COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.514  -0.975   0.244  1.00  0.00           C  
HETATM    2  C   UNL     1       2.864  -0.565   0.153  1.00  0.00           C  
HETATM    3  C   UNL     1       4.360   1.310   0.086  1.00  0.00           C  
HETATM    4  C   UNL     1       5.232  -0.926   0.018  1.00  0.00           C  
HETATM    5  C   UNL     1       5.439   0.446   0.015  1.00  0.00           C  
HETATM    6  C   UNL     1       3.947  -1.432   0.081  1.00  0.00           C  
HETATM    7  C   UNL     1       3.074   0.808   0.155  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.617   2.247  -0.434  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.035  -0.707   0.345  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.253  -0.560  -0.963  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.537   0.674  -0.088  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.273  -0.101   0.386  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.727  -0.783  -0.929  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.173   1.158   0.447  1.00  0.00           C  
HETATM   15  C   UNL     1       0.204   0.291   0.310  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.302   1.630   1.832  1.00  0.00           N  
HETATM   17  O   UNL     1      -6.006  -2.169   0.609  1.00  0.00           O  
HETATM   18  O   UNL     1      -1.954   2.318  -1.592  1.00  0.00           O  
HETATM   19  O   UNL     1      -6.258  -0.114  -0.162  1.00  0.00           O  
HETATM   20  O   UNL     1      -0.748   3.138   0.068  1.00  0.00           O  
HETATM   21  O   UNL     1      -1.426  -2.179  -0.898  1.00  0.00           O  
HETATM   22  F   UNL     1       6.695   0.939  -0.053  1.00  0.00           F  
HETATM   23  F   UNL     1       6.287  -1.768  -0.052  1.00  0.00           F  
HETATM   24  S   UNL     1       1.225  -1.206   0.234  1.00  0.00           S  
HETATM   25  H   UNL     1       4.523   2.377   0.083  1.00  0.00           H  
HETATM   26  H   UNL     1       3.786  -2.500   0.076  1.00  0.00           H  
HETATM   27  H   UNL     1       2.233   1.483   0.210  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.527  -1.184   1.182  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.764  -0.727  -1.911  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.260   1.430  -0.392  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.455  -0.752   1.241  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.253  -0.308  -1.788  1.00  0.00           H  
HETATM   33  H   UNL     1       0.375   0.894  -0.582  1.00  0.00           H  
HETATM   34  H   UNL     1       0.472   0.869   1.195  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.414   1.949   2.190  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.001   2.354   1.903  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.961  -2.294   0.527  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.419   3.818  -0.535  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.480  -2.378  -0.876  1.00  0.00           H  
CONECT    1   19   19   17    9                                       
CONECT    2    7    7    6   24                                       
CONECT    3    5    5    7   25                                       
CONECT    4    5   23    6    6                                       
CONECT    5   22    3    3    4                                       
CONECT    6    4    4    2   26                                       
CONECT    7    3    2    2   27                                       
CONECT    8   14   18   18   20                                       
CONECT    9    1   11   10   28                                       
CONECT   10    9   11   13   29                                       
CONECT   11    9   10   14   30                                       
CONECT   12   14   13   15   31                                       
CONECT   13   21   10   12   32                                       
CONECT   14   16   11   12    8                                       
CONECT   15   12   24   33   34                                       
CONECT   16   14   35   36                                            
CONECT   17    1   37                                                 
CONECT   18    8    8                                                 
CONECT   19    1    1                                                 
CONECT   20    8   38                                                 
CONECT   21   13   39                                                 
CONECT   22    5                                                      
CONECT   23    4                                                      
CONECT   24    2   15                                                 
CONECT   25    3                                                      
CONECT   26    6                                                      
CONECT   27    7                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
