COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.830   2.812   1.130  1.00  0.00           O  
HETATM    2  P   UNL     1      -5.989   2.438   0.289  1.00  0.00           P  
HETATM    3  O   UNL     1      -7.245   2.084   1.232  1.00  0.00           O  
HETATM    4  O   UNL     1      -6.371   3.669  -0.675  1.00  0.00           O  
HETATM    5  O   UNL     1      -5.611   1.153  -0.605  1.00  0.00           O  
HETATM    6  C   UNL     1      -5.126  -0.069  -0.046  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.867  -1.076  -1.168  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.169  -1.343  -1.925  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.824  -0.508  -2.133  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.348  -2.385  -0.569  1.00  0.00           C  
HETATM   11  O   UNL     1      -5.371  -2.981   0.230  1.00  0.00           O  
HETATM   12  C   UNL     1      -3.141  -2.102   0.288  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.225  -2.173   1.496  1.00  0.00           O  
HETATM   14  N   UNL     1      -1.969  -1.769  -0.288  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.769  -1.603   0.537  1.00  0.00           C  
HETATM   16  C   UNL     1       0.415  -1.228  -0.356  1.00  0.00           C  
HETATM   17  C   UNL     1       1.650  -1.058   0.492  1.00  0.00           C  
HETATM   18  O   UNL     1       1.588  -1.221   1.692  1.00  0.00           O  
HETATM   19  N   UNL     1       2.822  -0.725  -0.084  1.00  0.00           N  
HETATM   20  C   UNL     1       4.022  -0.560   0.741  1.00  0.00           C  
HETATM   21  C   UNL     1       5.206  -0.185  -0.152  1.00  0.00           C  
HETATM   22  S   UNL     1       6.692   0.020   0.868  1.00  0.00           S  
HETATM   23  C   UNL     1       7.966   0.455  -0.347  1.00  0.00           C  
HETATM   24  C   UNL     1       9.302   0.664   0.367  1.00  0.00           C  
HETATM   25  C   UNL     1      10.361   1.026  -0.643  1.00  0.00           C  
HETATM   26  O   UNL     1      10.075   1.107  -1.814  1.00  0.00           O  
HETATM   27  C   UNL     1      11.775   1.285  -0.193  1.00  0.00           C  
HETATM   28  H   UNL     1      -4.198   0.121   0.493  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.869  -0.474   0.641  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.566  -0.402  -2.307  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.974  -2.020  -2.757  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.895  -1.796  -1.250  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.941  -0.199  -1.572  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.545  -1.272  -2.858  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.242   0.353  -2.654  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.070  -3.067  -1.373  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.667  -2.429   0.966  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.919  -1.639  -1.248  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.937  -0.813   1.268  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.552  -2.538   1.054  1.00  0.00           H  
HETATM   41  H   UNL     1       0.583  -2.019  -1.088  1.00  0.00           H  
HETATM   42  H   UNL     1       0.199  -0.294  -0.874  1.00  0.00           H  
HETATM   43  H   UNL     1       2.871  -0.595  -1.044  1.00  0.00           H  
HETATM   44  H   UNL     1       3.854   0.230   1.472  1.00  0.00           H  
HETATM   45  H   UNL     1       4.238  -1.494   1.258  1.00  0.00           H  
HETATM   46  H   UNL     1       5.374  -0.975  -0.884  1.00  0.00           H  
HETATM   47  H   UNL     1       4.990   0.749  -0.670  1.00  0.00           H  
HETATM   48  H   UNL     1       8.065  -0.352  -1.074  1.00  0.00           H  
HETATM   49  H   UNL     1       7.680   1.373  -0.860  1.00  0.00           H  
HETATM   50  H   UNL     1       9.203   1.470   1.094  1.00  0.00           H  
HETATM   51  H   UNL     1       9.588  -0.254   0.880  1.00  0.00           H  
HETATM   52  H   UNL     1      11.840   1.166   0.889  1.00  0.00           H  
HETATM   53  H   UNL     1      12.447   0.577  -0.678  1.00  0.00           H  
HETATM   54  H   UNL     1      12.062   2.301  -0.464  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.042   1.829   0.747  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.611   4.478  -0.203  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    5                                       
CONECT    2    4                                                      
CONECT    3    2   55                                                 
CONECT    4    2   56                                                 
CONECT    5    2    6                                                 
CONECT    6    5   28    7   29                                       
CONECT    7    6    9    8   10                                       
CONECT    8    7   32   31   30                                       
CONECT    9    7   35   34   33                                       
CONECT   10    7   11   12   36                                       
CONECT   11   10   37                                                 
CONECT   12   10   14   13   13                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   38                                            
CONECT   15   14   16   40   39                                       
CONECT   16   15   42   41   17                                       
CONECT   17   16   19   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   17   43   20                                            
CONECT   20   19   21   45   44                                       
CONECT   21   20   47   22   46                                       
CONECT   22   21   23                                                 
CONECT   23   22   49   24   48                                       
CONECT   24   23   25   50   51                                       
CONECT   25   24   26   26   27                                       
CONECT   26   25   25                                                 
CONECT   27   25   53   54   52                                       
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55    3                                                      
CONECT   56    4                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
