0 B10R1.10 BrCCC1=CC=CC(Br)=C1 B23535 [0,0,0,0,0,0|1,1,0]=2 1 B10R1.10 CC1=CC=CC(CC#N)=C1 M67706 [0,0,0,0,0,0|1,0,2]=3 2 B10R1.10 CC1=CC=CC(CCCl)=C1 C49969 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.10 CC1=NC=CC(CC#N)=C1 M29959 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.10 CCNC1=NC=CC(N)=C1 A43751 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.10 CCOC1=CC(Br)=CN=C1 B46155 [0,0,0,0,0,0|3,1,0]=4 6 B10R1.10 CCOC1=CC(Br)=NC=C1 B21763 [0,0,0,0,0,0|3,1,0]=4 7 B10R1.10 CCOC1=CC(Cl)=NC=C1 C46183 [0,0,0,0,0,0|3,1,0]=4 8 B10R1.10 CCOC1=CC(F)=NC=C1 E46208 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.10 CCOC1=CC(N)=CC=C1 E64076 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.10 CCOC1=CC(N)=NC=C1 A43626 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.10 CCOC1=CC=CC(Br)=C1 B49423 [0,0,0,0,0,0|2,1,0]=3 12 B10R1.10 CCOC1=CC=CC(F)=C1 E49455 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.10 CCOC1=CC=CC([Mg+])=C1 E31766 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.10 CCOC1=CN=CC(N)=C1 E36780 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.10 CCOC1=NC=CC(Br)=C1 B24368 [0,0,0,0,0,0|3,1,0]=4 16 B10R1.10 CCOC1=NC=CC(N)=C1 A43627 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.10 CCSC1=CC=CC(Br)=C1 B3190 [0,0,0,0,0,0|2,1,0]=3 18 B10R1.10 CNCC1=CC(Br)=CN=C1 B46290 [0,0,0,0,0,0|3,1,0]=4 19 B10R1.10 CNCC1=CC(C)=CC=C1 M50313 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.10 CNCC1=CC(N)=CC=C1 M46965 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.10 CNCC1=CC=CC(Cl)=C1 C46754 [0,0,0,0,0,0|2,1,0]=3 22 B10R1.10 CNCC1=NC=CC(Cl)=C1 C46305 [0,0,0,0,0,0|3,1,0]=4 23 B10R1.10 ClC1=CC=CC(CCBr)=C1 C48759 [0,0,0,0,0,0|1,1,0]=2 24 B10R1.10 N#CCC1=CC(Br)=CN=C1 B10466 [0,0,0,0,0,0|1,1,2]=4 25 B10R1.10 N#CCC1=CC(F)=CN=C1 F12036 [0,0,0,0,0,0|1,0,2]=3 26 B10R1.10 N#CCC1=CC(N)=CC=C1 A48787 [0,0,0,0,0,0|1,0,2]=3 27 B10R1.10 N#CCC1=CC=CC(Br)=C1 B23025 [0,0,0,0,0,0|0,1,2]=3 28 B10R1.10 N#CCC1=CC=CC(Cl)=C1 C69079 [0,0,0,0,0,0|0,1,2]=3 29 B10R1.10 N#CCC1=CC=CC(F)=C1 F39467 [0,0,0,0,0,0|0,0,2]=2 30 B10R1.10 N#CCC1=CC=CC(O)=C1 H48451 [0,0,0,0,0,0|1,0,2]=3 31 B10R1.10 N#CCC1=NC=CC(F)=C1 F44801 [0,0,0,0,0,0|1,0,2]=3 32 B10R1.10 NCCC1=CC(=O)NC=C1 A46457 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.10 NCCC1=CC=CC(Br)=C1 B46722 [0,0,0,0,0,0|0,1,0]=1 34 B10R1.10 NCCC1=CC=CC(Br)=C1 B68552 [0,0,0,0,0,0|0,1,0]=1 35 B10R1.10 NCCC1=CC=CC(Cl)=C1 C10742 [0,0,0,0,0,0|0,1,0]=1 36 B10R1.10 NCCC1=CC=CC(F)=C1 F38570 [0,0,0,0,0,0|0,0,0]=0 37 B10R1.10 NCCC1=CC=CC(F)=C1 F46762 [0,0,0,0,0,0|0,0,0]=0 38 B10R1.10 NCCC1=CC=CC(O)=C1 A49522 [0,0,0,0,0,0|1,0,0]=1 39 B10R1.10 NNCC1=CC(Br)=CN=C1 B12725 [0,0,0,0,0,0|2,1,0]=3 40 B10R1.10 NNCC1=CC=CC(Br)=C1 B12216 [0,0,0,0,0,0|1,1,0]=2 41 B10R1.10 NNCC1=CC=CC(Cl)=C1 C12217 [0,0,0,0,0,0|1,1,0]=2 42 B10R1.10 NNCC1=CC=CC(Cl)=C1 C46306 [0,0,0,0,0,0|1,1,0]=2 43 B10R1.10 NNCC1=CC=CC(F)=C1 F0091 [0,0,0,0,0,0|1,0,0]=1 44 B10R1.10 NNCC1=CC=CC(F)=C1 F10204 [0,0,0,0,0,0|1,0,0]=1 45 B10R1.10 OCCC1=CC=CC(Br)=C1 B22812 [0,0,0,0,0,0|1,1,0]=2 46 B10R1.10 OCCC1=CC=CC(Br)=N1 B46160 [0,0,0,0,0,0|2,1,0]=3 47 B10R1.10 OCCC1=CC=CC(Cl)=C1 C49444 [0,0,0,0,0,0|1,1,0]=2 48 B10R1.10 OCCC1=CC=CC(F)=C1 F49458 [0,0,0,0,0,0|1,0,0]=1 49 B9R1.2 BrCC1=CC(Br)=NC=C1 B36914 [1,0,0,0,0,0|2,1,0]=4 50 B9R1.2 BrCC1=CC(Br)=NC=C1 B42520 [1,0,0,0,0,0|2,1,0]=4 51 B9R1.2 BrCC1=CC=CC(Br)=C1 B39369 [1,0,0,0,0,0|1,1,0]=3 52 B9R1.2 BrCC1=CC=CC(Br)=N1 B42519 [1,0,0,0,0,0|2,1,0]=4 53 B9R1.2 BrCC1=CC=CC(I)=C1 B45170 [1,0,0,0,0,0|1,1,0]=3 54 B9R1.2 C#CC1=CC(C)=CC=C1 E51331 [1,0,0,0,0,0|1,0,2]=4 55 B9R1.2 C#CC1=CC=CC(Br)=C1 B47527 [1,0,0,0,0,0|0,1,2]=4 56 B9R1.2 C#CC1=CC=CC(Cl)=C1 C25303 [1,0,0,0,0,0|0,1,2]=4 57 B9R1.2 C#CC1=CC=CC(F)=C1 F47538 [1,0,0,0,0,0|0,0,2]=3 58 B9R1.2 C#CC1=CC=CC(F)=N1 E32331 [1,0,0,0,0,0|1,0,2]=4 59 B9R1.2 C#CC1=CC=CC(N)=C1 E48307 [1,0,0,0,0,0|1,0,2]=4 60 B9R1.2 C#CC1=CC=CC(N)=C1 E49598 [1,0,0,0,0,0|1,0,2]=4 61 B9R1.2 C#CC1=CC=CC(O)=C1 E37627 [1,0,0,0,0,0|1,0,2]=4 62 B9R1.2 C=CC1=CC(F)=CN=C1 E16704 [1,0,0,0,0,0|1,0,2]=4 63 B9R1.2 C=CC1=CC=CC(Br)=C1 B36635 [1,0,0,0,0,0|0,1,2]=4 64 B9R1.2 C=CC1=CC=CC(N)=C1 V49171 [1,0,0,0,0,0|1,0,2]=4 65 B9R1.2 CC1=CC(CCl)=CN=C1 C46109 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.2 CC1=CC(CCl)=NC=C1 C46106 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.2 CC1=CC(CN)=NC=C1 A62602 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.2 CC1=CC(CN)=NC=C1 M46587 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.2 CC1=CC(CO)=CN=C1 H10516 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.2 CC1=CC(CO)=NC=C1 M46387 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 CC1=CC=CC(CBr)=N1 B46087 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.2 CC1=CC=CC(CCl)=N1 C46103 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.2 CC1=CC=CC(CN)=C1 M37355 [1,0,0,0,0,0|1,0,0]=2 74 B9R1.2 CC1=CC=CC(CN)=N1 M24786 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.2 CC1=CC=CC(CN)=N1 M63579 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.2 CC1=CC=CC(CO)=N1 M46384 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.2 CC1=CC=CC(NN)=C1 M46458 [1,0,0,0,0,0|2,0,0]=3 78 B9R1.2 CC1=CC=CC(NN)=N1 H69493 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.2 CC1=CC=NC(CN)=N1 A14426 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.2 CC1=CC=NC(CN)=N1 M29730 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.2 CC1=CN=NC(CN)=C1 A13026 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.2 CC1=CN=NC(CN)=C1 M27097 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.2 CC1=NC=CC(CBr)=C1 B37231 [1,0,0,0,0,0|3,0,0]=4 84 B9R1.2 CC1=NC=CC(CN)=C1 M46586 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.2 CC1=NC=CC(CO)=C1 M4019 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.2 CCC1=CC(=O)NC=N1 E43198 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.2 CCC1=CC(=O)NN=C1 E43197 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.2 CCC1=CC(Br)=CN=C1 B46076 [1,0,0,0,0,0|1,1,0]=3 89 B9R1.2 CCC1=CC(Cl)=NC=N1 C69336 [1,0,0,0,0,0|2,1,0]=4 90 B9R1.2 CCC1=CC(N)=NC=C1 E4696 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.2 CCC1=CC=CC(Br)=C1 B49158 [1,0,0,0,0,0|0,1,0]=2 92 B9R1.2 CCC1=CC=CC(Br)=N1 B46074 [1,0,0,0,0,0|1,1,0]=3 93 B9R1.2 CCC1=CC=CC(N)=C1 E68361 [1,0,0,0,0,0|1,0,0]=2 94 B9R1.2 CCC1=CC=CC(N)=N1 E43601 [1,0,0,0,0,0|2,0,0]=3 95 B9R1.2 CCC1=CC=CC([Mg+])=C1 E31740 [1,0,0,0,0,0|1,0,0]=2 96 B9R1.2 CCC1=CN=CC(N)=C1 E37485 [1,0,0,0,0,0|2,0,0]=3 97 B9R1.2 CCC1=NC=CC(Br)=C1 B46078 [1,0,0,0,0,0|1,1,0]=3 98 B9R1.2 CCC1=NC=CC(Cl)=N1 C29661 [1,0,0,0,0,0|2,1,0]=4 99 B9R1.2 CCC1=NC=CC(N)=C1 A15478 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.2 CNC1=CC(Br)=NC=C1 B25633 [1,0,0,0,0,0|2,1,0]=4 101 B9R1.2 CNC1=CC(C)=CC=C1 D46861 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.2 CNC1=CC=CC(Br)=C1 B46077 [1,0,0,0,0,0|1,1,0]=3 103 B9R1.2 CNC1=CC=CC(Br)=C1 B66504 [1,0,0,0,0,0|1,1,0]=3 104 B9R1.2 CNC1=CC=CC(Cl)=N1 C43001 [1,0,0,0,0,0|2,1,0]=4 105 B9R1.2 CNC1=NC(C)=CC=C1 D43615 [1,0,0,0,0,0|3,0,0]=4 106 B9R1.2 CNC1=NC=CC(Br)=C1 B23788 [1,0,0,0,0,0|2,1,0]=4 107 B9R1.2 CNC1=NC=CC(N)=C1 M43544 [1,0,0,0,0,0|3,0,0]=4 108 B9R1.2 COC1=CC(=O)NC=C1 M43139 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.2 COC1=CC(Br)=CN=C1 B2876 [1,0,0,0,0,0|2,1,0]=4 110 B9R1.2 COC1=CC(Br)=NC=C1 B9053 [1,0,0,0,0,0|2,1,0]=4 111 B9R1.2 COC1=CC(C)=NC=C1 M22575 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.2 COC1=CC(Cl)=NC=C1 C5269 [1,0,0,0,0,0|2,1,0]=4 113 B9R1.2 COC1=CC(F)=NC=C1 F21874 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.2 COC1=CC(N)=NC=C1 A43189 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.2 COC1=CC(O)=CC=C1 M27960 [1,0,0,0,0,0|2,0,0]=3 116 B9R1.2 COC1=CC=CC(Br)=N1 B2785 [1,0,0,0,0,0|2,1,0]=4 117 B9R1.2 COC1=CC=CC(Cl)=N1 C39269 [1,0,0,0,0,0|2,1,0]=4 118 B9R1.2 COC1=CC=CC(F)=C1 F45965 [1,0,0,0,0,0|1,0,0]=2 119 B9R1.2 COC1=CC=CC(F)=N1 F67375 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.2 COC1=CC=CC(I)=C1 K45966 [1,0,0,0,0,0|1,1,0]=3 121 B9R1.2 COC1=CC=CC(I)=N1 K42932 [1,0,0,0,0,0|2,1,0]=4 122 B9R1.2 COC1=CC=CC([Mg+])=C1 M31743 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.2 COC1=CN=CC(N)=C1 A14114 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.2 COC1=CN=CC(N)=C1 A7930 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.2 COC1=CN=CC(O)=C1 M43136 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.2 COC1=NC(C)=CC=C1 M46380 [1,0,0,0,0,0|3,0,0]=4 127 B9R1.2 COC1=NC(N)=CC=C1 A43190 [1,0,0,0,0,0|3,0,0]=4 128 B9R1.2 COC1=NC=CC(Br)=C1 B3113 [1,0,0,0,0,0|2,1,0]=4 129 B9R1.2 COC1=NC=CC(C)=C1 M46379 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.2 COC1=NC=CC(Cl)=C1 C42902 [1,0,0,0,0,0|2,1,0]=4 131 B9R1.2 COC1=NC=CC(F)=C1 F42927 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.2 COC1=NC=CC(I)=C1 K60534 [1,0,0,0,0,0|2,1,0]=4 133 B9R1.2 COC1=NC=CC(N)=C1 M3947 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.2 COC1=NC=CC(O)=C1 M38428 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.2 CSC1=CC(N)=CC=C1 M46442 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.2 CSC1=CC=CC(Br)=C1 B45613 [1,0,0,0,0,0|1,1,0]=3 137 B9R1.2 CSC1=CC=CC(Br)=N1 B2786 [1,0,0,0,0,0|2,1,0]=4 138 B9R1.2 CSC1=NC=CC(Cl)=C1 C42846 [1,0,0,0,0,0|2,1,0]=4 139 B9R1.2 ClC1=CC=CC(CBr)=C1 B39371 [1,0,0,0,0,0|1,1,0]=3 140 B9R1.2 ClC1=NC=CC(CBr)=C1 B42538 [1,0,0,0,0,0|2,1,0]=4 141 B9R1.2 ClCC1=CC(Br)=CN=C1 B15185 [1,0,0,0,0,0|2,1,0]=4 142 B9R1.2 ClCC1=CC(Cl)=CN=C1 C1777 [1,0,0,0,0,0|2,1,0]=4 143 B9R1.2 ClCC1=CC(Cl)=NC=C1 C12077 [1,0,0,0,0,0|2,1,0]=4 144 B9R1.2 ClCC1=CC=CC(Br)=C1 B45159 [1,0,0,0,0,0|1,1,0]=3 145 B9R1.2 ClCC1=CC=CC(Br)=N1 B27809 [1,0,0,0,0,0|2,1,0]=4 146 B9R1.2 ClCC1=CC=CC(Cl)=N1 C42562 [1,0,0,0,0,0|2,1,0]=4 147 B9R1.2 ClCC1=CC=CC(I)=C1 C45183 [1,0,0,0,0,0|1,1,0]=3 148 B9R1.2 ClCC1=NC=CC(Cl)=C1 C32395 [1,0,0,0,0,0|2,1,0]=4 149 B9R1.2 FC1=CC(CBr)=CN=C1 B37165 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.2 FC1=CC(CCl)=CN=C1 C1821 [1,0,0,0,0,0|2,0,0]=3 151 B9R1.2 FC1=CC=CC(CBr)=C1 B45165 [1,0,0,0,0,0|1,0,0]=2 152 B9R1.2 FC1=CC=CC(CBr)=N1 B42547 [1,0,0,0,0,0|2,0,0]=3 153 B9R1.2 FC1=CC=CC(CCl)=N1 C42570 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.2 N#CC1=CC(F)=CN=C1 F41835 [1,0,0,0,0,0|1,0,2]=4 155 B9R1.2 N#CC1=CC(F)=NC=C1 C2804 [1,0,0,0,0,0|1,0,2]=4 156 B9R1.2 N#CC1=CC=CC(Br)=C1 B67572 [1,0,0,0,0,0|0,1,2]=4 157 B9R1.2 N#CC1=CC=CC(Cl)=C1 C39326 [1,0,0,0,0,0|0,1,2]=4 158 B9R1.2 N#CC1=CC=CC(F)=C1 F39329 [1,0,0,0,0,0|0,0,2]=3 159 B9R1.2 N#CC1=CC=CC(F)=N1 F38605 [1,0,0,0,0,0|1,0,2]=4 160 B9R1.2 N#CC1=CC=CC(I)=C1 K44442 [1,0,0,0,0,0|0,1,2]=4 161 B9R1.2 N#CC1=CC=CC(O)=C1 H64947 [1,0,0,0,0,0|1,0,2]=4 162 B9R1.2 NC1=CC(CO)=CN=C1 A43207 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.2 NC1=CC(CO)=NC=C1 A15900 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.2 NC1=CC=CC(C=O)=C1 A46548 [1,0,0,0,0,0|2,0,1]=4 165 B9R1.2 NC1=CC=CC(CO)=C1 A37868 [1,0,0,0,0,0|2,0,0]=3 166 B9R1.2 NC1=CC=CC(CO)=N1 A43208 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.2 NC1=NC=CC(CO)=C1 A10460 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.2 NCC1=CC(=O)N=CN1 A0948 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.2 NCC1=CC(=O)NC=C1 A1717 [1,0,0,0,0,0|2,0,0]=3 170 B9R1.2 NCC1=CC(Br)=NC=C1 B25759 [1,0,0,0,0,0|1,1,0]=3 171 B9R1.2 NCC1=CC(Cl)=NC=C1 A10467 [1,0,0,0,0,0|1,1,0]=3 172 B9R1.2 NCC1=CC(Cl)=NC=C1 C30000 [1,0,0,0,0,0|1,1,0]=3 173 B9R1.2 NCC1=CC(F)=CN=C1 F5829 [1,0,0,0,0,0|1,0,0]=2 174 B9R1.2 NCC1=CC(F)=NC=C1 F43572 [1,0,0,0,0,0|1,0,0]=2 175 B9R1.2 NCC1=CC(F)=NC=C1 F61414 [1,0,0,0,0,0|1,0,0]=2 176 B9R1.2 NCC1=CC(N)=NC=C1 A43343 [1,0,0,0,0,0|2,0,0]=3 177 B9R1.2 NCC1=CC(N)=NC=N1 A0583 [1,0,0,0,0,0|3,0,0]=4 178 B9R1.2 NCC1=CC=CC(Br)=C1 B46079 [1,0,0,0,0,0|0,1,0]=2 179 B9R1.2 NCC1=CC=CC(Br)=N1 B42981 [1,0,0,0,0,0|1,1,0]=3 180 B9R1.2 NCC1=CC=CC(Cl)=C1 C46098 [1,0,0,0,0,0|0,1,0]=2 181 B9R1.2 NCC1=CC=CC(Cl)=N1 C43006 [1,0,0,0,0,0|1,1,0]=3 182 B9R1.2 NCC1=CC=CC(F)=C1 F15968 [1,0,0,0,0,0|0,0,0]=1 183 B9R1.2 NCC1=CC=CC(I)=C1 K46122 [1,0,0,0,0,0|0,1,0]=2 184 B9R1.2 NCC1=CC=CC(N)=C1 A43599 [1,0,0,0,0,0|1,0,0]=2 185 B9R1.2 NCC1=CC=NC(Cl)=N1 C29619 [1,0,0,0,0,0|2,1,0]=4 186 B9R1.2 NCC1=CN=CC(Cl)=N1 C18971 [1,0,0,0,0,0|2,1,0]=4 187 B9R1.2 NCC1=NC=CC(Br)=C1 A1747 [1,0,0,0,0,0|1,1,0]=3 188 B9R1.2 NCC1=NC=CC(Br)=C1 B42982 [1,0,0,0,0,0|1,1,0]=3 189 B9R1.2 NCC1=NC=CC(Cl)=C1 A14281 [1,0,0,0,0,0|1,1,0]=3 190 B9R1.2 NCC1=NC=CC(F)=C1 F43529 [1,0,0,0,0,0|1,0,0]=2 191 B9R1.2 NNC1=CC(=O)NC=C1 H41142 [1,0,0,0,0,0|3,0,0]=4 192 B9R1.2 NNC1=CC(Cl)=NC=C1 C68130 [1,0,0,0,0,0|2,1,0]=4 193 B9R1.2 NNC1=CC=CC(Br)=C1 B42979 [1,0,0,0,0,0|1,1,0]=3 194 B9R1.2 NNC1=CC=CC(Br)=N1 B41059 [1,0,0,0,0,0|2,1,0]=4 195 B9R1.2 NNC1=CC=CC(Cl)=N1 C4990 [1,0,0,0,0,0|2,1,0]=4 196 B9R1.2 NNC1=CC=CC(F)=C1 F43527 [1,0,0,0,0,0|1,0,0]=2 197 B9R1.2 NNC1=NC=CC(Cl)=C1 C41074 [1,0,0,0,0,0|2,1,0]=4 198 B9R1.2 O=C1C=C(CO)C=CN1 H0460 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.2 O=C1C=CC=C(CO)N1 H23237 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.2 O=CC1=CC(F)=CN=C1 F15543 [1,0,0,0,0,0|2,0,1]=4 201 B9R1.2 O=CC1=CC(F)=NC=C1 F2753 [1,0,0,0,0,0|2,0,1]=4 202 B9R1.2 O=CC1=CC(O)=CC=C1 H15969 [1,0,0,0,0,0|2,0,1]=4 203 B9R1.2 O=CC1=CC=CC(Br)=C1 B68146 [1,0,0,0,0,0|1,1,1]=4 204 B9R1.2 O=CC1=CC=CC(Cl)=C1 C69283 [1,0,0,0,0,0|1,1,1]=4 205 B9R1.2 O=CC1=CC=CC(F)=C1 F45149 [1,0,0,0,0,0|1,0,1]=3 206 B9R1.2 O=CC1=CC=CC(F)=N1 F42303 [1,0,0,0,0,0|2,0,1]=4 207 B9R1.2 O=CC1=CC=CC(I)=C1 K45152 [1,0,0,0,0,0|1,1,1]=4 208 B9R1.2 O=CC1=NC=CC(F)=C1 F16335 [1,0,0,0,0,0|2,0,1]=4 209 B9R1.2 OC1=CC=CC(CBr)=C1 B38962 [1,0,0,0,0,0|2,0,0]=3 210 B9R1.2 OCC1=CC(Br)=CN=C1 B12503 [1,0,0,0,0,0|2,1,0]=4 211 B9R1.2 OCC1=CC(Br)=NC=C1 B42880 [1,0,0,0,0,0|2,1,0]=4 212 B9R1.2 OCC1=CC(Cl)=CN=C1 C42912 [1,0,0,0,0,0|2,1,0]=4 213 B9R1.2 OCC1=CC(Cl)=NC=C1 C12733 [1,0,0,0,0,0|2,1,0]=4 214 B9R1.2 OCC1=CC(F)=CN=C1 F0704 [1,0,0,0,0,0|2,0,0]=3 215 B9R1.2 OCC1=CC(O)=CN=C1 H39124 [1,0,0,0,0,0|3,0,0]=4 216 B9R1.2 OCC1=CC=CC(Br)=N1 B12271 [1,0,0,0,0,0|2,1,0]=4 217 B9R1.2 OCC1=CC=CC(Cl)=C1 C39405 [1,0,0,0,0,0|1,1,0]=3 218 B9R1.2 OCC1=CC=CC(Cl)=N1 C38619 [1,0,0,0,0,0|2,1,0]=4 219 B9R1.2 OCC1=CC=CC(Cl)=N1 C42916 [1,0,0,0,0,0|2,1,0]=4 220 B9R1.2 OCC1=CC=CC(F)=C1 F39408 [1,0,0,0,0,0|1,0,0]=2 221 B9R1.2 OCC1=CC=CC(F)=N1 F67771 [1,0,0,0,0,0|2,0,0]=3 222 B9R1.2 OCC1=CC=CC(I)=C1 H61971 [1,0,0,0,0,0|1,1,0]=3 223 B9R1.2 OCC1=NC=CC(Br)=C1 B0602 [1,0,0,0,0,0|2,1,0]=4 224 B9R1.2 OCC1=NC=CC(Cl)=C1 C12436 [1,0,0,0,0,0|2,1,0]=4 225 B9R1.2 OCC1=NC=CC(F)=C1 F37340 [1,0,0,0,0,0|2,0,0]=3 226 B9R1.8 BrCCC1=CC=NC=C1 B46088 [1,0,0,0,0,0|2,0,0]=3 227 B9R1.8 CC#CC1=CC=CC=C1 P68608 [1,0,0,0,0,0|1,0,2]=4 228 B9R1.8 CCCC1=NC=CC=C1 P46859 [1,0,0,0,0,0|2,0,0]=3 229 B9R1.8 CCCC1=NC=CN=C1 P43598 [1,0,0,0,0,0|3,0,0]=4 230 B9R1.8 CCOC1=NC=CC=C1 E46369 [1,0,0,0,0,0|3,0,0]=4 231 B9R1.8 CNCC1=CC=NC=C1 M43623 [1,0,0,0,0,0|3,0,0]=4 232 B9R1.8 CNNC1=CC=CC=C1 M46459 [1,0,0,0,0,0|3,0,0]=4 233 B9R1.8 COCC1=NC=CC=C1 M46377 [1,0,0,0,0,0|3,0,0]=4 234 B9R1.8 C\C=C\C1=CC=CC=C1 P62367 [1,0,0,0,0,0|1,0,2]=4 235 B9R1.8 IC#CC1=CC=CC=C1 I1886 [1,0,0,0,0,0|1,0,2]=4 236 B9R1.8 N#CCC1=CN=CC=C1 P38543 [1,0,0,0,0,0|1,0,2]=4 237 B9R1.8 N#CCC1=NC=CC=C1 P45196 [1,0,0,0,0,0|1,0,2]=4 238 B9R1.8 N#COC1=CC=CC=C1 P44923 [1,0,0,0,0,0|1,0,2]=4 239 B9R1.8 NCCC1=CC=CN=C1 P43605 [1,0,0,0,0,0|1,0,0]=2 240 B9R1.8 NCCC1=NC=CC=C1 P67673 [1,0,0,0,0,0|1,0,0]=2 241 B9R1.8 NCCC1=NC=NC=C1 P14666 [1,0,0,0,0,0|2,0,0]=3 242 B9R1.8 NCCC1=NC=NC=C1 P29961 [1,0,0,0,0,0|2,0,0]=3 243 B9R1.8 NNCC1=CC=CC=C1 B6123 [1,0,0,0,0,0|1,0,0]=2 244 B9R1.8 NNCC1=CC=CC=C1 B68081 [1,0,0,0,0,0|1,0,0]=2 245 B9R1.8 NNCC1=CC=CN=C1 H0097 [1,0,0,0,0,0|2,0,0]=3 246 B9R1.8 NNCC1=CC=CN=C1 H36962 [1,0,0,0,0,0|2,0,0]=3 247 B9R1.8 NNCC1=CC=CN=N1 H13970 [1,0,0,0,0,0|3,0,0]=4 248 B9R1.8 NNCC1=CC=NC=C1 H0096 [1,0,0,0,0,0|2,0,0]=3 249 B9R1.8 NNCC1=CC=NC=C1 H26285 [1,0,0,0,0,0|2,0,0]=3 250 B9R1.8 NNCC1=CN=CN=C1 H0219 [1,0,0,0,0,0|3,0,0]=4 251 B9R1.8 NNCC1=CN=NC=C1 H12257 [1,0,0,0,0,0|3,0,0]=4 252 B9R1.8 NNCC1=NC=CC=C1 H0098 [1,0,0,0,0,0|2,0,0]=3 253 B9R1.8 NNCC1=NC=CC=N1 H7463 [1,0,0,0,0,0|3,0,0]=4 254 B9R1.8 NNCC1=NC=CN=C1 H7534 [1,0,0,0,0,0|3,0,0]=4 255 B9R1.8 NOCC1=CC=CC=C1 B68114 [1,0,0,0,0,0|1,0,0]=2 256 B9R1.8 O=COC1=CC=CC=C1 P45508 [1,0,0,0,0,0|2,0,1]=4 257 B9R1.8 OCCC1=CC=NC=C1 H46381 [1,0,0,0,0,0|2,0,0]=3 258 B9R1.8 OCCC1=CN=CC=C1 P46376 [1,0,0,0,0,0|2,0,0]=3 259 B9R1.8 OCCC1=NC=CN=C1 P24824 [1,0,0,0,0,0|3,0,0]=4 260 B9R1.8 ONCC1=CC=CC=C1 B36744 [1,0,0,0,0,0|2,0,0]=3 261 B9R1.8 ONCC1=CC=CC=C1 B46575 [1,0,0,0,0,0|2,0,0]=3 262 B9R1.8 O\N=C\C1=CC=CC=C1 B61148 [1,0,0,0,0,0|2,0,1]=4 263 B9R1.8 S=C=NC1=CC=CC=C1 T64712 [1,0,0,0,0,0|2,0,1]=4 264 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B66761 [1,0,0,0,0,0|2,0,0]=3 265 B9R1.8 [Mg+]CCC1=CC=CC=C1 P31723 [1,0,0,0,0,0|1,0,0]=2 266 B11R1.13 CC1=C(F)C=CC=C1CC#N F51462 [0,1,0,0,0,0|0,0,2]=3 267 B11R1.13 N#CCC1=CC=CC(Br)=C1F B47670 [0,1,0,0,0,0|0,1,2]=4 268 B11R1.13 N#CCC1=CC=CC(Cl)=C1Cl D47689 [0,1,0,0,0,0|0,1,2]=4 269 B11R1.13 N#CCC1=CC=CC(Cl)=C1F C47693 [0,1,0,0,0,0|0,1,2]=4 270 B11R1.13 N#CCC1=CC=CC(F)=C1F D47707 [0,1,0,0,0,0|0,0,2]=3 271 B11R1.13 OCCC1=CC=CC(Cl)=C1Cl D49145 [0,1,0,0,0,0|1,1,0]=3 272 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 B52023 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 M46653 [0,1,0,0,0,0|2,0,1]=4 274 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 A50349 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.23 CC1=CC=CC([C@H](N)CO)=C1 A50350 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.23 CC1=CC=CC([C@H](N)CO)=C1 A52173 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.23 CCC(=O)C1=CC(O)=CC=C1 H49893 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 F38669 [0,1,0,0,0,0|1,0,1]=3 279 B11R1.23 CC[C@@H](N)C1=CC(C)=CC=C1 T54183 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 F52145 [0,1,0,0,0,0|1,0,0]=2 281 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 B50234 [0,1,0,0,0,0|1,1,0]=3 282 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 F52148 [0,1,0,0,0,0|1,0,0]=2 283 B11R1.23 CN[C@@H](C)C1=CC=CC(Br)=C1 B50236 [0,1,0,0,0,0|2,1,0]=4 284 B11R1.23 COC(=O)C1=CC=CC(F)=C1 M39493 [0,1,0,0,0,0|2,0,1]=4 285 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 B45685 [0,1,0,0,0,0|1,1,1]=4 286 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 C45694 [0,1,0,0,0,0|1,1,1]=4 287 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 A46787 [0,1,0,0,0,0|1,1,0]=3 288 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A46801 [0,1,0,0,0,0|1,1,0]=3 289 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A46803 [0,1,0,0,0,0|1,1,0]=3 290 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A64410 [0,1,0,0,0,0|1,1,0]=3 291 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A66336 [0,1,0,0,0,0|1,1,0]=3 292 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 A49514 [0,1,0,0,0,0|1,0,0]=2 293 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=N1 A46570 [0,1,0,0,0,0|2,0,0]=3 294 B11R1.23 N[C@@H](CO)C1=CC=CC(O)=C1 A49526 [0,1,0,0,0,0|2,0,0]=3 295 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 A46799 [0,1,0,0,0,0|1,1,0]=3 296 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 A46804 [0,1,0,0,0,0|1,1,0]=3 297 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 A46810 [0,1,0,0,0,0|1,1,0]=3 298 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 A46820 [0,1,0,0,0,0|1,0,0]=2 299 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 A49516 [0,1,0,0,0,0|1,0,0]=2 300 B11R1.23 N[C@H](CO)C1=CC=CC(I)=C1 A11985 [0,1,0,0,0,0|1,1,0]=3 301 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 B48248 [0,1,0,0,0,0|1,1,1]=4 302 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 B48255 [0,1,0,0,0,0|1,0,1]=3 303 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 B68743 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 B68490 [0,1,0,0,0,0|1,1,1]=4 305 B11R1.23 O=CC(=O)C1=CC=CC(F)=C1 F63112 [0,1,0,0,0,0|1,0,2]=4 306 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 C49388 [0,1,0,0,0,0|1,1,0]=3 307 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C36827 [0,1,0,0,0,0|1,1,0]=3 308 B11R1.24 CC1=CC=CC(CCCO)=C1 M66328 [0,1,0,0,0,0|2,0,0]=3 309 B11R1.24 CC1=CC=CC(CN=[N+]=[N-])=C1 M9126 [0,1,0,0,0,0|2,0,1]=4 310 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 B54248 [0,1,0,0,0,0|3,0,0]=4 311 B11R1.24 CCNCC1=CC=CC(Br)=C1 E50224 [0,1,0,0,0,0|1,1,0]=3 312 B11R1.24 CCNCC1=CC=CC(Cl)=C1 C50239 [0,1,0,0,0,0|1,1,0]=3 313 B11R1.24 CCNCC1=CC=CC(Cl)=C1 C50242 [0,1,0,0,0,0|1,1,0]=3 314 B11R1.24 CCNCC1=CC=CC(F)=C1 F50251 [0,1,0,0,0,0|1,0,0]=2 315 B11R1.24 COCOC1=CC=CC(F)=C1 F49397 [0,1,0,0,0,0|2,0,0]=3 316 B11R1.24 FCCOC1=CC=CC(F)=C1 D49152 [0,1,0,0,0,0|1,0,0]=2 317 B11R1.24 O=CCCC1=CC=CC(Br)=C1 B64250 [0,1,0,0,0,0|1,1,0]=3 318 B11R1.24 OCCCC1=CC=CC(Br)=C1 B50149 [0,1,0,0,0,0|1,1,0]=3 319 B11R1.24 OCCNC1=CC=CC(Cl)=N1 C46329 [0,1,0,0,0,0|2,1,0]=4 320 B11R1.24 [N-]=[N+]=NCC1=CC=CC(F)=C1 A9128 [0,1,0,0,0,0|1,0,1]=3 321 B11R1.34 C=CCC1=CC(Br)=CC(F)=C1 A51332 [0,1,0,0,0,0|1,0,1]=3 322 B11R1.34 CC1=CC(F)=CC(CC#N)=C1 F51463 [0,1,0,0,0,0|0,0,2]=3 323 B11R1.34 CCOC1=CC(Br)=CC(F)=C1 B49135 [0,1,0,0,0,0|2,0,0]=3 324 B11R1.34 CNCC1=CC(Cl)=CC(Cl)=C1 D64876 [0,1,0,0,0,0|2,1,0]=4 325 B11R1.34 FC1=CC(F)=CC(CCBr)=C1 B63546 [0,1,0,0,0,0|1,0,0]=2 326 B11R1.34 N#CCC1=CC(Br)=CC(Br)=C1 D47658 [0,1,0,0,0,0|0,1,2]=4 327 B11R1.34 N#CCC1=CC(Cl)=CC(Cl)=C1 D47690 [0,1,0,0,0,0|0,1,2]=4 328 B11R1.34 N#CCC1=CC(Cl)=CC(F)=C1 C47697 [0,1,0,0,0,0|0,0,2]=3 329 B11R1.34 N#CCC1=CC(F)=CC(F)=C1 D47710 [0,1,0,0,0,0|0,0,2]=3 330 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 B64129 [0,1,0,0,0,0|1,1,1]=4 331 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 C52040 [0,1,0,0,0,0|1,1,1]=4 332 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 F52045 [0,1,0,0,0,0|1,0,1]=3 333 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 F2848 [0,1,0,0,0,0|2,0,1]=4 334 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 F48608 [0,1,0,0,0,0|2,0,1]=4 335 B11R1.157 CC(C)CC1=CC=CC(Br)=C1 B52868 [0,1,0,0,0,0|1,1,0]=3 336 B11R1.157 CC(C)OC1=CC(O)=CC=C1 M61115 [0,1,0,0,0,0|3,0,0]=4 337 B11R1.157 CC(C)OC1=CC=CC(Br)=C1 B66115 [0,1,0,0,0,0|2,1,0]=4 338 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 T49882 [0,1,0,0,0,0|2,0,1]=4 339 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 B50233 [0,1,0,0,0,0|2,1,0]=4 340 B11R1.157 CN(C)CC1=CC=CC(O)=C1 D50353 [0,1,0,0,0,0|3,0,0]=4 341 B11R1.157 FC(F)OC1=CC=CC(Br)=C1 B45141 [0,1,0,0,0,0|2,1,0]=4 342 B11R1.157 N=C(N)NC1=CC=CC(Cl)=C1 C65282 [0,1,0,0,0,0|1,1,1]=4 343 B11R1.157 NC(=O)CC1=CC(N)=CC=C1 A46654 [0,1,0,0,0,0|1,0,1]=3 344 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 C49034 [0,1,0,0,0,0|0,1,1]=3 345 B11R1.157 NC1=CC=CC(OC(F)F)=C1 D45885 [0,1,0,0,0,0|3,0,0]=4 346 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 F8162 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 B67653 [0,1,0,0,0,0|1,1,1]=4 348 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 C68317 [0,1,0,0,0,0|1,1,1]=4 349 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F23088 [0,1,0,0,0,0|1,0,1]=3 350 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 F15877 [0,1,0,0,0,0|2,0,1]=4 351 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 K48631 [0,1,0,0,0,0|1,1,1]=4 352 B11R1.157 OC1=CC=CC(OC(F)F)=C1 D45518 [0,1,0,0,0,0|3,0,0]=4 353 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 F51464 [0,1,0,0,0,0|0,0,2]=3 354 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 D52506 [0,1,0,0,0,0|1,0,2]=4 355 B11R1.182 CCOC1=C(C)C=CC(Br)=C1 B50153 [0,1,0,0,0,0|2,1,0]=4 356 B11R1.182 COCC1=C(F)C=CC(Br)=C1 B39083 [0,1,0,0,0,0|2,1,0]=4 357 B11R1.182 N#CCC1=C(Br)C=CC(F)=C1 B47684 [0,1,0,0,0,0|0,0,2]=3 358 B11R1.182 N#CCC1=C(Cl)C=CC(Cl)=C1 D47687 [0,1,0,0,0,0|0,1,2]=4 359 B11R1.182 N#CCC1=C(Cl)C=CC(F)=C1 C47691 [0,1,0,0,0,0|0,0,2]=3 360 B11R1.182 N#CCC1=C(F)C=CC(Br)=C1 B38134 [0,1,0,0,0,0|0,1,2]=4 361 B11R1.182 NC1=CC(CCO)=C(N)C=C1 D47001 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 D49228 [0,1,0,0,0,0|0,1,0]=2 363 B11R1.182 OCCC1=C(Cl)C=CC(Cl)=C1 D49148 [0,1,0,0,0,0|1,1,0]=3 364 B11R1.182 OCCC1=C(F)C=CC(F)=C1 D49156 [0,1,0,0,0,0|1,0,0]=2 365 B11R1.189 C=CCC1=CC=CC(OC)=C1 M52782 [0,1,0,0,0,0|2,0,1]=4 366 B11R1.189 CNCC1=CC=CC(C#N)=C1 M49715 [0,1,0,0,0,0|3,0,0]=4 367 B11R1.189 CNCC1=CC=CC(OC)=C1 M50357 [0,1,0,0,0,0|3,0,0]=4 368 B11R1.189 COC1=CC(CC#N)=CC=C1 M22153 [0,1,0,0,0,0|1,0,2]=4 369 B11R1.189 COC1=CC(CCN)=CC=C1 M52171 [0,1,0,0,0,0|1,0,0]=2 370 B11R1.189 COC1=CC(CCN)=CC=C1 M67069 [0,1,0,0,0,0|1,0,0]=2 371 B11R1.189 COC1=CC(CCO)=CC=C1 M50285 [0,1,0,0,0,0|2,0,0]=3 372 B11R1.189 COC1=CC(CNN)=CC=C1 M0100 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.189 N#CC1=CC(CCO)=NC=C1 H11913 [0,1,0,0,0,0|3,0,0]=4 374 B11R1.189 N#CC1=CC=CC(CCO)=C1 H38259 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.189 NCC1=CC=CC(CCO)=C1 A32377 [0,1,0,0,0,0|2,0,0]=3 376 B11R1.192 CCCC1=CC(F)=C(Br)C=C1 B49701 [0,1,0,0,0,0|1,0,0]=2 377 B11R1.192 CCOC1=CC(C)=C(Br)C=C1 B50152 [0,1,0,0,0,0|3,0,0]=4 378 B11R1.192 CCOC1=CC(F)=C(Br)C=C1 B49136 [0,1,0,0,0,0|2,0,0]=3 379 B11R1.192 CNCC1=CC(C)=C(C)C=C1 D53119 [0,1,0,0,0,0|3,0,0]=4 380 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 D67460 [0,1,0,0,0,0|2,1,0]=4 381 B11R1.192 CNCC1=CC(O)=C(O)C=C1 M49486 [0,1,0,0,0,0|3,0,0]=4 382 B11R1.192 FC1=C(Cl)C=CC(N=C=S)=C1 C7138 [0,1,0,0,0,0|2,0,1]=4 383 B11R1.192 FC1=C(F)C=C(CCBr)C=C1 B48302 [0,1,0,0,0,0|1,0,0]=2 384 B11R1.192 N#CCC1=CC(Br)=C(F)C=C1 B47685 [0,1,0,0,0,0|0,1,2]=4 385 B11R1.192 N#CCC1=CC(Cl)=C(Cl)C=C1 D67912 [0,1,0,0,0,0|0,1,2]=4 386 B11R1.192 N#CCC1=CC(Cl)=C(F)C=C1 C47694 [0,1,0,0,0,0|0,1,2]=4 387 B11R1.192 N#CCC1=CC(F)=C(Br)C=C1 B47671 [0,1,0,0,0,0|0,0,2]=3 388 B11R1.192 N#CCC1=CC(F)=C(Cl)C=C1 C47698 [0,1,0,0,0,0|0,0,2]=3 389 B11R1.192 N#CCC1=CC(F)=C(F)C=C1 D47709 [0,1,0,0,0,0|0,0,2]=3 390 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 D49146 [0,1,0,0,0,0|1,1,0]=3 391 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 C49151 [0,1,0,0,0,0|1,0,0]=2 392 B11R2.35 BrC1=CC(C2CC2)=CC=C1 B67707 [0,0,0,1,0,0|1,1,0]=3 393 B11R2.35 BrC1=CC(C2CC2)=NC=C1 B37241 [0,0,0,1,0,0|2,1,0]=4 394 B11R2.35 BrC1=CN=CC(C2CC2)=C1 B37616 [0,0,0,1,0,0|2,1,0]=4 395 B11R2.35 ClC1=NC=CC(C2CC2)=C1 C21734 [0,0,0,1,0,0|2,1,0]=4 396 B11R2.35 NC1=CC(C2CC2)=CC=C1 C49975 [0,0,0,1,0,0|2,0,0]=3 397 B11R2.35 NC1=CC(C2CC2)=CN=C1 C46641 [0,0,0,1,0,0|3,0,0]=4 398 B11R2.36 BrC1=CC2=C(C=C1)CCN2 B48873 [0,0,0,1,0,0|2,1,0]=4 399 B11R2.36 BrC1=CC2=C(C=C1)CCN2 B48878 [0,0,0,1,0,0|2,1,0]=4 400 B11R2.36 BrC1=CC2=C(C=C1)CCO2 B48719 [0,0,0,1,0,0|2,1,0]=4 401 B11R2.36 BrC1=CC2=C(C=C1)CNC2 B0713 [0,0,0,1,0,0|2,1,0]=4 402 B11R2.36 BrC1=CC2=C(C=C1)NC=C2 B2310 [0,0,0,1,0,0|0,1,2]=4 403 B11R2.36 BrC1=CC2=C(C=C1)NC=N2 B44744 [0,0,0,1,0,0|1,1,1]=4 404 B11R2.36 BrC1=CC2=C(C=C1)NCC2 B22435 [0,0,0,1,0,0|0,1,0]=2 405 B11R2.36 BrC1=CC2=C(C=C1)NN=C2 B3352 [0,0,0,1,0,0|1,1,1]=4 406 B11R2.36 BrC1=CC2=C(C=C1)NN=N2 B42142 [0,0,0,1,0,0|2,1,0]=4 407 B11R2.36 BrC1=CC2=C(C=C1)OCC2 B24807 [0,0,0,1,0,0|1,1,0]=3 408 B11R2.36 BrC1=CC2=C(C=C1)OCO2 B68095 [0,0,0,1,0,0|2,1,0]=4 409 B11R2.36 BrC1=CN=C2NCCC2=C1 B12242 [0,0,0,1,0,0|1,1,0]=3 410 B11R2.36 BrC1=CN=C2NCCC2=C1 B30154 [0,0,0,1,0,0|1,1,0]=3 411 B11R2.36 BrC1=NC2=C(C=C1)NCC2 B45617 [0,0,0,1,0,0|1,1,0]=3 412 B11R2.36 CC1=CC2=C(C=C1)NC=C2 M2329 [0,0,0,1,0,0|1,0,2]=4 413 B11R2.36 CC1=CC2=C(C=C1)NCC2 M49974 [0,0,0,1,0,0|1,0,0]=2 414 B11R2.36 CC1=CC2=C(C=C1)NN=C2 M9605 [0,0,0,1,0,0|2,0,1]=4 415 B11R2.36 CC1=CC2=C(C=C1)OCO2 M65617 [0,0,0,1,0,0|3,0,0]=4 416 B11R2.36 ClC1=CC2=C(C=C1)CCN2 C48881 [0,0,0,1,0,0|2,1,0]=4 417 B11R2.36 ClC1=CC2=C(C=C1)CNC2 C48884 [0,0,0,1,0,0|2,1,0]=4 418 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 C12131 [0,0,0,1,0,0|0,1,2]=4 419 B11R2.36 ClC1=CC2=C(C=C1)NN=C2 C9580 [0,0,0,1,0,0|1,1,1]=4 420 B11R2.36 ClC1=CC2=C(C=C1)NN=N2 C39240 [0,0,0,1,0,0|2,1,0]=4 421 B11R2.36 ClC1=CC2=C(C=C1)OCC2 C48731 [0,0,0,1,0,0|1,1,0]=3 422 B11R2.36 ClC1=CN=C2NCCC2=C1 C45621 [0,0,0,1,0,0|1,1,0]=3 423 B11R2.36 ClC1=NC2=C(C=C1)CCC2 C48882 [0,0,0,1,0,0|2,1,0]=4 424 B11R2.36 FC1=CC2=C(C=C1)C=NN2 F9571 [0,0,0,1,0,0|3,0,0]=4 425 B11R2.36 FC1=CC2=C(C=C1)CC=C2 F51044 [0,0,0,1,0,0|1,0,2]=4 426 B11R2.36 FC1=CC2=C(C=C1)CCC2 F51669 [0,0,0,1,0,0|1,0,0]=2 427 B11R2.36 FC1=CC2=C(C=C1)CNC2 F24902 [0,0,0,1,0,0|2,0,0]=3 428 B11R2.36 FC1=CC2=C(C=C1)N=CS2 F61570 [0,0,0,1,0,0|1,0,2]=4 429 B11R2.36 FC1=CC2=C(C=C1)N=NN2 F64515 [0,0,0,1,0,0|2,0,1]=4 430 B11R2.36 FC1=CC2=C(C=C1)NC=C2 F31500 [0,0,0,1,0,0|0,0,2]=3 431 B11R2.36 FC1=CC2=C(C=C1)NC=N2 F44797 [0,0,0,1,0,0|1,0,1]=3 432 B11R2.36 FC1=CC2=C(C=C1)NN=C2 F3439 [0,0,0,1,0,0|1,0,1]=3 433 B11R2.36 FC1=CC2=C(C=C1)OC=C2 F47842 [0,0,0,1,0,0|1,0,2]=4 434 B11R2.36 FC1=CC2=C(C=C1)OCC2 F62598 [0,0,0,1,0,0|1,0,0]=2 435 B11R2.36 FC1=CC2=C(C=C1)SC=N2 F44438 [0,0,0,1,0,0|2,0,1]=4 436 B11R2.36 FC1=CC2=C(C=CN2)C=C1 F2136 [0,0,0,1,0,0|2,0,1]=4 437 B11R2.36 FC1=CC2=C(C=CS2)C=C1 F38235 [0,0,0,1,0,0|2,0,1]=4 438 B11R2.36 FC1=CC2=CNN=C2C=C1 F44791 [0,0,0,1,0,0|1,0,2]=4 439 B11R2.36 FC1=CN=C2CNCC2=C1 F18831 [0,0,0,1,0,0|3,0,0]=4 440 B11R2.36 FC1=CN=C2NC=CC2=C1 F0323 [0,0,0,1,0,0|1,0,2]=4 441 B11R2.36 FC1=CN=C2NN=CC2=C1 F12053 [0,0,0,1,0,0|2,0,1]=4 442 B11R2.36 FC1=NC2=C(C=C1)NC=C2 F44799 [0,0,0,1,0,0|1,0,2]=4 443 B11R2.36 FC1=NC=C2NC=CC2=C1 F37610 [0,0,0,1,0,0|1,0,2]=4 444 B11R2.36 IC1=CC2=C(C=C1)CCC2 K64448 [0,0,0,1,0,0|1,1,0]=3 445 B11R2.36 IC1=CC2=C(C=C1)NC=C2 K47985 [0,0,0,1,0,0|0,1,2]=4 446 B11R2.36 IC1=CC2=C(C=C1)NN=C2 I0478 [0,0,0,1,0,0|1,1,1]=4 447 B11R2.36 IC1=CC2=C(C=C1)OCC2 I2714 [0,0,0,1,0,0|1,1,0]=3 448 B11R2.36 NC1=CC2=C(C=C1)COC2 D49267 [0,0,0,1,0,0|3,0,0]=4 449 B11R2.36 NC1=CC2=C(C=C1)NN=C2 I9274 [0,0,0,1,0,0|2,0,1]=4 450 B11R2.36 NC1=CC2=C(C=C1)NN=N2 B15799 [0,0,0,1,0,0|3,0,0]=4 451 B11R2.36 NC1=CC2=C(C=C1)OCC2 D49263 [0,0,0,1,0,0|2,0,0]=3 452 B11R2.36 NC1=CC2=C(C=C1)OCO2 M67396 [0,0,0,1,0,0|3,0,0]=4 453 B11R2.36 OC1=CC2=C(C=C1)CCN2 K49255 [0,0,0,1,0,0|3,0,0]=4 454 B11R2.36 OC1=CC2=C(C=C1)CCO2 D49068 [0,0,0,1,0,0|3,0,0]=4 455 B11R2.36 OC1=CC2=C(C=C1)CNC2 D29486 [0,0,0,1,0,0|3,0,0]=4 456 B11R2.36 OC1=CC2=C(C=C1)NC=C2 F2321 [0,0,0,1,0,0|1,0,2]=4 457 B11R2.36 OC1=CC2=C(C=C1)NC=N2 B67409 [0,0,0,1,0,0|2,0,1]=4 458 B11R2.36 OC1=CC2=C(C=C1)NCC2 K49254 [0,0,0,1,0,0|1,0,0]=2 459 B11R2.36 OC1=CC2=C(C=C1)NN=C2 H3304 [0,0,0,1,0,0|2,0,1]=4 460 B11R2.36 OC1=CC2=C(C=C1)OCC2 D49067 [0,0,0,1,0,0|2,0,0]=3 461 B11R2.36 [Mg+]C1=CC2=C(C=C1)OCO2 B31763 [0,0,0,1,0,0|3,0,0]=4 462 B11R2.106 BrC1=C2CCCC2=CC=C1 B10979 [0,0,0,1,0,0|1,1,0]=3 463 B11R2.106 BrC1=C2CCNC2=CC=C1 B48872 [0,0,0,1,0,0|2,1,0]=4 464 B11R2.106 BrC1=C2CNCC2=CC=C1 B5333 [0,0,0,1,0,0|2,1,0]=4 465 B11R2.106 BrC1=C2COCC2=CC=C1 B19438 [0,0,0,1,0,0|2,1,0]=4 466 B11R2.106 BrC1=C2NC=CC2=CC=C1 B2281 [0,0,0,1,0,0|0,1,2]=4 467 B11R2.106 BrC1=C2NCCC2=CN=C1 B8070 [0,0,0,1,0,0|1,1,0]=3 468 B11R2.106 BrC1=C2NN=CC2=CC=C1 B4875 [0,0,0,1,0,0|1,1,1]=4 469 B11R2.106 BrC1=C2NN=NC2=CC=C1 B16359 [0,0,0,1,0,0|2,1,0]=4 470 B11R2.106 BrC1=C2OCCC2=CC=C1 B22264 [0,0,0,1,0,0|1,1,0]=3 471 B11R2.106 BrC1=C2OCOC2=CC=C1 B24818 [0,0,0,1,0,0|2,1,0]=4 472 B11R2.106 CC1=C2CCCC2=CC=C1 M52674 [0,0,0,1,0,0|2,0,0]=3 473 B11R2.106 CC1=C2NC=CC2=CC=C1 M2101 [0,0,0,1,0,0|1,0,2]=4 474 B11R2.106 CC1=CC=CC2=C1NC=N2 M48788 [0,0,0,1,0,0|2,0,1]=4 475 B11R2.106 CC1=CC=CC2=C1NN=C2 M9828 [0,0,0,1,0,0|2,0,1]=4 476 B11R2.106 ClC1=C2CCCC2=NC=C1 C48883 [0,0,0,1,0,0|2,1,0]=4 477 B11R2.106 ClC1=C2CCNC2=CC=C1 C48879 [0,0,0,1,0,0|2,1,0]=4 478 B11R2.106 ClC1=C2CNCC2=CC=C1 C36885 [0,0,0,1,0,0|2,1,0]=4 479 B11R2.106 ClC1=C2NC=CC2=CC=C1 C24142 [0,0,0,1,0,0|0,1,2]=4 480 B11R2.106 ClC1=C2NC=NC2=CC=C1 C44775 [0,0,0,1,0,0|1,1,1]=4 481 B11R2.106 ClC1=C2NN=CC2=CC=C1 C4910 [0,0,0,1,0,0|1,1,1]=4 482 B11R2.106 ClC1=C2NN=NC2=CC=C1 C42159 [0,0,0,1,0,0|2,1,0]=4 483 B11R2.106 FC1=C2C=CNC2=CC=C1 F3191 [0,0,0,1,0,0|2,0,1]=4 484 B11R2.106 FC1=C2C=NNC2=CC=C1 B5804 [0,0,0,1,0,0|3,0,0]=4 485 B11R2.106 FC1=C2CCOC2=NC=C1 F30045 [0,0,0,1,0,0|3,0,0]=4 486 B11R2.106 FC1=C2CNCC2=CC=C1 F37051 [0,0,0,1,0,0|2,0,0]=3 487 B11R2.106 FC1=C2NC=CC2=CC=C1 F8169 [0,0,0,1,0,0|0,0,2]=3 488 B11R2.106 FC1=C2NC=CC2=CN=C1 F15522 [0,0,0,1,0,0|1,0,2]=4 489 B11R2.106 FC1=C2NC=CC2=NC=C1 F15525 [0,0,0,1,0,0|1,0,2]=4 490 B11R2.106 FC1=C2NCCC2=CC=C1 F49614 [0,0,0,1,0,0|0,0,0]=1 491 B11R2.106 FC1=C2NN=CC2=CC=C1 F6132 [0,0,0,1,0,0|1,0,1]=3 492 B11R2.106 FC1=C2OC=CC2=CC=C1 F63014 [0,0,0,1,0,0|1,0,2]=4 493 B11R2.106 FC1=C2OC=NC2=CC=C1 F44543 [0,0,0,1,0,0|2,0,1]=4 494 B11R2.106 FC1=C2SC=CC2=CC=C1 F47541 [0,0,0,1,0,0|1,0,2]=4 495 B11R2.106 FC1=CC=CC2=C1C=CS2 F47540 [0,0,0,1,0,0|2,0,1]=4 496 B11R2.106 IC1=C2CCCC2=CC=C1 K51671 [0,0,0,1,0,0|1,1,0]=3 497 B11R2.106 IC1=C2NN=CC2=CC=C1 I12807 [0,0,0,1,0,0|1,1,1]=4 498 B11R2.106 IC1=C2OCOC2=CC=C1 K45104 [0,0,0,1,0,0|2,1,0]=4 499 B11R2.106 NC1=C2OCCC2=CC=C1 A64522 [0,0,0,1,0,0|2,0,0]=3 500 B11R2.106 NC1=C2OCOC2=CC=C1 B45818 [0,0,0,1,0,0|3,0,0]=4 501 B11R2.106 NC1=CC=CC2=C1CCN2 K46638 [0,0,0,1,0,0|3,0,0]=4 502 B11R2.106 NC1=CC=CC2=C1CCO2 A12891 [0,0,0,1,0,0|3,0,0]=4 503 B11R2.106 NC1=CC=CC2=C1CNC2 K49654 [0,0,0,1,0,0|3,0,0]=4 504 B11R2.106 NC1=CC=CC2=C1NC=N2 B23667 [0,0,0,1,0,0|2,0,1]=4 505 B11R2.106 NC1=CC=CC2=C1NN=C2 I0487 [0,0,0,1,0,0|2,0,1]=4 506 B11R2.106 OC1=C2CCCC2=CC=C1 K49868 [0,0,0,1,0,0|2,0,0]=3 507 B11R2.106 OC1=C2CNCC2=CC=C1 K49644 [0,0,0,1,0,0|3,0,0]=4 508 B11R2.106 OC1=C2NN=CC2=CC=C1 K9570 [0,0,0,1,0,0|2,0,1]=4 509 B11R2.106 OC1=C2NN=NC2=CC=C1 B62192 [0,0,0,1,0,0|3,0,0]=4 510 B11R2.106 OC1=C2OCOC2=CC=C1 B24932 [0,0,0,1,0,0|3,0,0]=4 511 B9R1.7 CC1=CC=C(CCO)O1 M43716 [0,0,0,0,1,0|3,0,0]=4 512 B9R1.7 CCCC1=CC=C(Br)S1 B38199 [0,0,0,0,1,0|2,1,0]=4 513 B9R1.7 NNCC1=CC=C(Cl)S1 C13974 [0,0,0,0,1,0|2,1,0]=4 514 B9R1.33 CC1=C(CCN)SC=N1 M3229 [0,0,0,0,1,0|3,0,0]=4 515 B9R1.33 CC1=NC=CN1CCN M43556 [0,0,0,0,1,0|3,0,0]=4 516 B8R1.2 BrCC1=CC=NC=C1 B36897 [2,0,0,0,0,0|2,0,0]=4 517 B8R1.2 BrCC1=CN=CC=C1 B23879 [2,0,0,0,0,0|2,0,0]=4 518 B8R1.2 BrCC1=NC=CC=C1 B42841 [2,0,0,0,0,0|2,0,0]=4 519 B8R1.2 CCC1=NC=CN=C1 E43180 [2,0,0,0,0,0|2,0,0]=4 520 B8R1.2 CNC1=CC=CN=C1 M38086 [2,0,0,0,0,0|2,0,0]=4 521 B8R1.2 CNC1=CC=NC=C1 M68620 [2,0,0,0,0,0|2,0,0]=4 522 B8R1.2 COC1=CC=NC=C1 M9391 [2,0,0,0,0,0|2,0,0]=4 523 B8R1.2 COC1=CN=CC=C1 M67978 [2,0,0,0,0,0|2,0,0]=4 524 B8R1.2 COC1=NC=CC=C1 M39277 [2,0,0,0,0,0|2,0,0]=4 525 B8R1.2 ClCC1=CC=NC=C1 C68845 [2,0,0,0,0,0|2,0,0]=4 526 B8R1.2 ClCC1=NC=CC=C1 C67870 [2,0,0,0,0,0|2,0,0]=4 527 B8R1.2 NCC1=CC=CN=C1 A69257 [2,0,0,0,0,0|1,0,0]=3 528 B8R1.2 NCC1=CC=CN=N1 A0031 [2,0,0,0,0,0|2,0,0]=4 529 B8R1.2 NCC1=CC=CN=N1 P29569 [2,0,0,0,0,0|2,0,0]=4 530 B8R1.2 NCC1=CC=NC=C1 P67743 [2,0,0,0,0,0|1,0,0]=3 531 B8R1.2 NCC1=CN=CN=C1 P0028 [2,0,0,0,0,0|2,0,0]=4 532 B8R1.2 NCC1=CN=CN=C1 P29548 [2,0,0,0,0,0|2,0,0]=4 533 B8R1.2 NCC1=CN=NC=C1 A0027 [2,0,0,0,0,0|2,0,0]=4 534 B8R1.2 NCC1=CN=NC=C1 P41350 [2,0,0,0,0,0|2,0,0]=4 535 B8R1.2 NCC1=NC=CC=N1 A7421 [2,0,0,0,0,0|2,0,0]=4 536 B8R1.2 NCC1=NC=CC=N1 P0030 [2,0,0,0,0,0|2,0,0]=4 537 B8R1.2 NCC1=NC=CN=C1 P0029 [2,0,0,0,0,0|2,0,0]=4 538 B8R1.2 NCC1=NC=CN=C1 P4303 [2,0,0,0,0,0|2,0,0]=4 539 B8R1.2 NCC1=NC=NC=C1 A0032 [2,0,0,0,0,0|2,0,0]=4 540 B8R1.2 NCC1=NC=NC=C1 A10198 [2,0,0,0,0,0|2,0,0]=4 541 B8R1.2 NCC1=NC=NC=C1 P23754 [2,0,0,0,0,0|2,0,0]=4 542 B8R1.2 NNC1=CC=CC=C1 P68696 [2,0,0,0,0,0|1,0,0]=3 543 B8R1.2 NNC1=CC=CN=C1 H0043 [2,0,0,0,0,0|2,0,0]=4 544 B8R1.2 NNC1=CC=CN=C1 H41349 [2,0,0,0,0,0|2,0,0]=4 545 B8R1.2 NNC1=CC=NC=C1 H0042 [2,0,0,0,0,0|2,0,0]=4 546 B8R1.2 NNC1=NC=CC=C1 H38511 [2,0,0,0,0,0|2,0,0]=4 547 B8R1.2 NOC1=CC=CC=C1 P43533 [2,0,0,0,0,0|1,0,0]=3 548 B8R1.2 OCC1=CC=NC=C1 P43429 [2,0,0,0,0,0|2,0,0]=4 549 B8R1.2 OCC1=CC=NC=C1 P67894 [2,0,0,0,0,0|2,0,0]=4 550 B8R1.2 OCC1=CN=CC=C1 P15946 [2,0,0,0,0,0|2,0,0]=4 551 B8R1.2 OCC1=NC=CC=C1 P69303 [2,0,0,0,0,0|2,0,0]=4 552 B8R1.2 ONC1=CC=CC=C1 P67873 [2,0,0,0,0,0|2,0,0]=4 553 B8R1.4 BrC1=CC=CC(I)=C1 B24425 [2,0,0,0,0,0|1,1,0]=4 554 B8R1.4 CC1=CC(Br)=CN=C1 B10806 [2,0,0,0,0,0|1,1,0]=4 555 B8R1.4 CC1=CC(Br)=NC=C1 B5404 [2,0,0,0,0,0|1,1,0]=4 556 B8R1.4 CC1=CC(Cl)=CN=C1 C22076 [2,0,0,0,0,0|1,1,0]=4 557 B8R1.4 CC1=CC(Cl)=NC=C1 C4515 [2,0,0,0,0,0|1,1,0]=4 558 B8R1.4 CC1=CC(F)=CN=C1 F42848 [2,0,0,0,0,0|1,0,0]=3 559 B8R1.4 CC1=CC(N)=NC=C1 M67573 [2,0,0,0,0,0|2,0,0]=4 560 B8R1.4 CC1=CC(O)=CN=C1 H23648 [2,0,0,0,0,0|2,0,0]=4 561 B8R1.4 CC1=CC(O)=NC=C1 M18825 [2,0,0,0,0,0|2,0,0]=4 562 B8R1.4 CC1=CC=CC(=O)N1 M23064 [2,0,0,0,0,0|2,0,0]=4 563 B8R1.4 CC1=CC=CC(Br)=N1 B39267 [2,0,0,0,0,0|1,1,0]=4 564 B8R1.4 CC1=CC=CC(Cl)=N1 C4547 [2,0,0,0,0,0|1,1,0]=4 565 B8R1.4 CC1=CC=CC(F)=N1 F39268 [2,0,0,0,0,0|1,0,0]=3 566 B8R1.4 CC1=CC=CC(I)=C1 K68735 [2,0,0,0,0,0|0,1,0]=3 567 B8R1.4 CC1=CC=CC(I)=N1 K42850 [2,0,0,0,0,0|1,1,0]=4 568 B8R1.4 CC1=CC=CC(N)=N1 A13755 [2,0,0,0,0,0|2,0,0]=4 569 B8R1.4 CC1=CC=CC(S)=N1 M38177 [2,0,0,0,0,0|2,0,0]=4 570 B8R1.4 CC1=CC=CC([Mg+])=C1 M31730 [2,0,0,0,0,0|1,0,0]=3 571 B8R1.4 CC1=CN=CC(N)=C1 A4718 [2,0,0,0,0,0|2,0,0]=4 572 B8R1.4 CC1=NC=CC(Br)=C1 B1746 [2,0,0,0,0,0|1,1,0]=4 573 B8R1.4 CC1=NC=CC(Cl)=C1 C42842 [2,0,0,0,0,0|1,1,0]=4 574 B8R1.4 CC1=NC=CC(F)=C1 F67675 [2,0,0,0,0,0|1,0,0]=3 575 B8R1.4 CC1=NC=CC(I)=C1 K42851 [2,0,0,0,0,0|1,1,0]=4 576 B8R1.4 CC1=NC=CC(N)=C1 A12847 [2,0,0,0,0,0|2,0,0]=4 577 B8R1.4 CC1=NC=CC(O)=C1 H1019 [2,0,0,0,0,0|2,0,0]=4 578 B8R1.4 ClC1=CC=CC(Br)=C1 B68310 [2,0,0,0,0,0|1,1,0]=4 579 B8R1.4 ClC1=CC=CC(I)=C1 C39234 [2,0,0,0,0,0|1,1,0]=4 580 B8R1.4 FC1=CC(Br)=CN=C1 B4562 [2,0,0,0,0,0|2,0,0]=4 581 B8R1.4 FC1=CC(Br)=NC=C1 B4916 [2,0,0,0,0,0|2,0,0]=4 582 B8R1.4 FC1=CC(Cl)=CN=C1 C40642 [2,0,0,0,0,0|2,0,0]=4 583 B8R1.4 FC1=CC(Cl)=NC=C1 C40640 [2,0,0,0,0,0|2,0,0]=4 584 B8R1.4 FC1=CC(F)=NC=C1 D12477 [2,0,0,0,0,0|2,0,0]=4 585 B8R1.4 FC1=CC(I)=CN=C1 F40651 [2,0,0,0,0,0|2,0,0]=4 586 B8R1.4 FC1=CC=CC(Br)=N1 B2593 [2,0,0,0,0,0|2,0,0]=4 587 B8R1.4 FC1=CC=CC(Cl)=N1 C39168 [2,0,0,0,0,0|2,0,0]=4 588 B8R1.4 FC1=CC=CC(F)=N1 D5153 [2,0,0,0,0,0|2,0,0]=4 589 B8R1.4 FC1=CC=CC(I)=C1 F39235 [2,0,0,0,0,0|1,0,0]=3 590 B8R1.4 FC1=CC=CC([Mg+])=C1 F31732 [2,0,0,0,0,0|1,0,0]=3 591 B8R1.4 FC1=CN=CC(F)=C1 D2972 [2,0,0,0,0,0|2,0,0]=4 592 B8R1.4 FC1=NC=CC(Br)=C1 B2295 [2,0,0,0,0,0|2,0,0]=4 593 B8R1.4 FC1=NC=CC(Cl)=C1 C40643 [2,0,0,0,0,0|2,0,0]=4 594 B8R1.4 FC1=NC=CC(I)=C1 F2382 [2,0,0,0,0,0|2,0,0]=4 595 B8R1.4 IC1=CC=CC(I)=C1 D36613 [2,0,0,0,0,0|1,1,0]=4 596 B8R1.4 NC1=CC(=O)NC=C1 A0052 [2,0,0,0,0,0|2,0,0]=4 597 B8R1.4 NC1=CC(Br)=CN=C1 A4523 [2,0,0,0,0,0|1,1,0]=4 598 B8R1.4 NC1=CC(Br)=NC=C1 A2493 [2,0,0,0,0,0|1,1,0]=4 599 B8R1.4 NC1=CC(Cl)=CN=C1 C22457 [2,0,0,0,0,0|1,1,0]=4 600 B8R1.4 NC1=CC(Cl)=NC=C1 A4859 [2,0,0,0,0,0|1,1,0]=4 601 B8R1.4 NC1=CC(F)=CN=C1 F40881 [2,0,0,0,0,0|1,0,0]=3 602 B8R1.4 NC1=CC(F)=NC=C1 A10494 [2,0,0,0,0,0|1,0,0]=3 603 B8R1.4 NC1=CC(O)=CN=C1 A41024 [2,0,0,0,0,0|2,0,0]=4 604 B8R1.4 NC1=CC(O)=CN=C1 A41394 [2,0,0,0,0,0|2,0,0]=4 605 B8R1.4 NC1=CC(O)=NC=C1 A41022 [2,0,0,0,0,0|2,0,0]=4 606 B8R1.4 NC1=CC=CC(Br)=N1 A1106 [2,0,0,0,0,0|1,1,0]=4 607 B8R1.4 NC1=CC=CC(Cl)=N1 A1775 [2,0,0,0,0,0|1,1,0]=4 608 B8R1.4 NC1=CC=CC(F)=N1 A40882 [2,0,0,0,0,0|1,0,0]=3 609 B8R1.4 NC1=CC=CC(I)=C1 I37843 [2,0,0,0,0,0|0,1,0]=3 610 B8R1.4 NC1=CC=CC(I)=N1 K40888 [2,0,0,0,0,0|1,1,0]=4 611 B8R1.4 NC1=CC=CC(N)=N1 P69294 [2,0,0,0,0,0|2,0,0]=4 612 B8R1.4 NC1=CC=CC(O)=N1 A3198 [2,0,0,0,0,0|2,0,0]=4 613 B8R1.4 NC1=CC=NC(F)=N1 F30033 [2,0,0,0,0,0|2,0,0]=4 614 B8R1.4 NC1=CN=CC(N)=C1 P41138 [2,0,0,0,0,0|2,0,0]=4 615 B8R1.4 NC1=NC=CC(Br)=C1 A4983 [2,0,0,0,0,0|1,1,0]=4 616 B8R1.4 NC1=NC=CC(Cl)=C1 A1518 [2,0,0,0,0,0|1,1,0]=4 617 B8R1.4 NC1=NC=CC(F)=C1 A2971 [2,0,0,0,0,0|1,0,0]=3 618 B8R1.4 NC1=NC=CC(F)=N1 F13613 [2,0,0,0,0,0|2,0,0]=4 619 B8R1.4 NC1=NC=CC(I)=C1 A8059 [2,0,0,0,0,0|1,1,0]=4 620 B8R1.4 NC1=NC=CC(O)=C1 A41020 [2,0,0,0,0,0|2,0,0]=4 621 B8R1.4 O=C1C=C(F)C=CN1 F32104 [2,0,0,0,0,0|2,0,0]=4 622 B8R1.4 OC1=CC(F)=CN=C1 F40851 [2,0,0,0,0,0|2,0,0]=4 623 B8R1.4 OC1=CC=CC(F)=C1 F69298 [2,0,0,0,0,0|1,0,0]=3 624 B8R1.4 OC1=CC=CC(F)=N1 F40852 [2,0,0,0,0,0|2,0,0]=4 625 B8R1.4 OC1=CC=CC(I)=C1 K42723 [2,0,0,0,0,0|1,1,0]=4 626 B8R1.4 [Mg+]C1=CC=CC(Cl)=C1 C31751 [2,0,0,0,0,0|1,1,0]=4 627 B8R1.4 [O-][N+]1=CC=CC(F)=C1 F0791 [2,0,0,0,0,0|2,0,0]=4 628 B10R1.2 CC1=C(Br)C=CC=C1CO B36982 [1,1,0,0,0,0|1,1,0]=4 629 B10R1.2 CC1=C(F)C=CC=C1C#N F47975 [1,1,0,0,0,0|0,0,2]=4 630 B10R1.2 CC1=C(F)C=CC=C1C=O F48740 [1,1,0,0,0,0|1,0,1]=4 631 B10R1.2 CC1=CC=CC(CBr)=C1C B49965 [1,1,0,0,0,0|2,0,0]=4 632 B10R1.2 CC1=CC=CC(CN)=C1O A49525 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.2 CC1=CC=CC(CO)=C1C D50272 [1,1,0,0,0,0|2,0,0]=4 634 B10R1.2 CC1=CC=CC(CO)=C1N A46912 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.2 CN1C=CC=C(CN)C1=O A10236 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.2 CNC1=C(N)C(C)=CC=C1 D46971 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.2 COC1=C(Br)C(C)=CC=C1 B49438 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.2 COC1=C(Br)C(N)=CC=C1 B46150 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.2 COC1=C(Br)C(O)=CC=C1 B37391 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.2 COC1=C(C)C(C)=CC=C1 M50276 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.2 COC1=C(C)C(N)=CC=C1 M46898 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.2 COC1=C(C)C(N)=CC=C1 M49523 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.2 COC1=C(Cl)C(N)=CC=C1 C15640 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.2 COC1=C(Cl)C(N)=CC=C1 C64073 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.2 COC1=C(Cl)C(O)=CC=C1 C38626 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.2 COC1=C(F)C(N)=CC=C1 F36888 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.2 COC1=C(I)C(N)=CC=C1 K46227 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.2 COC1=C(N)C(C)=CC=C1 M46896 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.2 COC1=C(N)C(N)=CC=C1 M36728 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.2 COC1=C(N)C(O)=CC=C1 A46392 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.2 COC1=C(O)C(C)=CC=C1 M46825 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.2 COC1=C(O)C(N)=CC=C1 A46577 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.2 COC1=CC=CC(Br)=C1Br D45548 [1,1,0,0,0,0|1,1,0]=4 654 B10R1.2 COC1=CC=CC(Br)=C1C B49435 [1,1,0,0,0,0|1,1,0]=4 655 B10R1.2 COC1=CC=CC(Br)=C1Cl B45552 [1,1,0,0,0,0|1,1,0]=4 656 B10R1.2 COC1=CC=CC(Br)=C1F B45572 [1,1,0,0,0,0|1,1,0]=4 657 B10R1.2 COC1=CC=CC(Br)=C1I B45581 [1,1,0,0,0,0|1,1,0]=4 658 B10R1.2 COC1=CC=CC(Br)=C1N B36703 [1,1,0,0,0,0|1,1,0]=4 659 B10R1.2 COC1=CC=CC(Br)=C1O B1786 [1,1,0,0,0,0|1,1,0]=4 660 B10R1.2 COC1=CC=CC(Cl)=C1Cl D39394 [1,1,0,0,0,0|1,1,0]=4 661 B10R1.2 COC1=CC=CC(Cl)=C1F C45598 [1,1,0,0,0,0|1,1,0]=4 662 B10R1.2 COC1=CC=CC(Cl)=C1N C46186 [1,1,0,0,0,0|1,1,0]=4 663 B10R1.2 COC1=CC=CC(F)=C1Br B45576 [1,1,0,0,0,0|1,0,0]=3 664 B10R1.2 COC1=CC=CC(F)=C1F D45604 [1,1,0,0,0,0|1,0,0]=3 665 B10R1.2 COC1=CC=CC(F)=C1N F38548 [1,1,0,0,0,0|1,0,0]=3 666 B10R1.2 COC1=CC=CC(F)=C1O F45916 [1,1,0,0,0,0|1,0,0]=3 667 B10R1.2 COC1=CC=CC(I)=C1Br B63575 [1,1,0,0,0,0|1,1,0]=4 668 B10R1.2 COC1=CC=CC(I)=C1O K45923 [1,1,0,0,0,0|1,1,0]=4 669 B10R1.2 ClC1=CC=CC(CBr)=C1Cl B44706 [1,1,0,0,0,0|1,1,0]=4 670 B10R1.2 FC1=C(Br)C(CBr)=CC=C1 B44698 [1,1,0,0,0,0|1,0,0]=3 671 B10R1.2 FC1=C(Br)C=CC=C1CBr B44695 [1,1,0,0,0,0|1,1,0]=4 672 B10R1.2 FC1=C(CBr)C=CC=C1Cl B44715 [1,1,0,0,0,0|1,1,0]=4 673 B10R1.2 FC1=CC=CC(CBr)=C1Cl B44713 [1,1,0,0,0,0|1,0,0]=3 674 B10R1.2 FC1=CC=CC(CBr)=C1F D44722 [1,1,0,0,0,0|1,0,0]=3 675 B10R1.2 N#CC1=CC=CC(F)=C1Br B44103 [1,1,0,0,0,0|0,0,2]=4 676 B10R1.2 N#CC1=CC=CC(F)=C1Cl C62308 [1,1,0,0,0,0|0,0,2]=4 677 B10R1.2 N#CC1=CC=CC(F)=C1F D67980 [1,1,0,0,0,0|0,0,2]=4 678 B10R1.2 N#CC1=CC=CC(F)=C1I F44134 [1,1,0,0,0,0|0,0,2]=4 679 B10R1.2 N#CC1=CC=CC(F)=C1N A37388 [1,1,0,0,0,0|0,0,2]=4 680 B10R1.2 N#CC1=CC=CC(F)=C1O F44545 [1,1,0,0,0,0|0,0,2]=4 681 B10R1.2 NC1=C(Br)C=CC=C1CO A46163 [1,1,0,0,0,0|1,1,0]=4 682 B10R1.2 NC1=C(Cl)C=CC=C1CO A46194 [1,1,0,0,0,0|1,1,0]=4 683 B10R1.2 NC1=C(F)C(CO)=CC=C1 A46217 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.2 NC1=C(F)C=CC=C1C=O A45494 [1,1,0,0,0,0|1,0,1]=4 685 B10R1.2 NC1=C(F)C=CC=C1CO A46214 [1,1,0,0,0,0|1,0,0]=3 686 B10R1.2 NC1=CC=CC(CO)=C1N D43630 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.2 NCC1=CC=CC(Br)=C1F B45783 [1,1,0,0,0,0|0,1,0]=3 688 B10R1.2 NCC1=CC=CC(Br)=C1F B67797 [1,1,0,0,0,0|0,1,0]=3 689 B10R1.2 NCC1=CC=CC(F)=C1Br B45782 [1,1,0,0,0,0|0,0,0]=2 690 B10R1.2 NCC1=CC=CC(I)=C1Br B45784 [1,1,0,0,0,0|0,1,0]=3 691 B10R1.2 NCC1=CC=CC(I)=C1Cl C45806 [1,1,0,0,0,0|0,1,0]=3 692 B10R1.2 NNC1=CC=CC(Cl)=C1Cl D42756 [1,1,0,0,0,0|1,1,0]=4 693 B10R1.2 NNC1=CC=CC(Cl)=C1F C42763 [1,1,0,0,0,0|1,1,0]=4 694 B10R1.2 NNC1=CC=CC(F)=C1Cl C42759 [1,1,0,0,0,0|1,0,0]=3 695 B10R1.2 NNC1=CC=CC(F)=C1F D38781 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.2 O=CC1=CC=CC(F)=C1Br B44644 [1,1,0,0,0,0|1,0,1]=4 697 B10R1.2 O=CC1=CC=CC(F)=C1Cl C44662 [1,1,0,0,0,0|1,0,1]=4 698 B10R1.2 O=CC1=CC=CC(F)=C1F D28638 [1,1,0,0,0,0|1,0,1]=4 699 B10R1.2 O=CC1=CC=CC(F)=C1O F45096 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.2 OCC1=CC=CC(Br)=C1Cl B45555 [1,1,0,0,0,0|1,1,0]=4 701 B10R1.2 OCC1=CC=CC(Br)=C1F B37891 [1,1,0,0,0,0|1,1,0]=4 702 B10R1.2 OCC1=CC=CC(Cl)=C1Cl D45588 [1,1,0,0,0,0|1,1,0]=4 703 B10R1.2 OCC1=CC=CC(F)=C1F D45606 [1,1,0,0,0,0|1,0,0]=3 704 B10R1.2 OCC1=CC=CC(I)=C1Br B45578 [1,1,0,0,0,0|1,1,0]=4 705 B10R1.8 BrCC1=CC(Br)=CC(Br)=C1 D44704 [1,1,0,0,0,0|1,1,0]=4 706 B10R1.8 C#CC1=CC(F)=CC(F)=C1 E47323 [1,1,0,0,0,0|0,0,2]=4 707 B10R1.8 CC1=CC(Br)=CC(CN)=N1 B38998 [1,1,0,0,0,0|1,1,0]=4 708 B10R1.8 CC1=CC(C)=CC(CBr)=C1 B49967 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.8 CC1=CC(C)=CC(NN)=C1 D49537 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.8 CC1=CC(F)=CC(C#N)=C1 F47977 [1,1,0,0,0,0|0,0,2]=4 711 B10R1.8 CC1=CC(F)=CC(C=O)=C1 F38057 [1,1,0,0,0,0|1,0,1]=4 712 B10R1.8 CCC1=CC(Br)=CC(N)=C1 B69513 [1,1,0,0,0,0|0,1,0]=3 713 B10R1.8 CCC1=CC(C)=CC(O)=C1 E50268 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.8 COC1=CC(Br)=CC(Br)=C1 D45551 [1,1,0,0,0,0|1,1,0]=4 715 B10R1.8 COC1=CC(Br)=CC(Cl)=C1 B45561 [1,1,0,0,0,0|1,1,0]=4 716 B10R1.8 COC1=CC(Br)=CC(F)=C1 B45574 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.8 COC1=CC(C)=CC(Br)=C1 B49436 [1,1,0,0,0,0|1,1,0]=4 718 B10R1.8 COC1=CC(C)=CC(C)=C1 M50277 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.8 COC1=CC(C)=CC(F)=C1 F49465 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.8 COC1=CC(F)=CC(F)=C1 D45609 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.8 COC1=CC(N)=CC(Br)=C1 B38030 [1,1,0,0,0,0|1,1,0]=4 722 B10R1.8 COC1=CC(N)=CC(C)=C1 M46900 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.8 COC1=CC(N)=CC(Cl)=C1 C46188 [1,1,0,0,0,0|1,1,0]=4 724 B10R1.8 COC1=CC(N)=CC(F)=C1 F46207 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.8 COC1=CC(O)=CC(Br)=C1 B45900 [1,1,0,0,0,0|1,1,0]=4 726 B10R1.8 COC1=CC(O)=CC(Cl)=C1 C45911 [1,1,0,0,0,0|1,1,0]=4 727 B10R1.8 COC1=CC(O)=CC(F)=C1 F45917 [1,1,0,0,0,0|1,0,0]=3 728 B10R1.8 COC1=CC(O)=CC(N)=C1 A46395 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.8 COC1=CC([Mg+])=CC(F)=C1 F31772 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.8 ClC1=CC(Cl)=CC(CBr)=C1 B44707 [1,1,0,0,0,0|1,1,0]=4 731 B10R1.8 ClCC1=CC(Cl)=CC(Cl)=C1 D44731 [1,1,0,0,0,0|1,1,0]=4 732 B10R1.8 FC1=CC(CBr)=CC(Br)=C1 B44696 [1,1,0,0,0,0|1,0,0]=3 733 B10R1.8 FC1=CC(F)=CC(CBr)=C1 D19556 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.8 N#CC1=CC(Br)=CC(F)=C1 B44109 [1,1,0,0,0,0|0,0,2]=4 735 B10R1.8 N#CC1=CC(Cl)=CC(F)=C1 C44123 [1,1,0,0,0,0|0,0,2]=4 736 B10R1.8 N#CC1=CC(F)=CC(F)=C1 D44133 [1,1,0,0,0,0|0,0,2]=4 737 B10R1.8 N#CC1=CC(F)=CC(N)=C1 A44795 [1,1,0,0,0,0|0,0,2]=4 738 B10R1.8 N#CC1=CC(F)=CC(O)=C1 F44547 [1,1,0,0,0,0|0,0,2]=4 739 B10R1.8 N#CC1=CC(I)=CC(F)=C1 F44136 [1,1,0,0,0,0|0,0,2]=4 740 B10R1.8 NC1=CC(CO)=CC(Cl)=C1 A46198 [1,1,0,0,0,0|1,1,0]=4 741 B10R1.8 NCC1=CC(Cl)=CC(Cl)=C1 D45786 [1,1,0,0,0,0|0,1,0]=3 742 B10R1.8 NCC1=CC(Cl)=CC(F)=C1 C45799 [1,1,0,0,0,0|0,0,0]=2 743 B10R1.8 NCC1=CC(Cl)=NC(Cl)=C1 D42745 [1,1,0,0,0,0|1,1,0]=4 744 B10R1.8 NCC1=CC(F)=CC(F)=C1 D45808 [1,1,0,0,0,0|0,0,0]=2 745 B10R1.8 NNC1=CC(Cl)=CC(Cl)=C1 D42755 [1,1,0,0,0,0|1,1,0]=4 746 B10R1.8 NNC1=CC(F)=CC(F)=C1 D43517 [1,1,0,0,0,0|1,0,0]=3 747 B10R1.8 NNC1=CC(F)=NC(F)=C1 D40958 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.8 NOC1=CC(Cl)=CC(Cl)=C1 D42663 [1,1,0,0,0,0|1,1,0]=4 749 B10R1.8 O=CC1=CC(Br)=CC(F)=C1 B44645 [1,1,0,0,0,0|1,0,1]=4 750 B10R1.8 O=CC1=CC(Cl)=CC(F)=C1 C44665 [1,1,0,0,0,0|1,0,1]=4 751 B10R1.8 O=CC1=CC(F)=CC(F)=C1 D23035 [1,1,0,0,0,0|1,0,1]=4 752 B10R1.8 O=CC1=CC(F)=CC(O)=C1 F45102 [1,1,0,0,0,0|1,0,1]=4 753 B10R1.8 OCC1=CC(Br)=CC(Br)=C1 D45547 [1,1,0,0,0,0|1,1,0]=4 754 B10R1.8 OCC1=CC(Br)=CC(F)=C1 B38393 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.8 OCC1=CC(Cl)=CC(Cl)=C1 D45587 [1,1,0,0,0,0|1,1,0]=4 756 B10R1.8 OCC1=CC(I)=CC(I)=C1 D45611 [1,1,0,0,0,0|1,1,0]=4 757 B10R1.30 CC1=C(C#N)C=C(F)C=C1 F47980 [1,1,0,0,0,0|0,0,2]=4 758 B10R1.30 CC1=C(C=O)C=C(F)C=C1 F48743 [1,1,0,0,0,0|1,0,1]=4 759 B10R1.30 CC1=C(CBr)C=C(F)C=C1 B48769 [1,1,0,0,0,0|1,0,0]=3 760 B10R1.30 CC1=C(CO)C=C(Br)C=C1 B67343 [1,1,0,0,0,0|1,1,0]=4 761 B10R1.30 CC1=C(CO)C=C(I)C=C1 K49473 [1,1,0,0,0,0|1,1,0]=4 762 B10R1.30 CC1=C(NN)C=C(Br)C=C1 B62458 [1,1,0,0,0,0|1,1,0]=4 763 B10R1.30 CC1=C(NN)C=C(Cl)C=C1 C46308 [1,1,0,0,0,0|1,1,0]=4 764 B10R1.30 CC1=CC(CO)=C(Br)C=C1 B63209 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.30 CC1=CC(NN)=C(C)C=C1 D49535 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.30 CC1=CC(NN)=C(Cl)C=C1 C46307 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.30 CCC1=C(Br)C=CC(O)=C1 B49425 [1,1,0,0,0,0|1,0,0]=3 768 B10R1.30 CCC1=C(F)C=CC(Br)=C1 B48764 [1,1,0,0,0,0|0,1,0]=3 769 B10R1.30 CCC1=C(N)C=CC(Br)=C1 B66403 [1,1,0,0,0,0|0,1,0]=3 770 B10R1.30 CCC1=C(N)C=CC(Cl)=C1 C46752 [1,1,0,0,0,0|0,1,0]=3 771 B10R1.30 CCN1C=C(Br)C=CC1=O B46165 [1,1,0,0,0,0|1,1,0]=4 772 B10R1.30 CNC1=C(C)C=CC(O)=C1 M46910 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.30 CNC1=C(N)C=CC(Br)=C1 B46288 [1,1,0,0,0,0|1,1,0]=4 774 B10R1.30 CNC1=C(N)C=CC(C)=C1 D46972 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.30 CNC1=C(N)C=CC(Cl)=C1 C46304 [1,1,0,0,0,0|1,1,0]=4 776 B10R1.30 COC1=C(Br)C=CC(Br)=C1 D45542 [1,1,0,0,0,0|1,1,0]=4 777 B10R1.30 COC1=C(Br)C=CC(C)=C1 B49434 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 B45562 [1,1,0,0,0,0|1,1,0]=4 779 B10R1.30 COC1=C(Br)C=CC(F)=C1 B45575 [1,1,0,0,0,0|1,0,0]=3 780 B10R1.30 COC1=C(Br)C=CC(I)=C1 B45582 [1,1,0,0,0,0|1,1,0]=4 781 B10R1.30 COC1=C(Br)C=CC(N)=C1 B46156 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.30 COC1=C(Br)C=CC(O)=C1 B45901 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.30 COC1=C(C)C=CC(Br)=C1 B49441 [1,1,0,0,0,0|1,1,0]=4 784 B10R1.30 COC1=C(C)C=CC(C)=C1 M50278 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.30 COC1=C(C)C=CC(N)=C1 M46899 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 B45554 [1,1,0,0,0,0|1,1,0]=4 787 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 D45591 [1,1,0,0,0,0|1,1,0]=4 788 B10R1.30 COC1=C(Cl)C=CC(F)=C1 C45592 [1,1,0,0,0,0|1,0,0]=3 789 B10R1.30 COC1=C(Cl)C=CC(I)=C1 C45601 [1,1,0,0,0,0|1,1,0]=4 790 B10R1.30 COC1=C(Cl)C=CC(N)=C1 C46190 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.30 COC1=C(Cl)C=CC(O)=C1 C45912 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.30 COC1=C(F)C=CC(Br)=C1 B45577 [1,1,0,0,0,0|1,1,0]=4 793 B10R1.30 COC1=C(F)C=CC(I)=C1 F63969 [1,1,0,0,0,0|1,1,0]=4 794 B10R1.30 COC1=C(F)C=CC(N)=C1 F46210 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.30 COC1=C(F)C=CC(O)=C1 F45918 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.30 COC1=C(I)C=CC(Br)=C1 B38625 [1,1,0,0,0,0|1,1,0]=4 797 B10R1.30 COC1=C(I)C=CC(Cl)=C1 C45603 [1,1,0,0,0,0|1,1,0]=4 798 B10R1.30 COC1=C(I)C=CC(N)=C1 K46230 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.30 COC1=C(N)C=CC(Br)=C1 B37849 [1,1,0,0,0,0|1,1,0]=4 800 B10R1.30 COC1=C(N)C=CC(C)=C1 M69494 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.30 COC1=C(N)C=CC(Cl)=C1 C46189 [1,1,0,0,0,0|1,1,0]=4 802 B10R1.30 COC1=C(N)C=CC(Cl)=C1 C46203 [1,1,0,0,0,0|1,1,0]=4 803 B10R1.30 COC1=C(N)C=CC(F)=C1 F46209 [1,1,0,0,0,0|1,0,0]=3 804 B10R1.30 COC1=C(N)C=CC(N)=C1 M43596 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.30 COC1=C(O)C=CC(Br)=C1 B1785 [1,1,0,0,0,0|1,1,0]=4 806 B10R1.30 COC1=C(O)C=CC(C)=C1 M69495 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.30 COC1=C(O)C=CC(Cl)=C1 C63275 [1,1,0,0,0,0|1,1,0]=4 808 B10R1.30 COC1=C(O)C=CC(F)=C1 F23730 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.30 COC1=C(O)C=CC(N)=C1 A46396 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.30 COC1=C([Mg+])C=CC(Cl)=C1 C31792 [1,1,0,0,0,0|1,1,0]=4 811 B10R1.30 COC1=CC(F)=CN=C1N F43083 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.30 CSC1=C(N)C=CC(Br)=C1 B69348 [1,1,0,0,0,0|1,1,0]=4 813 B10R1.30 ClC1=CC(CBr)=C(Br)C=C1 B44690 [1,1,0,0,0,0|1,1,0]=4 814 B10R1.30 ClC1=CC(CBr)=C(Cl)C=C1 B44708 [1,1,0,0,0,0|1,1,0]=4 815 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 B44711 [1,1,0,0,0,0|1,1,0]=4 816 B10R1.30 FC1=C(CBr)C=C(Br)C=C1 B44693 [1,1,0,0,0,0|1,1,0]=4 817 B10R1.30 N#CC1=C(Br)C=CC(F)=C1 B44105 [1,1,0,0,0,0|0,0,2]=4 818 B10R1.30 N#CC1=C(Cl)C=CC(F)=C1 C44121 [1,1,0,0,0,0|0,0,2]=4 819 B10R1.30 N#CC1=C(F)C=CC(F)=C1 D44132 [1,1,0,0,0,0|0,0,2]=4 820 B10R1.30 N#CC1=C(N)C=CC(F)=C1 A44793 [1,1,0,0,0,0|0,0,2]=4 821 B10R1.30 N#CC1=C(O)C=CC(F)=C1 F44550 [1,1,0,0,0,0|0,0,2]=4 822 B10R1.30 NC1=C(CO)C=C(Br)C=C1 A10854 [1,1,0,0,0,0|1,1,0]=4 823 B10R1.30 NC1=C(CO)C=C(Cl)C=C1 A46196 [1,1,0,0,0,0|1,1,0]=4 824 B10R1.30 NC1=C(CO)C=C(F)C=C1 A46215 [1,1,0,0,0,0|1,0,0]=3 825 B10R1.30 NC1=CC(CO)=C(F)C=C1 A46219 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.30 NCC1=C(Br)C=CC(Cl)=N1 B42733 [1,1,0,0,0,0|1,1,0]=4 827 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 D45793 [1,1,0,0,0,0|0,1,0]=3 828 B10R1.30 NCC1=C(F)C=CC(Br)=C1 B61206 [1,1,0,0,0,0|0,1,0]=3 829 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 C38176 [1,1,0,0,0,0|0,1,0]=3 830 B10R1.30 NCC1=C(F)C=CC(F)=C1 D45811 [1,1,0,0,0,0|0,0,0]=2 831 B10R1.30 NCC1=C(N)C=CC(Br)=C1 A46294 [1,1,0,0,0,0|0,1,0]=3 832 B10R1.30 NCC1=C(N)C=CC(Cl)=C1 A46298 [1,1,0,0,0,0|0,1,0]=3 833 B10R1.30 NCC1=C(O)C=CC(Br)=C1 A46182 [1,1,0,0,0,0|0,1,0]=3 834 B10R1.30 NCC1=CC(Br)=CN=C1F A12901 [1,1,0,0,0,0|1,1,0]=4 835 B10R1.30 NNC1=C(Br)C=CC(Br)=C1 D42724 [1,1,0,0,0,0|1,1,0]=4 836 B10R1.30 NNC1=C(Br)C=CC(F)=C1 B42737 [1,1,0,0,0,0|1,0,0]=3 837 B10R1.30 NNC1=C(Cl)C=CC(Cl)=C1 D42757 [1,1,0,0,0,0|1,1,0]=4 838 B10R1.30 NNC1=C(Cl)C=CC(F)=C1 C42761 [1,1,0,0,0,0|1,0,0]=3 839 B10R1.30 NNC1=C(F)C=CC(Br)=C1 B42740 [1,1,0,0,0,0|1,1,0]=4 840 B10R1.30 NNC1=C(F)C=CC(F)=C1 D43515 [1,1,0,0,0,0|1,0,0]=3 841 B10R1.30 O=CC1=C(Cl)C=CC(F)=C1 C44663 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.30 O=CC1=C(F)C=CC(F)=C1 D44676 [1,1,0,0,0,0|1,0,1]=4 843 B10R1.30 O=CC1=C(O)C=CC(F)=C1 F67833 [1,1,0,0,0,0|1,0,1]=4 844 B10R1.30 OCC1=C(Br)C=CC(Br)=C1 D45545 [1,1,0,0,0,0|1,1,0]=4 845 B10R1.30 OCC1=C(Br)C=CC(Cl)=C1 B45558 [1,1,0,0,0,0|1,1,0]=4 846 B10R1.30 OCC1=C(Br)C=CC(F)=C1 B45568 [1,1,0,0,0,0|1,0,0]=3 847 B10R1.30 OCC1=C(Br)C=CC(I)=C1 B45579 [1,1,0,0,0,0|1,1,0]=4 848 B10R1.30 OCC1=C(Cl)C=CC(Br)=C1 B45559 [1,1,0,0,0,0|1,1,0]=4 849 B10R1.30 OCC1=C(Cl)C=CC(Cl)=C1 D45589 [1,1,0,0,0,0|1,1,0]=4 850 B10R1.30 OCC1=C(Cl)C=CC(F)=C1 C45595 [1,1,0,0,0,0|1,0,0]=3 851 B10R1.30 OCC1=C(Cl)C=CC(O)=C1 C45913 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.30 OCC1=C(F)C=CC(Br)=C1 B45571 [1,1,0,0,0,0|1,1,0]=4 853 B10R1.30 OCC1=C(I)C=CC(Br)=C1 B45580 [1,1,0,0,0,0|1,1,0]=4 854 B10R1.30 OCC1=C(O)C=CC(Br)=C1 B68796 [1,1,0,0,0,0|1,1,0]=4 855 B10R1.113 CC(=O)C1=CC(C)=CC=C1 T39528 [1,1,0,0,0,0|1,0,1]=4 856 B10R1.113 CC(=O)C1=CC(F)=CN=C1 F45496 [1,1,0,0,0,0|1,0,1]=4 857 B10R1.113 CC(=O)C1=CC(N)=CC=C1 A68568 [1,1,0,0,0,0|1,0,1]=4 858 B10R1.113 CC(=O)C1=CC(O)=CC=C1 H60763 [1,1,0,0,0,0|1,0,1]=4 859 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 C69069 [1,1,0,0,0,0|0,1,1]=4 860 B10R1.113 CC(=O)C1=CC=CC(F)=C1 F48736 [1,1,0,0,0,0|0,0,1]=3 861 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F45497 [1,1,0,0,0,0|1,0,1]=4 862 B10R1.113 CC(=O)C1=CC=CC(I)=C1 I37889 [1,1,0,0,0,0|0,1,1]=4 863 B10R1.113 CC(C)C1=CC(Br)=CN=C1 B32128 [1,1,0,0,0,0|1,1,0]=4 864 B10R1.113 CC(C)C1=CC(Br)=NC=C1 B46727 [1,1,0,0,0,0|1,1,0]=4 865 B10R1.113 CC(C)C1=CC=CC(Br)=C1 B49962 [1,1,0,0,0,0|0,1,0]=3 866 B10R1.113 CC(C)C1=CC=CC(Br)=N1 B46729 [1,1,0,0,0,0|1,1,0]=4 867 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 C37539 [1,1,0,0,0,0|1,1,0]=4 868 B10R1.113 CC(C)C1=CC=CC(N)=C1 P50307 [1,1,0,0,0,0|1,0,0]=3 869 B10R1.113 CC(C)C1=CC=CC([Mg+])=C1 P31758 [1,1,0,0,0,0|1,0,0]=3 870 B10R1.113 CC(C)C1=CN=CC(N)=C1 I32297 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.113 CC(C)C1=NC=CC(Br)=C1 B63808 [1,1,0,0,0,0|1,1,0]=4 872 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 C39059 [1,1,0,0,0,0|1,1,0]=4 873 B10R1.113 CC1=CC=CC(C(=N)N)=C1 M49488 [1,1,0,0,0,0|1,0,1]=4 874 B10R1.113 CC1=CC=CC(N(C)C)=C1 T39548 [1,1,0,0,0,0|2,0,0]=4 875 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 T50311 [1,1,0,0,0,0|1,0,0]=3 876 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 T52159 [1,1,0,0,0,0|1,0,0]=3 877 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 T50309 [1,1,0,0,0,0|1,0,0]=3 878 B10R1.113 CN(C)C1=CC(F)=NC=C1 F46309 [1,1,0,0,0,0|2,0,0]=4 879 B10R1.113 CN(C)C1=CC(N)=CC=C1 D49538 [1,1,0,0,0,0|2,0,0]=4 880 B10R1.113 CN(C)C1=CC(N)=CC=C1 D49665 [1,1,0,0,0,0|2,0,0]=4 881 B10R1.113 CN(C)C1=CC=CC(Br)=C1 B68052 [1,1,0,0,0,0|1,1,0]=4 882 B10R1.113 CN(C)C1=CC=CC(F)=C1 F46763 [1,1,0,0,0,0|1,0,0]=3 883 B10R1.113 CN(C)C1=CC=CC([Mg+])=C1 D31761 [1,1,0,0,0,0|2,0,0]=4 884 B10R1.113 C[C@@H](N)C1=CC(Br)=NC=C1 B46295 [1,1,0,0,0,0|1,1,0]=4 885 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 B46734 [1,1,0,0,0,0|0,1,0]=3 886 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=N1 B46291 [1,1,0,0,0,0|1,1,0]=4 887 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 F46765 [1,1,0,0,0,0|0,0,0]=2 888 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 F49508 [1,1,0,0,0,0|0,0,0]=2 889 B10R1.113 C[C@@H](N)C1=CC=CC(F)=N1 F46611 [1,1,0,0,0,0|1,0,0]=3 890 B10R1.113 C[C@@H](N)C1=CC=CC(O)=C1 A49524 [1,1,0,0,0,0|1,0,0]=3 891 B10R1.113 C[C@@H](O)C1=CC=CC(Cl)=C1 C49447 [1,1,0,0,0,0|0,1,0]=3 892 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 C13483 [1,1,0,0,0,0|1,1,0]=4 893 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 F46567 [1,1,0,0,0,0|1,0,0]=3 894 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B46739 [1,1,0,0,0,0|0,1,0]=3 895 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B46743 [1,1,0,0,0,0|0,1,0]=3 896 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B64158 [1,1,0,0,0,0|0,1,0]=3 897 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 C46299 [1,1,0,0,0,0|1,1,0]=4 898 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 F46761 [1,1,0,0,0,0|0,0,0]=2 899 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 F49511 [1,1,0,0,0,0|0,0,0]=2 900 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 F46568 [1,1,0,0,0,0|1,0,0]=3 901 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 A46961 [1,1,0,0,0,0|1,0,0]=3 902 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 A64155 [1,1,0,0,0,0|1,0,0]=3 903 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 A64991 [1,1,0,0,0,0|1,0,0]=3 904 B10R1.113 C[C@H](O)C1=CC(N)=CC=C1 A46893 [1,1,0,0,0,0|1,0,0]=3 905 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 B49430 [1,1,0,0,0,0|0,1,0]=3 906 B10R1.113 C[C@H](O)C1=CC=CC(Br)=N1 B37443 [1,1,0,0,0,0|1,1,0]=4 907 B10R1.113 C[C@H](O)C1=NC=CC(Cl)=C1 C46192 [1,1,0,0,0,0|1,1,0]=4 908 B10R1.113 FC(F)C1=CC=CC(Br)=C1 B44723 [1,1,0,0,0,0|1,1,0]=4 909 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 B45618 [1,1,0,0,0,0|0,1,1]=4 910 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 C69433 [1,1,0,0,0,0|0,1,1]=4 911 B10R1.113 N=C(N)C1=CC=CC(F)=C1 F46533 [1,1,0,0,0,0|0,0,1]=3 912 B10R1.113 NC(=O)C1=CC(O)=CC=C1 H45813 [1,1,0,0,0,0|1,0,1]=4 913 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 B45466 [1,1,0,0,0,0|0,1,1]=4 914 B10R1.113 NC(=O)C1=CC=CC(F)=C1 F45492 [1,1,0,0,0,0|0,0,1]=3 915 B10R1.113 O=C(O)C1=CC=CC(F)=C1 F68888 [1,1,0,0,0,0|1,0,1]=4 916 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 F42253 [1,1,0,0,0,0|2,0,0]=4 917 B10R1.113 OB(O)C1=CC=CC(F)=C1 F3360 [1,1,0,0,0,0|2,0,0]=4 918 B10R1.172 BrCC1=CC=CC(CBr)=C1 B48751 [1,1,0,0,0,0|1,1,0]=4 919 B10R1.172 C#CC1=CC=CC(CN)=C1 E39003 [1,1,0,0,0,0|1,0,0]=3 920 B10R1.172 C#CC1=CC=CC(OC)=C1 E25312 [1,1,0,0,0,0|2,0,0]=4 921 B10R1.172 CCC1=CC=CC(C#N)=C1 E38775 [1,1,0,0,0,0|1,0,0]=3 922 B10R1.172 CCC1=CC=CC(C#N)=N1 E13406 [1,1,0,0,0,0|2,0,0]=4 923 B10R1.172 CCC1=CC=CC(C=O)=C1 E49870 [1,1,0,0,0,0|1,0,0]=3 924 B10R1.172 CCC1=CC=CC(C=O)=N1 E49258 [1,1,0,0,0,0|2,0,0]=4 925 B10R1.172 CCC1=CC=CC(CC)=N1 D50308 [1,1,0,0,0,0|2,0,0]=4 926 B10R1.172 CCC1=CC=CC(CO)=N1 E46907 [1,1,0,0,0,0|2,0,0]=4 927 B10R1.172 CCC1=CC=CC(NC)=N1 E46969 [1,1,0,0,0,0|2,0,0]=4 928 B10R1.172 CCC1=NC=CC(C#N)=C1 E48777 [1,1,0,0,0,0|2,0,0]=4 929 B10R1.172 CNC1=CC=CC(C#N)=C1 M48778 [1,1,0,0,0,0|2,0,0]=4 930 B10R1.172 COC1=CC(C#N)=CC=C1 M65442 [1,1,0,0,0,0|2,0,0]=4 931 B10R1.172 COC1=CC(CN)=CC=C1 M27985 [1,1,0,0,0,0|1,0,0]=3 932 B10R1.172 COC1=CC(CN)=NC=C1 M36712 [1,1,0,0,0,0|2,0,0]=4 933 B10R1.172 COC1=CC(CN)=NC=C1 M46591 [1,1,0,0,0,0|2,0,0]=4 934 B10R1.172 COC1=CC(CO)=CC=C1 M39430 [1,1,0,0,0,0|2,0,0]=4 935 B10R1.172 COC1=CC(NN)=CC=C1 M69005 [1,1,0,0,0,0|2,0,0]=4 936 B10R1.172 COC1=CC=CC(C=O)=C1 M67838 [1,1,0,0,0,0|2,0,0]=4 937 B10R1.172 COC1=CC=CC(CCl)=C1 C49452 [1,1,0,0,0,0|1,1,0]=4 938 B10R1.172 COC1=CN=CC(CN)=C1 M11309 [1,1,0,0,0,0|2,0,0]=4 939 B10R1.172 COC1=NC(CN)=CC=C1 M46592 [1,1,0,0,0,0|2,0,0]=4 940 B10R1.172 COC1=NC=CC(CN)=C1 M0578 [1,1,0,0,0,0|2,0,0]=4 941 B10R1.172 ClCC1=CC=CC(CCl)=C1 B48773 [1,1,0,0,0,0|1,1,0]=4 942 B10R1.172 N#CC1=CC(CN)=CC=C1 A37624 [1,1,0,0,0,0|1,0,0]=3 943 B10R1.172 N#CC1=CC(NN)=CC=C1 C46543 [1,1,0,0,0,0|2,0,0]=4 944 B10R1.172 N#CC1=CC=CC(CBr)=C1 B47943 [1,1,0,0,0,0|2,0,0]=4 945 B10R1.172 N#CC1=CC=CC(CCl)=C1 C47958 [1,1,0,0,0,0|2,0,0]=4 946 B10R1.172 N#CC1=CC=CC(CO)=C1 C48440 [1,1,0,0,0,0|2,0,0]=4 947 B10R1.172 N#CC1=CN=CC(CN)=C1 A32262 [1,1,0,0,0,0|2,0,0]=4 948 B10R1.172 NCC1=CC=CC(CO)=C1 A46908 [1,1,0,0,0,0|1,0,0]=3 949 B10R1.172 NCC1=CC=CC(CO)=N1 A46595 [1,1,0,0,0,0|2,0,0]=4 950 B10R1.172 O=CC1=CC(CO)=CC=C1 H36764 [1,1,0,0,0,0|2,0,0]=4 951 B10R1.172 O=CC1=CC=CC(CBr)=C1 B48710 [1,1,0,0,0,0|2,0,0]=4 952 B10R1.172 OCC1=CC=CC(CCl)=C1 C49450 [1,1,0,0,0,0|1,1,0]=4 953 B10R1.176 BrCC1=CC(Br)=C(Br)C=C1 D44703 [1,1,0,0,0,0|1,1,0]=4 954 B10R1.176 C=CC1=CC(F)=C(Cl)C=C1 C60746 [1,1,0,0,0,0|0,0,2]=4 955 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 B38347 [1,1,0,0,0,0|1,1,0]=4 956 B10R1.176 CC1=C(Br)C=C(CO)C=C1 B49432 [1,1,0,0,0,0|1,1,0]=4 957 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 B48757 [1,1,0,0,0,0|2,0,0]=4 958 B10R1.176 CC1=C(Br)C=CC(CO)=C1 B49433 [1,1,0,0,0,0|2,0,0]=4 959 B10R1.176 CC1=C(C)C=C(CCl)C=C1 C49971 [1,1,0,0,0,0|2,0,0]=4 960 B10R1.176 CC1=C(C)C=C(CO)C=C1 D50275 [1,1,0,0,0,0|2,0,0]=4 961 B10R1.176 CC1=C(C)C=C(NN)C=C1 D39524 [1,1,0,0,0,0|2,0,0]=4 962 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 C46749 [1,1,0,0,0,0|0,1,0]=3 963 B10R1.176 CC1=C(F)C=C(C#N)C=C1 F47976 [1,1,0,0,0,0|0,0,2]=4 964 B10R1.176 CC1=C(F)C=C(CO)C=N1 F46223 [1,1,0,0,0,0|2,0,0]=4 965 B10R1.176 CC1=C(F)C=C(NN)C=C1 F46563 [1,1,0,0,0,0|1,0,0]=3 966 B10R1.176 CC1=C(F)C=CC(CN)=C1 F46767 [1,1,0,0,0,0|1,0,0]=3 967 B10R1.176 CC1=C(I)C=C(CO)C=C1 K63324 [1,1,0,0,0,0|1,1,0]=4 968 B10R1.176 CC1=C(O)C=CC(CO)=C1 H46832 [1,1,0,0,0,0|2,0,0]=4 969 B10R1.176 CCC1=CC(Br)=C(O)C=C1 B49424 [1,1,0,0,0,0|0,1,0]=3 970 B10R1.176 CCC1=CC(C)=C(C)C=C1 E53022 [1,1,0,0,0,0|1,0,0]=3 971 B10R1.176 CCC1=CC(C)=C(I)C=C1 E49973 [1,1,0,0,0,0|1,0,0]=3 972 B10R1.176 CCC1=CC(F)=C(N)C=C1 E46758 [1,1,0,0,0,0|0,0,0]=2 973 B10R1.176 CCC1=CC(N)=C(N)C=C1 E49664 [1,1,0,0,0,0|1,0,0]=3 974 B10R1.176 CCC1=CC(O)=C(N)C=C1 A49521 [1,1,0,0,0,0|1,0,0]=3 975 B10R1.176 CCC1=NC(Cl)=C(Br)C=C1 B45765 [1,1,0,0,0,0|1,1,0]=4 976 B10R1.176 CN1C=C(CN)C=CC1=O A12261 [1,1,0,0,0,0|2,0,0]=4 977 B10R1.176 CN1C=C(CN)C=CC1=O A31857 [1,1,0,0,0,0|2,0,0]=4 978 B10R1.176 CN1C=CC(CN)=CC1=O A10237 [1,1,0,0,0,0|2,0,0]=4 979 B10R1.176 CN1C=CC(CN)=CC1=O A7466 [1,1,0,0,0,0|2,0,0]=4 980 B10R1.176 CNC1=CC(Cl)=C(Cl)C=C1 D45789 [1,1,0,0,0,0|1,1,0]=4 981 B10R1.176 COC1=CC(Br)=C(Br)C=C1 D45549 [1,1,0,0,0,0|1,1,0]=4 982 B10R1.176 COC1=CC(Br)=C(C)C=C1 B49439 [1,1,0,0,0,0|1,1,0]=4 983 B10R1.176 COC1=CC(Br)=C(Cl)C=C1 B45563 [1,1,0,0,0,0|1,1,0]=4 984 B10R1.176 COC1=CC(Br)=C(F)C=C1 B45565 [1,1,0,0,0,0|1,1,0]=4 985 B10R1.176 COC1=CC(Br)=C(I)C=C1 B45583 [1,1,0,0,0,0|1,1,0]=4 986 B10R1.176 COC1=CC(Br)=C(N)C=C1 B38510 [1,1,0,0,0,0|1,1,0]=4 987 B10R1.176 COC1=CC(Br)=C(O)C=C1 B38008 [1,1,0,0,0,0|1,1,0]=4 988 B10R1.176 COC1=CC(C)=C(Br)C=C1 B49437 [1,1,0,0,0,0|2,0,0]=4 989 B10R1.176 COC1=CC(C)=C(F)C=C1 F49456 [1,1,0,0,0,0|2,0,0]=4 990 B10R1.176 COC1=CC(C)=C(O)C=C1 H38045 [1,1,0,0,0,0|2,0,0]=4 991 B10R1.176 COC1=CC(C)=C([Mg+])C=C1 M31768 [1,1,0,0,0,0|2,0,0]=4 992 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 B45553 [1,1,0,0,0,0|1,1,0]=4 993 B10R1.176 COC1=CC(Cl)=C(C)C=C1 C49453 [1,1,0,0,0,0|1,1,0]=4 994 B10R1.176 COC1=CC(Cl)=C(Cl)C=C1 D45585 [1,1,0,0,0,0|1,1,0]=4 995 B10R1.176 COC1=CC(Cl)=C(F)C=C1 C45600 [1,1,0,0,0,0|1,1,0]=4 996 B10R1.176 COC1=CC(Cl)=C(I)C=C1 C63668 [1,1,0,0,0,0|1,1,0]=4 997 B10R1.176 COC1=CC(Cl)=C(N)C=C1 C37946 [1,1,0,0,0,0|1,1,0]=4 998 B10R1.176 COC1=CC(Cl)=C(O)C=C1 C45910 [1,1,0,0,0,0|1,1,0]=4 999 B10R1.176 COC1=CC(F)=C(Br)C=C1 B45566 [1,1,0,0,0,0|1,0,0]=3 1000 B10R1.176 COC1=CC(F)=C(Br)C=N1 B60043 [1,1,0,0,0,0|2,0,0]=4 1001 B10R1.176 COC1=CC(F)=C(C)C=C1 F49466 [1,1,0,0,0,0|1,0,0]=3 1002 B10R1.176 COC1=CC(F)=C(Cl)C=C1 C45599 [1,1,0,0,0,0|1,0,0]=3 1003 B10R1.176 COC1=CC(F)=C(F)C=C1 D65181 [1,1,0,0,0,0|1,0,0]=3 1004 B10R1.176 COC1=CC(F)=C(N)C=C1 F38553 [1,1,0,0,0,0|1,0,0]=3 1005 B10R1.176 COC1=CC(F)=C(N)N=C1 F43081 [1,1,0,0,0,0|2,0,0]=4 1006 B10R1.176 COC1=CC(I)=C(Br)C=C1 B38541 [1,1,0,0,0,0|1,1,0]=4 1007 B10R1.176 COC1=CC(I)=C(Cl)C=C1 C63030 [1,1,0,0,0,0|1,1,0]=4 1008 B10R1.176 COC1=CC(I)=C(N)C=C1 K46228 [1,1,0,0,0,0|1,1,0]=4 1009 B10R1.176 COC1=CC(N)=C(Br)C=C1 B46152 [1,1,0,0,0,0|2,0,0]=4 1010 B10R1.176 COC1=CC(N)=C(C)C=C1 M46901 [1,1,0,0,0,0|2,0,0]=4 1011 B10R1.176 COC1=CC(N)=C(Cl)C=C1 C46185 [1,1,0,0,0,0|2,0,0]=4 1012 B10R1.176 COC1=CC(N)=C(F)C=C1 F36653 [1,1,0,0,0,0|2,0,0]=4 1013 B10R1.176 COC1=CC(N)=C(I)C=C1 I5695 [1,1,0,0,0,0|2,0,0]=4 1014 B10R1.176 COC1=CC(N)=C(N)C=C1 M43632 [1,1,0,0,0,0|2,0,0]=4 1015 B10R1.176 COC1=CC(N)=C(N)C=C1 M46463 [1,1,0,0,0,0|2,0,0]=4 1016 B10R1.176 COC1=CC(N)=C(O)C=C1 A46393 [1,1,0,0,0,0|2,0,0]=4 1017 B10R1.176 COC1=CC(O)=C(Br)C=C1 B45898 [1,1,0,0,0,0|2,0,0]=4 1018 B10R1.176 COC1=CC(O)=C(C)C=C1 M46827 [1,1,0,0,0,0|2,0,0]=4 1019 B10R1.176 COC1=CC(O)=C(I)C=C1 K45922 [1,1,0,0,0,0|2,0,0]=4 1020 B10R1.176 COC1=CC(O)=C(N)C=C1 A46394 [1,1,0,0,0,0|2,0,0]=4 1021 B10R1.176 COC1=CC(O)=C(N)C=C1 A46576 [1,1,0,0,0,0|2,0,0]=4 1022 B10R1.176 ClC1=C(Cl)C=C(CBr)C=C1 D44705 [1,1,0,0,0,0|1,1,0]=4 1023 B10R1.176 FC1=C(Br)C=C(CBr)C=C1 B44699 [1,1,0,0,0,0|1,1,0]=4 1024 B10R1.176 FC1=C(Br)C=CC(CBr)=C1 B44697 [1,1,0,0,0,0|1,0,0]=3 1025 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 B44717 [1,1,0,0,0,0|1,1,0]=4 1026 B10R1.176 FC1=C(Cl)C=C(CCl)C=C1 C44729 [1,1,0,0,0,0|1,1,0]=4 1027 B10R1.176 N#CC1=CC(F)=C(Br)C=C1 B44110 [1,1,0,0,0,0|0,0,2]=4 1028 B10R1.176 N#CC1=CC(F)=C(Cl)C=C1 C44125 [1,1,0,0,0,0|0,0,2]=4 1029 B10R1.176 N#CC1=CC(F)=C(F)C=C1 D39317 [1,1,0,0,0,0|0,0,2]=4 1030 B10R1.176 N#CC1=CC(F)=C(I)C=C1 F44135 [1,1,0,0,0,0|0,0,2]=4 1031 B10R1.176 N#CC1=CC(F)=C(N)C=C1 A38484 [1,1,0,0,0,0|0,0,2]=4 1032 B10R1.176 N#CC1=CC(F)=C(O)C=C1 F44546 [1,1,0,0,0,0|0,0,2]=4 1033 B10R1.176 NC1=C(Br)C=CC(CO)=C1 A63987 [1,1,0,0,0,0|2,0,0]=4 1034 B10R1.176 NC1=C(F)C=CC(CO)=C1 A46218 [1,1,0,0,0,0|2,0,0]=4 1035 B10R1.176 NC1=C(O)C=CC(CO)=C1 A46403 [1,1,0,0,0,0|2,0,0]=4 1036 B10R1.176 NCC1=CC(Cl)=C(Br)C=C1 B45768 [1,1,0,0,0,0|0,1,0]=3 1037 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 D45785 [1,1,0,0,0,0|0,1,0]=3 1038 B10R1.176 NCC1=CC(Cl)=C(F)C=C1 C45798 [1,1,0,0,0,0|0,1,0]=3 1039 B10R1.176 NCC1=CC(F)=C(Br)C=C1 B37399 [1,1,0,0,0,0|0,0,0]=2 1040 B10R1.176 NCC1=CC(F)=C(Cl)C=C1 C45803 [1,1,0,0,0,0|0,0,0]=2 1041 B10R1.176 NCC1=NC(Cl)=C(Br)C=C1 B36820 [1,1,0,0,0,0|1,1,0]=4 1042 B10R1.176 NNC1=CC(Cl)=C(Cl)C=C1 D42754 [1,1,0,0,0,0|1,1,0]=4 1043 B10R1.176 NNC1=CC(F)=C(Br)C=C1 B63571 [1,1,0,0,0,0|1,0,0]=3 1044 B10R1.176 NNC1=CC(F)=C(F)C=C1 D43516 [1,1,0,0,0,0|1,0,0]=3 1045 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 B18680 [1,1,0,0,0,0|1,0,1]=4 1046 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 C44666 [1,1,0,0,0,0|1,0,1]=4 1047 B10R1.176 O=CC1=CC(F)=C(F)C=C1 D39346 [1,1,0,0,0,0|1,0,1]=4 1048 B10R1.176 O=CC1=CC(F)=C(I)C=C1 F44687 [1,1,0,0,0,0|1,0,1]=4 1049 B10R1.176 O=CC1=CC(F)=C(O)C=C1 F45101 [1,1,0,0,0,0|1,0,1]=4 1050 B10R1.176 OCC1=CC(Br)=C(Cl)C=C1 B45556 [1,1,0,0,0,0|1,1,0]=4 1051 B10R1.176 OCC1=CC(Br)=C(O)C=C1 B45902 [1,1,0,0,0,0|1,1,0]=4 1052 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 D45586 [1,1,0,0,0,0|1,1,0]=4 1053 B10R1.176 OCC1=CC(F)=C(Br)C=C1 B45570 [1,1,0,0,0,0|1,0,0]=3 1054 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 C45597 [1,1,0,0,0,0|1,0,0]=3 1055 B10R1.176 OCC1=CC(F)=C(F)C=C1 D45608 [1,1,0,0,0,0|1,0,0]=3 1056 B10R1.176 OCC1=CC(O)=C(Br)C=C1 B45903 [1,1,0,0,0,0|2,0,0]=4 1057 B10R1.176 OCC1=CC(O)=C(F)C=C1 F45920 [1,1,0,0,0,0|2,0,0]=4 1058 B10R1.176 OCC1=CC(O)=C(I)C=C1 H45924 [1,1,0,0,0,0|2,0,0]=4 1059 B10R1.1 CC1=CC=C(CC#N)C=C1 M39574 [1,1,0,0,0,0|0,0,2]=4 1060 B10R1.1 CC1=CC=C(CCBr)C=C1 B0463 [1,1,0,0,0,0|1,0,0]=3 1061 B10R1.1 CC1=CC=C(CCO)C=C1 T50265 [1,1,0,0,0,0|1,0,0]=3 1062 B10R1.1 CC1=CC=C(CC[Mg+])C=C1 M31724 [1,1,0,0,0,0|1,0,0]=3 1063 B10R1.1 CC1=CC=C(CNN)C=C1 M49662 [1,1,0,0,0,0|1,0,0]=3 1064 B10R1.1 CC1=NC=C(CCO)C=C1 M15913 [1,1,0,0,0,0|2,0,0]=4 1065 B10R1.1 CCCC1=CC=C(Br)C=C1 B39542 [1,1,0,0,0,0|1,0,0]=3 1066 B10R1.1 CCCC1=CC=C(N)C=C1 P68566 [1,1,0,0,0,0|1,0,0]=3 1067 B10R1.1 CCCC1=CC=C([Mg+])C=C1 P31760 [1,1,0,0,0,0|1,0,0]=3 1068 B10R1.1 CCNC1=CC=C(F)C=C1 E46759 [1,1,0,0,0,0|2,0,0]=4 1069 B10R1.1 CCOC1=CC=C(I)C=C1 E49468 [1,1,0,0,0,0|2,0,0]=4 1070 B10R1.1 CCOC1=CC=C(O)C=C1 E68898 [1,1,0,0,0,0|2,0,0]=4 1071 B10R1.1 CCOC1=CC=C([Mg+])C=C1 E31767 [1,1,0,0,0,0|2,0,0]=4 1072 B10R1.1 CCSC1=CC=C([Mg+])C=C1 E31791 [1,1,0,0,0,0|2,0,0]=4 1073 B10R1.1 CNCC1=CC=C(Br)C=C1 B46738 [1,1,0,0,0,0|2,0,0]=4 1074 B10R1.1 CNCC1=CC=C(Br)C=C1 M46740 [1,1,0,0,0,0|2,0,0]=4 1075 B10R1.1 CNCC1=CC=C(C)C=C1 M50315 [1,1,0,0,0,0|2,0,0]=4 1076 B10R1.1 CNCC1=CC=C(C)C=C1 M52163 [1,1,0,0,0,0|2,0,0]=4 1077 B10R1.1 CNCC1=CC=C(Cl)C=C1 C46755 [1,1,0,0,0,0|2,0,0]=4 1078 B10R1.1 CNCC1=CC=C(Cl)C=C1 M46757 [1,1,0,0,0,0|2,0,0]=4 1079 B10R1.1 COCC1=CC=C(N)C=C1 M46895 [1,1,0,0,0,0|2,0,0]=4 1080 B10R1.1 ClC1=CC=C(CCBr)C=C1 B48760 [1,1,0,0,0,0|1,0,0]=3 1081 B10R1.1 FC1=CC=C(CCBr)C=C1 B13769 [1,1,0,0,0,0|1,0,0]=3 1082 B10R1.1 FC1=CC=C(CC[Mg+])C=C1 F31725 [1,1,0,0,0,0|1,0,0]=3 1083 B10R1.1 N#CCC1=CC=C(Cl)C=C1 C69078 [1,1,0,0,0,0|0,0,2]=4 1084 B10R1.1 N#CCC1=CC=C(I)C=C1 K47988 [1,1,0,0,0,0|0,0,2]=4 1085 B10R1.1 N#CCC1=CC=C(N)C=C1 A67449 [1,1,0,0,0,0|0,0,2]=4 1086 B10R1.1 N#CCC1=CC=C(O)C=C1 H68900 [1,1,0,0,0,0|0,0,2]=4 1087 B10R1.1 NCCC1=CC=C(Cl)C=C1 C67656 [1,1,0,0,0,0|0,0,0]=2 1088 B10R1.1 NCCC1=CC=C(F)C=C1 F69101 [1,1,0,0,0,0|0,0,0]=2 1089 B10R1.1 NCCC1=NC=C(Br)C=C1 A1731 [1,1,0,0,0,0|1,0,0]=3 1090 B10R1.1 NNCC1=CC=C(Br)C=C1 B0093 [1,1,0,0,0,0|1,0,0]=3 1091 B10R1.1 NNCC1=CC=C(Br)C=C1 B12215 [1,1,0,0,0,0|1,0,0]=3 1092 B10R1.1 NNCC1=CC=C(Cl)C=C1 C0094 [1,1,0,0,0,0|1,0,0]=3 1093 B10R1.1 NNCC1=CC=C(Cl)C=C1 C10206 [1,1,0,0,0,0|1,0,0]=3 1094 B10R1.1 NNCC1=CC=C(F)C=C1 F0090 [1,1,0,0,0,0|1,0,0]=3 1095 B10R1.1 NOCC1=CC=C(Cl)C=C1 C64524 [1,1,0,0,0,0|1,0,0]=3 1096 B10R1.1 NOCC1=CC=C(F)C=C1 F46562 [1,1,0,0,0,0|1,0,0]=3 1097 B10R1.1 O=CCC1=CC=C(Br)C=C1 B48709 [1,1,0,0,0,0|1,0,1]=4 1098 B10R1.1 O=CCC1=CC=C(Cl)C=C1 C48725 [1,1,0,0,0,0|1,0,1]=4 1099 B10R1.1 OC1=CC=C(CCBr)C=C1 B49426 [1,1,0,0,0,0|1,0,0]=3 1100 B10R1.1 OCCC1=CC=C(Br)C=C1 B36776 [1,1,0,0,0,0|1,0,0]=3 1101 B10R1.1 OCCC1=CC=C(Cl)C=C1 C39522 [1,1,0,0,0,0|1,0,0]=3 1102 B10R1.1 OCCC1=CC=C(F)C=C1 F49459 [1,1,0,0,0,0|1,0,0]=3 1103 B10R1.1 OCCC1=CC=C(I)C=C1 K49469 [1,1,0,0,0,0|1,0,0]=3 1104 B10R1.1 OCCC1=CN=C(Cl)C=C1 C37718 [1,1,0,0,0,0|2,0,0]=4 1105 B10R1.1 OCCC1=NC=C(Br)C=C1 B7705 [1,1,0,0,0,0|2,0,0]=4 1106 B10R1.1 [Mg+]CCC1=CC=C(Cl)C=C1 C31726 [1,1,0,0,0,0|1,0,0]=3 1107 B10R1.4 CC1=C(CC#N)C=CC=C1 T69238 [1,1,0,0,0,0|0,0,2]=4 1108 B10R1.4 CC1=C(CCO)C=CC=C1 T50264 [1,1,0,0,0,0|1,0,0]=3 1109 B10R1.4 CCOC1=C([Mg+])C=CC=C1 E31764 [1,1,0,0,0,0|2,0,0]=4 1110 B10R1.4 CCSC1=C(N)C=CC=C1 E46939 [1,1,0,0,0,0|2,0,0]=4 1111 B10R1.4 CNCC1=C(Br)C=CC=C1 B46737 [1,1,0,0,0,0|2,0,0]=4 1112 B10R1.4 CNCC1=C(C)C=CC=C1 M50314 [1,1,0,0,0,0|2,0,0]=4 1113 B10R1.4 CNCC1=C(Cl)C=CC=C1 C46748 [1,1,0,0,0,0|2,0,0]=4 1114 B10R1.4 CNCC1=C(F)C=CC=C1 F67727 [1,1,0,0,0,0|2,0,0]=4 1115 B10R1.4 COCC1=C(O)C=CC=C1 M69473 [1,1,0,0,0,0|2,0,0]=4 1116 B10R1.4 N#CCC1=C(Br)C=CC=C1 B69236 [1,1,0,0,0,0|0,0,2]=4 1117 B10R1.4 N#CCC1=C(Cl)C=CC=C1 C39466 [1,1,0,0,0,0|0,0,2]=4 1118 B10R1.4 N#CCC1=C(F)C=CC=C1 F68569 [1,1,0,0,0,0|0,0,2]=4 1119 B10R1.4 N#CCC1=C(I)C=CC=C1 K47987 [1,1,0,0,0,0|0,0,2]=4 1120 B10R1.4 N#CCC1=C(N)C=CC=C1 A48786 [1,1,0,0,0,0|0,0,2]=4 1121 B10R1.4 NC1=C(CCO)C=CC=C1 A46894 [1,1,0,0,0,0|1,0,0]=3 1122 B10R1.4 NCCC1=C(Br)C=CC=C1 B68553 [1,1,0,0,0,0|0,0,0]=2 1123 B10R1.4 NCCC1=C(Br)C=CC=N1 B14102 [1,1,0,0,0,0|1,0,0]=3 1124 B10R1.4 NCCC1=C(Cl)C=CC=C1 C69206 [1,1,0,0,0,0|0,0,0]=2 1125 B10R1.4 NCCC1=C(O)C=CC=C1 A46892 [1,1,0,0,0,0|0,0,0]=2 1126 B10R1.4 NNCC1=C(Br)C=CC=C1 B10205 [1,1,0,0,0,0|1,0,0]=3 1127 B10R1.4 NNCC1=C(Br)C=CC=C1 B7428 [1,1,0,0,0,0|1,0,0]=3 1128 B10R1.4 NNCC1=C(Cl)C=CC=C1 C10207 [1,1,0,0,0,0|1,0,0]=3 1129 B10R1.4 NNCC1=C(F)C=CC=C1 F0092 [1,1,0,0,0,0|1,0,0]=3 1130 B10R1.4 NNCC1=C(F)C=CC=C1 F7427 [1,1,0,0,0,0|1,0,0]=3 1131 B10R1.4 NOCC1=C(F)C=CC=C1 F63413 [1,1,0,0,0,0|1,0,0]=3 1132 B10R1.4 OCCC1=C(Br)C=CC=C1 B16411 [1,1,0,0,0,0|1,0,0]=3 1133 B10R1.4 OCCC1=C(Cl)C=CC=C1 C49443 [1,1,0,0,0,0|1,0,0]=3 1134 B10R1.4 OCCC1=C(F)C=CC=C1 F49457 [1,1,0,0,0,0|1,0,0]=3 1135 B10R1.4 OCCC1=C(I)C=CC=C1 K49472 [1,1,0,0,0,0|1,0,0]=3 1136 B10R1.15 C#C[C@@H](C)C1=CC=CC=C1 B64382 [1,1,0,0,0,0|1,0,1]=4 1137 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 P68581 [1,1,0,0,0,0|1,0,1]=4 1138 B10R1.15 C=C(CC)C1=CC=CC=C1 B52673 [1,1,0,0,0,0|1,0,1]=4 1139 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 P39004 [1,1,0,0,0,0|1,0,0]=3 1140 B10R1.15 CC[C@@H](N)C1=NC=CC=C1 P49666 [1,1,0,0,0,0|2,0,0]=4 1141 B10R1.15 CC[C@H](N)C1=CC=CN=C1 P46964 [1,1,0,0,0,0|2,0,0]=4 1142 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M50312 [1,1,0,0,0,0|2,0,0]=4 1143 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M52164 [1,1,0,0,0,0|2,0,0]=4 1144 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P37912 [1,1,0,0,0,0|0,0,0]=2 1145 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P39584 [1,1,0,0,0,0|0,0,0]=2 1146 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P60945 [1,1,0,0,0,0|0,0,0]=2 1147 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 P10845 [1,1,0,0,0,0|2,0,0]=4 1148 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 B48763 [1,1,0,0,0,0|1,0,0]=3 1149 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 A67914 [1,1,0,0,0,0|0,0,0]=2 1150 B10R1.15 NC[C@@H](O)C1=CN=CC=C1 A46466 [1,1,0,0,0,0|1,0,0]=3 1151 B10R1.15 NC[C@H](N)C1=CC=CC=C1 P49663 [1,1,0,0,0,0|0,0,0]=2 1152 B10R1.15 NC[C@H](O)C1=NC=CC=C1 A46589 [1,1,0,0,0,0|1,0,0]=3 1153 B10R1.15 NNC(=O)C1=CC=CC=C1 B69029 [1,1,0,0,0,0|1,0,1]=4 1154 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 A67686 [1,1,0,0,0,0|1,0,0]=3 1155 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 P39434 [1,1,0,0,0,0|1,0,0]=3 1156 B10R1.15 N[C@H](CO)C1=CC=CC=C1 A37812 [1,1,0,0,0,0|1,0,0]=3 1157 B10R1.15 O=C(CO)C1=CC=CC=C1 H67472 [1,1,0,0,0,0|1,0,1]=4 1158 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 P46829 [1,1,0,0,0,0|1,0,0]=3 1159 B10R1.15 OC[C@H](O)C1=CC=CC=C1 P46828 [1,1,0,0,0,0|1,0,0]=3 1160 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 C49445 [1,1,0,0,0,0|1,0,0]=3 1161 B10R1.17 BrCCCC1=CC=CC=C1 B49960 [1,1,0,0,0,0|1,0,0]=3 1162 B10R1.17 BrCCOC1=CC=CC=C1 B68804 [1,1,0,0,0,0|1,0,0]=3 1163 B10R1.17 C#CCCC1=CC=CC=C1 P62501 [1,1,0,0,0,0|1,0,0]=3 1164 B10R1.17 C=CCOC1=CC=CC=C1 A68573 [1,1,0,0,0,0|1,0,1]=4 1165 B10R1.17 C=COCC1=CC=CC=C1 B26636 [1,1,0,0,0,0|1,0,1]=4 1166 B10R1.17 CCCCC1=CC=NC=C1 B50306 [1,1,0,0,0,0|2,0,0]=4 1167 B10R1.17 CCCC[N+]1=CC=CC=C1 B52268 [1,1,0,0,0,0|2,0,0]=4 1168 B10R1.17 CCCOC1=CC=CC=C1 P50263 [1,1,0,0,0,0|1,0,0]=3 1169 B10R1.17 CCNCC1=CC=CC=C1 B39547 [1,1,0,0,0,0|1,0,0]=3 1170 B10R1.17 CCNCC1=NC=CC=C1 P46970 [1,1,0,0,0,0|2,0,0]=4 1171 B10R1.17 CCOCC1=CC=CC=C1 E50267 [1,1,0,0,0,0|1,0,0]=3 1172 B10R1.17 CNCCC1=CC=CN=C1 M46974 [1,1,0,0,0,0|1,0,0]=3 1173 B10R1.17 ClCC#CC1=CC=CC=C1 C51043 [1,1,0,0,0,0|1,0,1]=4 1174 B10R1.17 ClCCOC1=CC=CC=C1 C39521 [1,1,0,0,0,0|1,0,0]=3 1175 B10R1.17 ClCCSC1=CC=CC=C1 C49161 [1,1,0,0,0,0|1,0,0]=3 1176 B10R1.17 N#CCOC1=CC=CC=C1 P48439 [1,1,0,0,0,0|0,0,2]=4 1177 B10R1.17 NCCCC1=CC=NC=C1 P46966 [1,1,0,0,0,0|1,0,0]=3 1178 B10R1.17 NCCNC1=CC=CC=C1 P61733 [1,1,0,0,0,0|0,0,0]=2 1179 B10R1.17 NCCNC1=NC=CC=N1 P41447 [1,1,0,0,0,0|2,0,0]=4 1180 B10R1.17 NCCOC1=CC=CC=C1 P46889 [1,1,0,0,0,0|0,0,0]=2 1181 B10R1.17 NCCOC1=CC=NC=C1 P46588 [1,1,0,0,0,0|1,0,0]=3 1182 B10R1.17 NCCOC1=NC=CC=C1 P43633 [1,1,0,0,0,0|1,0,0]=3 1183 B10R1.17 OCC#CC1=CC=CC=C1 P51545 [1,1,0,0,0,0|1,0,1]=4 1184 B10R1.17 OCCCC1=CC=NC=C1 P46905 [1,1,0,0,0,0|2,0,0]=4 1185 B10R1.17 OCCCC1=NC=CC=C1 P62447 [1,1,0,0,0,0|2,0,0]=4 1186 B10R1.17 OCCCC1=NC=CC=C1 P7829 [1,1,0,0,0,0|2,0,0]=4 1187 B10R1.17 OCCSC1=NC=CC=C1 P46439 [1,1,0,0,0,0|2,0,0]=4 1188 B10R1.17 [Mg+]CCCC1=CC=CC=C1 P31712 [1,1,0,0,0,0|1,0,0]=3 1189 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 B9123 [1,1,0,0,0,0|1,0,1]=4 1190 B10R1.18 CC(C)NC1=CC=CC=C1 P69278 [1,1,0,0,0,0|2,0,0]=4 1191 B10R1.18 FC(F)OC1=CC=CC=C1 D45605 [1,1,0,0,0,0|2,0,0]=4 1192 B10R1.18 N=C(N)CC1=CC=CC=C1 P22633 [1,1,0,0,0,0|0,0,1]=3 1193 B10R1.18 N=C(N)NC1=CC=CC=C1 P49691 [1,1,0,0,0,0|1,0,1]=4 1194 B10R1.18 NC(=O)CC1=CC=CC=C1 P69172 [1,1,0,0,0,0|0,0,1]=3 1195 B10R1.18 NC(=O)CC1=CN=CC=C1 P45977 [1,1,0,0,0,0|1,0,1]=4 1196 B10R1.18 NC(=O)OC1=CC=CC=C1 P45812 [1,1,0,0,0,0|1,0,1]=4 1197 B10R1.187 NCCN1C(=O)C=CC1=O A46630 [0,1,0,0,1,0|2,0,0]=4 1198 B12R1.24 CC1=C(F)C=CC=C1[C@@H](N)CO A52157 [0,2,0,0,0,0|1,0,0]=3 1199 B12R1.24 CC1=C(F)C=CC=C1[C@H](N)CO A52158 [0,2,0,0,0,0|1,0,0]=3 1200 B12R1.24 N[C@H](CO)C1=CC=CC(Cl)=C1F A49370 [0,2,0,0,0,0|1,1,0]=4 1201 B12R1.224 CC1=C(F)C=CC=C1CC(=O)O F51950 [0,2,0,0,0,0|1,0,1]=4 1202 B12R1.224 FC1=C(Br)C(OC(F)F)=CC=C1 B44655 [0,2,0,0,0,0|2,0,0]=4 1203 B12R1.224 O=C(O)CC1=CC=CC(F)=C1Br B48141 [0,2,0,0,0,0|1,0,1]=4 1204 B12R1.224 O=C(O)CC1=CC=CC(F)=C1Cl C48171 [0,2,0,0,0,0|1,0,1]=4 1205 B12R1.224 O=C(O)CC1=CC=CC(F)=C1F D48190 [0,2,0,0,0,0|1,0,1]=4 1206 B12R1.542 CCOC1=CC=CC(F)=C1C#N E51534 [0,2,0,0,0,0|2,0,0]=4 1207 B12R1.544 CCOC1=C(F)C(F)=C(Br)C=C1 B48721 [0,2,0,0,0,0|2,0,0]=4 1208 B12R1.544 CCOC1=CC=C(O)C(F)=C1F E49084 [0,2,0,0,0,0|2,0,0]=4 1209 B12R1.544 N#CCC1=CC=C(F)C(F)=C1F T47379 [0,2,0,0,0,0|0,0,2]=4 1210 B12R1.10 CC(C)(CO)C1=CC=CC(Br)=C1 B53017 [0,2,0,0,0,0|1,1,0]=4 1211 B12R1.17 C=CC[C@H](N)C1=CC=CC(Cl)=C1 C62600 [0,2,0,0,0,0|1,1,0]=4 1212 B12R1.225 CC(C)[C@@H](N)C1=CC=CC(Cl)=C1 C53069 [0,2,0,0,0,0|1,1,0]=4 1213 B12R1.225 CC(C)[C@@H](N)C1=CC=CC(Cl)=C1 C53071 [0,2,0,0,0,0|1,1,0]=4 1214 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(F)=C1 F48687 [0,2,0,0,0,0|1,0,1]=4 1215 B12R1.354 CCC(=O)C1=C(F)C=CC(F)=C1 D63769 [0,2,0,0,0,0|1,0,1]=4 1216 B12R1.354 CC[C@H](N)C1=C(F)C=CC(F)=C1 D52098 [0,2,0,0,0,0|1,0,0]=3 1217 B12R1.354 CC[C@H](O)C1=C(C)C=CC(Cl)=C1 C37554 [0,2,0,0,0,0|1,1,0]=4 1218 B12R1.354 NNC(=S)C1=C(F)C=CC(F)=C1 D66058 [0,2,0,0,0,0|1,0,1]=4 1219 B12R1.354 N[C@H](CO)C1=C(F)C=CC(F)=C1 A49652 [0,2,0,0,0,0|1,0,0]=3 1220 B12R1.354 O=C(CCl)C1=C(F)C=CC(F)=C1 C47841 [0,2,0,0,0,0|1,0,1]=4 1221 B12R1.358 N[C@@H](CO)C1=CC(Cl)=CC(Cl)=C1 A49367 [0,2,0,0,0,0|1,1,0]=4 1222 B12R1.358 N[C@@H](CO)C1=CC(F)=CC(F)=C1 A49651 [0,2,0,0,0,0|1,0,0]=3 1223 B12R1.358 N[C@H](CO)C1=CC(F)=CC(F)=C1 A49653 [0,2,0,0,0,0|1,0,0]=3 1224 B12R1.358 O=C(CBr)C1=CC(F)=CC(F)=C1 B65072 [0,2,0,0,0,0|1,0,1]=4 1225 B12R1.367 CCC(=O)C1=CC(F)=C(F)C=C1 D51660 [0,2,0,0,0,0|1,0,1]=4 1226 B12R1.367 CC[C@@H](N)C1=CC(F)=C(F)C=C1 D52097 [0,2,0,0,0,0|1,0,0]=3 1227 B12R1.367 CC[C@H](N)C1=CC(F)=C(F)C=C1 D52099 [0,2,0,0,0,0|1,0,0]=3 1228 B12R1.367 N[C@@H](CO)C1=CC(Cl)=C(Cl)C=C1 A49366 [0,2,0,0,0,0|1,1,0]=4 1229 B12R1.367 N[C@H](CO)C1=CC(Cl)=C(Cl)C=C1 A49369 [0,2,0,0,0,0|1,1,0]=4 1230 B12R1.367 N[C@H](CO)C1=CC(Cl)=C(F)C=C1 A49371 [0,2,0,0,0,0|1,1,0]=4 1231 B12R1.367 O=C(CCl)C1=CC(F)=C(F)C=C1 C60695 [0,2,0,0,0,0|1,0,1]=4 1232 B12R1.367 OC[C@H](O)C1=CC(F)=C(Cl)C=C1 C62605 [0,2,0,0,0,0|1,0,0]=3 1233 B12R1.367 OC[C@H](O)C1=CC(F)=C(Cl)C=C1 C67021 [0,2,0,0,0,0|1,0,0]=3 1234 B12R1.367 O[C@H](CCl)C1=CC(F)=C(F)C=C1 C60696 [0,2,0,0,0,0|1,0,0]=3 1235 B12R1.435 CC[C@@H](N)C1=CC=CC(C#N)=C1 A54118 [0,2,0,0,0,0|2,0,0]=4 1236 B12R1.435 CC[C@@H](N)C1=CC=CC(OC)=C1 M54197 [0,2,0,0,0,0|2,0,0]=4 1237 B12R1.435 COC1=CC([C@H](N)CO)=CC=C1 A37413 [0,2,0,0,0,0|2,0,0]=4 1238 B12R1.435 COC1=CC([C@H](N)CO)=CC=C1 A52184 [0,2,0,0,0,0|2,0,0]=4 1239 B12R1.435 CSC1=CC([C@H](N)CO)=CC=C1 A52187 [0,2,0,0,0,0|2,0,0]=4 1240 B12R1.435 N#CC1=CC=CC([C@@H](N)CO)=C1 A52062 [0,2,0,0,0,0|2,0,0]=4 1241 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 M51938 [0,2,0,0,0,0|1,0,1]=4 1242 B12R1.50 N[C@H](CO)CC1=CC=CC(Cl)=C1 A50259 [0,2,0,0,0,0|0,1,0]=3 1243 B12R1.50 O=C(CCl)NC1=CC(F)=CC=C1 C64587 [0,2,0,0,0,0|1,0,1]=4 1244 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 M52805 [0,2,0,0,0,0|2,0,0]=4 1245 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 H67695 [0,2,0,0,0,0|2,0,0]=4 1246 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 B51889 [0,2,0,0,0,0|1,1,0]=4 1247 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 C51921 [0,2,0,0,0,0|1,1,0]=4 1248 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 F51935 [0,2,0,0,0,0|1,0,0]=3 1249 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 F48670 [0,2,0,0,0,0|1,0,1]=4 1250 B12R1.374 C#CCOC1=C(F)C=CC(F)=C1 D51032 [0,2,0,0,0,0|1,0,1]=4 1251 B12R1.374 CCNCC1=C(O)C=CC(Br)=C1 B50254 [0,2,0,0,0,0|1,1,0]=4 1252 B12R1.374 CCNCC1=C(O)C=CC(Cl)=C1 C50261 [0,2,0,0,0,0|1,1,0]=4 1253 B12R1.382 CCNCC1=CC=CC(OC)=C1 M53138 [0,2,0,0,0,0|2,0,0]=4 1254 B12R1.385 CC1=C(O)C=C(NCCO)C=C1 H50365 [0,2,0,0,0,0|2,0,0]=4 1255 B12R1.41 CCOC1=CC(C=O)=CC(F)=C1 E63430 [0,2,0,0,0,0|2,0,0]=4 1256 B12R1.41 COC1=CC(CC#N)=CC(F)=C1 F69202 [0,2,0,0,0,0|0,0,2]=4 1257 B12R1.41 COC1=CC(N)=CC(CCO)=C1 A65459 [0,2,0,0,0,0|2,0,0]=4 1258 B12R1.44 N#CCC1=CC(F)=C(F)C(F)=C1 T47380 [0,2,0,0,0,0|0,0,2]=4 1259 B12R1.101 O=C(O)CC1=CC(Cl)=CC(F)=C1 C48174 [0,2,0,0,0,0|1,0,1]=4 1260 B12R1.101 O=C(O)CC1=CC(F)=CC(F)=C1 D48186 [0,2,0,0,0,0|1,0,1]=4 1261 B12R1.19 CC1=C(F)C=C(CC(=O)O)C=C1 F51951 [0,2,0,0,0,0|1,0,1]=4 1262 B12R1.19 NC1=C(F)C=C(CC(=O)O)C=C1 A48971 [0,2,0,0,0,0|1,0,1]=4 1263 B12R1.19 NC1=C(F)C=C(OC(F)F)C=C1 D45502 [0,2,0,0,0,0|2,0,0]=4 1264 B12R1.19 O=C(O)CC1=CC(F)=C(Br)C=C1 B48139 [0,2,0,0,0,0|1,0,1]=4 1265 B12R1.19 O=C(O)CC1=CC(F)=C(Cl)C=C1 C48175 [0,2,0,0,0,0|1,0,1]=4 1266 B12R1.19 O=C(O)CC1=CC(F)=C(F)C=C1 D68031 [0,2,0,0,0,0|1,0,1]=4 1267 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 F67401 [0,2,0,0,0,0|1,0,1]=4 1268 B12R1.119 FC1=CC(OC(F)(F)F)=CC=C1 F44685 [0,2,0,0,0,0|2,0,0]=4 1269 B12R1.127 CC(C)OC1=C(N)C=CC(F)=C1 F28703 [0,2,0,0,0,0|2,0,0]=4 1270 B12R1.127 FC1=CC(OC(F)F)=C(Br)C=C1 B44654 [0,2,0,0,0,0|2,0,0]=4 1271 B12R1.127 O=C(O)CC1=C(Br)C=CC(F)=C1 B48137 [0,2,0,0,0,0|1,0,1]=4 1272 B12R1.127 O=C(O)CC1=C(Cl)C=CC(F)=C1 C48169 [0,2,0,0,0,0|1,0,1]=4 1273 B12R1.270 COC1=CC(CCO)=C(Br)C=C1 B50123 [0,2,0,0,0,0|2,0,0]=4 1274 B12R1.1123 FC1=CC(F)=C(CCBr)C=C1F B18244 [0,2,0,0,0,0|1,0,0]=3 1275 B12R1.279 OCCC1=CC(B(O)O)=CC=C1 H46946 [0,2,0,0,0,0|2,0,0]=4 1276 B12R1.286 O=CC1=C(Cl)C=CC(CCO)=C1 C63114 [0,2,0,0,0,0|2,0,0]=4 1277 B12R1.288 COC1=C(F)C=C(CC#N)C=C1 F51535 [0,2,0,0,0,0|0,0,2]=4 1278 B12R1.288 COC1=C(F)C=C(CCO)C=C1 F50130 [0,2,0,0,0,0|1,0,0]=3 1279 B12R1.288 COC1=C(O)C=C(CCN)C=C1 A69548 [0,2,0,0,0,0|1,0,0]=3 1280 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 C68851 [0,0,1,1,0,0|1,0,1]=4 1281 B10R1.25 NCC1=C(F)C=C(F)C=C1 D38872 [0,0,1,1,0,0|1,0,1]=4 1282 B10R1.245 NCC1=C(F)C=CC=C1F D45807 [0,0,1,1,0,0|1,0,1]=4 1283 B10R2.31 BrC1=CC2=C(C=C1)CC2 B48297 [1,0,0,1,0,0|0,1,0]=3 1284 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 P68601 [1,0,0,1,0,0|1,0,0]=3 1285 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 P68362 [1,0,0,1,0,0|1,0,0]=3 1286 B10R2.7 C1=CC2=C(C=C1)CNC2 D64953 [1,0,0,1,0,0|2,0,0]=4 1287 B10R2.7 C1=CC2=C(C=C1)NC=N2 B69282 [1,0,0,1,0,0|1,0,1]=4 1288 B10R2.7 C1=CC2=C(C=C1)NN=C2 I14459 [1,0,0,1,0,0|1,0,1]=4 1289 B10R2.7 C1=CC2=C(C=C1)NN=N2 B38421 [1,0,0,1,0,0|2,0,0]=4 1290 B10R2.7 C1=CC2=C(C=C1)OCC2 D65079 [1,0,0,1,0,0|1,0,0]=3 1291 B10R2.7 C1=CC2=C(C=C1)OCO2 B69389 [1,0,0,1,0,0|2,0,0]=4 1292 B10R2.7 C1=CC2=C(C=C1)SCS2 B61366 [1,0,0,1,0,0|2,0,0]=4 1293 B10R2.7 C1=CC2=C(C=N1)NCC2 D36872 [1,0,0,1,0,0|1,0,0]=3 1294 B10R2.7 C1=CC2=C(C=N1)NCC2 D46553 [1,0,0,1,0,0|1,0,0]=3 1295 B10R2.7 C1=CN=C2CCCC2=C1 C67437 [1,0,0,1,0,0|2,0,0]=4 1296 B10R2.7 C1=CN=C2NCCC2=C1 D0150 [1,0,0,1,0,0|1,0,0]=3 1297 B10R2.7 C1=CN=C2NCCC2=C1 D65478 [1,0,0,1,0,0|1,0,0]=3 1298 B10R2.320 Br[C@H]1CC2=C1C=CC=C2 B68954 [1,0,0,1,0,0|1,0,0]=3 1299 B10R2.320 O=C1CC2=C1C=CC=C2 B36727 [1,0,0,1,0,0|1,0,1]=4 1300 B12R2.82 CC1=C(F)C=CC2=C1C=NN2 F48342 [0,1,0,1,0,0|1,0,1]=4 1301 B12R2.82 FC1=C(Br)C2=C(C=C1)NC=C2 B47667 [0,1,0,1,0,0|0,0,2]=4 1302 B12R2.82 FC1=C(Br)C=CC2=C1CCN2 B48425 [0,1,0,1,0,0|0,1,0]=3 1303 B12R2.82 FC1=C(Br)C=CC2=C1NC=C2 B26665 [0,1,0,1,0,0|0,0,2]=4 1304 B12R2.82 FC1=C(Br)C=CC2=C1OCO2 B44578 [0,1,0,1,0,0|2,0,0]=4 1305 B12R2.82 FC1=C(F)C2=C(C=C1)C=NN2 D32290 [0,1,0,1,0,0|1,0,1]=4 1306 B12R2.82 FC1=C(F)C2=C(C=C1)NC=C2 D47700 [0,1,0,1,0,0|0,0,2]=4 1307 B12R2.202 FC1=CC=CC2=C1NC(=S)S2 F61525 [0,1,0,1,0,0|1,0,1]=4 1308 B12R2.202 FC1=CC=CC2=C1NC(Cl)=N2 C44332 [0,1,0,1,0,0|1,0,1]=4 1309 B12R2.202 NC1=CC=CC2=C1NC(=O)C2 A48794 [0,1,0,1,0,0|1,0,1]=4 1310 B12R2.202 NC1=NC2=C(C=CC=C2F)S1 F22218 [0,1,0,1,0,0|1,0,1]=4 1311 B12R2.202 O=C1CC2=CC=CC(Br)=C2N1 B12492 [0,1,0,1,0,0|0,1,1]=4 1312 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 F48096 [0,1,0,1,0,0|0,0,1]=3 1313 B12R2.202 O=C1NC2=C(C=CC=C2F)S1 F44555 [0,1,0,1,0,0|1,0,1]=4 1314 B12R2.202 O=C1NC2=CC=CC(F)=C2N1 F38220 [0,1,0,1,0,0|1,0,1]=4 1315 B12R2.202 O[C@H]1CC2=CC=CC(Br)=C2C1 B18025 [0,1,0,1,0,0|1,1,0]=4 1316 B12R2.1081 BrC1=C2CCCCC2=CC=C1 B4845 [0,1,0,1,0,0|1,1,0]=4 1317 B12R2.1081 BrC1=C2CCCNC2=CC=C1 B14750 [0,1,0,1,0,0|1,1,0]=4 1318 B12R2.1081 BrC1=C2CCCNC2=CC=C1 B49764 [0,1,0,1,0,0|1,1,0]=4 1319 B12R2.1081 BrC1=C2CCCOC2=CC=C1 B52015 [0,1,0,1,0,0|1,1,0]=4 1320 B12R2.1081 BrC1=C2CCNCC2=CC=C1 B14751 [0,1,0,1,0,0|1,1,0]=4 1321 B12R2.1081 BrC1=C2CCNCC2=CC=C1 B26536 [0,1,0,1,0,0|1,1,0]=4 1322 B12R2.1081 BrC1=C2CNCCC2=CC=C1 B14753 [0,1,0,1,0,0|0,1,0]=3 1323 B12R2.1081 BrC1=C2CNCCC2=CC=C1 B49767 [0,1,0,1,0,0|0,1,0]=3 1324 B12R2.1081 BrC1=C2CNCCC2=CN=C1 B59994 [0,1,0,1,0,0|1,1,0]=4 1325 B12R2.1081 BrC1=C2NCCCC2=CC=C1 B49762 [0,1,0,1,0,0|0,1,0]=3 1326 B12R2.1081 BrC1=C2NCCCC2=CN=C1 B8071 [0,1,0,1,0,0|1,1,0]=4 1327 B12R2.1081 BrC1=C2NCCOC2=CC=C1 B49028 [0,1,0,1,0,0|0,1,0]=3 1328 B12R2.1081 BrC1=C2OCCCC2=CC=C1 B63715 [0,1,0,1,0,0|1,1,0]=4 1329 B12R2.1081 BrC1=C2OCCNC2=CC=C1 B49031 [0,1,0,1,0,0|1,1,0]=4 1330 B12R2.1081 CC1=CC=CC2=C1CCCN2 M54142 [0,1,0,1,0,0|2,0,0]=4 1331 B12R2.1081 CC1=CC=CC2=C1NCCC2 M52879 [0,1,0,1,0,0|1,0,0]=3 1332 B12R2.1081 ClC1=C2CCCNC2=CC=C1 C36903 [0,1,0,1,0,0|1,1,0]=4 1333 B12R2.1081 ClC1=C2CNCCC2=CC=C1 C49773 [0,1,0,1,0,0|0,1,0]=3 1334 B12R2.1081 ClC1=C2CNCCC2=CC=C1 C49780 [0,1,0,1,0,0|0,1,0]=3 1335 B12R2.1081 ClC1=C2OCCCC2=CC=C1 C52035 [0,1,0,1,0,0|1,1,0]=4 1336 B12R2.1081 FC1=C2CCCNC2=CC=C1 F5341 [0,1,0,1,0,0|1,0,0]=3 1337 B12R2.1081 FC1=C2OCCNC2=CC=C1 F49054 [0,1,0,1,0,0|1,0,0]=3 1338 B12R2.1081 NC1=CC=CC2=C1CCNC2 T50168 [0,1,0,1,0,0|2,0,0]=4 1339 B12R2.1081 NC1=CC=CC2=C1CCNC2 T52129 [0,1,0,1,0,0|2,0,0]=4 1340 B12R2.1081 NC1=CC=CC2=C1OCCO2 D3222 [0,1,0,1,0,0|2,0,0]=4 1341 B12R2.1081 OC1=C2NCCCC2=CC=C1 H67535 [0,1,0,1,0,0|1,0,0]=3 1342 B12R2.1081 OC1=CC=CC2=C1OCCO2 D49104 [0,1,0,1,0,0|2,0,0]=4 1343 B12R2.132 CC1=CNC2=C1C=C(F)C=C2 F4725 [0,1,0,1,0,0|0,0,2]=4 1344 B12R2.132 FC1=CC2=C(C=C1)NN=C2Br B9807 [0,1,0,1,0,0|1,0,1]=4 1345 B12R2.132 FC1=CC2=C(C=C1)NN=C2I F9743 [0,1,0,1,0,0|1,0,1]=4 1346 B12R2.132 N[C@@H]1CCC2=C1C=C(Br)C=C2 B13142 [0,1,0,1,0,0|1,1,0]=4 1347 B12R2.132 N[C@@H]1CCC2=C1C=C(F)C=C2 F52069 [0,1,0,1,0,0|1,0,0]=3 1348 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 A31037 [0,1,0,1,0,0|2,0,0]=4 1349 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 H13146 [0,1,0,1,0,0|2,0,0]=4 1350 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 B13143 [0,1,0,1,0,0|1,1,0]=4 1351 B12R2.132 N[C@H]1CCC2=C1C=C(Br)C=C2 B63650 [0,1,0,1,0,0|1,1,0]=4 1352 B12R2.132 N[C@H]1CCC2=C1C=C(Cl)C=C2 C49778 [0,1,0,1,0,0|1,1,0]=4 1353 B12R2.132 N[C@H]1CCC2=C1C=C(Cl)C=C2 C63653 [0,1,0,1,0,0|1,1,0]=4 1354 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 F52065 [0,1,0,1,0,0|1,0,0]=3 1355 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 F52067 [0,1,0,1,0,0|1,0,0]=3 1356 B12R2.132 N[C@H]1CCC2=C1C=C(O)C=C2 H13147 [0,1,0,1,0,0|2,0,0]=4 1357 B12R2.132 N[C@H]1COC2=C1C=C(Cl)C=C2 C49041 [0,1,0,1,0,0|1,1,0]=4 1358 B12R2.132 O=C1CCC2=C1C=C(F)C=C2 F51322 [0,1,0,1,0,0|1,0,1]=4 1359 B12R2.132 O[C@H]1CCC2=C1C=C(Br)C=C2 B52030 [0,1,0,1,0,0|1,1,0]=4 1360 B12R2.196 CC1=CC=CC2=C1CC[C@@H]2N M54145 [0,1,0,1,0,0|2,0,0]=4 1361 B12R2.196 FC1=CC=CC2=C1NN=C2Br B18131 [0,1,0,1,0,0|1,0,1]=4 1362 B12R2.196 N[C@@H]1CCC2=C(Br)C=CC=C21 B61894 [0,1,0,1,0,0|1,1,0]=4 1363 B12R2.196 N[C@@H]1COC2=C(Cl)C=CC=C21 C49047 [0,1,0,1,0,0|1,1,0]=4 1364 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 B37290 [0,1,0,1,0,0|1,1,0]=4 1365 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 B49765 [0,1,0,1,0,0|1,1,0]=4 1366 B12R2.196 N[C@H]1CCC2=C(Br)C=CC=C21 B49768 [0,1,0,1,0,0|1,1,0]=4 1367 B12R2.196 N[C@H]1CCC2=C(Cl)C=CC=C21 C49777 [0,1,0,1,0,0|1,1,0]=4 1368 B12R2.196 N[C@H]1CCC2=C(Cl)C=CC=C21 C49781 [0,1,0,1,0,0|1,1,0]=4 1369 B12R2.196 N[C@H]1CCC2=C(F)C=CC=C21 F52070 [0,1,0,1,0,0|1,0,0]=3 1370 B12R2.196 O=C1CCC2=C(F)C=CC=C12 F51325 [0,1,0,1,0,0|1,0,1]=4 1371 B12R2.1282 NC1(C2=CC=CC(Br)=C2)CC1 B49761 [0,1,0,1,0,0|1,1,0]=4 1372 B12R2.1282 NC1(C2=CC=CC(Cl)=C2)CC1 C49769 [0,1,0,1,0,0|1,1,0]=4 1373 B12R2.1282 NC1(C2=CC=CC(F)=C2)CC1 F52066 [0,1,0,1,0,0|1,0,0]=3 1374 B12R2.2313 BrC1=CC(C2COC2)=CC=C1 B8384 [0,1,0,1,0,0|1,1,0]=4 1375 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 B52500 [0,1,0,1,0,0|1,1,0]=4 1376 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 B61360 [0,1,0,1,0,0|1,1,0]=4 1377 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 B8109 [0,1,0,1,0,0|1,1,0]=4 1378 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 B52017 [0,1,0,1,0,0|1,1,0]=4 1379 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 B11621 [0,1,0,1,0,0|1,1,0]=4 1380 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 B5487 [0,1,0,1,0,0|1,1,0]=4 1381 B12R2.24 BrC1=CC2=C(C=C1)CCOC2 B52019 [0,1,0,1,0,0|1,1,0]=4 1382 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 B14752 [0,1,0,1,0,0|0,1,0]=3 1383 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 B15726 [0,1,0,1,0,0|0,1,0]=3 1384 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 B14749 [0,1,0,1,0,0|0,1,0]=3 1385 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 B37601 [0,1,0,1,0,0|0,1,0]=3 1386 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 B49030 [0,1,0,1,0,0|0,1,0]=3 1387 B12R2.24 BrC1=CC2=C(C=C1)OCCC2 B52016 [0,1,0,1,0,0|1,1,0]=4 1388 B12R2.24 BrC1=CC2=C(C=C1)OCCN2 B49029 [0,1,0,1,0,0|1,1,0]=4 1389 B12R2.24 BrC1=CC2=C(C=C1)OCCO2 B48585 [0,1,0,1,0,0|1,1,0]=4 1390 B12R2.24 BrC1=CN=C2CNCCC2=C1 B14777 [0,1,0,1,0,0|1,1,0]=4 1391 B12R2.24 BrC1=CN=C2CNCCC2=C1 B31695 [0,1,0,1,0,0|1,1,0]=4 1392 B12R2.24 BrC1=CN=C2NCCOC2=C1 B38194 [0,1,0,1,0,0|1,1,0]=4 1393 B12R2.24 BrC1=NC2=C(C=C1)NCCC2 B37353 [0,1,0,1,0,0|1,1,0]=4 1394 B12R2.24 CC1=CC2=C(C=C1)CCCC2 M54692 [0,1,0,1,0,0|2,0,0]=4 1395 B12R2.24 CC1=CC2=C(C=C1)CCNC2 M52881 [0,1,0,1,0,0|2,0,0]=4 1396 B12R2.24 CC1=CC2=C(C=C1)CCNC2 M61207 [0,1,0,1,0,0|2,0,0]=4 1397 B12R2.24 CC1=CC=C2NCCNC2=N1 M46873 [0,1,0,1,0,0|2,0,0]=4 1398 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 C32116 [0,1,0,1,0,0|1,1,0]=4 1399 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 C49776 [0,1,0,1,0,0|1,1,0]=4 1400 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 C49772 [0,1,0,1,0,0|1,1,0]=4 1401 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 C49779 [0,1,0,1,0,0|1,1,0]=4 1402 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 C67678 [0,1,0,1,0,0|0,1,0]=3 1403 B12R2.24 ClC1=CC2=C(C=C1)NCCC2 C23914 [0,1,0,1,0,0|0,1,0]=3 1404 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 C49043 [0,1,0,1,0,0|1,1,0]=4 1405 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 C4158 [0,1,0,1,0,0|1,1,0]=4 1406 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 C49172 [0,1,0,1,0,0|1,1,0]=4 1407 B12R2.24 ClC1=NC2=C(C=C1)NCCN2 C46061 [0,1,0,1,0,0|1,1,0]=4 1408 B12R2.24 FC1=CC2=C(C=C1)CNCC2 F60960 [0,1,0,1,0,0|0,0,0]=2 1409 B12R2.24 FC1=CC2=C(C=C1)NCCC2 F38792 [0,1,0,1,0,0|0,0,0]=2 1410 B12R2.24 FC1=CC2=C(C=C1)OCCN2 F49619 [0,1,0,1,0,0|1,0,0]=3 1411 B12R2.24 NC1=CC2=C(C=C1)CCCN2 T63563 [0,1,0,1,0,0|2,0,0]=4 1412 B12R2.24 NC1=CC2=C(C=C1)CCCN2 T67419 [0,1,0,1,0,0|2,0,0]=4 1413 B12R2.24 NC1=CC2=C(C=C1)CCNC2 T52130 [0,1,0,1,0,0|2,0,0]=4 1414 B12R2.24 NC1=CC2=C(C=C1)OCCO2 D49293 [0,1,0,1,0,0|2,0,0]=4 1415 B12R2.24 O=C1C=CC2=C(CCNC2)N1 T39057 [0,1,0,1,0,0|2,0,0]=4 1416 B12R2.24 OC1=CC2=C(C=C1)CCCC2 T37096 [0,1,0,1,0,0|2,0,0]=4 1417 B12R2.24 OC1=CC2=C(C=C1)CCCN2 H50029 [0,1,0,1,0,0|2,0,0]=4 1418 B12R2.24 OC1=CC2=C(C=C1)CNCC2 T38163 [0,1,0,1,0,0|1,0,0]=3 1419 B12R2.24 OC1=CC2=C(C=C1)CNCC2 T67068 [0,1,0,1,0,0|1,0,0]=3 1420 B12R2.24 OC1=CC2=C(C=C1)NCCC2 H50028 [0,1,0,1,0,0|1,0,0]=3 1421 B12R2.24 OC1=CC2=C(C=C1)OCCN2 D49294 [0,1,0,1,0,0|2,0,0]=4 1422 B12R2.24 OC1=CC2=C(C=C1)OCCO2 H49092 [0,1,0,1,0,0|2,0,0]=4 1423 B12R2.24 [Mg+]C1=CC2=C(C=C1)OCCO2 D31785 [0,1,0,1,0,0|2,0,0]=4 1424 B12R2.203 CC1=C2C(=O)CCC2=CC=C1 M52416 [0,1,0,1,0,0|2,0,0]=4 1425 B12R2.203 NC1=NNC2=CC=CC(F)=C21 F9797 [0,1,0,1,0,0|1,0,1]=4 1426 B12R2.203 N[C@H]1CCC2=CC=CC(Br)=C21 B49763 [0,1,0,1,0,0|0,1,0]=3 1427 B12R2.203 N[C@H]1CCC2=CC=CC(Br)=C21 B49766 [0,1,0,1,0,0|0,1,0]=3 1428 B12R2.203 N[C@H]1CCC2=CC=CC(F)=C21 F52072 [0,1,0,1,0,0|0,0,0]=2 1429 B12R2.203 O=C1CCC2=CC=CC(Br)=C12 B64882 [0,1,0,1,0,0|1,1,0]=4 1430 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 C51316 [0,1,0,1,0,0|1,1,0]=4 1431 B12R2.203 O=C1CCC2=CC=CC(F)=C12 F51324 [0,1,0,1,0,0|1,0,0]=3 1432 B12R2.203 O=C1CCC2=CC=CC(O)=C12 H51557 [0,1,0,1,0,0|2,0,0]=4 1433 B12R2.203 O=C1COC2=CC=CC(F)=C12 F63171 [0,1,0,1,0,0|1,0,1]=4 1434 B12R2.203 O[C@H]1CCC2=CC=CC(Br)=C21 B63750 [0,1,0,1,0,0|1,1,0]=4 1435 B12R2.203 O[C@H]1CSC2=CC=CC(Br)=C21 B63765 [0,1,0,1,0,0|1,1,0]=4 1436 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 M52405 [0,1,0,1,0,0|2,0,0]=4 1437 B12R2.612 CC1=CC2=C(C=C1)[C@@H](N)CC2 M52880 [0,1,0,1,0,0|1,0,0]=3 1438 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 A3834 [0,1,0,1,0,0|2,0,0]=4 1439 B12R2.612 NC1=NNC2=C1C=CC(F)=C2 F23542 [0,1,0,1,0,0|1,0,1]=4 1440 B12R2.612 NC1=NOC2=C1C=CC(F)=C2 F44845 [0,1,0,1,0,0|1,0,1]=4 1441 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 B38120 [0,1,0,1,0,0|0,1,0]=3 1442 B12R2.612 N[C@@H]1CCC2=C1C=CC(Cl)=C2 C49774 [0,1,0,1,0,0|0,1,0]=3 1443 B12R2.612 N[C@@H]1CCC2=C1C=CC(F)=C2 F52068 [0,1,0,1,0,0|0,0,0]=2 1444 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 B36894 [0,1,0,1,0,0|0,1,0]=3 1445 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 B63483 [0,1,0,1,0,0|0,1,0]=3 1446 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 B63647 [0,1,0,1,0,0|0,1,0]=3 1447 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 B63729 [0,1,0,1,0,0|0,1,0]=3 1448 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 C49775 [0,1,0,1,0,0|0,1,0]=3 1449 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 C49782 [0,1,0,1,0,0|0,1,0]=3 1450 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 C69644 [0,1,0,1,0,0|0,1,0]=3 1451 B12R2.612 N[C@H]1CCC2=C1C=CC(F)=C2 F52071 [0,1,0,1,0,0|0,0,0]=2 1452 B12R2.612 N[C@H]1COC2=C1C=CC(Br)=C2 B37370 [0,1,0,1,0,0|0,1,0]=3 1453 B12R2.612 N[C@H]1COC2=C1C=CC(Cl)=C2 C49046 [0,1,0,1,0,0|0,1,0]=3 1454 B12R2.612 N[C@H]1COC2=C1C=CC(F)=C2 F49618 [0,1,0,1,0,0|0,0,0]=2 1455 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 B23186 [0,1,0,1,0,0|1,1,0]=4 1456 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 C39570 [0,1,0,1,0,0|1,1,0]=4 1457 B12R2.612 O=C1CCC2=C1C=CC(F)=C2 F51326 [0,1,0,1,0,0|1,0,0]=3 1458 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 D9498 [0,1,0,1,0,0|1,1,0]=4 1459 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 H38546 [0,1,0,1,0,0|2,0,0]=4 1460 B12R2.612 O=C1NCC2=C1C=CC(F)=C2 F48097 [0,1,0,1,0,0|1,0,1]=4 1461 B12R2.612 O=C1OCC2=C1C=CC(F)=C2 F47783 [0,1,0,1,0,0|1,0,1]=4 1462 B12R2.612 O[C@H]1CCC2=C1C=CC(Br)=C2 B52029 [0,1,0,1,0,0|1,1,0]=4 1463 B12R2.612 O[C@H]1CCC2=C1C=CC(Cl)=C2 C52041 [0,1,0,1,0,0|1,1,0]=4 1464 B12R2.612 O[C@H]1CCC2=C1C=CC(F)=C2 F52046 [0,1,0,1,0,0|1,0,0]=3 1465 B12R2.612 O[C@H]1COC2=C1C=CC(Br)=C2 B48578 [0,1,0,1,0,0|1,1,0]=4 1466 B12R2.1286 FC1=CC(OC2CC2)=CC=C1 C62726 [0,1,0,1,0,0|1,0,0]=3 1467 B12R2.246 CC1=C2NC=CC2=CC(F)=C1 F51458 [0,1,0,1,0,0|0,0,2]=4 1468 B12R2.246 FC1=C2NC=CC2=CC(Br)=C1 B15549 [0,1,0,1,0,0|0,0,2]=4 1469 B12R2.246 FC1=CC(Br)=C2NC=CC2=C1 B23568 [0,1,0,1,0,0|0,0,2]=4 1470 B12R2.246 FC1=CC(Cl)=C2NC=CC2=C1 C22696 [0,1,0,1,0,0|0,0,2]=4 1471 B12R2.246 FC1=CC(F)=C2CCNC2=C1 D49603 [0,1,0,1,0,0|2,0,0]=4 1472 B12R2.246 FC1=CC(F)=C2NC=CC2=C1 D22925 [0,1,0,1,0,0|0,0,2]=4 1473 B12R2.246 NC1=C2NC=CC2=CC(F)=C1 F60102 [0,1,0,1,0,0|0,0,2]=4 1474 B12R2.246 NC1=CC(F)=C2NC=CC2=C1 A0693 [0,1,0,1,0,0|0,0,2]=4 1475 B12R2.2294 FC1=CC(C2CC2)=CC(Br)=C1 B51333 [0,1,0,1,0,0|1,0,0]=3 1476 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 M51752 [0,1,0,1,0,0|1,0,1]=4 1477 B12R2.606 CC1=CC2=C(C=CC(F)=C2)N1 F12894 [0,1,0,1,0,0|0,0,2]=4 1478 B12R2.606 CC1=NC2=C(C=CC(F)=C2)N1 F48344 [0,1,0,1,0,0|1,0,1]=4 1479 B12R2.606 C[C@H]1CC2=C(C=CC(F)=C2)N1 F38745 [0,1,0,1,0,0|0,0,0]=2 1480 B12R2.606 FC1=CC2=C(C=C1)NC(=S)N2 F44802 [0,1,0,1,0,0|1,0,1]=4 1481 B12R2.606 FC1=CC2=C(C=C1)NC(=S)S2 F44440 [0,1,0,1,0,0|1,0,1]=4 1482 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 A0306 [0,1,0,1,0,0|1,0,1]=4 1483 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 A49612 [0,1,0,1,0,0|1,0,1]=4 1484 B12R2.606 NC1=NC2=C(C=C(F)C=C2)S1 F23205 [0,1,0,1,0,0|1,0,1]=4 1485 B12R2.606 NC1=NC2=C(C=CC(F)=C2)S1 A22219 [0,1,0,1,0,0|1,0,1]=4 1486 B12R2.606 N[C@H]1CC2=C(C=C(Br)C=C2)C1 B67543 [0,1,0,1,0,0|0,1,0]=3 1487 B12R2.606 N[C@H]1CC2=CC(Br)=CN=C2C1 B62941 [0,1,0,1,0,0|1,1,0]=4 1488 B12R2.606 O=C1CC2=C(C=CC(Br)=C2)N1 B0214 [0,1,0,1,0,0|0,1,1]=4 1489 B12R2.606 O=C1CC2=C(C=CC(F)=C2)N1 F28486 [0,1,0,1,0,0|0,0,1]=3 1490 B12R2.606 O=C1CC2=CC(F)=CN=C2N1 F0566 [0,1,0,1,0,0|1,0,1]=4 1491 B12R2.606 O=C1NC2=C(C=C(F)C=C2)N1 F44847 [0,1,0,1,0,0|1,0,1]=4 1492 B12R2.606 O=C1NC2=C(C=C(F)C=C2)S1 F44553 [0,1,0,1,0,0|1,0,1]=4 1493 B12R2.606 O[C@H]1CC2=C(C=C(Br)C=C2)C1 B52018 [0,1,0,1,0,0|1,1,0]=4 1494 B12R2.221 FC1=C2NC=CC2=C(Br)C=C1 B47668 [0,1,0,1,0,0|0,0,2]=4 1495 B12R2.43 NCC1=CC(C2CC2)=CC=C1 C32106 [0,1,0,1,0,0|2,0,0]=4 1496 B12R2.44 C#CC1=CC2=C(C=C1)CCC2 E64447 [0,1,0,1,0,0|2,0,0]=4 1497 B12R2.44 COC1=CC2=C(C=C1)NCC2 M22375 [0,1,0,1,0,0|1,0,0]=3 1498 B12R2.44 COC1=CC2=C(C=C1)NCC2 M52101 [0,1,0,1,0,0|1,0,0]=3 1499 B12R2.44 O=CC1=CC2=C(C=C1)CCC2 K52409 [0,1,0,1,0,0|2,0,0]=4 1500 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 D51558 [0,1,0,1,0,0|2,0,0]=4 1501 B12R2.44 OCC1=CC2=C(C=C1)OCC2 D65568 [0,1,0,1,0,0|2,0,0]=4 1502 B12R2.315 C#CC1=C2CCCC2=CC=C1 E64381 [0,1,0,1,0,0|2,0,0]=4 1503 B12R2.315 N#CC1=C2NCCC2=CC=C1 K5777 [0,1,0,1,0,0|1,0,0]=3 1504 B12R2.315 O=CC1=C2OCCC2=CC=C1 D51555 [0,1,0,1,0,0|2,0,0]=4 1505 B12R2.100 FC1=C(Br)C=C2CCNC2=C1 B48426 [0,1,0,1,0,0|0,1,0]=3 1506 B12R2.100 FC1=C(Br)C=C2NC=CC2=C1 B1597 [0,1,0,1,0,0|0,0,2]=4 1507 B12R2.100 FC1=C(Br)C=C2NN=CC2=C1 B8120 [0,1,0,1,0,0|1,0,1]=4 1508 B12R2.100 FC1=C(Br)C=C2NN=NC2=C1 B41870 [0,1,0,1,0,0|2,0,0]=4 1509 B12R2.100 FC1=C(Cl)C=C2NC=CC2=C1 C7633 [0,1,0,1,0,0|0,0,2]=4 1510 B12R2.100 FC1=C(Cl)C=C2NN=CC2=C1 C0479 [0,1,0,1,0,0|1,0,1]=4 1511 B12R2.100 FC1=C(F)C=C2NC=CC2=C1 D21740 [0,1,0,1,0,0|0,0,2]=4 1512 B12R2.100 FC1=C(F)C=C2NC=NC2=C1 D61648 [0,1,0,1,0,0|1,0,1]=4 1513 B12R2.100 FC1=C(F)C=C2NCCC2=C1 D48433 [0,1,0,1,0,0|0,0,0]=2 1514 B12R2.100 FC1=C(F)C=C2NN=CC2=C1 D44341 [0,1,0,1,0,0|1,0,1]=4 1515 B12R2.100 OC1=C(Br)C=C2CCCC2=C1 B52031 [0,1,0,1,0,0|1,1,0]=4 1516 B12R2.291 FC1=C(F)C=C([C@@H]2CO2)C=C1 D48285 [0,1,0,1,0,0|1,0,0]=3 1517 B12R2.291 FC1=C(F)C=C([C@H]2CO2)C=C1 D64414 [0,1,0,1,0,0|1,0,0]=3 1518 B8R1.1 CC1=CC=C(CN)O1 M37131 [1,0,0,0,1,0|2,0,0]=4 1519 B8R1.1 CCC1=CC=C(C)S1 E43745 [1,0,0,0,1,0|2,0,0]=4 1520 B8R1.1 NCC1=CC(Br)=CS1 B41112 [1,0,0,0,1,0|1,1,0]=4 1521 B8R1.1 NCC1=CC=C(Br)S1 A12757 [1,0,0,0,1,0|1,1,0]=4 1522 B8R1.1 NCC1=CC=C(Cl)S1 A12836 [1,0,0,0,1,0|1,1,0]=4 1523 B8R1.1 NCC1=CC=C(Cl)S1 C27089 [1,0,0,0,1,0|1,1,0]=4 1524 B8R1.1 NCC1=CC=C(F)S1 F8124 [1,0,0,0,1,0|1,0,0]=3 1525 B8R1.1 NCC1=CSC(Br)=C1 B16484 [1,0,0,0,1,0|1,1,0]=4 1526 B8R1.1 NCC1=CSC(Cl)=C1 C7665 [1,0,0,0,1,0|1,1,0]=4 1527 B8R1.1 OCC1=CC=C(F)S1 F8123 [1,0,0,0,1,0|2,0,0]=4 1528 B8R1.11 CN1C=CC=C1CN M41429 [1,0,0,0,1,0|2,0,0]=4 1529 B8R1.11 NCC1=C(Cl)C=CS1 A7919 [1,0,0,0,1,0|1,1,0]=4 1530 B8R1.8 CCCC1=CC=CS1 P43744 [1,0,0,0,1,0|2,0,0]=4 1531 B8R1.8 NCCC1=CC=CS1 T12818 [1,0,0,0,1,0|1,0,0]=3 1532 B8R1.8 NCCC1=CN=CS1 T41396 [1,0,0,0,1,0|2,0,0]=4 1533 B8R1.8 NCCC1=CSC=C1 T1049 [1,0,0,0,1,0|1,0,0]=3 1534 B8R1.8 NCCC1=CSC=C1 T10491 [1,0,0,0,1,0|1,0,0]=3 1535 B8R1.8 NCCC1=NC=CN1 K41400 [1,0,0,0,1,0|2,0,0]=4 1536 B8R1.8 NCCN1C=CC=C1 P41427 [1,0,0,0,1,0|1,0,0]=3 1537 B8R1.8 NCCN1C=CN=C1 K41369 [1,0,0,0,1,0|2,0,0]=4 1538 B8R1.8 NCCN1C=CN=C1 K41399 [1,0,0,0,1,0|2,0,0]=4 1539 B8R1.8 NNCC1=CC=CS1 H13973 [1,0,0,0,1,0|2,0,0]=4 1540 B8R1.8 NNCC1=CSC=C1 H13972 [1,0,0,0,1,0|2,0,0]=4 1541 B8R1.8 OCCC1=CC=CS1 T12817 [1,0,0,0,1,0|2,0,0]=4 1542 B8R1.8 OCCC1=CSC=C1 T12832 [1,0,0,0,1,0|2,0,0]=4