COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.720  -0.919   0.106  1.00  0.00           N  
HETATM    2  C   UNL     1      -0.692  -1.677   0.831  1.00  0.00           C  
HETATM    3  C   UNL     1       0.622  -0.943   0.752  1.00  0.00           C  
HETATM    4  C   UNL     1       1.046  -0.029   1.626  1.00  0.00           C  
HETATM    5  C   UNL     1       2.289   0.512   1.348  1.00  0.00           C  
HETATM    6  C   UNL     1       2.875   0.037   0.247  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.928   1.200  -0.114  1.00  0.00           C  
HETATM    8  N   UNL     1      -4.121   0.396  -0.419  1.00  0.00           N  
HETATM    9  C   UNL     1      -6.567   0.046  -0.532  1.00  0.00           C  
HETATM   10  O   UNL     1      -5.499   2.008   0.229  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.358   0.888  -0.213  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.927  -0.961  -0.955  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.950  -1.709  -0.043  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.990   0.366   0.765  1.00  0.00           C  
HETATM   15  S   UNL     1       1.834  -1.167  -0.502  1.00  0.00           S  
HETATM   16 BR   UNL     1       4.569   0.570  -0.403  1.00  0.00          Br  
HETATM   17  H   UNL     1      -0.987  -1.783   1.875  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.584  -2.664   0.382  1.00  0.00           H  
HETATM   19  H   UNL     1       0.463   0.267   2.486  1.00  0.00           H  
HETATM   20  H   UNL     1       2.750   1.263   1.974  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.420   1.467  -1.041  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.223   2.105   0.416  1.00  0.00           H  
HETATM   23  H   UNL     1      -6.543  -0.865   0.066  1.00  0.00           H  
HETATM   24  H   UNL     1      -7.472   0.608  -0.302  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.559  -0.214  -1.591  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.882  -1.485  -0.977  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.519  -0.901  -1.964  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.709  -2.677  -0.484  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.407  -1.859   0.936  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.460   0.188   1.732  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.053   0.904   0.909  1.00  0.00           H  
CONECT    1   13    2   14                                            
CONECT    2    1    3   17   18                                       
CONECT    3    2    4    4   15                                       
CONECT    4    3    3    5   19                                       
CONECT    5    4    6    6   20                                       
CONECT    6    5    5   16   15                                       
CONECT    7   14    8   21   22                                       
CONECT    8   11   12    7                                            
CONECT    9   11   23   24   25                                       
CONECT   10   11   11                                                 
CONECT   11    9   10   10    8                                       
CONECT   12    8   13   26   27                                       
CONECT   13   12    1   28   29                                       
CONECT   14    1    7   30   31                                       
CONECT   15    6    3                                                 
CONECT   16    6                                                      
CONECT   17    2                                                      
CONECT   18    2                                                      
CONECT   19    4                                                      
CONECT   20    5                                                      
CONECT   21    7                                                      
CONECT   22    7                                                      
CONECT   23    9                                                      
CONECT   24    9                                                      
CONECT   25    9                                                      
CONECT   26   12                                                      
CONECT   27   12                                                      
CONECT   28   13                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31   14                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
