COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.927  -0.086   1.745  1.00  0.00           C  
HETATM    2  C   UNL     1       2.619   0.354   1.682  1.00  0.00           C  
HETATM    3  C   UNL     1       1.839   0.053   0.574  1.00  0.00           C  
HETATM    4  C   UNL     1       2.373  -0.690  -0.470  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.480   0.616  -0.871  1.00  0.00           C  
HETATM    6  C   UNL     1       0.091   2.508  -0.785  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.737   0.768   1.503  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.284  -2.595  -1.106  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.619  -2.618  -0.218  1.00  0.00           C  
HETATM   10  C   UNL     1       6.235  -2.012  -0.350  1.00  0.00           C  
HETATM   11  C   UNL     1       3.681  -1.130  -0.405  1.00  0.00           C  
HETATM   12  C   UNL     1       4.462  -0.824   0.700  1.00  0.00           C  
HETATM   13  N   UNL     1       0.512   0.499   0.510  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.030   1.006  -0.754  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.854  -0.662  -0.661  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.233  -1.076  -0.932  1.00  0.00           C  
HETATM   17  C   UNL     1       0.689   3.194   0.260  1.00  0.00           C  
HETATM   18  N   UNL     1       0.782   4.512   0.195  1.00  0.00           N  
HETATM   19  C   UNL     1       0.315   5.172  -0.846  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.260   4.553  -1.857  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.388   3.236  -1.862  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.266   0.462   1.610  1.00  0.00           C  
HETATM   23  F   UNL     1      -2.294   0.837   2.784  1.00  0.00           F  
HETATM   24  C   UNL     1       0.756   0.407  -1.922  1.00  0.00           C  
HETATM   25  O   UNL     1       0.219   0.182   2.686  1.00  0.00           O  
HETATM   26  O   UNL     1      -2.312   1.452  -1.153  1.00  0.00           O  
HETATM   27  C   UNL     1      -4.724  -3.027  -1.389  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.568  -1.099  -0.044  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.128  -0.666   0.239  1.00  0.00           C  
HETATM   30  F   UNL     1      -6.936  -3.013  -0.477  1.00  0.00           F  
HETATM   31  F   UNL     1      -5.168  -3.237   0.953  1.00  0.00           F  
HETATM   32  O   UNL     1       5.749  -1.258   0.762  1.00  0.00           O  
HETATM   33  F   UNL     1       7.566  -2.375  -0.121  1.00  0.00           F  
HETATM   34  F   UNL     1       5.457  -3.165  -0.507  1.00  0.00           F  
HETATM   35  F   UNL     1       6.156  -1.235  -1.510  1.00  0.00           F  
HETATM   36  H   UNL     1       4.534   0.147   2.607  1.00  0.00           H  
HETATM   37  H   UNL     1       2.204   0.932   2.495  1.00  0.00           H  
HETATM   38  H   UNL     1       1.766  -0.925  -1.332  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.232  -0.019   0.933  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.646  -2.887  -1.941  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.932  -3.077  -0.194  1.00  0.00           H  
HETATM   42  H   UNL     1       4.096  -1.709  -1.217  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.209  -1.307  -0.331  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.584  -0.594  -1.844  1.00  0.00           H  
HETATM   45  H   UNL     1       1.074   2.660   1.116  1.00  0.00           H  
HETATM   46  H   UNL     1       0.405   6.248  -0.870  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.856   2.735  -2.697  1.00  0.00           H  
HETATM   48  H   UNL     1       0.567   0.990  -2.824  1.00  0.00           H  
HETATM   49  H   UNL     1       1.821   0.428  -1.693  1.00  0.00           H  
HETATM   50  H   UNL     1       0.438  -0.623  -2.083  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.076  -2.545  -2.301  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.761  -4.110  -1.513  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.919  -0.616  -0.956  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.206  -0.807   0.790  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.776  -1.148   1.151  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.091   0.416   0.363  1.00  0.00           H  
HETATM   57 CL   UNL     1      -1.963   2.348   0.664  1.00  0.00          Cl  
CONECT    1   12   12    2   36                                       
CONECT    2    1    3    3   37                                       
CONECT    3    2    2    4   13                                       
CONECT    4   11   11    3   38                                       
CONECT    5   26   26   15   14                                       
CONECT    6   14   17   17   21                                       
CONECT    7   22   23   39   57                                       
CONECT    8   27   16   40   41                                       
CONECT    9   30   28   31   27                                       
CONECT   10   33   34   35   32                                       
CONECT   11   12    4    4   42                                       
CONECT   12   32    1    1   11                                       
CONECT   13    3   14   22                                            
CONECT   14    5   13   24    6                                       
CONECT   15   16    5   43                                            
CONECT   16   29    8   15   44                                       
CONECT   17    6    6   18   45                                       
CONECT   18   17   19   19                                            
CONECT   19   18   18   20   46                                       
CONECT   20   21   21   19                                            
CONECT   21    6   20   20   47                                       
CONECT   22   13    7   25   25                                       
CONECT   23    7                                                      
CONECT   24   14   48   49   50                                       
CONECT   25   22   22                                                 
CONECT   26    5    5                                                 
CONECT   27    9    8   51   52                                       
CONECT   28    9   29   53   54                                       
CONECT   29   28   16   55   56                                       
CONECT   30    9                                                      
CONECT   31    9                                                      
CONECT   32   10   12                                                 
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    4                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42   11                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   24                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57    7                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
