COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -1.221   0.078   0.292  1.00  0.00           P  
HETATM    2  O   UNL     1      -2.673  -0.194   0.212  1.00  0.00           O  
HETATM    3  O   UNL     1      -0.418  -1.313   0.394  1.00  0.00           O  
HETATM    4  O   UNL     1      -4.783   1.221   3.950  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.821   0.532   3.149  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.414   1.003   3.524  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.135   0.702   4.908  1.00  0.00           O  
HETATM    8  C   UNL     1      -1.351   0.217   2.726  1.00  0.00           C  
HETATM    9  O   UNL     1      -0.913   0.972   1.595  1.00  0.00           O  
HETATM   10  C   UNL     1      -0.191   0.026   3.732  1.00  0.00           C  
HETATM   11  O   UNL     1       0.997   0.655   3.251  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.695   0.717   5.018  1.00  0.00           C  
HETATM   13  N   UNL     1      -0.266  -0.031   6.202  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.939  -1.058   6.794  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.271  -1.493   7.823  1.00  0.00           N  
HETATM   16  C   UNL     1       0.872  -0.778   7.953  1.00  0.00           C  
HETATM   17  C   UNL     1       1.948  -0.790   8.856  1.00  0.00           C  
HETATM   18  N   UNL     1       1.986  -1.699   9.899  1.00  0.00           N  
HETATM   19  N   UNL     1       2.930   0.087   8.683  1.00  0.00           N  
HETATM   20  C   UNL     1       2.902   0.958   7.691  1.00  0.00           C  
HETATM   21  N   UNL     1       1.912   1.010   6.824  1.00  0.00           N  
HETATM   22  C   UNL     1       0.886   0.171   6.918  1.00  0.00           C  
HETATM   23  N   UNL     1       2.691   0.550  -4.820  1.00  0.00           N  
HETATM   24  C   UNL     1       3.171  -0.539  -4.193  1.00  0.00           C  
HETATM   25  O   UNL     1       2.405  -1.280  -3.608  1.00  0.00           O  
HETATM   26  N   UNL     1       4.486  -0.825  -4.212  1.00  0.00           N  
HETATM   27  C   UNL     1       5.349  -0.013  -4.856  1.00  0.00           C  
HETATM   28  O   UNL     1       6.540  -0.268  -4.870  1.00  0.00           O  
HETATM   29  C   UNL     1       4.858   1.138  -5.516  1.00  0.00           C  
HETATM   30  C   UNL     1       3.533   1.399  -5.485  1.00  0.00           C  
HETATM   31  C   UNL     1       1.254   0.832  -4.786  1.00  0.00           C  
HETATM   32  C   UNL     1       0.444  -0.372  -5.327  1.00  0.00           C  
HETATM   33  O   UNL     1       0.324  -0.308  -6.750  1.00  0.00           O  
HETATM   34  C   UNL     1      -0.934  -0.170  -4.646  1.00  0.00           C  
HETATM   35  O   UNL     1      -1.843   0.475  -5.540  1.00  0.00           O  
HETATM   36  C   UNL     1      -0.624   0.732  -3.436  1.00  0.00           C  
HETATM   37  O   UNL     1       0.794   0.962  -3.423  1.00  0.00           O  
HETATM   38  O   UNL     1      -0.751   0.872  -1.027  1.00  0.00           O  
HETATM   39  C   UNL     1      -1.048   0.032  -2.143  1.00  0.00           C  
HETATM   40  P   UNL     1      -3.104  -0.510  -5.713  1.00  0.00           P  
HETATM   41  O   UNL     1      -3.737  -0.738  -4.394  1.00  0.00           O  
HETATM   42  O   UNL     1      -4.175   0.157  -6.713  1.00  0.00           O  
HETATM   43  O   UNL     1      -2.607  -1.916  -6.320  1.00  0.00           O  
HETATM   44  H   UNL     1       0.520  -1.091   0.444  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.654   0.895   3.682  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.006   0.743   2.096  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.903  -0.540   3.324  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.312   2.073   3.340  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.747  -0.747   2.410  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.014  -1.033   3.914  1.00  0.00           H  
HETATM   51  H   UNL     1       1.682   0.504   3.916  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.330   1.743   5.066  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.887  -1.453   6.459  1.00  0.00           H  
HETATM   54  H   UNL     1       2.736  -1.701  10.514  1.00  0.00           H  
HETATM   55  H   UNL     1       1.261  -2.333  10.018  1.00  0.00           H  
HETATM   56  H   UNL     1       3.721   1.653   7.587  1.00  0.00           H  
HETATM   57  H   UNL     1       4.815  -1.616  -3.758  1.00  0.00           H  
HETATM   58  H   UNL     1       5.533   1.800  -6.037  1.00  0.00           H  
HETATM   59  H   UNL     1       3.140   2.273  -5.983  1.00  0.00           H  
HETATM   60  H   UNL     1       1.028   1.734  -5.355  1.00  0.00           H  
HETATM   61  H   UNL     1       0.897  -1.315  -5.020  1.00  0.00           H  
HETATM   62  H   UNL     1       1.221  -0.346  -7.108  1.00  0.00           H  
HETATM   63  H   UNL     1      -1.340  -1.126  -4.315  1.00  0.00           H  
HETATM   64  H   UNL     1      -1.153   1.679  -3.535  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.507  -0.908  -2.044  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.120  -0.166  -2.173  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.912  -0.463  -6.789  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.202  -1.722  -7.177  1.00  0.00           H  
CONECT    1    2    2    3    9                                       
CONECT    1   38                                                      
CONECT    2    1    1                                                 
CONECT    3    1   44                                                 
CONECT    4    5   45                                                 
CONECT    5    4    6   46   47                                       
CONECT    6    5    7    8   48                                       
CONECT    7    6   12                                                 
CONECT    8    6    9   10   49                                       
CONECT    9    1    8                                                 
CONECT   10    8   11   12   50                                       
CONECT   11   10   51                                                 
CONECT   12    7   10   13   52                                       
CONECT   13   12   14   22                                            
CONECT   14   13   15   15   53                                       
CONECT   15   14   14   16                                            
CONECT   16   15   17   22   22                                       
CONECT   17   16   18   19   19                                       
CONECT   18   17   54   55                                            
CONECT   19   17   17   20                                            
CONECT   20   19   21   21   56                                       
CONECT   21   20   20   22                                            
CONECT   22   13   16   16   21                                       
CONECT   23   24   30   31                                            
CONECT   24   23   25   25   26                                       
CONECT   25   24   24                                                 
CONECT   26   24   27   57                                            
CONECT   27   26   28   28   29                                       
CONECT   28   27   27                                                 
CONECT   29   27   30   30   58                                       
CONECT   30   23   29   29   59                                       
CONECT   31   23   32   37   60                                       
CONECT   32   31   33   34   61                                       
CONECT   33   32   62                                                 
CONECT   34   32   35   36   63                                       
CONECT   35   34   40                                                 
CONECT   36   34   37   39   64                                       
CONECT   37   31   36                                                 
CONECT   38    1   39                                                 
CONECT   39   36   38   65   66                                       
CONECT   40   35   41   41   42                                       
CONECT   40   43                                                      
CONECT   41   40   40                                                 
CONECT   42   40   67                                                 
CONECT   43   40   68                                                 
CONECT   44    3                                                      
CONECT   45    4                                                      
CONECT   46    5                                                      
CONECT   47    5                                                      
CONECT   48    6                                                      
CONECT   49    8                                                      
CONECT   50   10                                                      
CONECT   51   11                                                      
CONECT   52   12                                                      
CONECT   53   14                                                      
CONECT   54   18                                                      
CONECT   55   18                                                      
CONECT   56   20                                                      
CONECT   57   26                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
CONECT   63   34                                                      
CONECT   64   36                                                      
CONECT   65   39                                                      
CONECT   66   39                                                      
CONECT   67   42                                                      
CONECT   68   43                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
