COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.399  -0.355   1.656  1.00  0.00           C  
HETATM    2  S   UNL     1       2.933  -0.203  -0.091  1.00  0.00           S  
HETATM    3  O   UNL     1       3.578   0.917  -0.683  1.00  0.00           O  
HETATM    4  O   UNL     1       2.947  -1.475  -0.723  1.00  0.00           O  
HETATM    5  C   UNL     1       1.230   0.246  -0.054  1.00  0.00           C  
HETATM    6  C   UNL     1       0.259  -0.732  -0.053  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.088  -0.382  -0.023  1.00  0.00           C  
HETATM    8  S   UNL     1      -2.544  -1.374  -0.014  1.00  0.00           S  
HETATM    9  C   UNL     1      -3.545   0.071   0.028  1.00  0.00           C  
HETATM   10  N   UNL     1      -4.924   0.073   0.053  1.00  0.00           N  
HETATM   11  N   UNL     1      -2.807   1.128   0.032  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.469   0.962   0.006  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.458   1.946   0.004  1.00  0.00           C  
HETATM   14  C   UNL     1       0.865   1.583  -0.019  1.00  0.00           C  
HETATM   15  H   UNL     1       2.787  -1.122   2.130  1.00  0.00           H  
HETATM   16  H   UNL     1       4.451  -0.633   1.728  1.00  0.00           H  
HETATM   17  H   UNL     1       3.241   0.599   2.159  1.00  0.00           H  
HETATM   18  H   UNL     1       0.545  -1.774  -0.075  1.00  0.00           H  
HETATM   19  H   UNL     1      -5.411  -0.766   0.047  1.00  0.00           H  
HETATM   20  H   UNL     1      -5.408   0.914   0.075  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.727   2.992   0.026  1.00  0.00           H  
HETATM   22  H   UNL     1       1.630   2.346  -0.016  1.00  0.00           H  
CONECT    1    2   15   16   17                                       
CONECT    2    4    4    3    3                                       
CONECT    2    5    1                                                 
CONECT    3    2    2                                                 
CONECT    4    2    2                                                 
CONECT    5    6    2   14   14                                       
CONECT    6    7    7    5   18                                       
CONECT    7    8    6    6   12                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   11   11                                       
CONECT   10    9   19   20                                            
CONECT   11    9    9   12                                            
CONECT   12    7   11   13   13                                       
CONECT   13   12   12   14   21                                       
CONECT   14    5    5   13   22                                       
CONECT   15    1                                                      
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    6                                                      
CONECT   19   10                                                      
CONECT   20   10                                                      
CONECT   21   13                                                      
CONECT   22   14                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
