COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.147  -0.807   0.456  1.00  0.00           N  
HETATM    2  C   UNL     1       2.826   1.055   1.246  1.00  0.00           C  
HETATM    3  C   UNL     1       3.603   2.548  -0.958  1.00  0.00           C  
HETATM    4  C   UNL     1       4.067   1.255  -0.805  1.00  0.00           C  
HETATM    5  C   UNL     1       3.678   0.504   0.299  1.00  0.00           C  
HETATM    6  C   UNL     1       1.748  -2.102   0.080  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.476  -1.421  -0.504  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.304  -0.811  -0.380  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.254   1.214   0.485  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.871   0.966   0.407  1.00  0.00           C  
HETATM   11  C   UNL     1       1.749  -2.999  -0.973  1.00  0.00           C  
HETATM   12  C   UNL     1       2.717   5.074  -1.331  1.00  0.00           C  
HETATM   13  O   UNL     1       2.282   4.363  -0.170  1.00  0.00           O  
HETATM   14  C   UNL     1       2.743   3.092  -0.016  1.00  0.00           C  
HETATM   15  C   UNL     1       2.360   2.346   1.088  1.00  0.00           C  
HETATM   16  F   UNL     1       4.904   0.724  -1.722  1.00  0.00           F  
HETATM   17  S   UNL     1       3.165  -1.964   1.119  1.00  0.00           S  
HETATM   18  C   UNL     1       0.641  -1.312   0.315  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.599  -0.622  -0.269  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.834  -1.113  -0.493  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.024  -0.305  -0.149  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.412  -0.049  -0.062  1.00  0.00           C  
HETATM   23  F   UNL     1      -7.652  -0.537  -0.286  1.00  0.00           F  
HETATM   24  C   UNL     1      -4.986   1.721   0.716  1.00  0.00           C  
HETATM   25  F   UNL     1      -4.839   2.953   1.250  1.00  0.00           F  
HETATM   26  O   UNL     1      -2.970  -2.219  -0.977  1.00  0.00           O  
HETATM   27  C   UNL     1      -0.474  -2.326  -1.557  1.00  0.00           C  
HETATM   28  C   UNL     1       0.639  -3.110  -1.790  1.00  0.00           C  
HETATM   29  O   UNL     1       3.865  -3.195   1.009  1.00  0.00           O  
HETATM   30  O   UNL     1       2.705  -1.439   2.357  1.00  0.00           O  
HETATM   31  H   UNL     1       5.046  -1.038   0.174  1.00  0.00           H  
HETATM   32  H   UNL     1       2.523   0.473   2.104  1.00  0.00           H  
HETATM   33  H   UNL     1       3.904   3.132  -1.816  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.428  -1.793  -0.811  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.123   1.808   0.727  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.882   1.362   0.588  1.00  0.00           H  
HETATM   37  H   UNL     1       2.618  -3.612  -1.158  1.00  0.00           H  
HETATM   38  H   UNL     1       3.804   5.155  -1.321  1.00  0.00           H  
HETATM   39  H   UNL     1       2.401   4.537  -2.226  1.00  0.00           H  
HETATM   40  H   UNL     1       2.278   6.071  -1.332  1.00  0.00           H  
HETATM   41  H   UNL     1       1.696   2.774   1.825  1.00  0.00           H  
HETATM   42  H   UNL     1       0.642  -0.609   1.136  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.489   0.285   0.056  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.340  -2.414  -2.196  1.00  0.00           H  
HETATM   45  H   UNL     1       0.641  -3.814  -2.610  1.00  0.00           H  
CONECT    1    5   17   31                                            
CONECT    2   15    5    5   32                                       
CONECT    3   14    4    4   33                                       
CONECT    4    3    3    5   16                                       
CONECT    5    2    2    4    1                                       
CONECT    6   18   18   11   17                                       
CONECT    7   19   27   27   18                                       
CONECT    8   22   22   21   34                                       
CONECT    9   24   24   22   35                                       
CONECT   10   24   21   21   36                                       
CONECT   11   28   28    6   37                                       
CONECT   12   13   38   39   40                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   15    3                                       
CONECT   15   14   14    2   41                                       
CONECT   16    4                                                      
CONECT   17    6   29   29    1                                       
CONECT   17   30   30                                                 
CONECT   18    7    6    6   42                                       
CONECT   19   20    7   43                                            
CONECT   20   21   19   26   26                                       
CONECT   21   10   10    8   20                                       
CONECT   22    9   23    8    8                                       
CONECT   23   22                                                      
CONECT   24   25    9    9   10                                       
CONECT   25   24                                                      
CONECT   26   20   20                                                 
CONECT   27    7    7   28   44                                       
CONECT   28   27   11   11   45                                       
CONECT   29   17   17                                                 
CONECT   30   17   17                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   15                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   27                                                      
CONECT   45   28                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
