COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1       1.779   0.169   2.251  1.00  0.00           N  
HETATM    2  C   UNK     1       0.347   0.481   2.351  1.00  0.00           C  
HETATM    3  C   UNK     1      -0.172   0.032   3.692  1.00  0.00           C  
HETATM    4  O   UNK     1       0.329  -0.916   4.247  1.00  0.00           O  
HETATM    5  C   UNK     1      -0.412  -0.245   1.240  1.00  0.00           C  
HETATM    6  C   UNK     1       0.114   0.211  -0.121  1.00  0.00           C  
HETATM    7  S   UNK     1      -0.786  -0.650  -1.438  1.00  0.00           S  
HETATM    8  C   UNK     1       0.024   0.065  -2.895  1.00  0.00           C  
HETATM    9  O   UNK     1      -1.192   0.685   4.271  1.00  0.00           O  
HETATM   10  F   UNK     1      -0.536  -0.479  -4.055  1.00  0.00           F  
HETATM   11  F   UNK     1      -0.158   1.452  -2.895  1.00  0.00           F  
HETATM   12  F   UNK     1       1.392  -0.225  -2.857  1.00  0.00           F  
HETATM   13  H   UNK     1       2.058   0.390   1.307  1.00  0.00           H  
HETATM   14  H   UNK     1       1.865  -0.831   2.352  1.00  0.00           H  
HETATM   15  H   UNK     1       0.202   1.557   2.247  1.00  0.00           H  
HETATM   16  H   UNK     1      -0.267  -1.320   1.344  1.00  0.00           H  
HETATM   17  H   UNK     1      -1.475  -0.013   1.315  1.00  0.00           H  
HETATM   18  H   UNK     1      -0.030   1.286  -0.225  1.00  0.00           H  
HETATM   19  H   UNK     1       1.177  -0.020  -0.195  1.00  0.00           H  
HETATM   20  H   UNK     1      -1.525   0.397   5.131  1.00  0.00           H  
CONECT    1    2   13   14                                            
CONECT    2    1    3    5   15                                       
CONECT    3    2    4    4    9                                       
CONECT    4    3    3                                                 
CONECT    5    2    6   16   17                                       
CONECT    6    5    7   18   19                                       
CONECT    7    6    8                                                 
CONECT    8    7   10   11   12                                       
CONECT    9    3   20                                                 
CONECT   10    8                                                      
CONECT   11    8                                                      
CONECT   12    8                                                      
CONECT   13    1                                                      
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    5                                                      
CONECT   17    5                                                      
CONECT   18    6                                                      
CONECT   19    6                                                      
CONECT   20    9                                                      
MASTER        0    0    0    0    0    0    0    0   20    0   20    0
END
