COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       6.045   1.745   0.143  1.00  0.00           P  
HETATM    2  O   UNL     1       7.394   0.968  -0.264  1.00  0.00           O  
HETATM    3  O   UNL     1       5.655   2.663  -0.951  1.00  0.00           O  
HETATM    4  O   UNL     1       4.866   0.678   0.394  1.00  0.00           O  
HETATM    5  C   UNL     1       4.335  -0.153  -0.640  1.00  0.00           C  
HETATM    6  C   UNL     1       3.234  -1.045  -0.063  1.00  0.00           C  
HETATM    7  O   UNL     1       2.075  -0.255   0.279  1.00  0.00           O  
HETATM    8  C   UNL     1       2.732  -2.039  -1.133  1.00  0.00           C  
HETATM    9  O   UNL     1       3.353  -3.315  -0.962  1.00  0.00           O  
HETATM   10  C   UNL     1       1.212  -2.138  -0.870  1.00  0.00           C  
HETATM   11  O   UNL     1       0.849  -3.477  -0.529  1.00  0.00           O  
HETATM   12  C   UNL     1       0.976  -1.191   0.327  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.300  -0.488   0.178  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.489   0.723  -0.419  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.749   1.048  -0.376  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.446   0.069   0.250  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.798  -0.125   0.580  1.00  0.00           C  
HETATM   18  N   UNL     1      -4.751   0.822   0.248  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.141  -1.240   1.216  1.00  0.00           N  
HETATM   20  C   UNL     1      -3.239  -2.150   1.536  1.00  0.00           C  
HETATM   21  N   UNL     1      -1.962  -2.010   1.249  1.00  0.00           N  
HETATM   22  C   UNL     1      -1.526  -0.930   0.608  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.156   0.602   0.599  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.981   1.773   0.130  1.00  0.00           C  
HETATM   25  C   UNL     1      -8.036   1.572  -0.620  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.761   2.745  -1.230  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.525   0.170  -0.873  1.00  0.00           C  
HETATM   28  O   UNL     1       6.298   2.592   1.489  1.00  0.00           O  
HETATM   29  H   UNL     1       7.709   0.348   0.408  1.00  0.00           H  
HETATM   30  H   UNL     1       3.920   0.472  -1.431  1.00  0.00           H  
HETATM   31  H   UNL     1       5.130  -0.776  -1.049  1.00  0.00           H  
HETATM   32  H   UNL     1       3.601  -1.582   0.812  1.00  0.00           H  
HETATM   33  H   UNL     1       2.924  -1.653  -2.134  1.00  0.00           H  
HETATM   34  H   UNL     1       3.074  -3.978  -1.608  1.00  0.00           H  
HETATM   35  H   UNL     1       0.651  -1.799  -1.741  1.00  0.00           H  
HETATM   36  H   UNL     1       1.033  -4.124  -1.224  1.00  0.00           H  
HETATM   37  H   UNL     1       0.995  -1.750   1.263  1.00  0.00           H  
HETATM   38  H   UNL     1       0.291   1.323  -0.863  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.488   1.632  -0.217  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.561  -3.041   2.054  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.512  -0.309   0.118  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.249   0.503   1.681  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.701   2.778   0.411  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.334   2.967  -2.208  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.817   2.500  -1.342  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.656   3.614  -0.581  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.940  -0.532  -0.278  1.00  0.00           H  
HETATM   48  H   UNL     1      -9.576   0.095  -0.593  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.413  -0.069  -1.931  1.00  0.00           H  
HETATM   50  H   UNL     1       6.997   3.255   1.411  1.00  0.00           H  
CONECT    1    3    3    2    4                                       
CONECT    1   28                                                      
CONECT    2    1   29                                                 
CONECT    3    1    1                                                 
CONECT    4    1    5                                                 
CONECT    5    4    6   30   31                                       
CONECT    6    5    8    7   32                                       
CONECT    7    6   12                                                 
CONECT    8    6    9   10   33                                       
CONECT    9    8   34                                                 
CONECT   10    8   12   11   35                                       
CONECT   11   10   36                                                 
CONECT   12    7   10   13   37                                       
CONECT   13   12   14   22                                            
CONECT   14   13   15   15   38                                       
CONECT   15   14   14   16                                            
CONECT   16   15   22   22   17                                       
CONECT   17   16   18   19   19                                       
CONECT   18   17   23   39                                            
CONECT   19   17   17   20                                            
CONECT   20   21   21   19   40                                       
CONECT   21   22   20   20                                            
CONECT   22   13   16   16   21                                       
CONECT   23   18   24   41   42                                       
CONECT   24   23   25   25   43                                       
CONECT   25   26   24   24   27                                       
CONECT   26   25   44   45   46                                       
CONECT   27   25   47   48   49                                       
CONECT   28    1   50                                                 
CONECT   29    2                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   18                                                      
CONECT   40   20                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   26                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
