COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.758  -1.115   0.641  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.701  -0.797  -0.521  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.227   1.640  -0.239  1.00  0.00           C  
HETATM    4  C   UNL     1       0.345  -0.056   0.707  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.284   1.321   0.923  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.330   0.581  -0.305  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.129  -2.493   0.425  1.00  0.00           C  
HETATM    8  O   UNL     1      -1.147  -3.495   0.479  1.00  0.00           O  
HETATM    9  O   UNL     1       1.081  -0.058  -0.518  1.00  0.00           O  
HETATM   10  O   UNL     1      -1.814   2.927  -0.037  1.00  0.00           O  
HETATM   11  O   UNL     1      -3.211   0.878  -1.390  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.731  -1.786  -0.583  1.00  0.00           O  
HETATM   13  S   UNL     1       2.564   0.237  -0.349  1.00  0.00           S  
HETATM   14  O   UNL     1       3.210  -1.016   0.227  1.00  0.00           O  
HETATM   15  O   UNL     1       3.094   0.395  -1.658  1.00  0.00           O  
HETATM   16  O   UNL     1       2.663   1.237   0.655  1.00  0.00           O  
HETATM   17  H   UNL     1      -1.319  -1.115   1.575  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.140  -0.798  -1.456  1.00  0.00           H  
HETATM   19  H   UNL     1      -0.666   1.639  -1.173  1.00  0.00           H  
HETATM   20  H   UNL     1       1.017  -0.283   1.535  1.00  0.00           H  
HETATM   21  H   UNL     1       0.502   2.076   0.970  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.891   0.582   0.629  1.00  0.00           H  
HETATM   23  H   UNL     1       0.357  -2.522  -0.550  1.00  0.00           H  
HETATM   24  H   UNL     1       0.609  -2.682   1.204  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.819  -4.396   0.350  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.425   3.194  -0.737  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.646   1.738  -1.320  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.367  -1.648  -1.298  1.00  0.00           H  
HETATM   29  O   UNL     1      -1.020   1.323   2.148  1.00  0.00           O  
HETATM   30  H   UNL     1       4.162  -0.935   0.375  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.446   2.167   2.350  1.00  0.00           H  
CONECT    1    2    7    4   17                                       
CONECT    2   12    6    1   18                                       
CONECT    3    6   10    5   19                                       
CONECT    4    1    9    5   20                                       
CONECT    5    3    4   21   29                                       
CONECT    6   11    2    3   22                                       
CONECT    7    1    8   23   24                                       
CONECT    8    7   25                                                 
CONECT    9    4   13                                                 
CONECT   10    3   26                                                 
CONECT   11    6   27                                                 
CONECT   12    2   28                                                 
CONECT   13    9   16   16   15                                       
CONECT   13   15   14                                                 
CONECT   14   13   30                                                 
CONECT   15   13   13                                                 
CONECT   16   13   13                                                 
CONECT   17    1                                                      
CONECT   18    2                                                      
CONECT   19    3                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    7                                                      
CONECT   24    7                                                      
CONECT   25    8                                                      
CONECT   26   10                                                      
CONECT   27   11                                                      
CONECT   28   12                                                      
CONECT   29    5   31                                                 
CONECT   30   14                                                      
CONECT   31   29                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
