COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.456  -2.728   0.435  1.00  0.00           C  
HETATM    2  N   UNL     1      -8.197  -3.747   0.987  1.00  0.00           N  
HETATM    3  C   UNL     1      -7.203  -2.706  -0.952  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.470  -1.692  -1.470  1.00  0.00           C  
HETATM    5  N   UNL     1      -6.978  -1.758   1.204  1.00  0.00           N  
HETATM    6  C   UNL     1      -6.259  -0.767   0.680  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.830   0.113   1.408  1.00  0.00           O  
HETATM    8  N   UNL     1      -5.996  -0.721  -0.639  1.00  0.00           N  
HETATM    9  C   UNL     1      -5.201   0.381  -1.186  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.918   1.729  -0.950  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.769   2.716  -0.641  1.00  0.00           C  
HETATM   12  O   UNL     1      -4.730   3.760  -1.615  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.949   0.499  -0.476  1.00  0.00           O  
HETATM   14  C   UNL     1      -3.495   1.847  -0.727  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.484   2.275   0.339  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.271   1.541   0.167  1.00  0.00           O  
HETATM   17  P   UNL     1       0.014   1.736   1.117  1.00  0.00           P  
HETATM   18  O   UNL     1      -0.348   1.267   2.614  1.00  0.00           O  
HETATM   19  O   UNL     1       0.406   3.163   1.129  1.00  0.00           O  
HETATM   20  O   UNL     1       1.236   0.849   0.558  1.00  0.00           O  
HETATM   21  P   UNL     1       2.821   0.826   0.837  1.00  0.00           P  
HETATM   22  O   UNL     1       3.455   2.255   0.453  1.00  0.00           O  
HETATM   23  O   UNL     1       3.065   0.547   2.270  1.00  0.00           O  
HETATM   24  C   UNL     1       3.597  -0.476  -0.176  1.00  0.00           C  
HETATM   25 BR   UNL     1       2.823  -2.221   0.293  1.00  0.00          Br  
HETATM   26 BR   UNL     1       3.273  -0.105  -2.080  1.00  0.00          Br  
HETATM   27  P   UNL     1       5.392  -0.503   0.140  1.00  0.00           P  
HETATM   28  O   UNL     1       5.658  -0.806   1.699  1.00  0.00           O  
HETATM   29  O   UNL     1       6.078  -1.652  -0.755  1.00  0.00           O  
HETATM   30  O   UNL     1       5.975   0.811  -0.213  1.00  0.00           O  
HETATM   31  H   UNL     1      -8.549  -4.452   0.422  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.369  -3.759   1.942  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.589  -3.486  -1.592  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.264  -1.653  -2.529  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.021   0.227  -2.250  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.456   2.038  -1.845  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.597   1.657  -0.101  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.881   3.131   0.361  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.532   4.300  -1.646  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.053   1.919  -1.721  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.281   3.342   0.238  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.894   2.075   1.329  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.615   0.340   2.682  1.00  0.00           H  
HETATM   44  H   UNL     1       3.332   2.503  -0.474  1.00  0.00           H  
HETATM   45  H   UNL     1       5.303  -1.653   2.001  1.00  0.00           H  
HETATM   46  H   UNL     1       7.035  -1.723  -0.637  1.00  0.00           H  
CONECT    1    5    5    2    3                                       
CONECT    2    1   31   32                                            
CONECT    3    1    4    4   33                                       
CONECT    4    8    3    3   34                                       
CONECT    5    6    1    1                                            
CONECT    6    7    7    5    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9    4                                            
CONECT    9   10    8   13   35                                       
CONECT   10    9   11   36   37                                       
CONECT   11   10   12   14   38                                       
CONECT   12   11   39                                                 
CONECT   13    9   14                                                 
CONECT   14   11   13   15   40                                       
CONECT   15   14   16   41   42                                       
CONECT   16   15   17                                                 
CONECT   17   16   20   19   19                                       
CONECT   17   18                                                      
CONECT   18   17   43                                                 
CONECT   19   17   17                                                 
CONECT   20   21   17                                                 
CONECT   21   23   23   20   22                                       
CONECT   21   24                                                      
CONECT   22   21   44                                                 
CONECT   23   21   21                                                 
CONECT   24   21   26   25   27                                       
CONECT   25   24                                                      
CONECT   26   24                                                      
CONECT   27   24   30   30   28                                       
CONECT   27   29                                                      
CONECT   28   27   45                                                 
CONECT   29   27   46                                                 
CONECT   30   27   27                                                 
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   18                                                      
CONECT   44   22                                                      
CONECT   45   28                                                      
CONECT   46   29                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
