COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       0.343   5.297   0.008  1.00  0.00           P  
HETATM    2  O   UNL     1      -1.007   5.600   0.535  1.00  0.00           O  
HETATM    3  O   UNL     1       1.441   5.574   1.153  1.00  0.00           O  
HETATM    4  C   UNL     1       1.871  -0.300  -0.507  1.00  0.00           C  
HETATM    5  C   UNL     1       1.034  -0.726   0.725  1.00  0.00           C  
HETATM    6  O   UNL     1       0.671  -2.105   0.644  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.213   0.182   0.600  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.316  -0.547  -0.033  1.00  0.00           N  
HETATM    9  C   UNL     1       0.254   1.344  -0.298  1.00  0.00           C  
HETATM   10  O   UNL     1       1.643   1.123  -0.595  1.00  0.00           O  
HETATM   11  C   UNL     1       0.085   2.673   0.441  1.00  0.00           C  
HETATM   12  O   UNL     1       0.410   3.752  -0.438  1.00  0.00           O  
HETATM   13  N   UNL     1       3.292  -0.582  -0.289  1.00  0.00           N  
HETATM   14  C   UNL     1       4.226   0.294   0.179  1.00  0.00           C  
HETATM   15  N   UNL     1       5.387  -0.289   0.250  1.00  0.00           N  
HETATM   16  C   UNL     1       6.164  -2.651  -0.303  1.00  0.00           C  
HETATM   17  N   UNL     1       7.501  -2.510   0.026  1.00  0.00           N  
HETATM   18  C   UNL     1       5.273  -1.574  -0.166  1.00  0.00           C  
HETATM   19  C   UNL     1       3.926  -1.779  -0.511  1.00  0.00           C  
HETATM   20  N   UNL     1       3.546  -2.974  -0.951  1.00  0.00           N  
HETATM   21  C   UNL     1       4.417  -3.955  -1.063  1.00  0.00           C  
HETATM   22  N   UNL     1       5.692  -3.810  -0.751  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.146  -1.297   0.718  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.981  -1.369   1.917  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.280  -2.046   0.068  1.00  0.00           C  
HETATM   26  N   UNL     1      -3.725  -3.125   0.954  1.00  0.00           N  
HETATM   27  C   UNL     1      -4.190  -2.836   2.186  1.00  0.00           C  
HETATM   28  O   UNL     1      -4.240  -1.683   2.560  1.00  0.00           O  
HETATM   29  C   UNL     1      -4.444  -1.087  -0.192  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.545  -1.817  -0.963  1.00  0.00           C  
HETATM   31  S   UNL     1      -6.924  -0.679  -1.271  1.00  0.00           S  
HETATM   32  C   UNL     1      -8.108  -1.709  -2.180  1.00  0.00           C  
HETATM   33  H   UNL     1       2.350   5.396   0.877  1.00  0.00           H  
HETATM   34  H   UNL     1       1.515  -0.804  -1.406  1.00  0.00           H  
HETATM   35  H   UNL     1       1.573  -0.521   1.651  1.00  0.00           H  
HETATM   36  H   UNL     1       1.426  -2.710   0.628  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.515   0.554   1.579  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.448  -0.489  -0.992  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.327   1.357  -1.221  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.948   2.775   0.774  1.00  0.00           H  
HETATM   41  H   UNL     1       0.749   2.695   1.305  1.00  0.00           H  
HETATM   42  H   UNL     1       4.031   1.321   0.449  1.00  0.00           H  
HETATM   43  H   UNL     1       7.832  -1.661   0.356  1.00  0.00           H  
HETATM   44  H   UNL     1       8.106  -3.262  -0.073  1.00  0.00           H  
HETATM   45  H   UNL     1       4.076  -4.914  -1.423  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.941  -2.470  -0.878  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.685  -4.046   0.654  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.518  -3.631   2.839  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.841  -0.732   0.759  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.091  -0.238  -0.778  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.148  -2.172  -1.914  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.898  -2.665  -0.377  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.397  -2.561  -1.563  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.992  -1.120  -2.421  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.647  -2.067  -3.100  1.00  0.00           H  
HETATM   56  O   UNL     1       0.646   6.236  -1.264  1.00  0.00           O  
HETATM   57  H   UNL     1       0.622   7.183  -1.068  1.00  0.00           H  
CONECT    1    2    2   12    3                                       
CONECT    1   56                                                      
CONECT    2    1    1                                                 
CONECT    3    1   33                                                 
CONECT    4   10   13    5   34                                       
CONECT    5    4    7    6   35                                       
CONECT    6    5   36                                                 
CONECT    7    9    8    5   37                                       
CONECT    8   23    7   38                                            
CONECT    9   10   11    7   39                                       
CONECT   10    9    4                                                 
CONECT   11   12    9   40   41                                       
CONECT   12    1   11                                                 
CONECT   13   19    4   14                                            
CONECT   14   13   15   15   42                                       
CONECT   15   18   14   14                                            
CONECT   16   22   17   18   18                                       
CONECT   17   16   43   44                                            
CONECT   18   16   16   19   15                                       
CONECT   19   20   20   18   13                                       
CONECT   20   21   19   19                                            
CONECT   21   22   22   20   45                                       
CONECT   22   21   21   16                                            
CONECT   23   25    8   24   24                                       
CONECT   24   23   23                                                 
CONECT   25   29   26   23   46                                       
CONECT   26   25   27   47                                            
CONECT   27   26   28   28   48                                       
CONECT   28   27   27                                                 
CONECT   29   30   25   49   50                                       
CONECT   30   31   29   51   52                                       
CONECT   31   32   30                                                 
CONECT   32   31   53   54   55                                       
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   11                                                      
CONECT   42   14                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   21                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   29                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
CONECT   53   32                                                      
CONECT   54   32                                                      
CONECT   55   32                                                      
CONECT   56    1   57                                                 
CONECT   57   56                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
