COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.875   2.169   0.001  1.00  0.00           C  
HETATM    2  O   UNL     1      -1.595  -1.800   0.000  1.00  0.00           O  
HETATM    3  C   UNL     1      -1.181  -0.657   0.000  1.00  0.00           C  
HETATM    4  O   UNL     1      -2.049   0.374   0.001  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.463   0.045   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.286   1.335   0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       0.268  -0.399   0.001  1.00  0.00           C  
HETATM    8  C   UNL     1       1.194  -1.385   0.001  1.00  0.00           C  
HETATM    9  S   UNL     1       2.751  -0.678   0.000  1.00  0.00           S  
HETATM   10  C   UNL     1       2.076   0.891   0.001  1.00  0.00           C  
HETATM   11  N   UNL     1       0.791   0.830  -0.004  1.00  0.00           N  
HETATM   12  H   UNL     1       3.939   1.932   0.001  1.00  0.00           H  
HETATM   13  H   UNL     1       2.632   2.750  -0.888  1.00  0.00           H  
HETATM   14  H   UNL     1       2.631   2.749   0.891  1.00  0.00           H  
HETATM   15  H   UNL     1      -3.700  -0.537  -0.890  1.00  0.00           H  
HETATM   16  H   UNL     1      -3.701  -0.538   0.890  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.049   1.917   0.891  1.00  0.00           H  
HETATM   18  H   UNL     1      -4.049   1.918  -0.889  1.00  0.00           H  
HETATM   19  H   UNL     1      -5.348   1.088   0.000  1.00  0.00           H  
HETATM   20  H   UNL     1       0.985  -2.444   0.001  1.00  0.00           H  
CONECT    1   10   12   13   14                                       
CONECT    2    3    3                                                 
CONECT    3    7    4    2    2                                       
CONECT    4    5    3                                                 
CONECT    5    4    6   15   16                                       
CONECT    6    5   17   18   19                                       
CONECT    7   11    8    8    3                                       
CONECT    8    9    7    7   20                                       
CONECT    9   10    8                                                 
CONECT   10    1    9   11   11                                       
CONECT   11   10   10    7                                            
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    1                                                      
CONECT   15    5                                                      
CONECT   16    5                                                      
CONECT   17    6                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    8                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
