COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       1.276  -3.338  -0.835  1.00  0.00           P  
HETATM    2  O   UNL     1       0.822  -3.852  -2.147  1.00  0.00           O  
HETATM    3  O   UNL     1       2.111  -4.483  -0.071  1.00  0.00           O  
HETATM    4  O   UNL     1       9.500   1.969   3.432  1.00  0.00           O  
HETATM    5  C   UNL     1       8.841   2.286   2.457  1.00  0.00           C  
HETATM    6  N   UNL     1       8.931   3.530   1.935  1.00  0.00           N  
HETATM    7  C   UNL     1       8.189   3.874   0.844  1.00  0.00           C  
HETATM    8  N   UNL     1       8.302   5.143   0.336  1.00  0.00           N  
HETATM    9  N   UNL     1       7.370   3.024   0.266  1.00  0.00           N  
HETATM   10  C   UNL     1       7.228   1.776   0.727  1.00  0.00           C  
HETATM   11  C   UNL     1       7.967   1.360   1.840  1.00  0.00           C  
HETATM   12  N   UNL     1       7.638   0.068   2.082  1.00  0.00           N  
HETATM   13  C   UNL     1       6.766  -0.326   1.200  1.00  0.00           C  
HETATM   14  N   UNL     1       6.475   0.699   0.347  1.00  0.00           N  
HETATM   15  C   UNL     1       5.541   0.649  -0.780  1.00  0.00           C  
HETATM   16  O   UNL     1       4.553  -0.384  -0.570  1.00  0.00           O  
HETATM   17  C   UNL     1       6.278   0.232  -2.072  1.00  0.00           C  
HETATM   18  O   UNL     1       6.600   1.381  -2.858  1.00  0.00           O  
HETATM   19  C   UNL     1       5.261  -0.664  -2.813  1.00  0.00           C  
HETATM   20  O   UNL     1       4.922  -0.095  -4.080  1.00  0.00           O  
HETATM   21  C   UNL     1       4.029  -0.682  -1.882  1.00  0.00           C  
HETATM   22  C   UNL     1       3.374  -2.065  -1.892  1.00  0.00           C  
HETATM   23  O   UNL     1       2.213  -2.049  -1.059  1.00  0.00           O  
HETATM   24  O   UNL     1      -0.004  -2.925   0.051  1.00  0.00           O  
HETATM   25  P   UNL     1      -1.420  -3.623   0.364  1.00  0.00           P  
HETATM   26  O   UNL     1      -1.942  -4.254  -0.869  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.226  -4.746   1.501  1.00  0.00           O  
HETATM   28  O   UNL     1      -2.464  -2.511   0.880  1.00  0.00           O  
HETATM   29  C   UNL     1      -3.839  -2.797   1.142  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.544  -1.524   1.616  1.00  0.00           C  
HETATM   31  O   UNL     1      -4.659  -0.580   0.529  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.000  -1.836   2.024  1.00  0.00           C  
HETATM   33  O   UNL     1      -6.102  -1.986   3.442  1.00  0.00           O  
HETATM   34  C   UNL     1      -6.796  -0.598   1.553  1.00  0.00           C  
HETATM   35  O   UNL     1      -7.415   0.053   2.664  1.00  0.00           O  
HETATM   36  C   UNL     1      -5.725   0.315   0.915  1.00  0.00           C  
HETATM   37  N   UNL     1      -6.271   0.996  -0.262  1.00  0.00           N  
HETATM   38  C   UNL     1      -6.931   2.194  -0.271  1.00  0.00           C  
HETATM   39  N   UNL     1      -7.279   3.074   0.675  1.00  0.00           N  
HETATM   40  C   UNL     1      -7.929   4.175   0.372  1.00  0.00           C  
HETATM   41  N   UNL     1      -8.264   5.049   1.376  1.00  0.00           N  
HETATM   42  N   UNL     1      -8.280   4.476  -0.910  1.00  0.00           N  
HETATM   43  C   UNL     1      -7.963   3.634  -1.919  1.00  0.00           C  
HETATM   44  O   UNL     1      -8.272   3.894  -3.069  1.00  0.00           O  
HETATM   45  C   UNL     1      -7.263   2.445  -1.607  1.00  0.00           C  
HETATM   46  N   UNL     1      -6.796   1.405  -2.340  1.00  0.00           N  
HETATM   47  C   UNL     1      -6.207   0.553  -1.552  1.00  0.00           C  
HETATM   48  H   UNL     1       2.440  -4.216   0.798  1.00  0.00           H  
HETATM   49  H   UNL     1       9.526   4.180   2.339  1.00  0.00           H  
HETATM   50  H   UNL     1       8.903   5.781   0.752  1.00  0.00           H  
HETATM   51  H   UNL     1       7.780   5.403  -0.440  1.00  0.00           H  
HETATM   52  H   UNL     1       6.330  -1.313   1.157  1.00  0.00           H  
HETATM   53  H   UNL     1       5.056   1.616  -0.914  1.00  0.00           H  
HETATM   54  H   UNL     1       7.180  -0.332  -1.832  1.00  0.00           H  
HETATM   55  H   UNL     1       7.064   1.177  -3.681  1.00  0.00           H  
HETATM   56  H   UNL     1       5.660  -1.670  -2.942  1.00  0.00           H  
HETATM   57  H   UNL     1       5.672  -0.004  -4.683  1.00  0.00           H  
HETATM   58  H   UNL     1       3.312   0.080  -2.186  1.00  0.00           H  
HETATM   59  H   UNL     1       3.086  -2.323  -2.911  1.00  0.00           H  
HETATM   60  H   UNL     1       4.081  -2.805  -1.516  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.886  -4.403   2.339  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.315  -3.158   0.230  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.911  -3.562   1.916  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.002  -1.080   2.451  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.355  -2.735   1.520  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.996  -2.183   3.753  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.544  -0.883   0.813  1.00  0.00           H  
HETATM   68  H   UNL     1      -8.053  -0.499   3.136  1.00  0.00           H  
HETATM   69  H   UNL     1      -5.365   1.044   1.641  1.00  0.00           H  
HETATM   70  H   UNL     1      -8.744   5.866   1.168  1.00  0.00           H  
HETATM   71  H   UNL     1      -8.022   4.849   2.294  1.00  0.00           H  
HETATM   72  H   UNL     1      -8.759   5.297  -1.100  1.00  0.00           H  
HETATM   73  H   UNL     1      -5.741  -0.368  -1.870  1.00  0.00           H  
CONECT    1   23    2    2   24                                       
CONECT    1    3                                                      
CONECT    2    1    1                                                 
CONECT    3    1   48                                                 
CONECT    4    5    5                                                 
CONECT    5    6    4    4   11                                       
CONECT    6    7    5   49                                            
CONECT    7    8    6    9    9                                       
CONECT    8    7   50   51                                            
CONECT    9    7    7   10                                            
CONECT   10    9   11   11   14                                       
CONECT   11    5   10   10   12                                       
CONECT   12   11   13   13                                            
CONECT   13   14   12   12   52                                       
CONECT   14   10   15   13                                            
CONECT   15   14   16   17   53                                       
CONECT   16   15   21                                                 
CONECT   17   15   18   19   54                                       
CONECT   18   17   55                                                 
CONECT   19   17   21   20   56                                       
CONECT   20   19   57                                                 
CONECT   21   16   19   22   58                                       
CONECT   22   21   23   59   60                                       
CONECT   23   22    1                                                 
CONECT   24    1   25                                                 
CONECT   25   24   26   26   27                                       
CONECT   25   28                                                      
CONECT   26   25   25                                                 
CONECT   27   25   61                                                 
CONECT   28   25   29                                                 
CONECT   29   30   28   62   63                                       
CONECT   30   31   32   29   64                                       
CONECT   31   36   30                                                 
CONECT   32   34   30   33   65                                       
CONECT   33   32   66                                                 
CONECT   34   36   35   32   67                                       
CONECT   35   34   68                                                 
CONECT   36   37   31   34   69                                       
CONECT   37   38   36   47                                            
CONECT   38   39   45   45   37                                       
CONECT   39   40   40   38                                            
CONECT   40   41   42   39   39                                       
CONECT   41   40   70   71                                            
CONECT   42   40   43   72                                            
CONECT   43   42   44   44   45                                       
CONECT   44   43   43                                                 
CONECT   45   43   38   38   46                                       
CONECT   46   45   47   47                                            
CONECT   47   46   46   37   73                                       
CONECT   48    3                                                      
CONECT   49    6                                                      
CONECT   50    8                                                      
CONECT   51    8                                                      
CONECT   52   13                                                      
CONECT   53   15                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   22                                                      
CONECT   60   22                                                      
CONECT   61   27                                                      
CONECT   62   29                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   32                                                      
CONECT   66   33                                                      
CONECT   67   34                                                      
CONECT   68   35                                                      
CONECT   69   36                                                      
CONECT   70   41                                                      
CONECT   71   41                                                      
CONECT   72   42                                                      
CONECT   73   47                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
