COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       0.016   0.217  -2.441  1.00  0.00           O  
HETATM    2  S   UNL     1      -0.100   0.636  -1.089  1.00  0.00           S  
HETATM    3  O   UNL     1      -0.610   1.907  -0.710  1.00  0.00           O  
HETATM    4  N   UNL     1      -1.046  -0.492  -0.329  1.00  0.00           N  
HETATM    5  C   UNL     1      -1.781  -0.132   0.886  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.186   0.273   0.520  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.537   0.263  -0.636  1.00  0.00           O  
HETATM    8  N   UNL     1      -4.052   0.647   1.484  1.00  0.00           N  
HETATM    9  O   UNL     1      -5.187   0.975   1.189  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.146  -1.849  -0.872  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.135  -2.756  -0.168  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.483  -2.875   1.213  1.00  0.00           O  
HETATM   13  C   UNL     1       1.513   0.519  -0.391  1.00  0.00           C  
HETATM   14  C   UNL     1       2.446  -0.337  -0.947  1.00  0.00           C  
HETATM   15  C   UNL     1       3.712  -0.430  -0.400  1.00  0.00           C  
HETATM   16  C   UNL     1       4.046   0.335   0.704  1.00  0.00           C  
HETATM   17  F   UNL     1       5.284   0.245   1.239  1.00  0.00           F  
HETATM   18  C   UNL     1       3.112   1.192   1.260  1.00  0.00           C  
HETATM   19  C   UNL     1       1.848   1.287   0.708  1.00  0.00           C  
HETATM   20  H   UNL     1      -1.814  -0.990   1.558  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.281   0.699   1.381  1.00  0.00           H  
HETATM   22  H   UNL     1      -2.153  -2.232  -0.709  1.00  0.00           H  
HETATM   23  H   UNL     1      -0.933  -1.829  -1.941  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.147  -3.742  -0.631  1.00  0.00           H  
HETATM   25  H   UNL     1       0.862  -2.325  -0.255  1.00  0.00           H  
HETATM   26  H   UNL     1       0.116  -3.437   1.723  1.00  0.00           H  
HETATM   27  H   UNL     1       2.185  -0.933  -1.809  1.00  0.00           H  
HETATM   28  H   UNL     1       4.440  -1.099  -0.835  1.00  0.00           H  
HETATM   29  H   UNL     1       3.371   1.789   2.122  1.00  0.00           H  
HETATM   30  H   UNL     1       1.120   1.959   1.139  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    3                                       
CONECT    2    4   13                                                 
CONECT    3    2    2                                                 
CONECT    4    2    5   10                                            
CONECT    5    4    6   20   21                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6    9    9                                            
CONECT    9    8    8                                                 
CONECT   10    4   11   22   23                                       
CONECT   11   10   12   24   25                                       
CONECT   12   11   26                                                 
CONECT   13    2   14   14   19                                       
CONECT   14   13   13   15   27                                       
CONECT   15   14   16   16   28                                       
CONECT   16   15   15   17   18                                       
CONECT   17   16                                                      
CONECT   18   16   19   19   29                                       
CONECT   19   13   18   18   30                                       
CONECT   20    5                                                      
CONECT   21    5                                                      
CONECT   22   10                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27   14                                                      
CONECT   28   15                                                      
CONECT   29   18                                                      
CONECT   30   19                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
