COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       5.662   1.677   0.204  1.00  0.00           P  
HETATM    2  N   UNL     1      -0.504  -0.949   0.099  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.426  -0.652  -1.208  1.00  0.00           C  
HETATM    4  O   UNL     1       0.643  -0.765  -1.774  1.00  0.00           O  
HETATM    5  N   UNL     1      -1.493  -0.233  -1.910  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.695  -0.096  -1.312  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.664   0.282  -1.943  1.00  0.00           O  
HETATM    8  C   UNL     1      -2.808  -0.415   0.120  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.673  -0.840   0.783  1.00  0.00           C  
HETATM   10  C   UNL     1       0.697  -1.406   0.802  1.00  0.00           C  
HETATM   11  C   UNL     1       1.156  -2.761   0.229  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.091  -0.285   0.826  1.00  0.00           C  
HETATM   13  O   UNL     1      -4.190  -0.650   1.982  1.00  0.00           O  
HETATM   14  N   UNL     1      -5.159   0.240   0.191  1.00  0.00           N  
HETATM   15  C   UNL     1      -6.405   0.473   0.925  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.450   1.070  -0.021  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.787   1.198   0.711  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.987   2.453  -0.484  1.00  0.00           C  
HETATM   19  C   UNL     1       2.599  -2.496  -0.262  1.00  0.00           C  
HETATM   20  O   UNL     1       3.456  -3.595   0.056  1.00  0.00           O  
HETATM   21  C   UNL     1       2.993  -1.235   0.549  1.00  0.00           C  
HETATM   22  O   UNL     1       1.768  -0.469   0.600  1.00  0.00           O  
HETATM   23  C   UNL     1       4.090  -0.451  -0.172  1.00  0.00           C  
HETATM   24  O   UNL     1       4.515   0.639   0.649  1.00  0.00           O  
HETATM   25  O   UNL     1       6.892   0.934  -0.146  1.00  0.00           O  
HETATM   26  O   UNL     1       5.159   2.516  -1.075  1.00  0.00           O  
HETATM   27  O   UNL     1       5.972   2.687   1.419  1.00  0.00           O  
HETATM   28  H   UNL     1      -1.398  -0.028  -2.854  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.714  -1.084   1.834  1.00  0.00           H  
HETATM   30  H   UNL     1       0.488  -1.505   1.867  1.00  0.00           H  
HETATM   31  H   UNL     1       1.151  -3.525   1.006  1.00  0.00           H  
HETATM   32  H   UNL     1       0.516  -3.060  -0.602  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.102   0.462  -0.751  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.774  -0.472   1.324  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.220   1.167   1.745  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.570   0.418  -0.886  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.666   1.849   1.577  1.00  0.00           H  
HETATM   38  H   UNL     1      -9.531   1.622   0.038  1.00  0.00           H  
HETATM   39  H   UNL     1      -9.116   0.212   1.042  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.035   2.361  -1.006  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.732   2.878  -1.158  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.867   3.104   0.381  1.00  0.00           H  
HETATM   43  H   UNL     1       2.615  -2.290  -1.333  1.00  0.00           H  
HETATM   44  H   UNL     1       3.196  -4.429  -0.359  1.00  0.00           H  
HETATM   45  H   UNL     1       3.313  -1.510   1.554  1.00  0.00           H  
HETATM   46  H   UNL     1       4.937  -1.109  -0.369  1.00  0.00           H  
HETATM   47  H   UNL     1       3.702  -0.065  -1.115  1.00  0.00           H  
HETATM   48  H   UNL     1       4.355   3.029  -0.918  1.00  0.00           H  
HETATM   49  H   UNL     1       6.655   3.343   1.221  1.00  0.00           H  
CONECT    1   24   25   25   26                                       
CONECT    1   27                                                      
CONECT    2   10    3    9                                            
CONECT    3    2    4    4    5                                       
CONECT    4    3    3                                                 
CONECT    5    3    6   28                                            
CONECT    6    5    8    7    7                                       
CONECT    7    6    6                                                 
CONECT    8    6    9    9   12                                       
CONECT    9    2    8    8   29                                       
CONECT   10    2   11   22   30                                       
CONECT   11   10   19   31   32                                       
CONECT   12    8   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   33                                            
CONECT   15   14   16   34   35                                       
CONECT   16   15   17   18   36                                       
CONECT   17   16   37   38   39                                       
CONECT   18   16   40   41   42                                       
CONECT   19   11   20   21   43                                       
CONECT   20   19   44                                                 
CONECT   21   19   23   22   45                                       
CONECT   22   10   21                                                 
CONECT   23   21   24   46   47                                       
CONECT   24    1   23                                                 
CONECT   25    1    1                                                 
CONECT   26    1   48                                                 
CONECT   27    1   49                                                 
CONECT   28    5                                                      
CONECT   29    9                                                      
CONECT   30   10                                                      
CONECT   31   11                                                      
CONECT   32   11                                                      
CONECT   33   14                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
