COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.591  -0.849   0.003  1.00  0.00           O  
HETATM    2  C   UNL     1      -3.446  -0.439   0.002  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.449  -1.332   0.000  1.00  0.00           N  
HETATM    4  C   UNL     1      -1.102  -0.966   0.000  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.105  -1.933  -0.002  1.00  0.00           C  
HETATM    6  C   UNL     1       1.223  -1.551  -0.002  1.00  0.00           C  
HETATM    7  C   UNL     1       1.564  -0.209   0.000  1.00  0.00           C  
HETATM    8 BR   UNL     1       3.385   0.303   0.000  1.00  0.00          Br  
HETATM    9  C   UNL     1       0.572   0.758   0.001  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.750   0.379   0.001  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.861   1.404   0.003  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.241   0.891  -0.001  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.377   1.816  -0.005  1.00  0.00           C  
HETATM   14  H   UNL     1      -2.672  -2.276  -0.001  1.00  0.00           H  
HETATM   15  H   UNL     1      -0.366  -2.980  -0.003  1.00  0.00           H  
HETATM   16  H   UNL     1       1.998  -2.302  -0.004  1.00  0.00           H  
HETATM   17  H   UNL     1       0.837   1.805   0.002  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.736   2.033   0.885  1.00  0.00           H  
HETATM   19  H   UNL     1      -1.737   2.035  -0.877  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.308   1.249  -0.004  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.334   2.447   0.883  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.333   2.441  -0.897  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   12                                       
CONECT    3    4    2   14                                            
CONECT    4    5    3   10   10                                       
CONECT    5    6    6    4   15                                       
CONECT    6    5    5    7   16                                       
CONECT    7    6    8    9    9                                       
CONECT    8    7                                                      
CONECT    9    7    7   10   17                                       
CONECT   10    4    4    9   11                                       
CONECT   11   10   12   18   19                                       
CONECT   12    2   11   13                                            
CONECT   13   12   20   21   22                                       
CONECT   14    3                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    9                                                      
CONECT   18   11                                                      
CONECT   19   11                                                      
CONECT   20   13                                                      
CONECT   21   13                                                      
CONECT   22   13                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
