COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1 BR   UNL     1      -6.736  -2.422  -0.709  1.00  0.00          Br  
HETATM    2  C   UNL     1      -5.478  -1.266   0.099  1.00  0.00           C  
HETATM    3  N   UNL     1      -4.453  -0.376   2.063  1.00  0.00           N  
HETATM    4  O   UNL     1      -6.072  -1.898   2.216  1.00  0.00           O  
HETATM    5  P   UNL     1       2.653   1.418   0.807  1.00  0.00           P  
HETATM    6  C   UNL     1      -4.681  -0.483  -0.660  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.776   0.349  -0.058  1.00  0.00           N  
HETATM    8  O   UNL     1      -2.858   1.136   1.797  1.00  0.00           O  
HETATM    9  P   UNL     1       5.111  -0.229   0.632  1.00  0.00           P  
HETATM   10  C   UNL     1      -3.672   0.394   1.283  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.524   1.000  -0.534  1.00  0.00           O  
HETATM   12  P   UNL     1       7.003  -1.872  -0.951  1.00  0.00           P  
HETATM   13  C   UNL     1      -5.361  -1.205   1.510  1.00  0.00           C  
HETATM   14  O   UNL     1      -4.235   3.215  -1.337  1.00  0.00           O  
HETATM   15  C   UNL     1      -1.811   3.339  -0.986  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.915   3.894  -2.299  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.153   2.696  -0.561  1.00  0.00           C  
HETATM   18  O   UNL     1       1.309   1.426  -0.078  1.00  0.00           O  
HETATM   19  C   UNL     1      -2.911   1.198  -0.881  1.00  0.00           C  
HETATM   20  O   UNL     1       3.571   0.167   0.378  1.00  0.00           O  
HETATM   21  C   UNL     1      -0.810   2.167  -0.975  1.00  0.00           C  
HETATM   22  O   UNL     1       2.269   1.293   2.365  1.00  0.00           O  
HETATM   23  C   UNL     1       0.336   2.471  -0.008  1.00  0.00           C  
HETATM   24  O   UNL     1       3.399   2.677   0.583  1.00  0.00           O  
HETATM   25  O   UNL     1       5.573  -1.314  -0.464  1.00  0.00           O  
HETATM   26  O   UNL     1       5.267  -0.857   2.107  1.00  0.00           O  
HETATM   27  O   UNL     1       5.957   0.979   0.518  1.00  0.00           O  
HETATM   28  O   UNL     1       7.533  -2.975   0.095  1.00  0.00           O  
HETATM   29  O   UNL     1       6.849  -2.543  -2.407  1.00  0.00           O  
HETATM   30  O   UNL     1       7.970  -0.755  -1.023  1.00  0.00           O  
HETATM   31  H   UNL     1      -4.365  -0.331   3.028  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.758  -0.513  -1.737  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.368   4.167  -1.240  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.512   4.105  -0.271  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.574   4.598  -2.377  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.335   2.842   0.503  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.075   0.998  -1.940  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.418   2.004  -1.979  1.00  0.00           H  
HETATM   39  H   UNL     1       1.778   0.489   2.586  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.053   2.537   1.008  1.00  0.00           H  
HETATM   41  H   UNL     1       0.801   3.418  -0.282  1.00  0.00           H  
HETATM   42  H   UNL     1       4.739  -1.653   2.253  1.00  0.00           H  
HETATM   43  H   UNL     1       6.947  -3.738   0.193  1.00  0.00           H  
HETATM   44  H   UNL     1       7.673  -2.902  -2.763  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    6    6   13                                       
CONECT    3   10   13   31                                            
CONECT    4   13   13                                                 
CONECT    5   18   20   22   24                                       
CONECT    5   24                                                      
CONECT    6    2    2    7   32                                       
CONECT    7    6   10   19                                            
CONECT    8   10   10                                                 
CONECT    9   20   25   26   27                                       
CONECT    9   27                                                      
CONECT   10    3    7    8    8                                       
CONECT   11   19   21                                                 
CONECT   12   25   28   29   30                                       
CONECT   12   30                                                      
CONECT   13    2    3    4    4                                       
CONECT   14   17   33                                                 
CONECT   15   16   17   21   34                                       
CONECT   16   15   35                                                 
CONECT   17   14   15   19   36                                       
CONECT   18    5   23                                                 
CONECT   19    7   11   17   37                                       
CONECT   20    5    9                                                 
CONECT   21   11   15   23   38                                       
CONECT   22    5   39                                                 
CONECT   23   18   21   40   41                                       
CONECT   24    5    5                                                 
CONECT   25    9   12                                                 
CONECT   26    9   42                                                 
CONECT   27    9    9                                                 
CONECT   28   12   43                                                 
CONECT   29   12   44                                                 
CONECT   30   12   12                                                 
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   26                                                      
CONECT   43   28                                                      
CONECT   44   29                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
