COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.377  -0.277  -0.054  1.00  0.00           C  
HETATM    2  C   UNL     1       0.634   0.665  -0.052  1.00  0.00           C  
HETATM    3  C   UNL     1       1.959   0.258  -0.005  1.00  0.00           C  
HETATM    4  C   UNL     1       2.266  -1.094   0.038  1.00  0.00           C  
HETATM    5  C   UNL     1       1.251  -2.032   0.036  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.069  -1.624  -0.010  1.00  0.00           C  
HETATM    7  C   UNL     1       4.296   0.691   0.045  1.00  0.00           C  
HETATM    8  N   UNL     1      -2.564   0.427   1.462  1.00  0.00           N  
HETATM    9  O   UNL     1      -2.065   1.536  -0.685  1.00  0.00           O  
HETATM   10  O   UNL     1      -2.799  -0.852  -0.636  1.00  0.00           O  
HETATM   11  O   UNL     1       2.955   1.182  -0.004  1.00  0.00           O  
HETATM   12  S   UNL     1      -2.061   0.240  -0.105  1.00  0.00           S  
HETATM   13  H   UNL     1       0.392   1.717  -0.086  1.00  0.00           H  
HETATM   14  H   UNL     1       3.297  -1.414   0.074  1.00  0.00           H  
HETATM   15  H   UNL     1       1.490  -3.085   0.070  1.00  0.00           H  
HETATM   16  H   UNL     1      -0.860  -2.359  -0.012  1.00  0.00           H  
HETATM   17  H   UNL     1       4.437   0.107   0.955  1.00  0.00           H  
HETATM   18  H   UNL     1       4.484   0.059  -0.824  1.00  0.00           H  
HETATM   19  H   UNL     1       4.991   1.530   0.041  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.950   0.253   2.192  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.473   0.710   1.649  1.00  0.00           H  
CONECT    1   12    2    2    6                                       
CONECT    2    1    1    3   13                                       
CONECT    3    2   11    4    4                                       
CONECT    4    3    3    5   14                                       
CONECT    5    6    6    4   15                                       
CONECT    6    1    5    5   16                                       
CONECT    7   11   17   18   19                                       
CONECT    8   12   20   21                                            
CONECT    9   12   12                                                 
CONECT   10   12   12                                                 
CONECT   11    7    3                                                 
CONECT   12    8   10   10    9                                       
CONECT   12    9    1                                                 
CONECT   13    2                                                      
CONECT   14    4                                                      
CONECT   15    5                                                      
CONECT   16    6                                                      
CONECT   17    7                                                      
CONECT   18    7                                                      
CONECT   19    7                                                      
CONECT   20    8                                                      
CONECT   21    8                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
