COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.786   0.562   0.145  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.135   0.647  -0.573  1.00  0.00           C  
HETATM    3  C   UNL     1       0.022  -0.103   0.092  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.339  -0.901   0.218  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.961  -0.972   0.883  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.517   1.329   0.024  1.00  0.00           C  
HETATM    7  O   UNL     1      -1.814   1.321  -0.577  1.00  0.00           O  
HETATM    8  O   UNL     1      -2.260  -1.443  -1.102  1.00  0.00           O  
HETATM    9  O   UNL     1      -0.607   1.868   1.344  1.00  0.00           O  
HETATM   10  O   UNL     1      -0.503  -2.326   0.890  1.00  0.00           O  
HETATM   11  S   UNL     1       2.478  -0.055  -0.208  1.00  0.00           S  
HETATM   12  O   UNL     1       3.639  -0.265   0.584  1.00  0.00           O  
HETATM   13  O   UNL     1       2.571   1.369  -0.738  1.00  0.00           O  
HETATM   14  O   UNL     1       2.135  -0.874  -1.317  1.00  0.00           O  
HETATM   15  O   UNL     1       1.293  -0.104   0.745  1.00  0.00           O  
HETATM   16  H   UNL     1      -2.885   0.962   1.153  1.00  0.00           H  
HETATM   17  H   UNL     1      -4.876   0.068  -0.023  1.00  0.00           H  
HETATM   18  H   UNL     1      -4.453   1.689  -0.625  1.00  0.00           H  
HETATM   19  H   UNL     1      -4.036   0.246  -1.582  1.00  0.00           H  
HETATM   20  H   UNL     1       0.129  -0.500  -0.917  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.058  -1.473   0.804  1.00  0.00           H  
HETATM   22  H   UNL     1      -1.031  -0.605   1.907  1.00  0.00           H  
HETATM   23  H   UNL     1       0.157   1.943  -0.574  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.098  -1.425  -1.585  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.942   2.774   1.377  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.078  -2.934   1.374  1.00  0.00           H  
HETATM   27  H   UNL     1       3.299   1.511  -1.359  1.00  0.00           H  
CONECT    1    4    7    2   16                                       
CONECT    2    1   17   18   19                                       
CONECT    3   15    5    6   20                                       
CONECT    4    5    1    8   21                                       
CONECT    5   10    3    4   22                                       
CONECT    6    9    3    7   23                                       
CONECT    7    6    1                                                 
CONECT    8    4   24                                                 
CONECT    9    6   25                                                 
CONECT   10    5   26                                                 
CONECT   11   14   14   15   12                                       
CONECT   11   12   13                                                 
CONECT   12   11   11                                                 
CONECT   13   11   27                                                 
CONECT   14   11   11                                                 
CONECT   15   11    3                                                 
CONECT   16    1                                                      
CONECT   17    2                                                      
CONECT   18    2                                                      
CONECT   19    2                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    8                                                      
CONECT   25    9                                                      
CONECT   26   10                                                      
CONECT   27   13                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
