COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.938  -1.685  -2.340  1.00  0.00           C  
HETATM    2  C   UNL     1       5.596  -2.330  -3.565  1.00  0.00           C  
HETATM    3  C   UNL     1       6.594  -3.400  -3.153  1.00  0.00           C  
HETATM    4  C   UNL     1       6.019  -4.386  -2.154  1.00  0.00           C  
HETATM    5  O   UNL     1       6.587  -5.465  -1.974  1.00  0.00           O  
HETATM    6  C   UNL     1       4.785  -4.025  -1.371  1.00  0.00           C  
HETATM    7 BR   UNL     1       4.002  -5.431  -0.418  1.00  0.00          Br  
HETATM    8  C   UNL     1       4.319  -2.765  -1.449  1.00  0.00           C  
HETATM    9  C   UNL     1       3.099  -2.160  -0.883  1.00  0.00           C  
HETATM   10  C   UNL     1       2.319  -2.495   0.216  1.00  0.00           C  
HETATM   11  C   UNL     1       1.201  -1.712   0.525  1.00  0.00           C  
HETATM   12  C   UNL     1       0.872  -0.596  -0.253  1.00  0.00           C  
HETATM   13  O   UNL     1      -0.221   0.151   0.063  1.00  0.00           O  
HETATM   14  C   UNL     1       1.665  -0.242  -1.342  1.00  0.00           C  
HETATM   15  C   UNL     1       2.777  -1.020  -1.633  1.00  0.00           C  
HETATM   16  C   UNL     1       3.744  -0.791  -2.756  1.00  0.00           C  
HETATM   17  C   UNL     1       5.959  -0.852  -1.534  1.00  0.00           C  
HETATM   18  C   UNL     1       6.553   0.249  -2.397  1.00  0.00           C  
HETATM   19  C   UNL     1       7.543   1.087  -1.588  1.00  0.00           C  
HETATM   20  C   UNL     1       8.126   2.217  -2.420  1.00  0.00           C  
HETATM   21  H   UNL     1       6.095  -1.571  -4.179  1.00  0.00           H  
HETATM   22  H   UNL     1       4.830  -2.795  -4.201  1.00  0.00           H  
HETATM   23  H   UNL     1       7.482  -2.945  -2.700  1.00  0.00           H  
HETATM   24  H   UNL     1       6.911  -3.956  -4.042  1.00  0.00           H  
HETATM   25  H   UNL     1       2.557  -3.332   0.862  1.00  0.00           H  
HETATM   26  H   UNL     1       0.584  -1.966   1.383  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.331   0.873  -0.576  1.00  0.00           H  
HETATM   28  H   UNL     1       1.417   0.629  -1.939  1.00  0.00           H  
HETATM   29  H   UNL     1       3.285  -1.114  -3.697  1.00  0.00           H  
HETATM   30  H   UNL     1       4.029   0.263  -2.837  1.00  0.00           H  
HETATM   31  H   UNL     1       6.734  -1.528  -1.177  1.00  0.00           H  
HETATM   32  H   UNL     1       5.444  -0.435  -0.671  1.00  0.00           H  
HETATM   33  H   UNL     1       7.064  -0.188  -3.264  1.00  0.00           H  
HETATM   34  H   UNL     1       5.755   0.894  -2.784  1.00  0.00           H  
HETATM   35  H   UNL     1       8.358   0.452  -1.223  1.00  0.00           H  
HETATM   36  H   UNL     1       7.042   1.509  -0.709  1.00  0.00           H  
HETATM   37  H   UNL     1       7.339   2.891  -2.774  1.00  0.00           H  
HETATM   38  H   UNL     1       8.662   1.827  -3.291  1.00  0.00           H  
HETATM   39  H   UNL     1       8.831   2.803  -1.822  1.00  0.00           H  
CONECT    1    2    8   16   17                                       
CONECT    2    1    3   21   22                                       
CONECT    3    2    4   23   24                                       
CONECT    4    3    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4    7    8    8                                       
CONECT    7    6                                                      
CONECT    8    1    6    6    9                                       
CONECT    9    8   10   10   15                                       
CONECT   10    9    9   11   25                                       
CONECT   11   10   12   12   26                                       
CONECT   12   11   11   13   14                                       
CONECT   13   12   27                                                 
CONECT   14   12   15   15   28                                       
CONECT   15    9   14   14   16                                       
CONECT   16    1   15   29   30                                       
CONECT   17    1   18   31   32                                       
CONECT   18   17   19   33   34                                       
CONECT   19   18   20   35   36                                       
CONECT   20   19   37   38   39                                       
CONECT   21    2                                                      
CONECT   22    2                                                      
CONECT   23    3                                                      
CONECT   24    3                                                      
CONECT   25   10                                                      
CONECT   26   11                                                      
CONECT   27   13                                                      
CONECT   28   14                                                      
CONECT   29   16                                                      
CONECT   30   16                                                      
CONECT   31   17                                                      
CONECT   32   17                                                      
CONECT   33   18                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
