COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  OXT UNL     1       1.728   1.878  -0.006  1.00  0.00           O  
HETATM    2  C   UNL     1       0.393   2.052  -0.001  1.00  0.00           C  
HETATM    3  O   UNL     1      -0.073   3.174   0.004  1.00  0.00           O  
HETATM    4  CA  UNL     1      -0.508   0.877  -0.001  1.00  0.00           C  
HETATM    5  C   UNL     1       0.007  -0.382  -0.001  1.00  0.00           C  
HETATM    6 BR   UNL     1       1.876  -0.664   0.001  1.00  0.00          Br  
HETATM    7  C   UNL     1      -0.926  -1.518   0.000  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.510  -2.661   0.001  1.00  0.00           O  
HETATM    9  N   UNL     1      -2.252  -1.270  -0.001  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.710  -0.006  -0.002  1.00  0.00           C  
HETATM   11  O   UNL     1      -3.910   0.189  -0.002  1.00  0.00           O  
HETATM   12  N   UNL     1      -1.877   1.048   0.004  1.00  0.00           N  
HETATM   13  HXT UNL     1       2.275   2.675  -0.005  1.00  0.00           H  
HETATM   14  H   UNL     1      -2.880  -2.010  -0.001  1.00  0.00           H  
HETATM   15  H   UNL     1      -2.245   1.946   0.007  1.00  0.00           H  
CONECT    1    2   13                                                 
CONECT    2    3    3    4    1                                       
CONECT    3    2    2                                                 
CONECT    4    5    5    2   12                                       
CONECT    5    6    7    4    4                                       
CONECT    6    5                                                      
CONECT    7    8    8    5    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   10   14                                            
CONECT   10    9   12   11   11                                       
CONECT   11   10   10                                                 
CONECT   12    4   10   15                                            
CONECT   13    1                                                      
CONECT   14    9                                                      
CONECT   15   12                                                      
MASTER        0    0    0    0    0    0    0    0   15    0   15    0
END
