COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -5.936   3.625   0.733  1.00  0.00           P  
HETATM    2  O   UNL     1      -6.589   3.395  -0.575  1.00  0.00           O  
HETATM    3  O   UNL     1      -4.976   2.380   1.080  1.00  0.00           O  
HETATM    4  C   UNL     1      -3.943   1.925   0.204  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.227   0.730   0.837  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.091   0.223  -0.086  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.795   0.997   0.166  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.946  -1.253   0.357  1.00  0.00           C  
HETATM    9  O   UNL     1      -0.868  -1.394   1.284  1.00  0.00           O  
HETATM   10  C   UNL     1      -3.291  -1.576   1.038  1.00  0.00           C  
HETATM   11  O   UNL     1      -4.116  -0.404   0.932  1.00  0.00           O  
HETATM   12  N   UNL     1      -3.936  -2.702   0.358  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.120  -3.882   1.027  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.714  -4.920   0.400  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.137  -4.764  -0.942  1.00  0.00           C  
HETATM   16  N   UNL     1      -4.937  -3.585  -1.566  1.00  0.00           N  
HETATM   17  C   UNL     1      -4.346  -2.565  -0.916  1.00  0.00           C  
HETATM   18  O   UNL     1      -4.177  -1.507  -1.489  1.00  0.00           O  
HETATM   19  O   UNL     1      -5.675  -5.686  -1.528  1.00  0.00           O  
HETATM   20  O   UNL     1      -5.060   4.974   0.664  1.00  0.00           O  
HETATM   21  C   UNL     1       0.250   0.565  -0.830  1.00  0.00           C  
HETATM   22  O   UNL     1      -0.014  -0.280  -1.659  1.00  0.00           O  
HETATM   23  N   UNL     1       1.479   1.117  -0.798  1.00  0.00           N  
HETATM   24  C   UNL     1       2.496   0.696  -1.766  1.00  0.00           C  
HETATM   25  C   UNL     1       3.791   1.471  -1.514  1.00  0.00           C  
HETATM   26  C   UNL     1       4.833   1.115  -2.592  1.00  0.00           C  
HETATM   27  O   UNL     1       5.218   2.283  -3.321  1.00  0.00           O  
HETATM   28  C   UNL     1       6.033   0.557  -1.791  1.00  0.00           C  
HETATM   29  O   UNL     1       7.270   1.029  -2.329  1.00  0.00           O  
HETATM   30  C   UNL     1       5.783   1.145  -0.379  1.00  0.00           C  
HETATM   31  O   UNL     1       4.346   1.095  -0.243  1.00  0.00           O  
HETATM   32  N   UNL     1       6.427   0.320   0.646  1.00  0.00           N  
HETATM   33  C   UNL     1       7.452   0.840   1.389  1.00  0.00           C  
HETATM   34  C   UNL     1       8.045   0.079   2.334  1.00  0.00           C  
HETATM   35  C   UNL     1       7.592  -1.247   2.536  1.00  0.00           C  
HETATM   36  N   UNL     1       6.580  -1.722   1.783  1.00  0.00           N  
HETATM   37  C   UNL     1       6.003  -0.940   0.851  1.00  0.00           C  
HETATM   38  O   UNL     1       5.088  -1.380   0.183  1.00  0.00           O  
HETATM   39  O   UNL     1       8.112  -1.952   3.382  1.00  0.00           O  
HETATM   40  H   UNL     1      -4.380   1.623  -0.748  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.228   2.730   0.037  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.837   0.995   1.820  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.383   0.287  -1.134  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.983   2.065   0.054  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.441   0.794   1.176  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.792  -1.898  -0.508  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.732  -2.300   1.595  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.126  -1.822   2.087  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.791  -3.983   2.050  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.866  -5.857   0.916  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.224  -3.471  -2.485  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.602   5.188   1.489  1.00  0.00           H  
HETATM   53  H   UNL     1       1.691   1.792  -0.135  1.00  0.00           H  
HETATM   54  H   UNL     1       2.684  -0.371  -1.655  1.00  0.00           H  
HETATM   55  H   UNL     1       2.142   0.900  -2.777  1.00  0.00           H  
HETATM   56  H   UNL     1       3.591   2.542  -1.528  1.00  0.00           H  
HETATM   57  H   UNL     1       4.438   0.356  -3.268  1.00  0.00           H  
HETATM   58  H   UNL     1       5.872   2.117  -4.013  1.00  0.00           H  
HETATM   59  H   UNL     1       6.012  -0.533  -1.767  1.00  0.00           H  
HETATM   60  H   UNL     1       7.429   0.760  -3.244  1.00  0.00           H  
HETATM   61  H   UNL     1       6.140   2.173  -0.323  1.00  0.00           H  
HETATM   62  H   UNL     1       7.784   1.854   1.221  1.00  0.00           H  
HETATM   63  H   UNL     1       8.856   0.477   2.927  1.00  0.00           H  
HETATM   64  H   UNL     1       6.264  -2.629   1.915  1.00  0.00           H  
HETATM   65  O   UNL     1      -7.060   3.772   1.876  1.00  0.00           O  
HETATM   66  H   UNL     1      -7.674   4.505   1.731  1.00  0.00           H  
CONECT    1    2    2    3   20                                       
CONECT    1   65                                                      
CONECT    2    1    1                                                 
CONECT    3    4    1                                                 
CONECT    4    5    3   40   41                                       
CONECT    5    4   11    6   42                                       
CONECT    6    5    7    8   43                                       
CONECT    7    6   21   44   45                                       
CONECT    8    9    6   10   46                                       
CONECT    9    8   47                                                 
CONECT   10   11    8   12   48                                       
CONECT   11    5   10                                                 
CONECT   12   10   13   17                                            
CONECT   13   12   14   14   49                                       
CONECT   14   13   13   15   50                                       
CONECT   15   14   16   19   19                                       
CONECT   16   17   15   51                                            
CONECT   17   12   18   18   16                                       
CONECT   18   17   17                                                 
CONECT   19   15   15                                                 
CONECT   20    1   52                                                 
CONECT   21    7   23   22   22                                       
CONECT   22   21   21                                                 
CONECT   23   21   24   53                                            
CONECT   24   23   25   54   55                                       
CONECT   25   24   31   26   56                                       
CONECT   26   25   27   28   57                                       
CONECT   27   26   58                                                 
CONECT   28   29   30   26   59                                       
CONECT   29   28   60                                                 
CONECT   30   31   28   32   61                                       
CONECT   31   25   30                                                 
CONECT   32   30   33   37                                            
CONECT   33   32   34   34   62                                       
CONECT   34   33   33   35   63                                       
CONECT   35   34   36   39   39                                       
CONECT   36   37   35   64                                            
CONECT   37   32   38   38   36                                       
CONECT   38   37   37                                                 
CONECT   39   35   35                                                 
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   16                                                      
CONECT   52   20                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   33                                                      
CONECT   63   34                                                      
CONECT   64   36                                                      
CONECT   65    1   66                                                 
CONECT   66   65                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
