COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.683   2.232   0.907  1.00  0.00           O  
HETATM    2  C   UNL     1       0.444   1.136   0.022  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.038   0.754   0.069  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.884   1.930  -0.421  1.00  0.00           C  
HETATM    5  O   UNL     1      -3.270   1.617  -0.267  1.00  0.00           O  
HETATM    6  O   UNL     1      -1.263  -0.379  -0.772  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.537  -1.547  -0.385  1.00  0.00           C  
HETATM    8  O   UNL     1      -0.894  -1.910   0.950  1.00  0.00           O  
HETATM    9  C   UNL     1      -2.224  -2.417   1.079  1.00  0.00           C  
HETATM   10  C   UNL     1       0.965  -1.258  -0.451  1.00  0.00           C  
HETATM   11  O   UNL     1       1.333  -0.947  -1.796  1.00  0.00           O  
HETATM   12  C   UNL     1       1.288  -0.067   0.457  1.00  0.00           C  
HETATM   13  S   UNL     1       3.049   0.345   0.315  1.00  0.00           S  
HETATM   14  H   UNL     1       1.604   2.527   0.927  1.00  0.00           H  
HETATM   15  H   UNL     1       0.714   1.423  -0.995  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.317   0.507   1.094  1.00  0.00           H  
HETATM   17  H   UNL     1      -1.645   2.818   0.164  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.668   2.119  -1.473  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.866   2.320  -0.559  1.00  0.00           H  
HETATM   20  H   UNL     1      -0.779  -2.367  -1.061  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.418  -2.669   2.122  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.935  -1.659   0.751  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.334  -3.309   0.463  1.00  0.00           H  
HETATM   24  H   UNL     1       1.520  -2.134  -0.115  1.00  0.00           H  
HETATM   25  H   UNL     1       1.151  -1.656  -2.428  1.00  0.00           H  
HETATM   26  H   UNL     1       1.054  -0.322   1.490  1.00  0.00           H  
HETATM   27  H   UNL     1       3.657  -0.784   0.723  1.00  0.00           H  
CONECT    1    2   14                                                 
CONECT    2    1    3   12   15                                       
CONECT    3    2    4    6   16                                       
CONECT    4    3    5   17   18                                       
CONECT    5    4   19                                                 
CONECT    6    3    7                                                 
CONECT    7    6    8   10   20                                       
CONECT    8    7    9                                                 
CONECT    9    8   21   22   23                                       
CONECT   10    7   11   12   24                                       
CONECT   11   10   25                                                 
CONECT   12    2   10   13   26                                       
CONECT   13   12   27                                                 
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    3                                                      
CONECT   17    4                                                      
CONECT   18    4                                                      
CONECT   19    5                                                      
CONECT   20    7                                                      
CONECT   21    9                                                      
CONECT   22    9                                                      
CONECT   23    9                                                      
CONECT   24   10                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27   13                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
