COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       2.548  -1.564  -0.958  1.00  0.00           F  
HETATM    2  C   UNL     1       2.993  -0.504  -0.248  1.00  0.00           C  
HETATM    3  C   UNL     1       4.361  -0.350  -0.002  1.00  0.00           C  
HETATM    4  C   UNL     1       5.324  -1.342  -0.517  1.00  0.00           C  
HETATM    5  N   UNL     1       5.656  -2.412   0.233  1.00  0.00           N  
HETATM    6  O   UNL     1       5.818  -1.196  -1.618  1.00  0.00           O  
HETATM    7  C   UNL     1       2.096   0.436   0.235  1.00  0.00           C  
HETATM    8  C   UNL     1       2.555   1.524   0.964  1.00  0.00           C  
HETATM    9  C   UNL     1       3.906   1.677   1.214  1.00  0.00           C  
HETATM   10  C   UNL     1       4.812   0.751   0.735  1.00  0.00           C  
HETATM   11  F   UNL     1       6.132   0.904   0.982  1.00  0.00           F  
HETATM   12  O   UNL     1       0.766   0.293  -0.007  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.101   1.299   0.520  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.527   0.975   0.154  1.00  0.00           C  
HETATM   15  S   UNL     1      -2.335   1.519  -1.309  1.00  0.00           S  
HETATM   16  C   UNL     1      -3.809   0.682  -0.823  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.569   0.059   0.409  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.318   0.261   0.864  1.00  0.00           N  
HETATM   19  N   UNL     1      -4.993   0.584  -1.422  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.988  -0.094  -0.898  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.838  -0.748   0.330  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.619  -0.676   0.996  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.928  -1.484   0.895  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.822  -2.088   1.358  1.00  0.00           C  
HETATM   25  H   UNL     1       5.262  -2.529   1.112  1.00  0.00           H  
HETATM   26  H   UNL     1       6.289  -3.064  -0.105  1.00  0.00           H  
HETATM   27  H   UNL     1       1.853   2.255   1.337  1.00  0.00           H  
HETATM   28  H   UNL     1       4.255   2.527   1.782  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.003   1.332   1.605  1.00  0.00           H  
HETATM   30  H   UNL     1       0.170   2.268   0.100  1.00  0.00           H  
HETATM   31  H   UNL     1      -6.932  -0.147  -1.420  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.480  -1.173   1.944  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.622  -2.628   1.772  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    7    7    1    3                                       
CONECT    3    2   10   10    4                                       
CONECT    4    5    3    6    6                                       
CONECT    5    4   25   26                                            
CONECT    6    4    4                                                 
CONECT    7   12    8    2    2                                       
CONECT    8    7    9    9   27                                       
CONECT    9    8    8   10   28                                       
CONECT   10    9    3    3   11                                       
CONECT   11   10                                                      
CONECT   12   13    7                                                 
CONECT   13   14   12   29   30                                       
CONECT   14   18   18   13   15                                       
CONECT   15   14   16                                                 
CONECT   16   17   17   19   15                                       
CONECT   17   22   18   16   16                                       
CONECT   18   17   14   14                                            
CONECT   19   20   20   16                                            
CONECT   20   21   19   19   31                                       
CONECT   21   23   22   22   20                                       
CONECT   22   21   21   17   32                                       
CONECT   23   24   24   24   21                                       
CONECT   24   23   23   23   33                                       
CONECT   25    5                                                      
CONECT   26    5                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   13                                                      
CONECT   30   13                                                      
CONECT   31   20                                                      
CONECT   32   22                                                      
CONECT   33   24                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
