COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.051   1.265  -0.105  1.00  0.00           C  
HETATM    2  N   UNL     1       4.305   0.818  -0.155  1.00  0.00           N  
HETATM    3  C   UNL     1       3.983  -0.472   0.058  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.656   1.290   0.581  1.00  0.00           C  
HETATM    5  F   UNL     1      -4.811  -0.293   1.196  1.00  0.00           F  
HETATM    6  C   UNL     1      -4.137  -0.648   0.022  1.00  0.00           C  
HETATM    7  F   UNL     1      -3.934  -2.032   0.002  1.00  0.00           F  
HETATM    8  F   UNL     1      -4.902  -0.272  -1.087  1.00  0.00           F  
HETATM    9  C   UNL     1      -2.805   0.056  -0.024  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.736  -0.535  -0.673  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.514   0.108  -0.718  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.360   1.348  -0.111  1.00  0.00           C  
HETATM   13  N   UNL     1       0.875   2.001  -0.155  1.00  0.00           N  
HETATM   14  N   UNL     1       3.261   1.712  -0.235  1.00  0.00           N  
HETATM   15  S   UNL     1       5.046  -1.805   0.204  1.00  0.00           S  
HETATM   16  S   UNL     1       2.211  -0.482   0.155  1.00  0.00           S  
HETATM   17  C   UNL     1      -1.438   1.940   0.534  1.00  0.00           C  
HETATM   18  H   UNL     1       5.227   1.104  -0.245  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.493   1.748   1.086  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.856  -1.499  -1.144  1.00  0.00           H  
HETATM   21  H   UNL     1       0.321  -0.354  -1.223  1.00  0.00           H  
HETATM   22  H   UNL     1       0.910   2.968  -0.219  1.00  0.00           H  
HETATM   23  H   UNL     1      -1.322   2.905   1.007  1.00  0.00           H  
CONECT    1   16   13   14   14                                       
CONECT    2    3   14   18                                            
CONECT    3   15   15   16    2                                       
CONECT    4    9    9   17   19                                       
CONECT    5    6                                                      
CONECT    6    7    9    8    5                                       
CONECT    7    6                                                      
CONECT    8    6                                                      
CONECT    9   10    6    4    4                                       
CONECT   10   11   11    9   20                                       
CONECT   11   10   10   12   21                                       
CONECT   12   11   13   17   17                                       
CONECT   13    1   12   22                                            
CONECT   14    2    1    1                                            
CONECT   15    3    3                                                 
CONECT   16    3    1                                                 
CONECT   17   12   12    4   23                                       
CONECT   18    2                                                      
CONECT   19    4                                                      
CONECT   20   10                                                      
CONECT   21   11                                                      
CONECT   22   13                                                      
CONECT   23   17                                                      
MASTER        0    0    0    0    0    0    0    0   23    0   23    0
END
