COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.451  -0.199   0.860  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.735   1.727  -0.018  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.803   0.367   0.628  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.217   0.467   2.053  1.00  0.00           C  
HETATM    5  C   UNL     1       0.162  -1.086   0.370  1.00  0.00           C  
HETATM    6  C   UNL     1       0.307  -2.527  -0.147  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.332  -2.392  -1.551  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.281  -1.223  -1.421  1.00  0.00           C  
HETATM    9  C   UNL     1       1.349  -0.223   0.026  1.00  0.00           C  
HETATM   10  C   UNL     1       1.336   0.543  -1.125  1.00  0.00           C  
HETATM   11  C   UNL     1       2.425   1.334  -1.441  1.00  0.00           C  
HETATM   12  C   UNL     1       3.527   1.358  -0.606  1.00  0.00           C  
HETATM   13  C   UNL     1       3.537   0.597   0.547  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.103  -0.595  -0.230  1.00  0.00           N  
HETATM   15  O   UNL     1      -2.307   2.784   0.580  1.00  0.00           O  
HETATM   16  O   UNL     1      -1.165   1.867  -1.074  1.00  0.00           O  
HETATM   17  O   UNL     1      -2.088  -0.892  -2.263  1.00  0.00           O  
HETATM   18  S   UNL     1      -0.236  -1.090   2.162  1.00  0.00           S  
HETATM   19  H   UNL     1       2.461  -0.797   1.759  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.849   0.071   0.704  1.00  0.00           H  
HETATM   21  H   UNL     1      -0.573   1.342   2.150  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.010   0.482   2.801  1.00  0.00           H  
HETATM   23  H   UNL     1       1.355  -2.817  -0.217  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.252  -3.226   0.475  1.00  0.00           H  
HETATM   25  H   UNL     1       0.433  -2.181  -2.299  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.877  -3.300  -1.810  1.00  0.00           H  
HETATM   27  H   UNL     1       0.475   0.524  -1.777  1.00  0.00           H  
HETATM   28  H   UNL     1       2.415   1.933  -2.339  1.00  0.00           H  
HETATM   29  H   UNL     1       4.378   1.976  -0.854  1.00  0.00           H  
HETATM   30  H   UNL     1       4.398   0.616   1.199  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.237   3.635   0.128  1.00  0.00           H  
CONECT    1   13   13    9   19                                       
CONECT    2   16   16    3   15                                       
CONECT    3    4    2   14   20                                       
CONECT    4   18    3   21   22                                       
CONECT    5   18    9   14    6                                       
CONECT    6    5    7   23   24                                       
CONECT    7    8    6   25   26                                       
CONECT    8   14   17   17    7                                       
CONECT    9   10   10    1    5                                       
CONECT   10   11    9    9   27                                       
CONECT   11   12   12   10   28                                       
CONECT   12   11   11   13   29                                       
CONECT   13   12    1    1   30                                       
CONECT   14    3    5    8                                            
CONECT   15    2   31                                                 
CONECT   16    2    2                                                 
CONECT   17    8    8                                                 
CONECT   18    4    5                                                 
CONECT   19    1                                                      
CONECT   20    3                                                      
CONECT   21    4                                                      
CONECT   22    4                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27   10                                                      
CONECT   28   11                                                      
CONECT   29   12                                                      
CONECT   30   13                                                      
CONECT   31   15                                                      
MASTER        0    0    0    0    0    0    0    0   31    0   31    0
END
