0 B11R1.605 C=CCC1=C(I)C=CN=C1F A48436 [0,0,0,0,0,0|2,1,1]=4 1 B11R1.605 CCOC1=C(F)C=CC=C1F E49153 [0,0,0,0,0,0|2,1,0]=3 2 B11R1.605 N#CCC1=C(Br)C=CC=C1Br D47659 [0,0,0,0,0,0|0,2,2]=4 3 B11R1.605 N#CCC1=C(Cl)C=CC=C1Cl D39458 [0,0,0,0,0,0|0,1,2]=3 4 B11R1.605 N#CCC1=C(Cl)C=CC=C1F C47692 [0,0,0,0,0,0|0,0,2]=2 5 B11R1.605 N#CCC1=C(F)C=CC=C1F D38482 [0,0,0,0,0,0|0,1,2]=3 6 B11R1.605 NCCC1=C(Cl)C=CC=C1Cl D64783 [0,0,0,0,0,0|0,1,0]=1 7 B11R1.605 OCCC1=C(Cl)C=CC=C1Cl D38686 [0,0,0,0,0,0|1,1,0]=2 8 B11R1.605 O\N=C\C1=C(Cl)C=CC=C1Cl D65200 [0,0,0,0,0,0|2,1,1]=4 9 B10R1.4 CC1=C(CC#N)C=CC=C1 T69238 [1,0,0,0,0,0|1,0,2]=4 10 B10R1.4 CC1=C(CCO)C=CC=C1 T50264 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.4 CCOC1=C([Mg+])C=CC=C1 E31764 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.4 CCSC1=C(N)C=CC=C1 E46939 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.4 CNCC1=C(Br)C=CC=C1 B46737 [1,0,0,0,0,0|2,1,0]=4 14 B10R1.4 CNCC1=C(C)C=CC=C1 M50314 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.4 CNCC1=C(Cl)C=CC=C1 C46748 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.4 CNCC1=C(F)C=CC=C1 F67727 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.4 CNCC1=C(F)C=CC=N1 F14667 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.4 COCC1=C(O)C=CC=C1 M69473 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.4 N#CCC1=C(Br)C=CC=C1 B69236 [1,0,0,0,0,0|0,1,2]=4 20 B10R1.4 N#CCC1=C(Cl)C=CC=C1 C39466 [1,0,0,0,0,0|0,0,2]=3 21 B10R1.4 N#CCC1=C(F)C=CC=C1 F68569 [1,0,0,0,0,0|0,0,2]=3 22 B10R1.4 N#CCC1=C(F)C=CC=N1 F44800 [1,0,0,0,0,0|1,0,2]=4 23 B10R1.4 N#CCC1=C(I)C=CC=C1 K47987 [1,0,0,0,0,0|0,1,2]=4 24 B10R1.4 N#CCC1=C(N)C=CC=C1 A48786 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.4 N#CCC1=CC=CN=C1Cl C0579 [1,0,0,0,0,0|1,0,2]=4 26 B10R1.4 NC1=C(CCO)C=CC=C1 A46894 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.4 NCCC1=C(Br)C=CC=C1 B68553 [1,0,0,0,0,0|0,1,0]=2 28 B10R1.4 NCCC1=C(Br)C=CC=N1 B14102 [1,0,0,0,0,0|1,1,0]=3 29 B10R1.4 NCCC1=C(Cl)C=CC=C1 C69206 [1,0,0,0,0,0|0,0,0]=1 30 B10R1.4 NCCC1=C(O)C=CC=C1 A46892 [1,0,0,0,0,0|1,0,0]=2 31 B10R1.4 NNCC1=C(Br)C=CC=C1 B10205 [1,0,0,0,0,0|1,1,0]=3 32 B10R1.4 NNCC1=C(Br)C=CC=C1 B7428 [1,0,0,0,0,0|1,1,0]=3 33 B10R1.4 NNCC1=C(Cl)C=CC=C1 C10207 [1,0,0,0,0,0|1,0,0]=2 34 B10R1.4 NNCC1=C(F)C=CC=C1 F0092 [1,0,0,0,0,0|1,0,0]=2 35 B10R1.4 NNCC1=C(F)C=CC=C1 F7427 [1,0,0,0,0,0|1,0,0]=2 36 B10R1.4 NOCC1=C(F)C=CC=C1 F63413 [1,0,0,0,0,0|1,0,0]=2 37 B10R1.4 OCCC1=C(Br)C=CC=C1 B16411 [1,0,0,0,0,0|1,1,0]=3 38 B10R1.4 OCCC1=C(Cl)C=CC=C1 C49443 [1,0,0,0,0,0|1,0,0]=2 39 B10R1.4 OCCC1=C(F)C=CC=C1 F49457 [1,0,0,0,0,0|1,0,0]=2 40 B10R1.4 OCCC1=C(I)C=CC=C1 K49472 [1,0,0,0,0,0|1,1,0]=3 41 B10R1.245 CC1=CC=CC(C)=C1CBr B38662 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.245 CC1=CC=CC(C)=C1CCl C49970 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.245 CC1=CC=CC(C)=C1CN D38617 [1,0,0,0,0,0|2,0,0]=3 44 B10R1.245 CC1=CC=CC(C)=C1CO D50274 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.245 CC1=CC=CC(C)=C1NN D49536 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.245 CC1=CC=CC(F)=C1C#N F47974 [1,0,0,0,0,0|1,0,2]=4 47 B10R1.245 CC1=CC=CC(F)=C1C=O F48739 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.245 CC1=CC=CC(F)=C1CO F49464 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.245 CC1=CC=CC(O)=C1CO H46831 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.245 CCC1=C(Br)C=NC=C1F B45774 [1,0,0,0,0,0|1,1,0]=3 51 B10R1.245 CNC1=C(Br)C=CC=C1N B46289 [1,0,0,0,0,0|2,1,0]=4 52 B10R1.245 CNC1=C(F)C=CC=C1F D46547 [1,0,0,0,0,0|1,1,0]=3 53 B10R1.245 COC1=C(Br)C=CC=C1Br D45550 [1,0,0,0,0,0|1,2,0]=4 54 B10R1.245 COC1=C(Br)C=CC=C1Cl B45560 [1,0,0,0,0,0|1,1,0]=3 55 B10R1.245 COC1=C(Br)C=CC=C1F B45573 [1,0,0,0,0,0|1,1,0]=3 56 B10R1.245 COC1=C(Br)C=CC=C1N B46153 [1,0,0,0,0,0|2,1,0]=4 57 B10R1.245 COC1=C(Br)C=CC=C1O B61272 [1,0,0,0,0,0|2,1,0]=4 58 B10R1.245 COC1=C(Cl)C=CC=C1F C45593 [1,0,0,0,0,0|1,0,0]=2 59 B10R1.245 COC1=C(Cl)C=CC=C1N C46187 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.245 COC1=C(Cl)C=CN=C1C C11879 [1,0,0,0,0,0|3,0,0]=4 61 B10R1.245 COC1=C(Cl)C=CN=C1N C18269 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.245 COC1=C(F)C=CC=C1N F38584 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.245 COC1=C(F)C=CN=C1N F43082 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.245 ClC1=CC=CC(Br)=C1CBr B44689 [1,0,0,0,0,0|1,1,0]=3 65 B10R1.245 ClC1=CC=CC(Cl)=C1CBr D22237 [1,0,0,0,0,0|1,1,0]=3 66 B10R1.245 FC1=CC=CC(Cl)=C1CBr B44716 [1,0,0,0,0,0|1,0,0]=2 67 B10R1.245 FC1=CC=CC(I)=C1CBr B44728 [1,0,0,0,0,0|1,1,0]=3 68 B10R1.245 FC1=CN=CC(Br)=C1CCl B42206 [1,0,0,0,0,0|2,1,0]=4 69 B10R1.245 N#CC1=C(Br)C=CC=C1Cl B44092 [1,0,0,0,0,0|0,1,2]=4 70 B10R1.245 N#CC1=C(Br)C=CC=C1F B44106 [1,0,0,0,0,0|0,1,2]=4 71 B10R1.245 N#CC1=C(Cl)C=CC=C1F C39315 [1,0,0,0,0,0|0,0,2]=3 72 B10R1.245 N#CC1=C(Cl)C=CC=C1N A44770 [1,0,0,0,0,0|1,0,2]=4 73 B10R1.245 N#CC1=C(Cl)C=CC=C1O C1753 [1,0,0,0,0,0|1,0,2]=4 74 B10R1.245 N#CC1=C(F)C=CC=C1F D68893 [1,0,0,0,0,0|0,1,2]=4 75 B10R1.245 N#CC1=C(F)C=CC=C1N A39354 [1,0,0,0,0,0|1,0,2]=4 76 B10R1.245 N#CC1=C(F)C=CC=C1O F44544 [1,0,0,0,0,0|1,0,2]=4 77 B10R1.245 N#CC1=C(F)C=CN=C1Cl C41683 [1,0,0,0,0,0|1,0,2]=4 78 B10R1.245 N#CC1=C(I)C=CC=C1Cl C44129 [1,0,0,0,0,0|0,1,2]=4 79 B10R1.245 N#CC1=C(I)C=CC=C1F F25440 [1,0,0,0,0,0|0,1,2]=4 80 B10R1.245 NC1=CC=CC(Cl)=C1C=O A45482 [1,0,0,0,0,0|2,0,1]=4 81 B10R1.245 NC1=CC=CC(Cl)=C1CO A46197 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.245 NC1=CC=CC(F)=C1CO A46216 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.245 NCC1=C(Br)C=CC=C1Br D45759 [1,0,0,0,0,0|0,2,0]=3 84 B10R1.245 NCC1=C(Cl)C=CC=C1Cl D45794 [1,0,0,0,0,0|0,1,0]=2 85 B10R1.245 NCC1=C(Cl)C=NC=C1Cl D42752 [1,0,0,0,0,0|1,1,0]=3 86 B10R1.245 NCC1=C(F)C=CC=C1F D45807 [1,0,0,0,0,0|0,1,0]=2 87 B10R1.245 NNC1=C(Br)C=CC=C1F B42738 [1,0,0,0,0,0|1,1,0]=3 88 B10R1.245 NNC1=C(Cl)C=CC=C1Cl D42753 [1,0,0,0,0,0|1,1,0]=3 89 B10R1.245 NNC1=C(Cl)C=CC=C1F C42762 [1,0,0,0,0,0|1,0,0]=2 90 B10R1.245 NNC1=C(F)C=CC=C1F D42765 [1,0,0,0,0,0|1,1,0]=3 91 B10R1.245 NNC1=C(F)C=CC=C1F D69479 [1,0,0,0,0,0|1,1,0]=3 92 B10R1.245 O=CC1=C(Br)C=CC=C1Cl B44636 [1,0,0,0,0,0|1,1,1]=4 93 B10R1.245 O=CC1=C(Br)C=CC=C1F B38461 [1,0,0,0,0,0|1,1,1]=4 94 B10R1.245 O=CC1=C(Cl)C=CC=C1Cl D67911 [1,0,0,0,0,0|1,1,1]=4 95 B10R1.245 O=CC1=C(Cl)C=CC=C1F C68856 [1,0,0,0,0,0|1,0,1]=3 96 B10R1.245 O=CC1=C(Cl)C=CC=C1O C21966 [1,0,0,0,0,0|2,0,1]=4 97 B10R1.245 O=CC1=C(Cl)C=CN=C1F C42013 [1,0,0,0,0,0|2,0,1]=4 98 B10R1.245 O=CC1=C(F)C=CC=C1F D44677 [1,0,0,0,0,0|1,1,1]=4 99 B10R1.245 O=CC1=C(F)C=CC=C1O F45100 [1,0,0,0,0,0|2,0,1]=4 100 B10R1.245 O=CC1=C(I)C=CC=C1Cl C44673 [1,0,0,0,0,0|1,1,1]=4 101 B10R1.245 OCC1=C(Br)C=CC=C1Br D45546 [1,0,0,0,0,0|1,2,0]=4 102 B10R1.245 OCC1=C(Br)C=CC=C1F B45569 [1,0,0,0,0,0|1,1,0]=3 103 B10R1.245 OCC1=C(Br)C=NC=C1Cl B42650 [1,0,0,0,0,0|2,1,0]=4 104 B10R1.245 OCC1=C(Cl)C=CC=C1Cl D45590 [1,0,0,0,0,0|1,1,0]=3 105 B10R1.245 OCC1=C(Cl)C=NC=C1Cl D8287 [1,0,0,0,0,0|2,1,0]=4 106 B10R1.245 OCC1=C(F)C=CC=C1F D39395 [1,0,0,0,0,0|1,1,0]=3 107 B10R1.245 OCC1=C(I)C=CN=C1F F3125 [1,0,0,0,0,0|2,1,0]=4 108 B12R1.1009 O=C(O)CC1=C(Cl)C=CC=C1Cl D68787 [0,1,0,0,0,0|1,1,1]=4 109 B12R1.1095 CC1=CC(C)=C(CCO)C(C)=C1 M54948 [0,1,0,0,0,0|3,0,0]=4 110 B12R1.1095 FC1=CC(F)=C(CCBr)C(F)=C1 B18254 [0,1,0,0,0,0|1,1,0]=3 111 B12R1.1112 COC1=CC=CC(F)=C1CC#N F51536 [0,1,0,0,0,0|1,0,2]=4 112 B12R1.3441 COC(=O)C1=C(Cl)C=CC=C1F M48164 [0,1,0,0,0,0|2,0,1]=4 113 B12R1.3441 O=C(CBr)C1=C(Cl)C=CC=C1Cl B47835 [0,1,0,0,0,0|1,1,1]=4 114 B12R2.202 NC1=NC2=C(C=CC=C2F)S1 F22218 [0,0,0,1,0,0|2,0,1]=4 115 B12R2.202 NC1=NC2=C(Cl)C=CC=C2S1 A44786 [0,0,0,1,0,0|2,0,1]=4 116 B12R2.202 NC1=NC2=CC=CC(Cl)=C2S1 C44789 [0,0,0,1,0,0|2,0,1]=4 117 B12R2.202 O=C1CC2=C(Cl)C=CC=C2N1 C22284 [0,0,0,1,0,0|2,0,1]=4 118 B12R2.202 O=C1CC2=C(F)C=CC=C2N1 F48095 [0,0,0,1,0,0|2,0,1]=4 119 B12R2.202 O[C@H]1CC2=CC=CC(Br)=C2C1 B18025 [0,0,0,1,0,0|2,1,0]=4 120 B12R2.1081 BrC1=C2CCCCC2=CC=C1 B4845 [0,0,0,1,0,0|2,1,0]=4 121 B12R2.1081 BrC1=C2CCCNC2=CC=C1 B14750 [0,0,0,1,0,0|2,1,0]=4 122 B12R2.1081 BrC1=C2CCCNC2=CC=C1 B49764 [0,0,0,1,0,0|2,1,0]=4 123 B12R2.1081 BrC1=C2CCCOC2=CC=C1 B52015 [0,0,0,1,0,0|2,1,0]=4 124 B12R2.1081 BrC1=C2CCNCC2=CC=C1 B14751 [0,0,0,1,0,0|1,1,0]=3 125 B12R2.1081 BrC1=C2CCNCC2=CC=C1 B26536 [0,0,0,1,0,0|1,1,0]=3 126 B12R2.1081 CC1=CC=CC2=C1CCCN2 M54142 [0,0,0,1,0,0|3,0,0]=4 127 B12R2.1081 ClC1=C2CCCCC2=NC=C1 C49771 [0,0,0,1,0,0|3,0,0]=4 128 B12R2.1081 ClC1=C2CCCNC2=CC=C1 C36903 [0,0,0,1,0,0|2,0,0]=3 129 B12R2.1081 ClC1=C2CNCCC2=CC=C1 C49773 [0,0,0,1,0,0|3,0,0]=4 130 B12R2.1081 ClC1=C2CNCCC2=CC=C1 C49780 [0,0,0,1,0,0|3,0,0]=4 131 B12R2.1081 ClC1=C2OCCCC2=CC=C1 C52035 [0,0,0,1,0,0|3,0,0]=4 132 B12R2.1081 FC1=C2CCCNC2=CC=C1 F5341 [0,0,0,1,0,0|2,0,0]=3 133 B12R2.1081 FC1=C2OCCNC2=CC=C1 F49054 [0,0,0,1,0,0|3,0,0]=4 134 B12R2.1081 NC1=CC=CC2=C1CCNC2 T50168 [0,0,0,1,0,0|2,0,0]=3 135 B12R2.1081 NC1=CC=CC2=C1CCNC2 T52129 [0,0,0,1,0,0|2,0,0]=3 136 B12R2.1081 O=C1NC=CC2=C1CCNC2 T4210 [0,0,0,1,0,0|3,0,0]=4 137 B12R2.1081 O=C1NC=CC2=C1CCNC2 T49494 [0,0,0,1,0,0|3,0,0]=4 138 B10R1.187 NCCN1C(=O)C=CC1=O A46630 [0,0,0,0,1,0|3,0,0]=4 139 B9R1.8 BrCCC1=CC=NC=C1 B46088 [2,0,0,0,0,0|2,0,0]=4 140 B9R1.8 CCCC1=NC=CC=C1 P46859 [2,0,0,0,0,0|2,0,0]=4 141 B9R1.8 NCCC1=CC=CN=C1 P43605 [2,0,0,0,0,0|1,0,0]=3 142 B9R1.8 NCCC1=NC=CC=C1 P67673 [2,0,0,0,0,0|1,0,0]=3 143 B9R1.8 NCCC1=NC=NC=C1 P14666 [2,0,0,0,0,0|2,0,0]=4 144 B9R1.8 NCCC1=NC=NC=C1 P29961 [2,0,0,0,0,0|2,0,0]=4 145 B9R1.8 NNCC1=CC=CC=C1 B6123 [2,0,0,0,0,0|1,0,0]=3 146 B9R1.8 NNCC1=CC=CC=C1 B68081 [2,0,0,0,0,0|1,0,0]=3 147 B9R1.8 NNCC1=CC=CN=C1 H0097 [2,0,0,0,0,0|2,0,0]=4 148 B9R1.8 NNCC1=CC=CN=C1 H36962 [2,0,0,0,0,0|2,0,0]=4 149 B9R1.8 NNCC1=CC=NC=C1 H0096 [2,0,0,0,0,0|2,0,0]=4 150 B9R1.8 NNCC1=CC=NC=C1 H26285 [2,0,0,0,0,0|2,0,0]=4 151 B9R1.8 NNCC1=NC=CC=C1 H0098 [2,0,0,0,0,0|2,0,0]=4 152 B9R1.8 NOCC1=CC=CC=C1 B68114 [2,0,0,0,0,0|1,0,0]=3 153 B9R1.8 OCCC1=CC=NC=C1 H46381 [2,0,0,0,0,0|2,0,0]=4 154 B9R1.8 OCCC1=CN=CC=C1 P46376 [2,0,0,0,0,0|2,0,0]=4 155 B9R1.8 ONCC1=CC=CC=C1 B36744 [2,0,0,0,0,0|2,0,0]=4 156 B9R1.8 ONCC1=CC=CC=C1 B46575 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B66761 [2,0,0,0,0,0|2,0,0]=4 158 B9R1.8 [Mg+]CCC1=CC=CC=C1 P31723 [2,0,0,0,0,0|1,0,0]=3 159 B9R1.15 BrCC1=C(I)C=CC=C1 B37896 [2,0,0,0,0,0|1,1,0]=4 160 B9R1.15 C#CC1=C(Cl)C=CC=C1 C38576 [2,0,0,0,0,0|0,0,2]=4 161 B9R1.15 C#CC1=C(F)C=CC=C1 E47539 [2,0,0,0,0,0|0,0,2]=4 162 B9R1.15 C=CC1=C(Cl)C=CC=C1 C48303 [2,0,0,0,0,0|0,0,2]=4 163 B9R1.15 CC1=C(CN)C=CC=C1 M65907 [2,0,0,0,0,0|1,0,0]=3 164 B9R1.15 CC1=C(CN)C=NC=C1 A11511 [2,0,0,0,0,0|2,0,0]=4 165 B9R1.15 CC1=C(NN)C=CC=C1 T39424 [2,0,0,0,0,0|2,0,0]=4 166 B9R1.15 CC1=CC=CN=C1CN M46460 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.15 CCC1=C(Br)C=CC=C1 B68946 [2,0,0,0,0,0|0,1,0]=3 168 B9R1.15 CCC1=C(Br)C=CC=N1 B23432 [2,0,0,0,0,0|1,1,0]=4 169 B9R1.15 CCC1=C(Br)C=CN=C1 B10961 [2,0,0,0,0,0|1,1,0]=4 170 B9R1.15 CCC1=C(Br)C=CN=C1 B30062 [2,0,0,0,0,0|1,1,0]=4 171 B9R1.15 CCC1=C(Br)C=NC=C1 B23431 [2,0,0,0,0,0|1,1,0]=4 172 B9R1.15 CCC1=C(C)C=CC=C1 E50165 [2,0,0,0,0,0|1,0,0]=3 173 B9R1.15 CCC1=C(F)C=NC=N1 E0673 [2,0,0,0,0,0|2,0,0]=4 174 B9R1.15 CCC1=C([Mg+])C=CC=C1 E31738 [2,0,0,0,0,0|1,0,0]=3 175 B9R1.15 CCC1=CN=CN=C1Cl C42985 [2,0,0,0,0,0|2,0,0]=4 176 B9R1.15 CCC1=NC=CN=C1Cl C38966 [2,0,0,0,0,0|2,0,0]=4 177 B9R1.15 CC[N+]1=C(Br)C=CC=C1 B46367 [2,0,0,0,0,0|1,1,0]=4 178 B9R1.15 CNC1=C(Br)C=CC=C1 B46075 [2,0,0,0,0,0|1,1,0]=4 179 B9R1.15 CNC1=C(C)C=CC=C1 D46860 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.15 CNC1=C(Cl)C=CC=C1 C46094 [2,0,0,0,0,0|1,0,0]=3 181 B9R1.15 CNC1=C(Cl)C=CC=N1 C42995 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.15 CNC1=C(F)C=CC=C1 M39414 [2,0,0,0,0,0|1,0,0]=3 183 B9R1.15 CNC1=C(N)C=CC=C1 M43618 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.15 CNC1=C(N)C=CC=C1 M68814 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.15 CNC1=C(O)C=CC=C1 M64657 [2,0,0,0,0,0|2,0,0]=4 186 B9R1.15 CNC1=CC=CN=C1Cl C42994 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.15 COC1=C(Br)C=CC=C1 B67901 [2,0,0,0,0,0|1,1,0]=4 188 B9R1.15 COC1=C(Cl)C=CC=N1 C42900 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.15 COC1=C(Cl)C=NC=C1 C42901 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.15 COC1=C(F)C=CC=N1 F42926 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.15 COC1=C(I)C=CC=C1 K68160 [2,0,0,0,0,0|1,1,0]=4 192 B9R1.15 COC1=C([Mg+])C=CC=C1 M31742 [2,0,0,0,0,0|2,0,0]=4 193 B9R1.15 COC1=CC=CN=C1Cl C24085 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.15 COC1=CC=CN=C1F F42924 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.15 CSC1=C(F)N=CC=C1 F42849 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.15 CSC1=C([Mg+])C=CC=C1 M31770 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.15 ClCC1=C(Cl)C=CC=N1 C42563 [2,0,0,0,0,0|2,0,0]=4 198 B9R1.15 ClCC1=C(Cl)C=CC=N1 C42564 [2,0,0,0,0,0|2,0,0]=4 199 B9R1.15 ClCC1=CC=CN=C1Cl C7688 [2,0,0,0,0,0|2,0,0]=4 200 B9R1.15 FC1=C(C[Mg+])C=CC=C1 F6778 [2,0,0,0,0,0|1,0,0]=3 201 B9R1.15 FC1=CC=CN=C1CBr B19661 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.15 FC1=CC=CN=C1CBr B7783 [2,0,0,0,0,0|2,0,0]=4 203 B9R1.15 FC1=CC=CN=C1CCl C13988 [2,0,0,0,0,0|2,0,0]=4 204 B9R1.15 N#CC1=C(F)C=CC=C1 F68598 [2,0,0,0,0,0|0,0,2]=4 205 B9R1.15 NC1=C(CO)C=CC=C1 A7795 [2,0,0,0,0,0|2,0,0]=4 206 B9R1.15 NCC1=C(Br)C=CC=C1 B36643 [2,0,0,0,0,0|0,1,0]=3 207 B9R1.15 NCC1=C(Br)C=CN=C1 B63849 [2,0,0,0,0,0|1,1,0]=4 208 B9R1.15 NCC1=C(Br)C=NC=C1 B36920 [2,0,0,0,0,0|1,1,0]=4 209 B9R1.15 NCC1=C(Cl)C=CC=C1 C46097 [2,0,0,0,0,0|0,0,0]=2 210 B9R1.15 NCC1=C(Cl)C=CC=C1 C46104 [2,0,0,0,0,0|0,0,0]=2 211 B9R1.15 NCC1=C(Cl)C=CC=N1 A14307 [2,0,0,0,0,0|1,0,0]=3 212 B9R1.15 NCC1=C(Cl)C=CC=N1 C29809 [2,0,0,0,0,0|1,0,0]=3 213 B9R1.15 NCC1=C(F)C=CC=C1 F26320 [2,0,0,0,0,0|0,0,0]=2 214 B9R1.15 NCC1=C(F)C=CC=N1 A12648 [2,0,0,0,0,0|1,0,0]=3 215 B9R1.15 NCC1=C(F)C=CC=N1 A1712 [2,0,0,0,0,0|1,0,0]=3 216 B9R1.15 NCC1=C(F)C=CC=N1 F61824 [2,0,0,0,0,0|1,0,0]=3 217 B9R1.15 NCC1=C(F)C=NC=C1 F9408 [2,0,0,0,0,0|1,0,0]=3 218 B9R1.15 NCC1=C(I)C=CC=C1 I36799 [2,0,0,0,0,0|0,1,0]=3 219 B9R1.15 NCC1=C(O)C=CC=C1 A38718 [2,0,0,0,0,0|1,0,0]=3 220 B9R1.15 NCC1=C(O)C=CC=C1 A46574 [2,0,0,0,0,0|1,0,0]=3 221 B9R1.15 NCC1=C(O)C=CC=N1 A43199 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.15 NCC1=C(O)C=NC=C1 A43200 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.15 NCC1=CC=CN=C1Cl A10464 [2,0,0,0,0,0|1,0,0]=3 224 B9R1.15 NCC1=CC=CN=C1F F43528 [2,0,0,0,0,0|1,0,0]=3 225 B9R1.15 NCC1=NC=CN=C1Cl C25893 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.15 NCC1=NC=CN=C1Cl C26687 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.15 NNC1=C(Br)C=CC=C1 B39273 [2,0,0,0,0,0|1,1,0]=4 228 B9R1.15 NNC1=C(Cl)C=CC=C1 C39274 [2,0,0,0,0,0|1,0,0]=3 229 B9R1.15 NNC1=C(Cl)C=CC=N1 C5118 [2,0,0,0,0,0|2,0,0]=4 230 B9R1.15 NNC1=C(F)C=CC=C1 F39286 [2,0,0,0,0,0|1,0,0]=3 231 B9R1.15 NNC1=C(F)C=CC=N1 F41082 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.15 NNC1=C(I)C=CC=C1 K43028 [2,0,0,0,0,0|1,1,0]=4 233 B9R1.15 O=CC1=C(Cl)C=CC=C1 C67575 [2,0,0,0,0,0|1,0,1]=4 234 B9R1.15 O=CC1=C(F)C=CC=C1 F68099 [2,0,0,0,0,0|1,0,1]=4 235 B9R1.15 OCC1=C(Br)C=CC=C1 B39402 [2,0,0,0,0,0|1,1,0]=4 236 B9R1.15 OCC1=C(Cl)C=CC=C1 C68885 [2,0,0,0,0,0|1,0,0]=3 237 B9R1.15 OCC1=C(Cl)C=CC=N1 C42910 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.15 OCC1=C(Cl)C=CN=C1 C42911 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.15 OCC1=C(Cl)C=CN=C1 C42915 [2,0,0,0,0,0|2,0,0]=4 240 B9R1.15 OCC1=C(F)C=CC=C1 F39407 [2,0,0,0,0,0|1,0,0]=3 241 B9R1.15 OCC1=C(F)C=CC=N1 F1706 [2,0,0,0,0,0|2,0,0]=4 242 B9R1.15 OCC1=C(F)C=CN=C1 F30083 [2,0,0,0,0,0|2,0,0]=4 243 B9R1.15 OCC1=C(F)C=NC=C1 F10404 [2,0,0,0,0,0|2,0,0]=4 244 B9R1.15 OCC1=C(I)C=CC=C1 K45967 [2,0,0,0,0,0|1,1,0]=4 245 B9R1.15 OCC1=CC=CN=C1Cl C0580 [2,0,0,0,0,0|2,0,0]=4 246 B9R1.15 OCC1=CC=CN=C1F F42930 [2,0,0,0,0,0|2,0,0]=4 247 B9R1.3 CC1=C(Br)C=CC=C1Br D45153 [2,0,0,0,0,0|0,2,0]=4 248 B9R1.3 CC1=C(Br)C=CC=C1Cl B39372 [2,0,0,0,0,0|0,1,0]=3 249 B9R1.3 CC1=C(Br)C=CC=C1F B45164 [2,0,0,0,0,0|0,1,0]=3 250 B9R1.3 CC1=C(Br)C=CC=C1N B9477 [2,0,0,0,0,0|1,1,0]=4 251 B9R1.3 CC1=C(Br)C=CC=C1O B45947 [2,0,0,0,0,0|1,1,0]=4 252 B9R1.3 CC1=C(Br)C=CN=C1Cl B18413 [2,0,0,0,0,0|1,1,0]=4 253 B9R1.3 CC1=C(Br)C=CN=C1F B18412 [2,0,0,0,0,0|1,1,0]=4 254 B9R1.3 CC1=C(Br)C=NC=C1Cl B42534 [2,0,0,0,0,0|1,1,0]=4 255 B9R1.3 CC1=C(C)C(Cl)=NC=C1 C46100 [2,0,0,0,0,0|2,0,0]=4 256 B9R1.3 CC1=C(Cl)C=CC=C1N C64896 [2,0,0,0,0,0|1,0,0]=3 257 B9R1.3 CC1=C(Cl)C=CC=C1O C45954 [2,0,0,0,0,0|1,0,0]=3 258 B9R1.3 CC1=C(Cl)C=CN=C1Br B61884 [2,0,0,0,0,0|1,1,0]=4 259 B9R1.3 CC1=C(Cl)C=CN=C1Cl D18641 [2,0,0,0,0,0|1,1,0]=4 260 B9R1.3 CC1=C(Cl)C=CN=C1N C42996 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.3 CC1=C(Cl)C=NC=C1Cl D37338 [2,0,0,0,0,0|1,1,0]=4 262 B9R1.3 CC1=C(F)C=CC=C1F D45186 [2,0,0,0,0,0|0,1,0]=3 263 B9R1.3 CC1=C(F)C=CC=C1N F46112 [2,0,0,0,0,0|1,0,0]=3 264 B9R1.3 CC1=C(F)C=CC=C1O F38593 [2,0,0,0,0,0|1,0,0]=3 265 B9R1.3 CC1=C(I)C=CC=C1Br B38558 [2,0,0,0,0,0|0,2,0]=4 266 B9R1.3 CC1=C(I)C=CC=C1Cl C45180 [2,0,0,0,0,0|0,1,0]=3 267 B9R1.3 CC1=C(I)C=CC=C1F F45192 [2,0,0,0,0,0|0,1,0]=3 268 B9R1.3 CC1=C(I)C=CC=C1N A46115 [2,0,0,0,0,0|1,1,0]=4 269 B9R1.3 CC1=C(I)C=CN=C1Cl C68165 [2,0,0,0,0,0|1,1,0]=4 270 B9R1.3 CC1=C(I)C=CN=C1F F42593 [2,0,0,0,0,0|1,1,0]=4 271 B9R1.3 CC1=C(N)C(Cl)=NC=C1 C67997 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.3 CC1=C(N)C(F)=NC=C1 F43013 [2,0,0,0,0,0|2,0,0]=4 273 B9R1.3 CC1=C(O)C=CC=C1N A46372 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.3 CC1=C(O)C=CC=C1O M68594 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.3 CC1=C([Mg+])C=CC=C1F F31749 [2,0,0,0,0,0|1,0,0]=3 276 B9R1.3 CC1=CC=CC(Br)=C1N B9480 [2,0,0,0,0,0|1,1,0]=4 277 B9R1.3 CC1=CC=CC(Cl)=C1Br B45162 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.3 CC1=CC=CC(Cl)=C1I C45181 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.3 CC1=CC=CC(Cl)=C1N C46093 [2,0,0,0,0,0|1,0,0]=3 280 B9R1.3 CC1=CC=CC(F)=C1Br B45169 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.3 CC1=CC=CC(F)=C1C F49163 [2,0,0,0,0,0|1,0,0]=3 282 B9R1.3 CC1=CC=CC(F)=C1F D45187 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.3 CC1=CC=CC(F)=C1I F45190 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.3 CC1=CC=CC(F)=C1N F38493 [2,0,0,0,0,0|1,0,0]=3 285 B9R1.3 CC1=CC=CC(I)=C1C K49168 [2,0,0,0,0,0|1,1,0]=4 286 B9R1.3 CC1=CC=CC(N)=C1N M68904 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.3 CC1=CC=CC(O)=C1N A46371 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.3 CC1=CC=CC([Mg+])=C1C D31734 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.3 CC1=CN=CC(Cl)=C1N C32268 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.3 CC1=CN=CC(F)=C1N F43016 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.3 CN1C(=O)C=CC=C1Cl C42913 [2,0,0,0,0,0|2,0,0]=4 292 B9R1.3 ClC1=CC=CC(Br)=C1Cl B41776 [2,0,0,0,0,0|1,1,0]=4 293 B9R1.3 ClC1=CC=CC(Br)=C1I B41784 [2,0,0,0,0,0|1,1,0]=4 294 B9R1.3 ClC1=CC=CC(Cl)=C1Br B41777 [2,0,0,0,0,0|1,1,0]=4 295 B9R1.3 ClC1=CC=CC(Cl)=C1I D41802 [2,0,0,0,0,0|1,1,0]=4 296 B9R1.3 ClC1=CC=CC(I)=C1Br B37218 [2,0,0,0,0,0|1,1,0]=4 297 B9R1.3 ClC1=CC=CC(I)=C1Cl D41800 [2,0,0,0,0,0|1,1,0]=4 298 B9R1.3 FC1=C(Br)C(Cl)=CC=N1 B40510 [2,0,0,0,0,0|2,0,0]=4 299 B9R1.3 FC1=C(Br)C=CC=C1Cl B41782 [2,0,0,0,0,0|1,1,0]=4 300 B9R1.3 FC1=C(Cl)C=CC=C1Cl D39227 [2,0,0,0,0,0|1,1,0]=4 301 B9R1.3 FC1=C(I)C=CC=C1Cl C41808 [2,0,0,0,0,0|1,1,0]=4 302 B9R1.3 FC1=CC=CC(Br)=C1Cl B41781 [2,0,0,0,0,0|1,1,0]=4 303 B9R1.3 FC1=CC=CC(Br)=C1F B67479 [2,0,0,0,0,0|1,1,0]=4 304 B9R1.3 FC1=CC=CC(Br)=C1I B41793 [2,0,0,0,0,0|1,1,0]=4 305 B9R1.3 FC1=CC=CC(Cl)=C1Br B38490 [2,0,0,0,0,0|1,0,0]=3 306 B9R1.3 FC1=CC=CC(Cl)=C1F C41803 [2,0,0,0,0,0|1,0,0]=3 307 B9R1.3 FC1=CC=CC(Cl)=C1I C41809 [2,0,0,0,0,0|1,0,0]=3 308 B9R1.3 FC1=CC=CC(F)=C1Br B41789 [2,0,0,0,0,0|1,1,0]=4 309 B9R1.3 FC1=CC=CC(F)=C1I D41814 [2,0,0,0,0,0|1,1,0]=4 310 B9R1.3 FC1=CN=CC(Cl)=C1Br B40513 [2,0,0,0,0,0|2,0,0]=4 311 B9R1.3 FC1=NC=CC(Cl)=C1F D40530 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.3 NC1=C(Br)C=CC=C1Br D42513 [2,0,0,0,0,0|0,2,0]=4 313 B9R1.3 NC1=C(Br)C=CC=C1Cl B38738 [2,0,0,0,0,0|0,1,0]=3 314 B9R1.3 NC1=C(Br)C=CC=C1F B42542 [2,0,0,0,0,0|0,1,0]=3 315 B9R1.3 NC1=C(Br)C=CC=C1O A32065 [2,0,0,0,0,0|1,1,0]=4 316 B9R1.3 NC1=C(Br)C=CN=C1Cl B40708 [2,0,0,0,0,0|1,1,0]=4 317 B9R1.3 NC1=C(Br)C=NC=C1Cl B40707 [2,0,0,0,0,0|1,1,0]=4 318 B9R1.3 NC1=C(Br)C=NC=C1F B8754 [2,0,0,0,0,0|1,1,0]=4 319 B9R1.3 NC1=C(Cl)C=CC=C1F C42567 [2,0,0,0,0,0|0,0,0]=2 320 B9R1.3 NC1=C(Cl)C=CC=C1O A42895 [2,0,0,0,0,0|1,0,0]=3 321 B9R1.3 NC1=C(Cl)C=CN=C1Cl A37901 [2,0,0,0,0,0|1,1,0]=4 322 B9R1.3 NC1=C(F)C=CC=C1F D42587 [2,0,0,0,0,0|0,1,0]=3 323 B9R1.3 NC1=C(F)C=CC=C1O A42917 [2,0,0,0,0,0|1,0,0]=3 324 B9R1.3 NC1=C(F)C=NC=C1F D4907 [2,0,0,0,0,0|1,1,0]=4 325 B9R1.3 NC1=C(I)C=CC=C1Br B63450 [2,0,0,0,0,0|0,2,0]=4 326 B9R1.3 NC1=C(I)C=CC=C1Cl C42576 [2,0,0,0,0,0|0,1,0]=3 327 B9R1.3 NC1=C(I)C=CC=C1F F42588 [2,0,0,0,0,0|0,1,0]=3 328 B9R1.3 NC1=C(I)C=NC=C1Cl C40739 [2,0,0,0,0,0|1,1,0]=4 329 B9R1.3 NC1=C(N)C(Cl)=NC=C1 C3943 [2,0,0,0,0,0|2,0,0]=4 330 B9R1.3 NC1=C(O)C=CC=C1O A38678 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.3 NC1=C(O)C=CC=C1O A43534 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.3 NC1=CC=CC(Br)=C1N B32181 [2,0,0,0,0,0|1,1,0]=4 333 B9R1.3 NC1=CC=CC(Br)=C1N B5243 [2,0,0,0,0,0|1,1,0]=4 334 B9R1.3 NC1=CC=CC(Cl)=C1Br B36963 [2,0,0,0,0,0|2,0,0]=4 335 B9R1.3 NC1=CC=CC(Cl)=C1F C69237 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.3 NC1=CC=CC(Cl)=C1I C42577 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.3 NC1=CC=CC(Cl)=C1N D42986 [2,0,0,0,0,0|1,0,0]=3 338 B9R1.3 NC1=CC=CC(Cl)=C1O A42896 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.3 NC1=CC=CC(F)=C1Br B42541 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.3 NC1=CC=CC(F)=C1Cl C42566 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.3 NC1=CC=CC(F)=C1F D42586 [2,0,0,0,0,0|2,0,0]=4 342 B9R1.3 NC1=CC=CC(F)=C1I F42589 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.3 NC1=CC=CC(F)=C1I F42597 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.3 NC1=CC=CC(F)=C1N F43010 [2,0,0,0,0,0|1,0,0]=3 345 B9R1.3 NC1=CC=CC(F)=C1O F42923 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.3 NC1=CC=CC(N)=C1N B43329 [2,0,0,0,0,0|2,0,0]=4 347 B9R1.3 NC1=CC=CC(O)=C1N D43186 [2,0,0,0,0,0|2,0,0]=4 348 B9R1.3 NC1=CN=CC(Cl)=C1N C41072 [2,0,0,0,0,0|2,0,0]=4 349 B9R1.3 NC1=NC=CC(Cl)=C1N D0349 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.3 OC1=C(Br)C=CC=C1Cl B42339 [2,0,0,0,0,0|1,1,0]=4 351 B9R1.3 OC1=C(Br)C=CC=C1F B36617 [2,0,0,0,0,0|1,1,0]=4 352 B9R1.3 OC1=C(Cl)C=CC=C1F C68563 [2,0,0,0,0,0|1,0,0]=3 353 B9R1.3 OC1=C(F)C=CC=C1F D68585 [2,0,0,0,0,0|1,1,0]=4 354 B9R1.3 OC1=C(I)C=CC=C1Cl C42360 [2,0,0,0,0,0|1,1,0]=4 355 B9R1.3 OC1=C(I)C=CC=C1F F42368 [2,0,0,0,0,0|1,1,0]=4 356 B9R1.3 OC1=CC=CC(Cl)=C1Br B42338 [2,0,0,0,0,0|2,0,0]=4 357 B9R1.3 OC1=CC=CC(Cl)=C1F C42354 [2,0,0,0,0,0|2,0,0]=4 358 B9R1.3 OC1=CC=CC(Cl)=C1I C42361 [2,0,0,0,0,0|2,0,0]=4 359 B9R1.3 OC1=CC=CC(F)=C1Br B38692 [2,0,0,0,0,0|2,0,0]=4 360 B9R1.3 OC1=CC=CC(F)=C1Cl C11181 [2,0,0,0,0,0|2,0,0]=4 361 B9R1.3 OC1=CC=CC(F)=C1O F42701 [2,0,0,0,0,0|2,0,0]=4 362 B9R1.3 SC1=CC=CC(Cl)=C1Cl D62484 [2,0,0,0,0,0|2,0,0]=4 363 B11R1.13 N#CCC1=CC=CC(Br)=C1F B47670 [1,1,0,0,0,0|0,0,2]=4 364 B11R1.13 N#CCC1=CC=CC(Cl)=C1Cl D47689 [1,1,0,0,0,0|0,0,2]=4 365 B11R1.13 N#CCC1=CC=CC(Cl)=C1F C47693 [1,1,0,0,0,0|0,0,2]=4 366 B11R1.13 N#CCC1=CC=CC(F)=C1F D47707 [1,1,0,0,0,0|0,0,2]=4 367 B11R1.13 OCCC1=CC=CC(Cl)=C1Cl D49145 [1,1,0,0,0,0|1,0,0]=3 368 B11R1.17 CC1=C(NCCO)C=CC=C1 H50355 [1,1,0,0,0,0|2,0,0]=4 369 B11R1.17 CC1=C(OCCN)C=CC=C1 M50346 [1,1,0,0,0,0|1,0,0]=3 370 B11R1.17 CCCOC1=C(O)C=CC=C1 P50279 [1,1,0,0,0,0|2,0,0]=4 371 B11R1.17 OCCCC1=C(Br)C=CC=C1 B50150 [1,1,0,0,0,0|1,1,0]=4 372 B11R1.17 [N-]=[N+]=NCC1=C(F)C=CC=C1 A9130 [1,1,0,0,0,0|1,0,1]=4 373 B11R1.41 COC1=C(CCBr)C=CC=C1 B50155 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.41 COC1=C(CCN)C=CC=C1 M66296 [1,1,0,0,0,0|1,0,0]=3 375 B11R1.41 COC1=C(CCO)C=CC=C1 M50284 [1,1,0,0,0,0|2,0,0]=4 376 B11R1.41 COC1=C(CNN)C=CC=C1 M12218 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.41 N#CC1=C(CCBr)C=CC=C1 B51450 [1,1,0,0,0,0|2,0,0]=4 378 B11R1.41 O=CC1=C(CCBr)C=CC=C1 B52025 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.81 CC1=CC(F)=C(CC#N)C=C1 F51461 [1,1,0,0,0,0|0,0,2]=4 380 B11R1.81 CCCC1=C(O)C=C(O)C=C1 P50281 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.81 CCOC1=C(Cl)C=C(N)C=C1 C38144 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 D1582 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 D29989 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.81 CNCC1=C(F)C=C(F)C=C1 D49253 [1,1,0,0,0,0|2,0,0]=4 385 B11R1.81 COCC1=C(F)C=C(N)C=C1 F46814 [1,1,0,0,0,0|2,0,0]=4 386 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 B48298 [1,1,0,0,0,0|1,1,0]=4 387 B11R1.81 N#CCC1=C(Cl)C=C(F)C=C1 C47696 [1,1,0,0,0,0|0,0,2]=4 388 B11R1.81 N#CCC1=C(F)C=C(Br)C=C1 B47686 [1,1,0,0,0,0|0,0,2]=4 389 B11R1.81 N#CCC1=C(F)C=C(Cl)C=C1 C60777 [1,1,0,0,0,0|0,0,2]=4 390 B11R1.81 N#CCC1=C(F)C=C(F)C=C1 D47708 [1,1,0,0,0,0|0,0,2]=4 391 B11R1.81 NCCC1=C(F)C=C(F)C=C1 D69468 [1,1,0,0,0,0|0,0,0]=2 392 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 D12478 [1,1,0,0,0,0|1,0,0]=3 393 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 D26039 [1,1,0,0,0,0|1,0,0]=3 394 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 C12475 [1,1,0,0,0,0|1,0,0]=3 395 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 C31594 [1,1,0,0,0,0|1,0,0]=3 396 B11R1.81 NOCC1=C(Cl)C=C(Cl)C=C1 D45883 [1,1,0,0,0,0|1,0,0]=3 397 B11R1.81 OCCC1=C(Cl)C=C(Cl)C=C1 D49147 [1,1,0,0,0,0|1,0,0]=3 398 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 C52039 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 F52044 [1,1,0,0,0,0|1,0,1]=4 400 B11R1.86 NC(=O)CC1=C(Cl)C=CC=C1 C49033 [1,1,0,0,0,0|0,0,1]=3 401 B11R1.86 NC(=S)NC1=C(Cl)C=CC=C1 C39396 [1,1,0,0,0,0|1,0,1]=4 402 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 F39494 [1,1,0,0,0,0|1,0,1]=4 403 B11R1.182 COCC1=C(F)C=CC(Br)=C1 B39083 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.182 N#CCC1=C(Cl)C=CC(Cl)=C1 D47687 [1,1,0,0,0,0|0,0,2]=4 405 B11R1.182 N#CCC1=C(Cl)C=CC(F)=C1 C47691 [1,1,0,0,0,0|0,0,2]=4 406 B11R1.182 N#CCC1=C(F)C=CC(Br)=C1 B38134 [1,1,0,0,0,0|0,0,2]=4 407 B11R1.182 NC1=CC(CCO)=C(N)C=C1 D47001 [1,1,0,0,0,0|2,0,0]=4 408 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 D49228 [1,1,0,0,0,0|0,0,0]=2 409 B11R1.182 OCCC1=C(Cl)C=CC(Cl)=C1 D49148 [1,1,0,0,0,0|1,0,0]=3 410 B11R1.182 OCCC1=C(F)C=CC(F)=C1 D49156 [1,1,0,0,0,0|1,0,0]=3 411 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 C52038 [1,1,0,0,0,0|1,0,1]=4 412 B11R1.222 CC[C@@H](N)C1=C(C)C=CC=C1 T54184 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 B53112 [1,1,0,0,0,0|2,0,0]=4 414 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 C50243 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 F52141 [1,1,0,0,0,0|1,0,0]=3 416 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 F52147 [1,1,0,0,0,0|1,0,0]=3 417 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 A52170 [1,1,0,0,0,0|2,0,0]=4 418 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 A69482 [1,1,0,0,0,0|0,0,1]=3 419 B11R1.222 NNC(=O)C1=C(Cl)C=CC=C1 C45693 [1,1,0,0,0,0|1,0,1]=4 420 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 F45704 [1,1,0,0,0,0|1,0,1]=4 421 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 A46331 [1,1,0,0,0,0|2,0,0]=4 422 B11R1.222 N[C@H](CO)C1=C(Cl)C=CC=C1 A46809 [1,1,0,0,0,0|1,0,0]=3 423 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 A46819 [1,1,0,0,0,0|1,0,0]=3 424 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 A49515 [1,1,0,0,0,0|1,0,0]=3 425 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 B60597 [1,1,0,0,0,0|1,0,1]=4 426 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 B48254 [1,1,0,0,0,0|1,0,1]=4 427 B11R1.222 O=C(CF)C1=C(F)C=CC=C1 F48290 [1,1,0,0,0,0|1,0,1]=4 428 B11R1.72 CC1=CC=C(Cl)C(CCl)=C1Cl D32379 [1,1,0,0,0,0|1,1,0]=4 429 B11R1.72 CC1=CC=C(Cl)C(CO)=C1Cl D49150 [1,1,0,0,0,0|1,1,0]=4 430 B11R1.72 COC1=C(Br)C=CC(F)=C1F B61018 [1,1,0,0,0,0|1,1,0]=4 431 B11R1.72 NCC1=C(F)C=CC(Cl)=C1F C32160 [1,1,0,0,0,0|0,1,0]=3 432 B11R1.72 O=CC1=C(F)C=CC(Br)=C1Cl B9142 [1,1,0,0,0,0|1,0,1]=4 433 B11R1.72 O=CC1=C(F)C=CC(F)=C1Cl C44261 [1,1,0,0,0,0|1,0,1]=4 434 B11R1.72 OCC1=C(F)C=CC(Br)=C1F B45144 [1,1,0,0,0,0|1,1,0]=4 435 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F B48252 [1,1,0,0,0,0|0,1,1]=4 436 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl D48271 [1,1,0,0,0,0|0,1,1]=4 437 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F C48278 [1,1,0,0,0,0|0,0,1]=3 438 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1O C48601 [1,1,0,0,0,0|1,0,1]=4 439 B11R1.156 CC(=O)C1=C(F)C=CC=C1F D19087 [1,1,0,0,0,0|0,1,1]=4 440 B11R1.156 CC(=O)C1=C(F)C=CC=C1N A49050 [1,1,0,0,0,0|1,0,1]=4 441 B11R1.156 CC(=O)C1=C(F)C=CC=C1O F48624 [1,1,0,0,0,0|1,0,1]=4 442 B11R1.156 CC1=CC=CC(C)=C1[C@@H](C)N D54186 [1,1,0,0,0,0|2,0,0]=4 443 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N D54188 [1,1,0,0,0,0|2,0,0]=4 444 B11R1.156 CC1=CC=CC(F)=C1C(N)=O F49048 [1,1,0,0,0,0|1,0,1]=4 445 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1Cl D49231 [1,1,0,0,0,0|0,1,0]=3 446 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1F C49234 [1,1,0,0,0,0|0,0,0]=2 447 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1F C49239 [1,1,0,0,0,0|0,0,0]=2 448 B11R1.156 C[C@@H](N)C1=C(F)C=CC=C1F D49636 [1,1,0,0,0,0|0,1,0]=3 449 B11R1.156 C[C@@H](O)C1=C(Cl)C=NC=C1Cl D64394 [1,1,0,0,0,0|1,1,0]=4 450 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl D49230 [1,1,0,0,0,0|0,1,0]=3 451 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl D49233 [1,1,0,0,0,0|0,1,0]=3 452 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F C49236 [1,1,0,0,0,0|0,0,0]=2 453 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F C49244 [1,1,0,0,0,0|0,0,0]=2 454 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F D49632 [1,1,0,0,0,0|0,1,0]=3 455 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F D49641 [1,1,0,0,0,0|0,1,0]=3 456 B11R1.156 C[C@H](O)C1=C(Br)C=CC=C1F B49138 [1,1,0,0,0,0|0,1,0]=3 457 B11R1.156 C[C@H](O)C1=C(Cl)C=NC=C1Cl D45881 [1,1,0,0,0,0|1,1,0]=4 458 B11R1.156 C[C@H](O)C1=C(Cl)C=NC=C1Cl D45882 [1,1,0,0,0,0|1,1,0]=4 459 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F D49154 [1,1,0,0,0,0|0,1,0]=3 460 B11R1.156 NC(=O)C1=C(Br)C=CC=C1F B45031 [1,1,0,0,0,0|0,1,1]=4 461 B11R1.156 NC(=O)C1=C(F)C=CC=C1F D60799 [1,1,0,0,0,0|0,1,1]=4 462 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1F C69007 [1,1,0,0,0,0|1,0,1]=4 463 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1F C41934 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.156 OB(O)C1=C(Cl)C=CC=C1F C42692 [1,1,0,0,0,0|2,0,0]=4 465 B11R1.265 COC1=C(Cl)C=CC=C1C=O C48597 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.265 COC1=C(F)C=CC=C1C#N F63472 [1,1,0,0,0,0|2,0,0]=4 467 B11R1.265 COC1=C(F)C=CC=C1CO F49395 [1,1,0,0,0,0|2,0,0]=4 468 B11R1.265 COC1=CC=CC(F)=C1CN F46815 [1,1,0,0,0,0|1,0,0]=3 469 B11R1.265 COC1=CC=CC(F)=C1CN F49513 [1,1,0,0,0,0|1,0,0]=3 470 B11R1.265 N#CC1=CC=CC(Cl)=C1CBr B39017 [1,1,0,0,0,0|2,0,0]=4 471 B11R1.265 N#CC1=CC=CC(F)=C1CBr B47672 [1,1,0,0,0,0|2,0,0]=4 472 B11R1.464 CC1=CC(C)=C(CN)C(C)=C1 M53111 [1,1,0,0,0,0|2,0,0]=4 473 B11R1.464 COC1=C(Br)C=C(F)C=C1F B45139 [1,1,0,0,0,0|1,1,0]=4 474 B11R1.464 COC1=C(F)C=C(Br)C=C1N B45877 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.464 COC1=C(F)C=C(N)C=C1F D45887 [1,1,0,0,0,0|1,1,0]=4 476 B11R1.464 FC1=CC(Br)=CC(F)=C1CBr B44274 [1,1,0,0,0,0|1,1,0]=4 477 B11R1.464 FC1=CC(Cl)=CC(F)=C1CBr B44277 [1,1,0,0,0,0|1,1,0]=4 478 B11R1.464 NCC1=C(F)C=C(F)C=C1F T45323 [1,1,0,0,0,0|0,1,0]=3 479 B11R1.464 OCC1=C(Cl)C=C(Cl)C=C1Cl T45148 [1,1,0,0,0,0|1,1,0]=4 480 B11R1.464 OCC1=C(F)C=C(Br)C=C1F B45145 [1,1,0,0,0,0|1,1,0]=4 481 B11R1.464 OCC1=C(F)C=C(O)C=C1F D45519 [1,1,0,0,0,0|1,1,0]=4 482 B13R1.1601 OCCOC1=C(Cl)C=C(Cl)C=C1Cl T48605 [0,2,0,0,0,0|1,1,0]=4 483 B13R1.8919 OCCOCC1=C(Cl)C=CC=C1Cl D66631 [0,2,0,0,0,0|1,1,0]=4 484 B11R2.10 BrC1CC2=C(C=CC=C2)C1 B51667 [1,0,0,1,0,0|2,0,0]=4 485 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 M13896 [1,0,0,1,0,0|2,0,0]=4 486 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 M15830 [1,0,0,1,0,0|2,0,0]=4 487 B11R2.10 OC1CC2=C(C=CC=C2)C1 D67665 [1,0,0,1,0,0|2,0,0]=4 488 B11R2.20 C1=CC2=C(C=C1)COCC2 C39527 [1,0,0,1,0,0|2,0,0]=4 489 B11R2.20 C1=CC2=C(C=C1)NCCC2 T37825 [1,0,0,1,0,0|2,0,0]=4 490 B11R2.20 C1=CC2=C(C=C1)OCCC2 D66932 [1,0,0,1,0,0|2,0,0]=4 491 B11R2.20 C1=CC2=C(C=N1)CCNC2 T49657 [1,0,0,1,0,0|2,0,0]=4 492 B11R2.20 C1=CC2=C(C=N1)CCNC2 T69820 [1,0,0,1,0,0|2,0,0]=4 493 B11R2.20 C1=CC2=C(C=N1)CNCC2 N14836 [1,0,0,1,0,0|2,0,0]=4 494 B11R2.20 C1=CC2=C(C=N1)CNCC2 T49489 [1,0,0,1,0,0|2,0,0]=4 495 B11R2.20 C1=CN=C2CCNCC2=C1 T23208 [1,0,0,1,0,0|2,0,0]=4 496 B11R2.20 C1=CN=C2CCNCC2=C1 T4076 [1,0,0,1,0,0|2,0,0]=4 497 B11R2.20 C1=CN=C2CCNCC2=C1 T5331 [1,0,0,1,0,0|2,0,0]=4 498 B11R2.20 C1=CN=C2CNCCC2=C1 T13476 [1,0,0,1,0,0|2,0,0]=4 499 B11R2.20 C1=CN=C2CNCCC2=C1 T18760 [1,0,0,1,0,0|2,0,0]=4 500 B11R2.20 C1=CN=C2CNCCC2=C1 T23221 [1,0,0,1,0,0|2,0,0]=4 501 B11R2.55 ClC1=C(C2CC2)C=NC=C1 C48885 [1,0,0,1,0,0|2,0,0]=4 502 B11R2.55 ClC1=NC=CC=C1C2CC2 C48880 [1,0,0,1,0,0|2,0,0]=4 503 B11R2.55 FC1=NC=CC=C1C2CC2 C48886 [1,0,0,1,0,0|2,0,0]=4 504 B11R2.55 NC1=C(C2CC2)C=CC=C1 C37591 [1,0,0,1,0,0|2,0,0]=4 505 B11R2.106 BrC1=C2CCCC2=CC=C1 B10979 [1,0,0,1,0,0|1,1,0]=4 506 B11R2.106 BrC1=C2CCNC2=CC=C1 B48872 [1,0,0,1,0,0|0,1,0]=3 507 B11R2.106 BrC1=C2CCNC2=CN=C1 B60365 [1,0,0,1,0,0|1,1,0]=4 508 B11R2.106 BrC1=C2CCNC2=NC=C1 B19352 [1,0,0,1,0,0|1,1,0]=4 509 B11R2.106 CC1=C2CCCC2=CC=C1 M52674 [1,0,0,1,0,0|2,0,0]=4 510 B11R2.106 ClC1=C2C=CNC2=CC=C1 C2290 [1,0,0,1,0,0|0,0,2]=4 511 B11R2.106 ClC1=C2C=NNC2=CC=C1 C9583 [1,0,0,1,0,0|1,0,1]=4 512 B11R2.106 ClC1=C2CC=CC2=CC=C1 C51042 [1,0,0,1,0,0|1,0,1]=4 513 B11R2.106 ClC1=C2CCCC2=NC=C1 C48883 [1,0,0,1,0,0|2,0,0]=4 514 B11R2.106 ClC1=C2CCNC2=CC=C1 C48879 [1,0,0,1,0,0|0,0,0]=2 515 B11R2.106 ClC1=C2CCNC2=NC=C1 C30162 [1,0,0,1,0,0|1,0,0]=3 516 B11R2.106 ClC1=C2CNCC2=CC=C1 C36885 [1,0,0,1,0,0|2,0,0]=4 517 B11R2.106 ClC1=NC=CC2=C1CCN2 C14624 [1,0,0,1,0,0|1,0,0]=3 518 B11R2.106 ClC1=NC=CC2=C1CCN2 C5708 [1,0,0,1,0,0|1,0,0]=3 519 B11R2.106 ClC1=NC=NC2=C1CCN2 C20810 [1,0,0,1,0,0|2,0,0]=4 520 B11R2.106 FC1=C2C=CNC2=CC=C1 F3191 [1,0,0,1,0,0|0,0,2]=4 521 B11R2.106 FC1=C2C=NNC2=CC=C1 B5804 [1,0,0,1,0,0|1,0,1]=4 522 B11R2.106 FC1=C2CCOC2=NC=C1 F30045 [1,0,0,1,0,0|2,0,0]=4 523 B11R2.106 FC1=C2CNCC2=CC=C1 F37051 [1,0,0,1,0,0|2,0,0]=4 524 B11R2.106 FC1=C2NCCC2=CC=C1 F49614 [1,0,0,1,0,0|2,0,0]=4 525 B11R2.106 IC1=C2CCCC2=CC=C1 K51671 [1,0,0,1,0,0|1,1,0]=4 526 B11R2.106 NC1=CC=CC2=C1CCN2 K46638 [1,0,0,1,0,0|1,0,0]=3 527 B11R2.106 NC1=CC=CC2=C1CCO2 A12891 [1,0,0,1,0,0|2,0,0]=4 528 B11R2.106 O=C1C=CC=C2NCCN12 D45988 [1,0,0,1,0,0|2,0,0]=4 529 B11R2.106 OC1=C2CCCC2=CC=C1 K49868 [1,0,0,1,0,0|2,0,0]=4 530 B11R2.106 OC1=C2CCNC2=NC=C1 D62930 [1,0,0,1,0,0|2,0,0]=4 531 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 B49879 [1,0,0,1,0,0|2,0,0]=4 532 B13R2.371 NC1=C2CNCCC2=C(Br)C=C1 B49980 [0,1,0,1,0,0|1,1,0]=4 533 B13R2.342 CC1=CC=CC2=C1CCNC2=O M69560 [0,1,0,1,0,0|2,0,0]=4 534 B13R2.342 N[C@H]1CCCC2=C(F)C=CC=C21 F52751 [0,1,0,1,0,0|2,0,0]=4 535 B13R2.342 O=C1CCCC2=C(Cl)C=CC=C12 C54050 [0,1,0,1,0,0|2,0,0]=4 536 B13R2.342 O=C1CCCC2=C(F)C=CC=C12 F38818 [0,1,0,1,0,0|2,0,0]=4 537 B13R2.342 O=C1NCCC2=C(Br)C=CC=C12 B51519 [0,1,0,1,0,0|1,1,0]=4 538 B13R2.342 O=C1NCCC2=C(F)C=CC=C12 F51538 [0,1,0,1,0,0|1,0,0]=3 539 B13R2.5179 CN1CCC2=C(O)C=CC=C2C1 M52932 [0,1,0,1,0,0|2,0,0]=4 540 B13R2.5179 O=C1CCC2=C(Cl)C=CC=C2C1 C64114 [0,1,0,1,0,0|2,0,0]=4