COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.137  -0.058   2.041  1.00  0.00           O  
HETATM    2  C   UNL     1       0.748   0.163   0.786  1.00  0.00           C  
HETATM    3  C   UNL     1       1.373   1.543   0.675  1.00  0.00           C  
HETATM    4  O   UNL     1       2.470   1.422  -0.246  1.00  0.00           O  
HETATM    5  C   UNL     1       2.725   0.023  -0.498  1.00  0.00           C  
HETATM    6  C   UNL     1       2.282  -0.292  -1.921  1.00  0.00           C  
HETATM    7  O   UNL     1       3.063   0.476  -2.819  1.00  0.00           O  
HETATM    8  P   UNL     1       2.812   0.347  -4.417  1.00  0.00           P  
HETATM    9  S   UNL     1       1.133   1.036  -5.105  1.00  0.00           S  
HETATM   10  O   UNL     1       3.104  -1.222  -4.708  1.00  0.00           O  
HETATM   11  O   UNL     1       4.136   1.046  -5.041  1.00  0.00           O  
HETATM   12  C   UNL     1       1.940  -0.742   0.560  1.00  0.00           C  
HETATM   13  O   UNL     1       2.742  -0.809   1.739  1.00  0.00           O  
HETATM   14  N   UNL     1       0.452   2.524   0.177  1.00  0.00           N  
HETATM   15  C   UNL     1       0.308   2.664  -1.199  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.516   3.539  -1.779  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.338   4.427  -0.933  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.105   5.242  -1.435  1.00  0.00           O  
HETATM   19  N   UNL     1      -1.161   4.252   0.431  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.301   3.338   1.055  1.00  0.00           C  
HETATM   21  O   UNL     1      -0.226   3.271   2.284  1.00  0.00           O  
HETATM   22  H   UNL     1      -0.494   0.669   2.185  1.00  0.00           H  
HETATM   23  H   UNL     1       0.000   0.004   0.000  1.00  0.00           H  
HETATM   24  H   UNL     1       1.754   1.910   1.633  1.00  0.00           H  
HETATM   25  H   UNL     1       3.804  -0.139  -0.410  1.00  0.00           H  
HETATM   26  H   UNL     1       1.229  -0.035  -2.051  1.00  0.00           H  
HETATM   27  H   UNL     1       2.428  -1.352  -2.133  1.00  0.00           H  
HETATM   28  H   UNL     1       3.952  -1.609  -4.402  1.00  0.00           H  
HETATM   29  H   UNL     1       4.167   1.222  -6.006  1.00  0.00           H  
HETATM   30  H   UNL     1       1.675  -1.764   0.277  1.00  0.00           H  
HETATM   31  H   UNL     1       3.447  -0.153   1.628  1.00  0.00           H  
HETATM   32  H   UNL     1       0.921   2.002  -1.802  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.601   3.619  -2.856  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.712   4.848   1.042  1.00  0.00           H  
CONECT    1    2   22                                                 
CONECT    2    1    3   12   23                                       
CONECT    3    2    4   14   24                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   12   25                                       
CONECT    6    5    7   26   27                                       
CONECT    7    6    8                                                 
CONECT    8    7    9    9   10                                       
CONECT    8   11                                                      
CONECT    9    8    8                                                 
CONECT   10    8   28                                                 
CONECT   11    8   29                                                 
CONECT   12    2    5   13   30                                       
CONECT   13   12   31                                                 
CONECT   14    3   15   20                                            
CONECT   15   14   16   16   32                                       
CONECT   16   15   15   17   33                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   34                                            
CONECT   20   14   19   21   21                                       
CONECT   21   20   20                                                 
CONECT   22    1                                                      
CONECT   23    2                                                      
CONECT   24    3                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    6                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   13                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
CONECT   34   19                                                      
MASTER        0    0    0    0    0    0    0    0   34    0   34    0
END
