COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.210   0.364   0.295  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.377  -0.599   1.143  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.091   0.102   1.591  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.492  -0.312  -0.120  1.00  0.00           C  
HETATM    5  N   UNL     1       0.605   0.618   0.405  1.00  0.00           N  
HETATM    6  C   UNL     1       3.541  -1.747  -1.194  1.00  0.00           C  
HETATM    7  O   UNL     1       2.721  -0.035   1.414  1.00  0.00           O  
HETATM    8  C   UNL     1       2.120  -1.286  -0.865  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.133   1.482  -0.527  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.418   0.765  -0.952  1.00  0.00           C  
HETATM   11  O   UNL     1       2.680   1.315  -0.659  1.00  0.00           O  
HETATM   12  O   UNL     1      -3.715  -1.447   0.226  1.00  0.00           O  
HETATM   13  O   UNL     1      -4.385   0.348  -0.874  1.00  0.00           O  
HETATM   14  S   UNL     1       2.191   0.234   0.123  1.00  0.00           S  
HETATM   15  H   UNL     1      -2.442   1.255   0.879  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.951  -0.902   2.019  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.124  -1.479   0.551  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.339   0.929   2.257  1.00  0.00           H  
HETATM   19  H   UNL     1       0.550  -0.608   2.114  1.00  0.00           H  
HETATM   20  H   UNL     1       3.498  -2.661  -1.787  1.00  0.00           H  
HETATM   21  H   UNL     1       4.054  -0.970  -1.760  1.00  0.00           H  
HETATM   22  H   UNL     1       4.083  -1.941  -0.268  1.00  0.00           H  
HETATM   23  H   UNL     1       1.577  -1.092  -1.790  1.00  0.00           H  
HETATM   24  H   UNL     1       1.607  -2.063  -0.299  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.385   2.421  -0.034  1.00  0.00           H  
HETATM   26  H   UNL     1       0.481   1.681  -1.405  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.164  -0.128  -1.524  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.021   1.432  -1.567  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.192  -0.127  -1.116  1.00  0.00           H  
CONECT    1    2   10    4   15                                       
CONECT    2    3    1   16   17                                       
CONECT    3    5    2   18   19                                       
CONECT    4    1   12   12   13                                       
CONECT    5    9   14    3                                            
CONECT    6    8   20   21   22                                       
CONECT    7   14   14                                                 
CONECT    8    6   14   23   24                                       
CONECT    9    5   10   25   26                                       
CONECT   10    9    1   27   28                                       
CONECT   11   14   14                                                 
CONECT   12    4    4                                                 
CONECT   13    4   29                                                 
CONECT   14    8   11   11    5                                       
CONECT   14    7    7                                                 
CONECT   15    1                                                      
CONECT   16    2                                                      
CONECT   17    2                                                      
CONECT   18    3                                                      
CONECT   19    3                                                      
CONECT   20    6                                                      
CONECT   21    6                                                      
CONECT   22    6                                                      
CONECT   23    8                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26    9                                                      
CONECT   27   10                                                      
CONECT   28   10                                                      
CONECT   29   13                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
