0]=4 884 B12R1.24 CC1=C(\C(N)=N/O)C=CC=C1Cl C13743 [0,2,0,0,0,0|2,0,0]=4 885 B12R1.24 CC1=CC=CC(C(=O)NN)=C1O H7713 [0,2,0,0,0,0|2,0,0]=4 886 B12R1.24 CNC(=O)C1=CC=CC(Br)=C1N A19283 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.24 CNC(=O)C1=CC=CC(F)=C1N A18226 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.24 COC(=O)C1=CC=CC(Br)=C1N M19336 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.24 COC(=O)C1=CC=CC(C)=C1N M12386 [0,2,0,0,0,0|1,0,0]=3 890 B12R1.24 COC(=O)C1=CC=CC(Cl)=C1N M8428 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.24 COC(=O)C1=CC=CC(Cl)=C1N M8428 [0,2,0,0,0,0|1,0,0]=3 892 B12R1.24 COC(=O)C1=CC=CC(N)=C1C M1396 [0,2,0,0,0,0|1,0,0]=3 893 B12R1.24 COC(=O)C1=CC=CC(N)=C1C M1396 [0,2,0,0,0,0|1,0,0]=3 894 B12R1.24 COC(=O)C1=CC=CC(N)=C1N D12472 [0,2,0,0,0,0|1,0,0]=3 895 B12R1.24 N#CC(=O)C1=CC=CC(Cl)=C1Cl D3483 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.24 N\C(=N/O)C1=C(Cl)C(Cl)=CC=C1 D9235 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.354 CCC(=O)C1=CC(Br)=CC=C1O B10262 [0,2,0,0,0,0|2,0,0]=4 898 B12R1.354 CCC(=O)C1=CC(C)=CC=C1O H7641 [0,2,0,0,0,0|2,0,0]=4 899 B12R1.354 COC(=O)C1=C(N)C=CC(Br)=C1 M10298 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.354 COC(=O)C1=C(N)C=CC(Cl)=C1 M5449 [0,2,0,0,0,0|1,0,0]=3 901 B12R1.354 COC(=O)C1=C(N)C=CC(F)=C1 M7802 [0,2,0,0,0,0|1,0,0]=3 902 B12R1.354 COC(=O)C1=C(O)C=CC(C)=C1 M7708 [0,2,0,0,0,0|1,0,0]=3 903 B12R1.354 COC(=O)C1=C(O)C=CC(N)=C1 M12778 [0,2,0,0,0,0|1,0,0]=3 904 B12R1.354 COC(=O)C1=CC(N)=CC=C1C M12387 [0,2,0,0,0,0|1,0,0]=3 905 B12R1.354 COC(=O)C1=CC(O)=CC=C1O M1340 [0,2,0,0,0,0|0,0,0]=2 906 B12R1.354 O=C(CBr)C1=CC(F)=CC=C1O B10427 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.354 O=C(CCl)C1=CC(F)=CC=C1F C2684 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.358 CCC(=O)C1=CC(F)=CC(F)=C1 D7825 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.358 NNC(=O)C1=CC(Cl)=CC(Cl)=C1 D4415 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.435 COC(=O)C1=CC(CO)=CC=C1 H14918 [0,2,0,0,0,0|0,0,0]=2 911 B12R1.435 COC(=O)C1=CC=CC(CBr)=N1 B3505 [0,2,0,0,0,0|2,0,0]=4 912 B12R1.435 COC(=O)C1=CC=CC(CO)=N1 M5930 [0,2,0,0,0,0|1,0,0]=3 913 B12R1.435 COC(=O)C1=NC=CC(OC)=C1 M13878 [0,2,0,0,0,0|1,0,0]=3 914 B12R1.435 COC1=CC(\C(N)=N/O)=CC=C1 H13792 [0,2,0,0,0,0|1,0,0]=3 915 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 M10259 [0,2,0,0,0,0|1,0,0]=3 916 B12R1.435 N#CC1=CC=CC(C(=O)C=O)=C1 O15097 [0,2,0,0,0,0|1,0,1]=4 917 B12R1.435 N#CC1=CC=CC(C(=O)CBr)=C1 B10063 [0,2,0,0,0,0|2,0,0]=4 918 B12R1.11 COC1=CC(C(=O)O)=CC(C)=C1 M19335 [0,2,0,0,0,0|0,0,0]=2 919 B12R1.11 COC1=CC(N)=CC(C(=O)O)=C1 A18147 [0,2,0,0,0,0|0,0,0]=2 920 B12R1.11 COC1=NC(Cl)=CC(C(=O)Cl)=C1 C9263 [0,2,0,0,0,0|2,0,0]=4 921 B12R1.511 CC(=O)C1=C(F)C(Cl)=CC(Cl)=C1 D3854 [0,2,0,0,0,0|2,0,0]=4 922 B12R1.511 CC(=O)C1=CC(C)=CC(C)=C1O D7643 [0,2,0,0,0,0|2,0,0]=4 923 B12R1.511 CC(=O)C1=CC(C)=CC(N)=C1O A7674 [0,2,0,0,0,0|2,0,0]=4 924 B12R1.511 CC(=O)C1=CC(Cl)=CC(Cl)=C1O D9232 [0,2,0,0,0,0|2,0,0]=4 925 B12R1.511 CC1=C(N)C(C(=O)O)=CC(Cl)=C1 B6769 [0,2,0,0,0,0|1,0,0]=3 926 B12R1.511 CC1=C(O)C(C(=O)O)=CC(Br)=C1 B10334 [0,2,0,0,0,0|1,0,0]=3 927 B12R1.511 CC1=CC(C)=C(N)C(C(=O)O)=C1 A6758 [0,2,0,0,0,0|1,0,0]=3 928 B12R1.511 NC1=C(C(=O)O)C=C(Br)C=C1Br A1128 [0,2,0,0,0,0|1,0,0]=3 929 B12R1.511 NC1=C(Cl)C=C(Cl)C=C1C(=O)O A0586 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.511 O=C(Cl)C1=CC(F)=CC(F)=C1F T4276 [0,2,0,0,0,0|2,0,0]=4 931 B12R1.511 O=C(Cl)C1=CC(I)=CC(I)=C1O D3393 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.511 O=C(O)C1=C(O)C(Cl)=CC(Cl)=C1 D1382 [0,2,0,0,0,0|1,0,0]=3 933 B12R1.511 O=C(O)C1=C(O)C(I)=CC(I)=C1 D0675 [0,2,0,0,0,0|1,0,0]=3 934 B12R1.511 O=C(O)C1=CC(F)=CC(F)=C1F T4250 [0,2,0,0,0,0|1,0,0]=3 935 B12R1.511 O=C(O)C1=CC(F)=CC(F)=C1O D14795 [0,2,0,0,0,0|1,0,0]=3 936 B12R1.511 O=C(O)C1=CC(I)=CC(I)=C1I T4258 [0,2,0,0,0,0|1,0,0]=3 937 B12R1.128 NC1=CC=C(N)C(S(=O)(=O)O)=C1 D11290 [0,2,0,0,0,0|2,0,0]=4 938 B12R1.128 O=S(=O)(O)C1=CC(O)=CC=C1O E19011 [0,2,0,0,0,0|1,0,0]=3 939 B12R1.128 O=S(=O)(O)C1=CC(O)=CC=C1O E19011 [0,2,0,0,0,0|1,0,0]=3 940 B12R1.440 COC1=C(C)C(C(=O)O)=CC=C1 M7712 [0,2,0,0,0,0|0,0,0]=2 941 B12R1.440 COC1=C(N)C(C(=O)O)=CC=C1 A12072 [0,2,0,0,0,0|0,0,0]=2 942 B12R1.440 COC1=CC=CC(C(=O)O)=C1O H1464 [0,2,0,0,0,0|0,0,0]=2 943 B12R1.440 COC1=CC=CC(C(=O)O)=C1O H1464 [0,2,0,0,0,0|0,0,0]=2 944 B12R1.440 NC1=C(C=O)C=CC=C1C(=O)O A18528 [0,2,0,0,0,0|0,0,1]=3 945 B12R1.440 O=C(O)C1=C(F)C(CO)=CC=C1 F14811 [0,2,0,0,0,0|0,0,0]=2 946 B12R1.440 O=C(O)C1=CC=CC(CF)=C1Cl C8543 [0,2,0,0,0,0|1,0,0]=3 947 B12R1.894 CC(=O)C1=C(Cl)C(F)=CC=C1Cl D3195 [0,2,0,0,0,0|2,0,0]=4 948 B12R1.894 CC(=O)C1=C(F)C(Cl)=CC=C1F C8621 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.894 CC1=CC=C(Cl)C(C(=O)Cl)=C1F C9311 [0,2,0,0,0,0|2,0,0]=4 950 B12R1.894 CC1=CC=C(Cl)C(C(=O)O)=C1F C8541 [0,2,0,0,0,0|1,0,0]=3 951 B12R1.894 CC1=CC=C(F)C(C(=O)Cl)=C1Cl C9310 [0,2,0,0,0,0|2,0,0]=4 952 B12R1.894 CC1=CC=C(F)C(C(=O)Cl)=C1F D8622 [0,2,0,0,0,0|2,0,0]=4 953 B12R1.894 O=C(Cl)C1=C(Cl)C(F)=CC=C1F C9480 [0,2,0,0,0,0|2,0,0]=4 954 B12R1.894 O=C(Cl)C1=C(F)C=CC(F)=C1F T4277 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.894 O=C(O)C1=C(Cl)C(F)=CC=C1Cl D4252 [0,2,0,0,0,0|1,0,0]=3 956 B12R1.894 O=C(O)C1=C(Cl)C(F)=CC=C1F C8709 [0,2,0,0,0,0|1,0,0]=3 957 B12R1.894 O=C(O)C1=C(F)C(Cl)=CC=C1F C8707 [0,2,0,0,0,0|1,0,0]=3 958 B12R1.894 O=C(O)C1=C(F)C=CC(F)=C1F T1003 [0,2,0,0,0,0|1,0,0]=3 959 B12R1.894 O=[N+]([O-])C1=C(Cl)C(O)=CC=C1Cl P6952 [0,2,0,0,0,0|1,0,1]=4 960 B12R1.46 COC1=C(C(=O)Cl)C=C(Cl)C=C1 C9233 [0,2,0,0,0,0|2,0,0]=4 961 B12R1.46 COC1=C(C(=O)O)C=C(Cl)C=C1 C5341 [0,2,0,0,0,0|1,0,0]=3 962 B12R1.46 COC1=C(C(C)=O)C=C(Br)C=C1 B10268 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.46 COC1=C(C(C)=O)C=C(Cl)C=C1 C16138 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.46 COC1=CC=C(C)C=C1C(=O)O M2853 [0,2,0,0,0,0|1,0,0]=3 965 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=C1 C8461 [0,2,0,0,0,0|0,0,0]=2 966 B12R1.453 COC1=CC=C(Br)C(C(=O)O)=C1 B11505 [0,2,0,0,0,0|0,0,0]=2 967 B12R1.453 COC1=CC=C(N)C(C(=O)O)=C1 A3781 [0,2,0,0,0,0|0,0,0]=2 968 B12R1.453 NCC1=CC=C(O)C(C(=O)O)=C1 A15459 [0,2,0,0,0,0|1,0,0]=3 969 B12R1.453 O=C(O)C1=CC(CO)=CC=C1F F14810 [0,2,0,0,0,0|0,0,0]=2 970 B12R1.453 O=[N+]([O-])C1=C(O)C=CC(CO)=C1 H7797 [0,2,0,0,0,0|1,0,1]=4 971 B12R1.258 CC(=O)C1=CC=CC([N+](=O)[O-])=C1 N11368 [0,2,0,0,0,0|1,0,1]=4 972 B12R1.258 CN(C)C1=CC=CC(C(=O)O)=C1 D0170 [0,2,0,0,0,0|1,0,0]=3 973 B12R1.258 CN(C)C1=CC=CC(C(N)=O)=C1 D7649 [0,2,0,0,0,0|2,0,0]=4 974 B12R1.258 N=C(N)C1=CC(C(=O)O)=CC=C1 A13140 [0,2,0,0,0,0|1,0,0]=3 975 B12R1.258 NC(=O)C1=CC(B(O)O)=CC=C1 A18151 [0,2,0,0,0,0|1,0,0]=3 976 B12R1.258 NC(=O)C1=CC([N+](=O)[O-])=CC=C1 N18870 [0,2,0,0,0,0|1,0,1]=4 977 B12R1.258 O=C(O)C1=CC(B(O)O)=CC=C1 C3820 [0,2,0,0,0,0|0,0,0]=2 978 B12R1.258 O=C(O)C1=CC(C(=O)O)=NC=C1 P2442 [0,2,0,0,0,0|1,0,0]=3 979 B12R1.258 O=C(O)C1=CC=CC(C(=O)O)=N1 P0292 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.258 O=C(O)C1=CN=CC(C(=O)O)=C1 P7738 [0,2,0,0,0,0|1,0,0]=3 981 B12R1.258 O=C(O)C1=CN=CC([N+](=O)[O-])=C1 N7759 [0,2,0,0,0,0|1,0,1]=4 982 B12R1.258 O=[N+]([O-])C1=CC(B(O)O)=CC=C1 N5386 [0,2,0,0,0,0|1,0,1]=4 983 B12R1.279 CCOC1=CC=CC(B(O)O)=C1 E3977 [0,2,0,0,0,0|1,0,1]=4 984 B12R1.279 O=C(O)C1=CC=CC(N=C=S)=C1 C8169 [0,2,0,0,0,0|0,1,0]=3 985 B10R1.23 O=C(O)C(=O)C1=CC=CS1 T7418 [0,0,1,1,0,0|1,1,0]=4 986 B10R1.66 O=C(O)\C=C\C1=NC=CN1 I14893 [0,0,1,1,0,0|2,0,0]=4 987 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 P4799 [1,0,0,1,0,0|1,0,1]=4 988 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 P4800 [1,0,0,1,0,0|1,0,1]=4 989 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 P4800 [1,0,0,1,0,0|1,0,1]=4 990 B12R2.202 CC1=CC2=C(O)C=CC=C2N1 H17969 [0,0,0,1,0,1|2,0,0]=4 991 B12R2.202 CC1=CC=CC2=C1CC(=O)N2 M19383 [0,0,0,1,0,1|2,0,0]=4 992 B12R2.202 NC1=NC2=C(C=CC=C2O)S1 A7725 [0,0,0,1,0,1|2,0,0]=4 993 B12R2.202 O=C1CC2=C(Cl)C=CC=C2N1 C12293 [0,0,0,1,0,1|2,0,0]=4 994 B12R2.202 O=C1CC2=C(F)C=CC=C2N1 F12294 [0,0,0,1,0,1|2,0,0]=4 995 B12R2.202 O=C1CC2=C(O)C=CC=C2N1 H3671 [0,0,0,1,0,1|1,0,0]=3 996 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 F11057 [0,0,0,1,0,1|2,0,0]=4 997 B12R2.202 O=C1NC2=C(C=CC=C2Cl)S1 H1623 [0,0,0,1,0,1|2,0,0]=4 998 B12R2.606 CC1=CC2=C(C=CC(O)=C2)N1 M14933 [0,0,0,1,0,1|2,0,0]=4 999 B12R2.606 CC1=CC=C2OC(C)=NC2=C1 D11741 [0,0,0,1,0,1|2,0,0]=4 1000 B12R2.606 CC1=NC2=C(C=CC(Cl)=C2)O1 C3840 [0,0,0,1,0,1|2,0,0]=4 1001 B12R2.606 ClC1=CC=C2OC(Cl)=NC2=C1 C17875 [0,0,0,1,0,1|2,0,0]=4 1002 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 A0178 [0,0,0,1,0,1|2,0,0]=4 1003 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 A0178 [0,0,0,1,0,1|2,0,0]=4 1004 B12R2.606 NC1=CC=C2NC(=O)OC2=C1 A5322 [0,0,0,1,0,1|2,0,0]=4 1005 B12R2.606 NC1=NC2=CC=C(O)C=C2S1 A13418 [0,0,0,1,0,1|2,0,0]=4 1006 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)N1 B9528 [0,0,0,1,0,1|2,0,0]=4 1007 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 C7755 [0,0,0,1,0,1|2,0,0]=4 1008 B12R2.606 O=C1CC2=C(C=CC(O)=C2)N1 H14834 [0,0,0,1,0,1|1,0,0]=3 1009 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 B4472 [0,0,0,1,0,1|2,0,0]=4 1010 B12R2.606 O=C1CC2=CC(Br)=CC=C2N1 B4472 [0,0,0,1,0,1|2,0,0]=4 1011 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 F4471 [0,0,0,1,0,1|2,0,0]=4 1012 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 F4471 [0,0,0,1,0,1|2,0,0]=4 1013 B12R2.606 O=C1CC2=CC=C(F)C=C2N1 F11056 [0,0,0,1,0,1|2,0,0]=4 1014 B12R2.606 O=C1CC2=CC=C(O)C=C2N1 H14906 [0,0,0,1,0,1|1,0,0]=3 1015 B12R2.606 O=C1NC2=CC(Cl)=CC=C2O1 C1739 [0,0,0,1,0,1|1,0,0]=3 1016 B12R2.606 O=C1NC2=CC(Cl)=CC=C2S1 C5390 [0,0,0,1,0,1|1,1,0]=4 1017 B12R2.606 O=C1NC2=CC=C(Cl)C=C2O1 C1063 [0,0,0,1,0,1|2,0,0]=4 1018 B12R2.606 O=C1NC2=CC=C(Cl)C=C2O1 C1063 [0,0,0,1,0,1|2,0,0]=4 1019 B12R2.606 OC1=NC2=C(C=CC(Cl)=C2)N1 C15657 [0,0,0,1,0,1|2,0,0]=4 1020 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 B13710 [0,1,0,1,0,0|2,0,0]=4 1021 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 C17004 [0,1,0,1,0,0|2,0,0]=4 1022 B12R2.132 O=C1CCC2=CC=C(F)C=C12 F14034 [0,1,0,1,0,0|2,0,0]=4 1023 B12R2.132 O=C1NCC2=CC=C(Br)C=C12 B19421 [0,1,0,1,0,0|2,0,0]=4 1024 B12R2.196 O=C1CCC2=C1C=CC=C2Br B9482 [0,1,0,1,0,0|2,0,0]=4 1025 B8R1.1 C(=O)C1=CC(Br)=CS1 B0240 [1,0,0,0,1,0|2,0,0]=4 1026 B8R1.1 C(=O)C1=CC=C(C)S1 M5366 [1,0,0,0,1,0|2,0,0]=4 1027 B8R1.1 O=CC1=CC(Br)=CO1 B8008 [1,0,0,0,1,0|2,0,0]=4 1028 B8R1.1 O=CC1=CC=C(Br)O1 B8007 [1,0,0,0,1,0|2,0,0]=4 1029 B8R1.1 O=CC1=CC=C(I)O1 I9961 [1,0,0,0,1,0|2,0,0]=4 1030 B8R1.11 C(=O)C1=C(C)C=CS1 M0714 [1,0,0,0,1,0|2,0,0]=4 1031 B8R1.11 O=CC1=C(Br)C=CS1 B8637 [1,0,0,0,1,0|2,0,0]=4 1032 B8R1.7 CC(=O)C1=CC=CN1 A0582 [1,0,0,0,1,0|2,0,0]=4 1033 B8R1.7 CC(=O)C1=CC=CO1 A1473 [1,0,0,0,1,0|2,0,0]=4 1034 B8R1.7 CC(=O)C1=CC=CS1 A0583 [1,0,0,0,1,0|2,0,0]=4 1035 B8R1.7 CC(=O)C1=CNC=C1 P7297 [1,0,0,0,1,0|2,0,0]=4 1036 B8R1.7 O=C(O)C1=CC=CS1 T4980 [1,0,0,0,1,0|1,0,0]=3 1037 B8R1.7 O=C(O)C1=CC=CS1 T4980 [1,0,0,0,1,0|1,0,0]=3 1038 B8R1.7 O=C(O)C1=CN=CS1 T17631 [1,0,0,0,1,0|2,0,0]=4 1039 B8R1.7 O=C(O)C1=CNC=C1 P7298 [1,0,0,0,1,0|1,0,0]=3 1040 B8R1.7 O=C(O)C1=CNC=C1 P7298 [1,0,0,0,1,0|1,0,0]=3 1041 B8R1.7 O=C(O)C1=CNC=N1 I11557 [1,0,0,0,1,0|2,0,0]=4 1042 B8R1.7 O=C(O)C1=CSC=N1 T11462 [1,0,0,0,1,0|2,0,0]=4 1043 B8R1.7 O=C(O)C1=NNC=C1 P4441 [1,0,0,0,1,0|2,0,0]=4 1044 B10R1.18 CC(=O)NC1=NC=CC=C1 A14929 [1,0,0,0,0,1|2,0,0]=4 1045 B10R1.18 N=C(N)CC1=CC=CC=C1 P13924 [1,0,0,0,0,1|2,0,0]=4 1046 B10R1.18 N=C(N)NC1=CC=CC=C1 P8891 [1,0,0,0,0,1|2,0,0]=4 1047 B10R1.18 N=C(N)SC1=CC=CC=C1 P13914 [1,0,0,0,0,1|2,0,0]=4 1048 B10R1.18 NC(=O)C[N+]1=CC=CC=C1 C7929 [1,0,0,0,0,1|2,0,0]=4 1049 B10R1.18 NC(N)=NC1=CC=CC=C1 D8941 [1,0,0,0,0,1|2,0,0]=4 1050 B10R1.18 O=C(O)CC1=CC=CN=C1 P3052 [1,0,0,0,0,1|1,0,0]=3 1051 B10R1.18 O=C(O)CC1=CC=NC=C1 P7971 [1,0,0,0,0,1|1,0,0]=3 1052 B10R1.18 O=C(O)CC1=NC=CC=C1 P7970 [1,0,0,0,0,1|1,0,0]=3 1053 B10R1.18 O=C(O)CC1=NC=CC=N1 P14936 [1,0,0,0,0,1|2,0,0]=4 1054 B12R1.226 NC1=CC(CCC(=O)O)=CC=C1 A1801 [0,0,0,0,0,2|1,0,0]=3 1055 B12R1.226 NC1=NC(CCC(=O)O)=CC=C1 A14728 [0,0,0,0,0,2|2,0,0]=4 1056 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 H7709 [0,0,0,0,0,2|0,0,0]=2 1057 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 B10265 [0,0,0,0,0,2|1,0,0]=3 1058 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 F2687 [0,0,0,0,0,2|1,0,0]=3 1059 B12R1.226 O=C(O)COC1=CC(Cl)=CC=C1 C17836 [0,0,0,0,0,2|1,0,0]=3 1060 B12R1.226 O=C(O)COC1=CC(F)=CC=C1 F17844 [0,0,0,0,0,2|1,0,0]=3 1061 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 C8303 [0,0,0,0,0,2|1,0,0]=3 1062 B12R1.226 O=C(O)\C=C\C1=CC=CC(Br)=C1 B3797 [0,0,0,0,0,2|1,0,0]=3 1063 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 F0985 [0,0,0,0,0,2|1,0,0]=3 1064 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 H4009 [0,0,0,0,0,2|0,0,0]=2