0 B11R1.166 CC1=CC(Br)=C(C(=O)Cl)C=C1 062786 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.166 CS(=O)C1=C(F)C=C(F)C=C1 064546 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.166 C[S+](C)C1=C(O)C=C(O)C=C1 021801 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.166 C[S+](C)C1=C(O)C=C(O)C=C1 021821 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.13 CC(C)C1=CC=[N+]([O-])C=C1 032678 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.13 CN(C)C1=NC=C(Br)C=C1 093291 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.25 COC1=C(Br)C=C(S)C=C1 038040 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.25 COC1=C(Cl)C=C(S)C=C1 038033 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.25 COC1=C(S)C=C(Br)C=C1 038041 [1,0,0,0,0,0|2,1,0]=4 9 B10R1.25 COC1=CC=C(F)C=C1I 075745 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.25 COC1=CC=C(S)C=C1C 038027 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.25 COC1=CC=C(S)C=C1F 023073 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.25 CSC1=C(Cl)C=C(Cl)C=C1 019344 [1,0,0,0,0,0|3,0,0]=4 13 B10R1.25 FC1=CC(F)=C(CS)C=C1 024358 [1,0,0,0,0,0|3,0,0]=4 14 B12R1.126 CC(F)(F)C1=C(F)C=C(Cl)C=C1 101911 [0,1,0,0,0,0|3,0,0]=4 15 B12R1.126 CC(F)(F)C1=C(F)C=C(F)C=C1 101921 [0,1,0,0,0,0|3,0,0]=4 16 B12R1.893 CC(=O)C1=C(O)C(F)=C(F)C=C1 046461 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.1703 CNC(=O)C1=C(F)C=C(C)C=C1 104543 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.233 CC(C)OC1=C(Cl)C=C(F)C=C1 013286 [0,0,0,0,0,1|2,0,0]=3 19 B12R1.233 CC(C)OC1=C(F)C=C(N)C=C1 038778 [0,0,0,0,0,1|2,0,0]=3 20 B12R1.233 CC(C)SC1=C(Cl)C=C(Cl)C=C1 094678 [0,0,0,0,0,1|2,0,0]=3 21 B12R1.233 CC1=CC=C(OC(F)F)C(N)=C1 030396 [0,0,0,0,0,1|3,0,0]=4 22 B9R1.6 CC(C)[N+]1=CC=CC=C1 184885 [2,0,0,0,0,0|1,0,0]=3 23 B9R1.15 C#CC1=CC=CC=C1O 222906 [2,0,0,0,0,0|0,0,2]=4 24 B9R1.15 CCC1=C(F)C=CC=C1 037698 [2,0,0,0,0,0|1,0,0]=3 25 B9R1.15 NCC1=CC=CC=C1Cl 209763 [2,0,0,0,0,0|2,0,0]=4 26 B9R1.69 CC1=CC(Cl)=C(S)C=C1 070834 [2,0,0,0,0,0|2,0,0]=4 27 B9R1.69 CC1=CC(S)=C(Br)C=C1 037984 [2,0,0,0,0,0|1,1,0]=4 28 B9R1.69 CC1=CC(S)=C(F)C=C1 037942 [2,0,0,0,0,0|1,1,0]=4 29 B9R1.69 CC1=CC=C(C)C(N)=N1 032657 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.69 CC1=CC=C(S)C=C1F 023072 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.69 CC1=CC=[N+](C)C=C1C 032583 [2,0,0,0,0,0|2,0,0]=4 32 B11R1.19 CC(C)(C)C1=CC=[N+]([O-])C=C1 403463 [1,1,0,0,0,0|2,0,0]=4 33 B11R1.19 CC(F)(F)C1=CC=C(Cl)C=C1 101883 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.19 CC(F)(F)C1=CC=C(I)C=C1 492178 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.21 CC(C)C1=CC(Br)=C(Cl)C=C1 037568 [1,1,0,0,0,0|1,0,0]=3 36 B11R1.21 CC(C)C1=CC(Br)=C(I)C=C1 035646 [1,1,0,0,0,0|1,0,0]=3 37 B11R1.21 C[C@@H](N)C1=CC=C(F)C(F)=C1 210212 [1,1,0,0,0,0|2,0,0]=4 38 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 180337 [1,1,0,0,0,0|1,0,1]=4 39 B11R1.81 CCNC1=CC=C(Cl)C=C1N 017139 [1,1,0,0,0,0|2,0,0]=4 40 B11R1.81 CCOC1=C(F)C=C(Br)C=C1 070618 [1,1,0,0,0,0|2,0,0]=4 41 B11R1.81 CCOC1=C(F)C=C(I)C=C1 038780 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.81 CCOC1=C(F)C=C(N)C=C1 038781 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.277 COC1=CC(Br)=C(C)C=C1Cl 038677 [1,1,0,0,0,0|2,0,0]=4 44 B11R1.277 COC1=CC(Br)=C(C)C=C1I 038679 [1,1,0,0,0,0|2,0,0]=4 45 B11R1.53 CC(C)C1=C(CO)C=CC=C1 093926 [1,1,0,0,0,0|0,0,0]=2 46 B11R1.87 CC(C)(C)C1=C(S)C=CC=C1 104816 [1,1,0,0,0,0|0,1,0]=3 47 B11R1.87 CC(C)(C)C1=CC=CC=C1Br 075662 [1,1,0,0,0,0|1,0,0]=3 48 B11R1.87 CC(C)(C)C1=CC=CC=C1I 075658 [1,1,0,0,0,0|1,0,0]=3 49 B11R1.87 CC(F)(F)C1=C(F)C=CC=C1 101870 [1,1,0,0,0,0|2,0,0]=4 50 B11R1.87 CC(F)(F)C1=C(I)C=CC=C1 035832 [1,1,0,0,0,0|2,0,0]=4 51 B11R1.156 CC(O)C1=C(F)C=CC=C1F 033750 [1,1,0,0,0,0|2,0,0]=4 52 B11R1.167 CC(C)C1=C(Br)C=CC(Br)=C1 037576 [1,1,0,0,0,0|1,0,0]=3 53 B11R1.167 CC(C)C1=C(Cl)C=CC(Br)=C1 037575 [1,1,0,0,0,0|1,0,0]=3 54 B13R1.653 CC(C)OC1=C(I)C=C(C=O)C=C1 104748 [0,1,0,0,0,1|1,0,1]=4 55 B11R1.157 CC1=CC=CC(SC(C)C)=C1 094880 [0,0,1,1,0,0|2,0,0]=4 56 B13R2.5400 NC1=C(NC2CC2)C=CC(F)=C1 094276 [0,0,0,1,0,1|2,0,0]=4 57 B11R1.20 CC(C)OC1=CC=C(F)C=C1 098420 [1,0,0,0,0,1|1,0,0]=3