COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.830  -0.602  -0.099  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.648  -1.453   0.143  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.952  -1.009   0.064  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.217   0.319  -0.217  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.176   1.210  -0.421  1.00  0.00           C  
HETATM    6  C   UNL     1       2.820  -0.765  -0.090  1.00  0.00           C  
HETATM    7  C   UNL     1       3.984  -0.617  -0.130  1.00  0.00           C  
HETATM    8  C   UNL     1       5.404  -0.437  -0.178  1.00  0.00           C  
HETATM    9  C   UNL     1       6.332  -1.418   0.023  1.00  0.00           C  
HETATM   10  O   UNL     1       0.715   1.698   1.795  1.00  0.00           O  
HETATM   11  C   UNL     1       0.851   2.263   0.736  1.00  0.00           C  
HETATM   12  O   UNL     1       1.091   3.584   0.706  1.00  0.00           O  
HETATM   13  C   UNL     1       0.751   1.486  -0.551  1.00  0.00           C  
HETATM   14  C   UNL     1       0.479   0.037  -0.243  1.00  0.00           C  
HETATM   15  C   UNL     1       1.400  -0.945  -0.042  1.00  0.00           C  
HETATM   16  O   UNL     1       0.774  -2.113   0.209  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.566  -1.954   0.191  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.625  -2.831   0.386  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.923  -2.378   0.306  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.192  -1.035   0.028  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.146  -0.147  -0.186  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.596  -0.561  -0.056  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.866   0.775  -0.344  1.00  0.00           C  
HETATM   24  F   UNL     1      -6.442   2.506  -0.696  1.00  0.00           F  
HETATM   25  C   UNL     1       7.638  -0.993  -0.076  1.00  0.00           C  
HETATM   26  C   UNL     1       7.796   0.306  -0.353  1.00  0.00           C  
HETATM   27  S   UNL     1       6.226   1.082  -0.513  1.00  0.00           S  
HETATM   28  H   UNL     1      -5.443  -2.490   0.363  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.767  -1.699   0.221  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.240   0.663  -0.278  1.00  0.00           H  
HETATM   31  H   UNL     1       6.064  -2.441   0.243  1.00  0.00           H  
HETATM   32  H   UNL     1       1.147   4.039   1.557  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.062   1.888  -1.156  1.00  0.00           H  
HETATM   34  H   UNL     1       1.688   1.571  -1.101  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.431  -3.872   0.601  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.741  -3.066   0.460  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.349   0.891  -0.404  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.055   1.468  -0.507  1.00  0.00           H  
HETATM   39  H   UNL     1       8.476  -1.662   0.060  1.00  0.00           H  
HETATM   40  H   UNL     1       8.747   0.804  -0.465  1.00  0.00           H  
CONECT    1   17   14   21   21                                       
CONECT    2   22    3    3   28                                       
CONECT    3    2    2    4   29                                       
CONECT    4    5    5    3   30                                       
CONECT    5   23   24    4    4                                       
CONECT    6    7    7    7   15                                       
CONECT    7    8    6    6    6                                       
CONECT    8    9    9   27    7                                       
CONECT    9   25    8    8   31                                       
CONECT   10   11   11                                                 
CONECT   11   10   10   13   12                                       
CONECT   12   11   32                                                 
CONECT   13   14   11   33   34                                       
CONECT   14   15   15    1   13                                       
CONECT   15    6   16   14   14                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   18    1                                       
CONECT   18   17   17   19   35                                       
CONECT   19   18   20   20   36                                       
CONECT   20   19   19   21   22                                       
CONECT   21    1    1   20   37                                       
CONECT   22   20   23   23    2                                       
CONECT   23   22   22    5   38                                       
CONECT   24    5                                                      
CONECT   25   26   26    9   39                                       
CONECT   26   25   25   27   40                                       
CONECT   27   26    8                                                 
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   13                                                      
CONECT   35   18                                                      
CONECT   36   19                                                      
CONECT   37   21                                                      
CONECT   38   23                                                      
CONECT   39   25                                                      
CONECT   40   26                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
