COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -8.406  -1.135   3.489  1.00  0.00           F  
HETATM    2  C   UNL     1      -8.560  -0.864   2.159  1.00  0.00           C  
HETATM    3  F   UNL     1      -9.758  -0.215   2.065  1.00  0.00           F  
HETATM    4  F   UNL     1      -8.752  -2.075   1.559  1.00  0.00           F  
HETATM    5  C   UNL     1      -7.421  -0.105   1.568  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.336   0.258   2.366  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.270   0.969   1.814  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.440   0.243   0.218  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.375   0.953  -0.335  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.294   1.313   0.466  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.173   2.062  -0.115  1.00  0.00           C  
HETATM   12  O   UNL     1      -4.263   3.289  -0.047  1.00  0.00           O  
HETATM   13  N   UNL     1      -3.088   1.369  -0.667  1.00  0.00           N  
HETATM   14  C   UNL     1      -3.010  -0.062  -1.042  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.660  -0.881   0.170  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.563  -1.875   0.353  1.00  0.00           O  
HETATM   17  O   UNL     1      -1.695  -0.687   0.894  1.00  0.00           O  
HETATM   18  C   UNL     1      -4.267  -0.636  -1.703  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.078  -2.065  -2.234  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.937  -2.167  -3.247  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.818  -3.018  -1.065  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.850  -0.130  -2.062  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.962   1.073  -1.759  1.00  0.00           C  
HETATM   24  C   UNL     1       0.162   0.687  -0.840  1.00  0.00           C  
HETATM   25  O   UNL     1       0.951   1.757  -0.573  1.00  0.00           O  
HETATM   26  O   UNL     1       0.346  -0.433  -0.388  1.00  0.00           O  
HETATM   27  C   UNL     1      -1.945   2.121  -1.220  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.321   3.104  -0.244  1.00  0.00           C  
HETATM   29  S   UNL     1      -0.656   4.563  -0.837  1.00  0.00           S  
HETATM   30  C   UNL     1      -1.204   2.991   1.120  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.556   4.123   1.692  1.00  0.00           C  
HETATM   32  C   UNL     1      -0.205   5.055   0.739  1.00  0.00           C  
HETATM   33  H   UNL     1      -6.313  -0.009   3.419  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.281  -0.035  -0.412  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.430   1.245   2.445  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.400   1.218  -1.389  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.348   2.706  -2.058  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.091  -0.603  -0.982  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.541   0.025  -2.532  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.242  -0.018  -3.082  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.307  -1.082  -2.020  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.351  -2.423   1.139  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.004  -2.385  -2.728  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.996  -1.801  -2.822  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.152  -1.587  -4.149  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.786  -3.206  -3.558  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.899  -2.752  -0.532  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.719  -4.050  -1.418  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.646  -2.990  -0.348  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.475   1.438  -2.672  1.00  0.00           H  
HETATM   51  H   UNL     1       1.691   1.526   0.028  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.564   2.141   1.687  1.00  0.00           H  
HETATM   53  H   UNL     1       0.297   6.000   0.895  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.357   4.247   2.748  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    3    4    5                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    2    6    8    8                                       
CONECT    6    5    7    7   33                                       
CONECT    7    6    6   10   35                                       
CONECT    8    5    5    9   34                                       
CONECT    9    8   10   10   36                                       
CONECT   10    7    9    9   11                                       
CONECT   11   10   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   27                                            
CONECT   14   13   15   18   22                                       
CONECT   15   14   16   17   17                                       
CONECT   16   15   42                                                 
CONECT   17   15   15                                                 
CONECT   18   14   19   38   39                                       
CONECT   19   18   20   21   43                                       
CONECT   20   19   44   45   46                                       
CONECT   21   19   47   48   49                                       
CONECT   22   14   23   40   41                                       
CONECT   23   22   24   27   50                                       
CONECT   24   23   25   26   26                                       
CONECT   25   24   51                                                 
CONECT   26   24   24                                                 
CONECT   27   13   23   28   37                                       
CONECT   28   27   29   30   30                                       
CONECT   29   28   32                                                 
CONECT   30   28   28   31   52                                       
CONECT   31   30   32   32   54                                       
CONECT   32   29   31   31   53                                       
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    7                                                      
CONECT   36    9                                                      
CONECT   37   27                                                      
CONECT   38   18                                                      
CONECT   39   18                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   25                                                      
CONECT   52   30                                                      
CONECT   53   32                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
