COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 BR   UNL     1      -4.760  -2.218   0.679  1.00  0.00          Br  
HETATM    2  C   UNL     1      -3.270  -1.192   0.129  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.302   0.182   0.231  1.00  0.00           C  
HETATM    4 BR   UNL     1      -4.840   1.037   0.922  1.00  0.00          Br  
HETATM    5  C   UNL     1      -2.211   0.943  -0.170  1.00  0.00           C  
HETATM    6 BR   UNL     1      -2.275   2.827  -0.021  1.00  0.00          Br  
HETATM    7  C   UNL     1      -1.081   0.334  -0.676  1.00  0.00           C  
HETATM    8 BR   UNL     1       0.398   1.380  -1.219  1.00  0.00          Br  
HETATM    9  C   UNL     1      -1.033  -1.050  -0.786  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.130  -1.825  -0.377  1.00  0.00           C  
HETATM   11  N   UNL     1      -1.802  -3.124  -0.597  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.605  -3.193  -1.102  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.082  -1.945  -1.236  1.00  0.00           N  
HETATM   14  C   UNL     1       1.243  -1.611  -1.766  1.00  0.00           C  
HETATM   15  C   UNL     1       2.218  -1.464  -0.626  1.00  0.00           C  
HETATM   16  O   UNL     1       1.844  -1.622   0.516  1.00  0.00           O  
HETATM   17  N   UNL     1       3.506  -1.156  -0.877  1.00  0.00           N  
HETATM   18  H   UNL     1      -0.100  -4.109  -1.372  1.00  0.00           H  
HETATM   19  H   UNL     1       1.579  -2.406  -2.431  1.00  0.00           H  
HETATM   20  H   UNL     1       1.187  -0.674  -2.319  1.00  0.00           H  
HETATM   21  H   UNL     1       3.805  -1.029  -1.791  1.00  0.00           H  
HETATM   22  C   UNL     1       4.454  -1.013   0.231  1.00  0.00           C  
HETATM   23  C   UNL     1       5.837  -0.665  -0.323  1.00  0.00           C  
HETATM   24  C   UNL     1       6.827  -0.515   0.834  1.00  0.00           C  
HETATM   25  C   UNL     1       8.210  -0.167   0.280  1.00  0.00           C  
HETATM   26  C   UNL     1       9.200  -0.017   1.437  1.00  0.00           C  
HETATM   27  H   UNL     1       4.118  -0.218   0.896  1.00  0.00           H  
HETATM   28  H   UNL     1       4.510  -1.951   0.784  1.00  0.00           H  
HETATM   29  H   UNL     1       6.173  -1.460  -0.989  1.00  0.00           H  
HETATM   30  H   UNL     1       5.781   0.273  -0.877  1.00  0.00           H  
HETATM   31  H   UNL     1       6.491   0.280   1.499  1.00  0.00           H  
HETATM   32  H   UNL     1       6.883  -1.453   1.387  1.00  0.00           H  
HETATM   33  H   UNL     1       8.546  -0.962  -0.386  1.00  0.00           H  
HETATM   34  H   UNL     1       8.153   0.771  -0.273  1.00  0.00           H  
HETATM   35  H   UNL     1       8.864   0.778   2.102  1.00  0.00           H  
HETATM   36  H   UNL     1       9.256  -0.955   1.990  1.00  0.00           H  
HETATM   37  C   UNL     1      10.562   0.326   0.891  1.00  0.00           C  
HETATM   38  O   UNL     1      10.724   0.440  -0.301  1.00  0.00           O  
HETATM   39  O   UNL     1      11.595   0.506   1.730  1.00  0.00           O  
HETATM   40  H   UNL     1      12.449   0.725   1.333  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2   10    1    3    3                                       
CONECT    3    2    2    5    4                                       
CONECT    4    3                                                      
CONECT    5    7    7    3    6                                       
CONECT    6    5                                                      
CONECT    7    9    8    5    5                                       
CONECT    8    7                                                      
CONECT    9   13   10   10    7                                       
CONECT   10   11    9    9    2                                       
CONECT   11   12   12   10                                            
CONECT   12   11   11   13   18                                       
CONECT   13   12   14    9                                            
CONECT   14   15   13   19   20                                       
CONECT   15   16   16   14   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   21   22                                            
CONECT   18   12                                                      
CONECT   19   14                                                      
CONECT   20   14                                                      
CONECT   21   17                                                      
CONECT   22   17   23   27   28                                       
CONECT   23   22   24   29   30                                       
CONECT   24   23   25   31   32                                       
CONECT   25   24   26   33   34                                       
CONECT   26   25   35   36   37                                       
CONECT   27   22                                                      
CONECT   28   22                                                      
CONECT   29   23                                                      
CONECT   30   23                                                      
CONECT   31   24                                                      
CONECT   32   24                                                      
CONECT   33   25                                                      
CONECT   34   25                                                      
CONECT   35   26                                                      
CONECT   36   26                                                      
CONECT   37   26   38   38   39                                       
CONECT   38   37   37                                                 
CONECT   39   37   40                                                 
CONECT   40   39                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
