COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -4.701  -0.638   0.952  1.00  0.00           P  
HETATM    2  O   UNL     1      -3.380   0.281   0.903  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.790   0.730  -0.319  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.555   1.577  -0.007  1.00  0.00           C  
HETATM    5  O   UNL     1      -0.520   0.767   0.592  1.00  0.00           O  
HETATM    6  C   UNL     1      -0.900   2.090  -1.315  1.00  0.00           C  
HETATM    7  O   UNL     1      -1.507   3.310  -1.745  1.00  0.00           O  
HETATM    8  C   UNL     1       0.565   2.327  -0.874  1.00  0.00           C  
HETATM    9  C   UNL     1       0.724   1.458   0.388  1.00  0.00           C  
HETATM   10  N   UNL     1       1.805   0.489   0.193  1.00  0.00           N  
HETATM   11  C   UNL     1       1.755  -0.630  -0.585  1.00  0.00           C  
HETATM   12  N   UNL     1       2.893  -1.262  -0.529  1.00  0.00           N  
HETATM   13  C   UNL     1       3.742  -0.590   0.286  1.00  0.00           C  
HETATM   14  C   UNL     1       5.065  -0.789   0.714  1.00  0.00           C  
HETATM   15  N   UNL     1       5.603   0.100   1.542  1.00  0.00           N  
HETATM   16  C   UNL     1       4.917   1.149   1.960  1.00  0.00           C  
HETATM   17  N   UNL     1       3.676   1.375   1.586  1.00  0.00           N  
HETATM   18  C   UNL     1       3.057   0.544   0.754  1.00  0.00           C  
HETATM   19  O   UNL     1      -5.889   0.189   0.643  1.00  0.00           O  
HETATM   20  O   UNL     1      -4.583  -1.726  -0.045  1.00  0.00           O  
HETATM   21  N   UNL     1       5.792  -1.885   0.282  1.00  0.00           N  
HETATM   22 BR   UNL     1       0.255  -1.183  -1.596  1.00  0.00          Br  
HETATM   23  O   UNL     1      -4.858  -1.273   2.423  1.00  0.00           O  
HETATM   24  H   UNL     1      -2.497  -0.131  -0.919  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.512   1.330  -0.872  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.816   2.410   0.646  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.953   1.334  -2.099  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.132   3.671  -2.559  1.00  0.00           H  
HETATM   29  H   UNL     1       1.255   2.000  -1.652  1.00  0.00           H  
HETATM   30  H   UNL     1       0.727   3.379  -0.638  1.00  0.00           H  
HETATM   31  H   UNL     1       0.942   2.090   1.249  1.00  0.00           H  
HETATM   32  H   UNL     1       5.393   1.847   2.633  1.00  0.00           H  
HETATM   33  H   UNL     1       5.388  -2.527  -0.323  1.00  0.00           H  
HETATM   34  H   UNL     1       6.705  -2.011   0.584  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.635  -1.840   2.526  1.00  0.00           H  
CONECT    1   20   20    2   19                                       
CONECT    1   19   23                                                 
CONECT    2    3    1                                                 
CONECT    3    4    2   24   25                                       
CONECT    4    5    3    6   26                                       
CONECT    5    4    9                                                 
CONECT    6    4    7    8   27                                       
CONECT    7    6   28                                                 
CONECT    8    9    6   29   30                                       
CONECT    9    5    8   10   31                                       
CONECT   10    9   11   18                                            
CONECT   11   22   10   12   12                                       
CONECT   12   11   11   13                                            
CONECT   13   12   18   18   14                                       
CONECT   14   13   21   15   15                                       
CONECT   15   14   14   16                                            
CONECT   16   17   17   15   32                                       
CONECT   17   18   16   16                                            
CONECT   18   10   13   13   17                                       
CONECT   19    1    1                                                 
CONECT   20    1    1                                                 
CONECT   21   14   33   34                                            
CONECT   22   11                                                      
CONECT   23    1   35                                                 
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    4                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   16                                                      
CONECT   33   21                                                      
CONECT   34   21                                                      
CONECT   35   23                                                      
MASTER        0    0    0    0    0    0    0    0   35    0   35    0
END
