COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       9.466  62.156   1.543  1.00  0.00           F  
HETATM    2  C   UNL     1       8.629  61.683   2.462  1.00  0.00           C  
HETATM    3  C   UNL     1       8.222  60.356   2.423  1.00  0.00           C  
HETATM    4  C   UNL     1       7.374  59.827   3.400  1.00  0.00           C  
HETATM    5  N   UNL     1       6.912  58.507   3.349  1.00  0.00           N  
HETATM    6  C   UNL     1       7.380  57.542   4.175  1.00  0.00           C  
HETATM    7  C   UNL     1       6.899  56.255   4.118  1.00  0.00           C  
HETATM    8  C   UNL     1       5.912  55.917   3.205  1.00  0.00           C  
HETATM    9  C   UNL     1       5.441  56.915   2.361  1.00  0.00           C  
HETATM   10  C   UNL     1       5.961  58.202   2.436  1.00  0.00           C  
HETATM   11  O   UNL     1       5.527  59.122   1.669  1.00  0.00           O  
HETATM   12  C   UNL     1       6.928  60.693   4.408  1.00  0.00           C  
HETATM   13  C   UNL     1       7.358  62.029   4.431  1.00  0.00           C  
HETATM   14  C   UNL     1       8.204  62.539   3.444  1.00  0.00           C  
HETATM   15  N   UNL     1       8.604  63.885   3.395  1.00  0.00           N  
HETATM   16  C   UNL     1       8.186  64.622   2.322  1.00  0.00           C  
HETATM   17  O   UNL     1       7.499  64.137   1.405  1.00  0.00           O  
HETATM   18  C   UNL     1       8.545  66.084   2.228  1.00  0.00           C  
HETATM   19  N   UNL     1       9.490  66.422   3.286  1.00  0.00           N  
HETATM   20  C   UNL     1       9.578  67.877   3.558  1.00  0.00           C  
HETATM   21  C   UNL     1      10.937  67.987   4.249  1.00  0.00           C  
HETATM   22  O   UNL     1      11.586  69.228   3.932  1.00  0.00           O  
HETATM   23  C   UNL     1      10.825  65.964   2.895  1.00  0.00           C  
HETATM   24  C   UNL     1      11.781  66.870   3.642  1.00  0.00           C  
HETATM   25  N   UNL     1      12.490  66.169   4.727  1.00  0.00           N  
HETATM   26  C   UNL     1      13.472  65.316   4.451  1.00  0.00           C  
HETATM   27  O   UNL     1      13.801  65.036   3.291  1.00  0.00           O  
HETATM   28  C   UNL     1      14.207  64.685   5.592  1.00  0.00           C  
HETATM   29  C   UNL     1      14.163  64.964   6.975  1.00  0.00           C  
HETATM   30  C   UNL     1      15.034  64.124   7.674  1.00  0.00           C  
HETATM   31  S   UNL     1      15.307  63.428   5.133  1.00  0.00           S  
HETATM   32  C   UNL     1      15.694  63.296   6.800  1.00  0.00           C  
HETATM   33 CL   UNL     1      16.901  62.040   7.264  1.00  0.00          Cl  
HETATM   34  H   UNL     1       8.568  59.720   1.622  1.00  0.00           H  
HETATM   35  H   UNL     1       6.252  60.332   5.169  1.00  0.00           H  
HETATM   36  H   UNL     1       8.147  57.788   4.894  1.00  0.00           H  
HETATM   37  H   UNL     1       7.292  55.504   4.787  1.00  0.00           H  
HETATM   38  H   UNL     1       5.522  54.911   3.152  1.00  0.00           H  
HETATM   39  H   UNL     1       4.667  56.690   1.643  1.00  0.00           H  
HETATM   40  H   UNL     1       7.027  62.677   5.229  1.00  0.00           H  
HETATM   41  H   UNL     1       9.170  64.287   4.115  1.00  0.00           H  
HETATM   42  H   UNL     1       9.003  66.287   1.249  1.00  0.00           H  
HETATM   43  H   UNL     1       7.636  66.693   2.341  1.00  0.00           H  
HETATM   44  H   UNL     1      10.979  64.911   3.175  1.00  0.00           H  
HETATM   45  H   UNL     1      10.976  66.013   1.806  1.00  0.00           H  
HETATM   46  H   UNL     1       9.534  68.474   2.635  1.00  0.00           H  
HETATM   47  H   UNL     1       8.744  68.265   4.161  1.00  0.00           H  
HETATM   48  H   UNL     1      12.546  67.242   2.945  1.00  0.00           H  
HETATM   49  H   UNL     1      10.819  67.925   5.341  1.00  0.00           H  
HETATM   50  H   UNL     1      11.729  69.724   4.730  1.00  0.00           H  
HETATM   51  H   UNL     1      12.231  66.336   5.678  1.00  0.00           H  
HETATM   52  H   UNL     1      13.542  65.722   7.430  1.00  0.00           H  
HETATM   53  H   UNL     1      15.168  64.126   8.746  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3   14   14                                       
CONECT    3    2    4    4   34                                       
CONECT    4    3    3    5   12                                       
CONECT    5    4    6   10                                            
CONECT    6    5    7    7   36                                       
CONECT    7    6    6    8   37                                       
CONECT    8    7    9    9   38                                       
CONECT    9    8    8   10   39                                       
CONECT   10    5    9   11   11                                       
CONECT   11   10   10                                                 
CONECT   12    4   13   13   35                                       
CONECT   13   12   12   14   40                                       
CONECT   14    2    2   13   15                                       
CONECT   15   14   16   41                                            
CONECT   16   15   17   17   18                                       
CONECT   17   16   16                                                 
CONECT   18   16   19   42   43                                       
CONECT   19   18   23   20                                            
CONECT   20   19   21   46   47                                       
CONECT   21   20   22   24   49                                       
CONECT   22   21   50                                                 
CONECT   23   19   24   44   45                                       
CONECT   24   23   21   25   48                                       
CONECT   25   26   24   51                                            
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   26   29   29   31                                       
CONECT   29   28   28   30   52                                       
CONECT   30   29   32   32   53                                       
CONECT   31   28   32                                                 
CONECT   32   30   30   31   33                                       
CONECT   33   32                                                      
CONECT   34    3                                                      
CONECT   35   12                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   24                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   25                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
