COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -8.021   0.834  -0.658  1.00  0.00           O  
HETATM    2  P   UNL     1      -7.008  -0.132   0.137  1.00  0.00           P  
HETATM    3  O   UNL     1      -7.037   0.202   1.579  1.00  0.00           O  
HETATM    4  O   UNL     1      -7.456  -1.665  -0.067  1.00  0.00           O  
HETATM    5  O   UNL     1      -5.515   0.072  -0.431  1.00  0.00           O  
HETATM    6  P   UNL     1      -4.051  -0.333   0.102  1.00  0.00           P  
HETATM    7  O   UNL     1      -3.982  -0.121   1.565  1.00  0.00           O  
HETATM    8  O   UNL     1      -3.768  -1.883  -0.229  1.00  0.00           O  
HETATM    9  O   UNL     1      -2.944   0.582  -0.625  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.555   0.537  -0.291  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.787   1.528  -1.168  1.00  0.00           C  
HETATM   12  C   UNL     1       0.678   1.480  -0.815  1.00  0.00           C  
HETATM   13  C   UNL     1       1.579   0.677  -1.380  1.00  0.00           C  
HETATM   14  C   UNL     1       1.223  -0.303  -2.468  1.00  0.00           C  
HETATM   15  S   UNL     1       1.461   2.482   0.401  1.00  0.00           S  
HETATM   16  C   UNL     1       3.013   1.725   0.068  1.00  0.00           C  
HETATM   17  C   UNL     1       4.309   2.061   0.759  1.00  0.00           C  
HETATM   18  O   UNL     1       4.087   2.159   2.167  1.00  0.00           O  
HETATM   19  C   UNL     1       2.868   0.811  -0.892  1.00  0.00           C  
HETATM   20  C   UNL     1       4.019  -0.016  -1.405  1.00  0.00           C  
HETATM   21  C   UNL     1       4.165  -1.254  -0.558  1.00  0.00           C  
HETATM   22  C   UNL     1       3.246  -1.548   0.430  1.00  0.00           C  
HETATM   23  N   UNL     1       3.406  -2.646   1.156  1.00  0.00           N  
HETATM   24  C   UNL     1       4.424  -3.455   0.947  1.00  0.00           C  
HETATM   25  C   UNL     1       4.563  -4.692   1.798  1.00  0.00           C  
HETATM   26  N   UNL     1       5.324  -3.214   0.015  1.00  0.00           N  
HETATM   27  C   UNL     1       5.229  -2.136  -0.756  1.00  0.00           C  
HETATM   28  N   UNL     1       6.177  -1.885  -1.735  1.00  0.00           N  
HETATM   29  C   UNL     1       4.836   3.398   0.232  1.00  0.00           C  
HETATM   30  O   UNL     1       6.121   3.660   0.800  1.00  0.00           O  
HETATM   31  H   UNL     1      -8.941   0.764  -0.367  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.460  -1.953  -0.990  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.797  -2.095  -1.172  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.425   0.804   0.758  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.173  -0.470  -0.460  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.916   1.261  -2.217  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.169   2.535  -0.999  1.00  0.00           H  
HETATM   38  H   UNL     1       1.259   0.199  -3.435  1.00  0.00           H  
HETATM   39  H   UNL     1       1.934  -1.129  -2.461  1.00  0.00           H  
HETATM   40  H   UNL     1       0.217  -0.688  -2.296  1.00  0.00           H  
HETATM   41  H   UNL     1       5.041   1.278   0.560  1.00  0.00           H  
HETATM   42  H   UNL     1       3.446   2.838   2.418  1.00  0.00           H  
HETATM   43  H   UNL     1       3.828  -0.304  -2.438  1.00  0.00           H  
HETATM   44  H   UNL     1       4.937   0.569  -1.354  1.00  0.00           H  
HETATM   45  H   UNL     1       2.408  -0.891   0.610  1.00  0.00           H  
HETATM   46  H   UNL     1       4.036  -5.520   1.324  1.00  0.00           H  
HETATM   47  H   UNL     1       5.618  -4.944   1.902  1.00  0.00           H  
HETATM   48  H   UNL     1       4.135  -4.505   2.783  1.00  0.00           H  
HETATM   49  H   UNL     1       6.960  -2.454  -1.809  1.00  0.00           H  
HETATM   50  H   UNL     1       6.058  -1.142  -2.347  1.00  0.00           H  
HETATM   51  H   UNL     1       4.921   3.352  -0.854  1.00  0.00           H  
HETATM   52  H   UNL     1       4.147   4.195   0.509  1.00  0.00           H  
HETATM   53  H   UNL     1       6.516   4.493   0.509  1.00  0.00           H  
CONECT    1    2   31                                                 
CONECT    2    3    3    4    5                                       
CONECT    2    1                                                      
CONECT    3    2    2                                                 
CONECT    4    2   32                                                 
CONECT    5    2    6                                                 
CONECT    6    5    7    7    8                                       
CONECT    6    9                                                      
CONECT    7    6    6                                                 
CONECT    8    6   33                                                 
CONECT    9    6   10                                                 
CONECT   10    9   11   34   35                                       
CONECT   11   10   12   36   37                                       
CONECT   12   15   11   13   13                                       
CONECT   13   12   12   19   14                                       
CONECT   14   13   38   39   40                                       
CONECT   15   16   12                                                 
CONECT   16   17   15   19   19                                       
CONECT   17   18   29   16   41                                       
CONECT   18   17   42                                                 
CONECT   19   16   16   20   13                                       
CONECT   20   19   21   43   44                                       
CONECT   21   27   20   22   22                                       
CONECT   22   21   21   23   45                                       
CONECT   23   24   24   22                                            
CONECT   24   26   25   23   23                                       
CONECT   25   24   46   47   48                                       
CONECT   26   27   27   24                                            
CONECT   27   28   26   26   21                                       
CONECT   28   27   49   50                                            
CONECT   29   17   30   51   52                                       
CONECT   30   29   53                                                 
CONECT   31    1                                                      
CONECT   32    4                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
