COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.975   1.556  -0.002  1.00  0.00           C  
HETATM    2  C   UNL     1       0.985   0.189  -0.001  1.00  0.00           C  
HETATM    3  C   UNL     1       2.271  -0.537  -0.002  1.00  0.00           C  
HETATM    4  C   UNL     1       4.504  -0.926  -0.004  1.00  0.00           C  
HETATM    5  C   UNL     1       3.777  -2.285   0.002  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.394   0.112   0.004  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.493   1.463  -0.004  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.319   2.246  -0.001  1.00  0.00           C  
HETATM    9  N   UNL     1       3.417   0.062  -0.004  1.00  0.00           N  
HETATM   10  N   UNL     1       2.354  -1.907   0.005  1.00  0.00           N  
HETATM   11  N   UNL     1      -0.193  -0.509   0.002  1.00  0.00           N  
HETATM   12  O   UNL     1       2.137   2.259   0.001  1.00  0.00           O  
HETATM   13  O   UNL     1      -0.379   3.467   0.004  1.00  0.00           O  
HETATM   14 BR   UNL     1      -2.972  -0.929  -0.001  1.00  0.00          Br  
HETATM   15  H   UNL     1       5.117  -0.819   0.891  1.00  0.00           H  
HETATM   16  H   UNL     1       5.116  -0.819  -0.900  1.00  0.00           H  
HETATM   17  H   UNL     1       4.021  -2.858  -0.893  1.00  0.00           H  
HETATM   18  H   UNL     1       4.027  -2.848   0.901  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.463   1.938  -0.003  1.00  0.00           H  
HETATM   20  H   UNL     1       1.603  -2.522   0.009  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.165  -1.479   0.008  1.00  0.00           H  
HETATM   22  H   UNL     1       2.016   3.218   0.004  1.00  0.00           H  
CONECT    1    2    2    8   12                                       
CONECT    2   11    3    1    1                                       
CONECT    3   10    2    9    9                                       
CONECT    4    5    9   15   16                                       
CONECT    5   10    4   17   18                                       
CONECT    6   14   11    7    7                                       
CONECT    7    6    6    8   19                                       
CONECT    8    7    1   13   13                                       
CONECT    9    4    3    3                                            
CONECT   10    5    3   20                                            
CONECT   11    6    2   21                                            
CONECT   12    1   22                                                 
CONECT   13    8    8                                                 
CONECT   14    6                                                      
CONECT   15    4                                                      
CONECT   16    4                                                      
CONECT   17    5                                                      
CONECT   18    5                                                      
CONECT   19    7                                                      
CONECT   20   10                                                      
CONECT   21   11                                                      
CONECT   22   12                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
