COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1      -3.355   2.901   0.618  1.00  0.00           F  
HETATM    2  C   UNL     1      -2.132   2.399   0.337  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.006   1.339  -0.545  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.232   0.746  -1.190  1.00  0.00           C  
HETATM    5  N   UNL     1      -2.836  -0.350  -2.071  1.00  0.00           N  
HETATM    6  C   UNL     1      -2.953  -1.593  -1.751  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.536  -2.536  -2.657  1.00  0.00           N  
HETATM    8  O   UNL     1      -3.461  -2.019  -0.580  1.00  0.00           O  
HETATM    9  C   UNL     1      -3.569  -1.062   0.479  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.476  -1.611   1.582  1.00  0.00           C  
HETATM   11  F   UNL     1      -4.486  -0.722   2.662  1.00  0.00           F  
HETATM   12  F   UNL     1      -5.776  -1.757   1.087  1.00  0.00           F  
HETATM   13  C   UNL     1      -3.950  -2.971   2.045  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.177   0.222  -0.104  1.00  0.00           C  
HETATM   15  F   UNL     1      -5.428  -0.058  -0.662  1.00  0.00           F  
HETATM   16  C   UNL     1      -3.947   1.823  -2.009  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.007   2.950   0.926  1.00  0.00           C  
HETATM   18  C   UNL     1       0.244   2.439   0.640  1.00  0.00           C  
HETATM   19  C   UNL     1       0.373   1.372  -0.240  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.757   0.825  -0.834  1.00  0.00           C  
HETATM   21  N   UNL     1       1.639   0.853  -0.531  1.00  0.00           N  
HETATM   22  C   UNL     1       2.600   0.849   0.414  1.00  0.00           C  
HETATM   23  O   UNL     1       2.340   1.207   1.546  1.00  0.00           O  
HETATM   24  C   UNL     1       3.970   0.409   0.074  1.00  0.00           C  
HETATM   25  C   UNL     1       4.964   0.404   1.051  1.00  0.00           C  
HETATM   26  N   UNL     1       6.187   0.011   0.745  1.00  0.00           N  
HETATM   27  C   UNL     1       6.469  -0.379  -0.490  1.00  0.00           C  
HETATM   28  C   UNL     1       5.474  -0.375  -1.469  1.00  0.00           C  
HETATM   29  N   UNL     1       4.254   0.011  -1.166  1.00  0.00           N  
HETATM   30  O   UNL     1       7.725  -0.782  -0.803  1.00  0.00           O  
HETATM   31  C   UNL     1       8.693  -0.760   0.248  1.00  0.00           C  
HETATM   32  F   UNL     1       8.465  -1.834   1.115  1.00  0.00           F  
HETATM   33  H   UNL     1      -2.165  -2.259  -3.510  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.611  -3.480  -2.445  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.580  -0.850   0.886  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.942  -3.663   1.203  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.937  -2.856   2.431  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.596  -3.362   2.831  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.283   0.969   0.683  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.276   2.199  -2.780  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.834   1.395  -2.476  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.242   2.642  -1.352  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.107   3.780   1.610  1.00  0.00           H  
HETATM   44  H   UNL     1       1.122   2.869   1.100  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.659  -0.002  -1.522  1.00  0.00           H  
HETATM   46  H   UNL     1       1.825   0.496  -1.414  1.00  0.00           H  
HETATM   47  H   UNL     1       4.734   0.722   2.057  1.00  0.00           H  
HETATM   48  H   UNL     1       5.705  -0.693  -2.475  1.00  0.00           H  
HETATM   49  H   UNL     1       9.693  -0.843  -0.178  1.00  0.00           H  
HETATM   50  H   UNL     1       8.610   0.176   0.800  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1   17   17    3                                       
CONECT    3    2    4   20   20                                       
CONECT    4   14   16    3    5                                       
CONECT    5    4    6    6                                            
CONECT    6    8    5    5    7                                       
CONECT    7    6   33   34                                            
CONECT    8    9    6                                                 
CONECT    9   10   14    8   35                                       
CONECT   10   11   13   12    9                                       
CONECT   11   10                                                      
CONECT   12   10                                                      
CONECT   13   10   36   37   38                                       
CONECT   14   15    9    4   39                                       
CONECT   15   14                                                      
CONECT   16    4   40   41   42                                       
CONECT   17    2    2   18   43                                       
CONECT   18   17   19   19   44                                       
CONECT   19   18   18   20   21                                       
CONECT   20    3    3   19   45                                       
CONECT   21   19   22   46                                            
CONECT   22   21   23   23   24                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   25   29                                       
CONECT   25   24   24   26   47                                       
CONECT   26   25   27   27                                            
CONECT   27   26   26   28   30                                       
CONECT   28   29   29   27   48                                       
CONECT   29   24   28   28                                            
CONECT   30   27   31                                                 
CONECT   31   30   32   49   50                                       
CONECT   32   31                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   25                                                      
CONECT   48   28                                                      
CONECT   49   31                                                      
CONECT   50   31                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
