0 B9R1.15 C#CC1=CC=CC=C1O 222906 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.15 CCC1=C(F)C=CC=C1 037698 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.15 NCC1=CC=CC=C1Cl 209763 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.2 C=C[N+]1=CC=CC=C1 180799 [1,0,0,0,0,0|2,0,1]=4 4 B8R1.5 CN1C=CC=NC1=S 099218 [1,0,0,0,0,0|2,1,0]=4 5 B8R1.5 OC1=C(Cl)C=NN=C1 324534 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.2 CC1=C(F)C=CC=C1CBr 342591 [0,1,0,0,0,0|2,0,0]=3 7 B10R1.2 CCC1=CC=CC(C)=C1I 038641 [0,1,0,0,0,0|2,0,0]=3 8 B10R1.2 CNC1=CC=CC(F)=C1F 045885 [0,1,0,0,0,0|2,0,0]=3 9 B10R1.2 COC1=C(Cl)C(F)=CC=C1 038293 [0,1,0,0,0,0|1,0,0]=2 10 B10R1.2 COC1=CC=CC(F)=C1S 043182 [0,1,0,0,0,0|1,0,0]=2 11 B10R1.2 N#CC1=C(Cl)C(Br)=CC=C1 062766 [0,1,0,0,0,0|3,0,0]=4 12 B10R1.2 N#CC1=CC=CC(Cl)=C1Br 038274 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.4 CNCC1=CC=CC=C1Cl 060304 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.4 N#CSC1=C(Br)C=CC=C1 005336 [0,1,0,0,0,0|1,1,1]=4 15 B10R1.4 [O-][N+]1=CC=CC=C1CCO 180119 [0,1,0,0,0,0|3,0,0]=4 16 B10R1.20 CCC1=CC=CC=C1CBr 246564 [0,1,0,0,0,0|1,0,0]=2 17 B10R1.25 C#CC1=CC=C(Cl)C=C1F 046009 [0,1,0,0,0,0|2,0,1]=4 18 B10R1.25 C#CC1=CC=C(N)C=C1F 045991 [0,1,0,0,0,0|2,0,1]=4 19 B10R1.25 COC1=C(Br)C=C(S)C=C1 038040 [0,1,0,0,0,0|1,0,0]=2 20 B10R1.25 COC1=C(Cl)C=C(S)C=C1 038033 [0,1,0,0,0,0|1,0,0]=2 21 B10R1.25 COC1=C(S)C=C(Br)C=C1 038041 [0,1,0,0,0,0|1,0,0]=2 22 B10R1.25 COC1=CC=C(F)C=C1I 075745 [0,1,0,0,0,0|1,0,0]=2 23 B10R1.25 COC1=CC=C(S)C=C1C 038027 [0,1,0,0,0,0|0,0,0]=1 24 B10R1.25 COC1=CC=C(S)C=C1F 023073 [0,1,0,0,0,0|1,0,0]=2 25 B10R1.25 CSC1=C(Cl)C=C(Cl)C=C1 019344 [0,1,0,0,0,0|1,1,0]=3 26 B10R1.25 FC1=CC(F)=C(CS)C=C1 024358 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.30 C#CC1=CC(F)=CC=C1F 046033 [0,1,0,0,0,0|2,0,1]=4 28 B10R1.30 CC1=C(C#N)C=C(S)C=C1 098553 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.30 CC1=C(CO)C=C(Br)C=C1 403122 [0,1,0,0,0,0|2,0,0]=3 30 B10R1.30 CCC1=C(F)C=CC(F)=C1 105468 [0,1,0,0,0,0|2,0,0]=3 31 B10R1.30 COC1=CC(C)=CC=C1I 038666 [0,1,0,0,0,0|1,0,0]=2 32 B10R1.30 COC1=NC(Cl)=CN=C1N 076801 [0,1,0,0,0,0|3,0,0]=4 33 B10R1.30 CSC1=CC(C)=NN=C1C 189294 [0,1,0,0,0,0|2,1,0]=4 34 B10R1.30 FC1=CC(CS)=C(F)C=C1 024359 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.30 N#CC1=CC(F)=CC=C1I 240068 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.30 OCC1=CC(Br)=CC=C1Br 229556 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.245 C#CC1=C(C)C=CC=C1C 046041 [0,1,0,0,0,0|1,0,1]=3 38 B10R1.245 COC1=C(I)C=CC=C1C 038816 [0,1,0,0,0,0|0,0,0]=1 39 B10R1.245 C[N+]1=CC=CC(O)=C1C#N 180354 [0,1,0,0,0,0|3,0,0]=4 40 B10R2.7 C1=CC2=C(C=C1)[N-]N=N2 180580 [0,0,0,1,0,0|3,0,0]=4 41 B7R1.3 N[N+]1=CC=CC=C1 184347 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.2 CCC1=CC(C)=CN=C1 180046 [1,1,0,0,0,0|2,0,0]=4 43 B9R1.6 CC(C)[N+]1=CC=CC=C1 184885 [1,1,0,0,0,0|2,0,0]=4 44 B9R1.8 CCC[N+]1=CC=CC=C1 243010 [1,1,0,0,0,0|2,0,0]=4 45 B9R1.8 CCOC1=CC=CN=C1 180053 [1,1,0,0,0,0|1,0,0]=3 46 B9R1.3 CC1=C(Br)C=CC=C1S 061645 [1,1,0,0,0,0|0,1,0]=3 47 B9R1.3 CC1=C(C)C(Br)=NC=C1 335456 [1,1,0,0,0,0|1,0,0]=3 48 B9R1.3 CC1=C(C)C(N)=NC=C1 208701 [1,1,0,0,0,0|1,0,0]=3 49 B9R1.3 CC1=C(I)C(Br)=CC=C1 038624 [1,1,0,0,0,0|1,0,0]=3 50 B9R1.3 CC1=CC=CC(S)=C1Br 061615 [1,1,0,0,0,0|1,0,0]=3 51 B9R1.3 CN1C=CC=C(O)C1=S 180130 [1,1,0,0,0,0|1,1,0]=4 52 B9R1.3 FC1=C(S)C=CC=C1Cl 037929 [1,1,0,0,0,0|1,1,0]=4 53 B9R1.3 FC1=CC=CC(Cl)=C1S 037927 [1,1,0,0,0,0|1,1,0]=4 54 B9R1.3 FC1=CC=CC(F)=C1S 037939 [1,1,0,0,0,0|1,1,0]=4 55 B9R1.3 FC1=CC=CC(I)=C1Br 043102 [1,1,0,0,0,0|2,0,0]=4 56 B9R1.3 FC1=CC=CC(S)=C1Cl 038015 [1,1,0,0,0,0|1,1,0]=4 57 B9R1.3 FC1=CC=CC(S)=C1F 061702 [1,1,0,0,0,0|1,1,0]=4 58 B9R1.3 OC1=CC=CC(I)=C1Cl 319868 [1,1,0,0,0,0|1,0,0]=3 59 B9R1.69 CC1=C(S)C=CC(Br)=C1 037981 [1,1,0,0,0,0|0,1,0]=3 60 B9R1.69 CC1=C(S)C=CC(F)=C1 023130 [1,1,0,0,0,0|0,1,0]=3 61 B9R1.69 CC1=CC(C)=[N+]([O-])C=C1 032556 [1,1,0,0,0,0|1,0,1]=4 62 B9R1.69 CC1=CC(Cl)=C(S)C=C1 070834 [1,1,0,0,0,0|1,1,0]=4 63 B9R1.69 CC1=CC(S)=C(Br)C=C1 037984 [1,1,0,0,0,0|1,1,0]=4 64 B9R1.69 CC1=CC(S)=C(F)C=C1 037942 [1,1,0,0,0,0|1,1,0]=4 65 B9R1.69 CC1=CC=C(C)C(N)=N1 032657 [1,1,0,0,0,0|2,0,0]=4 66 B9R1.69 CC1=CC=C(S)C=C1F 023072 [1,1,0,0,0,0|1,0,0]=3 67 B9R1.69 CC1=CC=[N+](C)C=C1C 032583 [1,1,0,0,0,0|1,0,0]=3 68 B9R1.69 CC1=[N+](C)C=C(O)C=C1 181609 [1,1,0,0,0,0|1,0,0]=3 69 B9R1.69 ClC1=C(Br)C=C(Br)C=C1 037509 [1,1,0,0,0,0|2,0,0]=4 70 B9R1.69 FC1=C(S)C=C(Br)C=C1 037911 [1,1,0,0,0,0|1,1,0]=4 71 B9R1.69 FC1=C(S)C=C(Cl)C=C1 037933 [1,1,0,0,0,0|1,1,0]=4 72 B9R1.69 FC1=C(S)C=CC(Cl)=C1 037930 [1,1,0,0,0,0|1,1,0]=4 73 B9R1.69 OC1=CC=C(I)C(F)=C1 226296 [1,1,0,0,0,0|2,0,0]=4 74 B9R1.69 SC1=C(Br)C=C(Br)C=C1 037937 [1,1,0,0,0,0|1,1,0]=4 75 B9R1.69 SC1=C(Br)C=C(Cl)C=C1 061712 [1,1,0,0,0,0|1,1,0]=4 76 B9R1.69 SC1=C(Br)C=CC(Cl)=C1 062559 [1,1,0,0,0,0|1,1,0]=4 77 B9R1.69 SC1=C(Cl)C=C(Br)C=C1 037897 [1,1,0,0,0,0|1,1,0]=4 78 B9R1.69 SC1=C(Cl)C=CC(Br)=C1 037979 [1,1,0,0,0,0|1,1,0]=4 79 B9R1.69 SC1=CC(Br)=CC=C1Br 038020 [1,1,0,0,0,0|1,1,0]=4 80 B9R1.69 SC1=CC(Cl)=C(Br)C=C1 037898 [1,1,0,0,0,0|2,0,0]=4 81 B9R1.69 SC1=CC=C(Cl)C(Br)=C1 061642 [1,1,0,0,0,0|2,0,0]=4 82 B9R1.132 COC1=NOC(C)=C1C 184495 [0,1,0,0,1,0|2,0,0]=4 83 B11R1.8 COC1=C(Br)C(Br)=CC(N)=C1 061628 [0,2,0,0,0,0|1,0,0]=3 84 B11R1.8 COC1=C(Cl)C(Br)=CC(I)=C1 061631 [0,2,0,0,0,0|1,0,0]=3 85 B11R1.8 COC1=CC(C)=CC(Br)=C1N 038669 [0,2,0,0,0,0|1,0,0]=3 86 B11R1.13 CC1=C(Br)C=CC=C1N=C=O 097656 [0,2,0,0,0,0|1,0,1]=4 87 B11R1.72 COC1=C(N)C=CC(Br)=C1C 038821 [0,2,0,0,0,0|0,0,0]=2 88 B11R1.72 COC1=C(O)C(F)=CC=C1F 038322 [0,2,0,0,0,0|1,0,0]=3 89 B11R1.159 CC1=C(C(=O)Cl)C=CC=C1Cl 062740 [0,2,0,0,0,0|2,0,0]=4 90 B11R1.265 CCC1=CC=CC(C)=C1C=O 038660 [0,2,0,0,0,0|1,0,1]=4 91 B11R1.265 COC1=C(C#N)C(Br)=NC=C1 080230 [0,2,0,0,0,0|1,0,1]=4 92 B11R1.265 COC1=C(OC)C(F)=CC=C1 021826 [0,2,0,0,0,0|0,0,0]=2 93 B11R1.267 COC1=CC=CC(C=O)=C1F 049660 [0,2,0,0,0,0|1,0,0]=3 94 B11R1.278 CC1=C(F)C(Br)=CC=C1C#N 069442 [0,2,0,0,0,0|2,0,0]=4 95 B11R1.278 COC1=CC=C(F)C(F)=C1C 043243 [0,2,0,0,0,0|0,0,0]=2 96 B11R1.17 CC1=C(CCCO)C=CN=C1 180193 [0,2,0,0,0,0|2,0,0]=4 97 B11R1.17 CC1=CC=CC=C1OCCN 057697 [0,2,0,0,0,0|0,0,0]=2 98 B11R1.17 CCCSC1=C(Cl)C=CC=C1 094634 [0,2,0,0,0,0|1,1,0]=4 99 B11R1.17 COCCC1=[N+]([O-])C=CC=C1 180207 [0,2,0,0,0,0|2,0,0]=4 100 B11R1.17 N#CCSC1=C(Cl)C=CC=C1 097737 [0,2,0,0,0,0|1,1,0]=4 101 B11R1.41 CCSC1=C(CC)C=CC=C1 094764 [0,2,0,0,0,0|0,1,0]=3 102 B11R1.41 CCSC1=C(OC)C=CC=C1 094905 [0,2,0,0,0,0|0,0,0]=2 103 B11R1.41 COC1=CC=CN=C1CC#N 326063 [0,2,0,0,0,0|1,0,0]=3 104 B11R1.41 N#CC1=CC=CC=C1CCO 043962 [0,2,0,0,0,0|1,0,1]=4 105 B11R1.81 CC1=C(N=C=O)C=CC(F)=C1 102268 [0,2,0,0,0,0|1,0,1]=4 106 B11R1.81 CCNC1=CC=C(Cl)C=C1N 017139 [0,2,0,0,0,0|2,0,0]=4 107 B11R1.81 CCOC1=C(F)C=C(Br)C=C1 070618 [0,2,0,0,0,0|1,0,0]=3 108 B11R1.81 CCOC1=C(F)C=C(I)C=C1 038780 [0,2,0,0,0,0|1,0,0]=3 109 B11R1.81 CCOC1=C(F)C=C(N)C=C1 038781 [0,2,0,0,0,0|1,0,0]=3 110 B11R1.182 CCOC1=C(I)C=CC(Br)=C1 038699 [0,2,0,0,0,0|1,0,0]=3 111 B11R1.182 CCSC1=C(C)C=CC(C)=C1 094808 [0,2,0,0,0,0|0,1,0]=3 112 B11R1.182 CCSC1=C(Cl)C=CC(Cl)=C1 095076 [0,2,0,0,0,0|1,1,0]=4 113 B11R1.222 COC(=O)C1=NC=CC=C1N 066881 [0,2,0,0,0,0|2,0,0]=4 114 B11R1.605 CC1=CC=CC(F)=C1N=C=O 102267 [0,2,0,0,0,0|1,0,1]=4 115 B11R1.605 CC1=CC=CC(F)=C1N=C=S 102430 [0,2,0,0,0,0|1,0,1]=4 116 B11R1.605 OCCC1=C(F)C=CC=C1F 233833 [0,2,0,0,0,0|2,0,0]=4 117 B11R1.37 COC1=C(CCl)C=C(F)C=C1 347441 [0,2,0,0,0,0|0,0,0]=2 118 B11R1.37 COC1=CN=C(Cl)N=C1OC 088622 [0,2,0,0,0,0|2,0,0]=4 119 B11R1.53 CC(C)C1=C(CO)C=CC=C1 093926 [0,2,0,0,0,0|1,0,0]=3 120 B11R1.166 CC1=C(C(N)=O)C=CC(Br)=C1 062790 [0,2,0,0,0,0|2,0,0]=4 121 B11R1.166 CS(=O)C1=C(F)C=C(F)C=C1 064546 [0,2,0,0,0,0|1,1,0]=4 122 B11R1.166 C[S+](C)C1=C(O)C=C(O)C=C1 021801 [0,2,0,0,0,0|1,1,0]=4 123 B11R1.166 C[S+](C)C1=C(O)C=C(O)C=C1 021821 [0,2,0,0,0,0|1,1,0]=4 124 B11R1.277 CC1=C(C#N)C=C(Br)C(F)=C1 098486 [0,2,0,0,0,0|2,0,0]=4 125 B11R1.277 CC1=C(C=O)C=C(F)C(Br)=C1 069438 [0,2,0,0,0,0|2,0,0]=4 126 B11R1.277 CC1=CC(C#N)=C(C)C=C1Cl 044825 [0,2,0,0,0,0|2,0,0]=4 127 B11R1.277 CC1=CC(Cl)=C(C)C=C1C=O 037483 [0,2,0,0,0,0|2,0,0]=4 128 B11R1.277 COC1=C(I)C=C(Cl)C(Br)=C1 037540 [0,2,0,0,0,0|1,0,0]=3 129 B11R1.277 COC1=C(I)C=C(F)C(Br)=C1 094765 [0,2,0,0,0,0|1,0,0]=3 130 B11R1.277 COC1=CC(Br)=C(C)C=C1Cl 038677 [0,2,0,0,0,0|1,0,0]=3 131 B11R1.277 COC1=CC(Br)=C(C)C=C1I 038679 [0,2,0,0,0,0|1,0,0]=3 132 B11R1.464 COC1=C(Br)C=C(Cl)C=C1Br 037536 [0,2,0,0,0,0|1,0,0]=3 133 B11R1.464 COC1=C(Br)C=C(F)C=C1F 013195 [0,2,0,0,0,0|1,0,0]=3 134 B11R1.167 CC(C)C1=C(Br)C=CC(Br)=C1 037576 [0,2,0,0,0,0|2,0,0]=4 135 B11R1.167 CC(C)C1=C(Cl)C=CC(Br)=C1 037575 [0,2,0,0,0,0|2,0,0]=4 136 B11R1.167 CC1=C(B(O)O)C=C(N)C=C1 102571 [0,2,0,0,0,0|2,0,0]=4 137 B11R1.280 COC1=CC(C=O)=C(C)C=C1 038680 [0,2,0,0,0,0|2,0,0]=4 138 B11R1.87 CC(C)(C)C1=C(S)C=CC=C1 104816 [0,2,0,0,0,0|2,0,0]=4 139 B11R1.87 CC(C)(C)C1=CC=CC=C1Br 075662 [0,2,0,0,0,0|2,0,0]=4 140 B11R1.87 CC(C)(C)C1=CC=CC=C1I 075658 [0,2,0,0,0,0|2,0,0]=4 141 B11R1.87 CC(F)(F)C1=C(F)C=CC=C1 101870 [0,2,0,0,0,0|2,0,0]=4 142 B11R1.87 CC(F)(F)C1=C(I)C=CC=C1 035832 [0,2,0,0,0,0|2,0,0]=4 143 B11R1.156 CC(O)C1=C(F)C=CC=C1F 033750 [0,2,0,0,0,0|2,0,0]=4 144 B11R2.106 CC1=CC=CC2=C1N=NN2 043047 [0,1,0,1,0,0|2,0,0]=4