COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.833  -2.311  -0.510  1.00  0.00           O  
HETATM    2  C   UNL     1       4.674  -1.445  -0.392  1.00  0.00           C  
HETATM    3  N   UNL     1       5.982  -1.773  -0.378  1.00  0.00           N  
HETATM    4  C   UNL     1       6.365  -3.114  -0.400  1.00  0.00           C  
HETATM    5  C   UNL     1       5.633  -4.055  -1.122  1.00  0.00           C  
HETATM    6  C   UNL     1       6.045  -5.372  -1.119  1.00  0.00           C  
HETATM    7  N   UNL     1       7.117  -5.743  -0.444  1.00  0.00           N  
HETATM    8  C   UNL     1       7.836  -4.882   0.252  1.00  0.00           C  
HETATM    9  C   UNL     1       7.494  -3.547   0.294  1.00  0.00           C  
HETATM   10  C   UNL     1       4.257  -0.002  -0.268  1.00  0.00           C  
HETATM   11  C   UNL     1       4.858   0.803  -1.422  1.00  0.00           C  
HETATM   12  C   UNL     1       4.544   2.264  -1.231  1.00  0.00           C  
HETATM   13  C   UNL     1       5.305   3.221  -0.424  1.00  0.00           C  
HETATM   14  C   UNL     1       6.455   3.129   0.363  1.00  0.00           C  
HETATM   15  C   UNL     1       6.926   4.237   1.008  1.00  0.00           C  
HETATM   16  C   UNL     1       6.270   5.455   0.888  1.00  0.00           C  
HETATM   17  C   UNL     1       5.134   5.568   0.118  1.00  0.00           C  
HETATM   18  C   UNL     1       4.637   4.453  -0.549  1.00  0.00           C  
HETATM   19  N   UNL     1       3.553   4.246  -1.373  1.00  0.00           N  
HETATM   20  C   UNL     1       3.517   2.938  -1.774  1.00  0.00           C  
HETATM   21  N   UNL     1       2.796   0.090  -0.317  1.00  0.00           N  
HETATM   22  C   UNL     1       2.072  -0.082   0.807  1.00  0.00           C  
HETATM   23  O   UNL     1       2.632  -0.313   1.861  1.00  0.00           O  
HETATM   24  C   UNL     1       0.602   0.011   0.757  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.153  -0.167   1.924  1.00  0.00           C  
HETATM   26  F   UNL     1       0.464  -0.423   3.098  1.00  0.00           F  
HETATM   27  C   UNL     1      -1.529  -0.079   1.869  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.159   0.186   0.658  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.406   0.361  -0.500  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.043   0.282  -0.454  1.00  0.00           C  
HETATM   31  N   UNL     1      -3.546   0.275   0.603  1.00  0.00           N  
HETATM   32  C   UNL     1      -4.173  -0.950   1.120  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.694  -0.781   1.117  1.00  0.00           C  
HETATM   34  N   UNL     1      -6.150  -0.497  -0.251  1.00  0.00           N  
HETATM   35  C   UNL     1      -5.523   0.727  -0.768  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.002   0.559  -0.765  1.00  0.00           C  
HETATM   37  C   UNL     1      -7.543  -0.408  -0.306  1.00  0.00           C  
HETATM   38  C   UNL     1      -8.298  -0.577   0.848  1.00  0.00           C  
HETATM   39  C   UNL     1      -9.675  -0.488   0.791  1.00  0.00           C  
HETATM   40  C   UNL     1     -10.303  -0.230  -0.415  1.00  0.00           C  
HETATM   41 CL   UNL     1     -12.034  -0.119  -0.483  1.00  0.00          Cl  
HETATM   42  C   UNL     1      -9.554  -0.061  -1.566  1.00  0.00           C  
HETATM   43  C   UNL     1      -8.176  -0.144  -1.514  1.00  0.00           C  
HETATM   44  H   UNL     1       6.656  -1.076  -0.352  1.00  0.00           H  
HETATM   45  H   UNL     1       4.755  -3.758  -1.676  1.00  0.00           H  
HETATM   46  H   UNL     1       5.484  -6.108  -1.675  1.00  0.00           H  
HETATM   47  H   UNL     1       8.706  -5.227   0.791  1.00  0.00           H  
HETATM   48  H   UNL     1       8.090  -2.847   0.861  1.00  0.00           H  
HETATM   49  H   UNL     1       4.615   0.399   0.680  1.00  0.00           H  
HETATM   50  H   UNL     1       5.939   0.663  -1.439  1.00  0.00           H  
HETATM   51  H   UNL     1       4.432   0.460  -2.365  1.00  0.00           H  
HETATM   52  H   UNL     1       6.970   2.185   0.461  1.00  0.00           H  
HETATM   53  H   UNL     1       7.815   4.165   1.617  1.00  0.00           H  
HETATM   54  H   UNL     1       6.655   6.322   1.405  1.00  0.00           H  
HETATM   55  H   UNL     1       4.631   6.520   0.031  1.00  0.00           H  
HETATM   56  H   UNL     1       2.913   4.926  -1.633  1.00  0.00           H  
HETATM   57  H   UNL     1       2.772   2.510  -2.428  1.00  0.00           H  
HETATM   58  H   UNL     1       2.350   0.274  -1.158  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.115  -0.215   2.766  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.901   0.566  -1.438  1.00  0.00           H  
HETATM   61  H   UNL     1       0.536   0.419  -1.355  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.899  -1.794   0.488  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.829  -1.132   2.139  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.162  -1.699   1.473  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.970   0.046   1.771  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.866   0.910  -1.786  1.00  0.00           H  
HETATM   67  H   UNL     1      -5.797   1.571  -0.135  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.533   1.476  -1.121  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.726  -0.268  -1.419  1.00  0.00           H  
HETATM   70  H   UNL     1      -7.808  -0.779   1.789  1.00  0.00           H  
HETATM   71  H   UNL     1     -10.262  -0.619   1.688  1.00  0.00           H  
HETATM   72  H   UNL     1     -10.047   0.140  -2.506  1.00  0.00           H  
HETATM   73  H   UNL     1      -7.592  -0.007  -2.412  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   10                                       
CONECT    3    2    4   44                                            
CONECT    4    5    3    9    9                                       
CONECT    5    6    6    4   45                                       
CONECT    6    5    5    7   46                                       
CONECT    7    6    8    8                                            
CONECT    8    7    7    9   47                                       
CONECT    9    4    4    8   48                                       
CONECT   10    2   21   11   49                                       
CONECT   11   10   12   50   51                                       
CONECT   12   11   20   20   13                                       
CONECT   13   12   18   18   14                                       
CONECT   14   13   15   15   52                                       
CONECT   15   14   14   16   53                                       
CONECT   16   17   17   15   54                                       
CONECT   17   18   16   16   55                                       
CONECT   18   19   13   13   17                                       
CONECT   19   20   18   56                                            
CONECT   20   12   12   19   57                                       
CONECT   21   22   10   58                                            
CONECT   22   23   23   24   21                                       
CONECT   23   22   22                                                 
CONECT   24   30   22   25   25                                       
CONECT   25   24   24   27   26                                       
CONECT   26   25                                                      
CONECT   27   28   28   25   59                                       
CONECT   28   29   31   27   27                                       
CONECT   29   30   30   28   60                                       
CONECT   30   29   29   24   61                                       
CONECT   31   32   28   36                                            
CONECT   32   33   31   62   63                                       
CONECT   33   32   34   64   65                                       
CONECT   34   33   37   35                                            
CONECT   35   34   36   66   67                                       
CONECT   36   31   35   68   69                                       
CONECT   37   38   34   43   43                                       
CONECT   38   39   39   37   70                                       
CONECT   39   38   38   40   71                                       
CONECT   40   41   39   42   42                                       
CONECT   41   40                                                      
CONECT   42   40   40   43   72                                       
CONECT   43   37   37   42   73                                       
CONECT   44    3                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    8                                                      
CONECT   48    9                                                      
CONECT   49   10                                                      
CONECT   50   11                                                      
CONECT   51   11                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   16                                                      
CONECT   55   17                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   27                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   32                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   33                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   36                                                      
CONECT   70   38                                                      
CONECT   71   39                                                      
CONECT   72   42                                                      
CONECT   73   43                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
