COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.866  -4.301   2.661  1.00  0.00           N  
HETATM    2  C   UNL     1       6.306  -3.656   1.612  1.00  0.00           C  
HETATM    3  C   UNL     1       0.423   2.171   2.740  1.00  0.00           C  
HETATM    4  C   UNL     1       0.273   3.693   2.711  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.926   1.514   2.608  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.868   0.634   3.115  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.640   0.492   1.778  1.00  0.00           C  
HETATM    8  C   UNL     1       4.386  -0.684  -1.625  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.301  -1.873   0.627  1.00  0.00           C  
HETATM   10 CL   UNL     1       5.189  -0.202  -4.159  1.00  0.00          Cl  
HETATM   11  N   UNL     1       1.280   1.749   1.630  1.00  0.00           N  
HETATM   12  C   UNL     1       1.975   0.598   1.715  1.00  0.00           C  
HETATM   13  C   UNL     1       2.831   0.176   0.606  1.00  0.00           C  
HETATM   14  C   UNL     1       3.527  -0.977   0.691  1.00  0.00           C  
HETATM   15  C   UNL     1       4.387  -1.400  -0.424  1.00  0.00           C  
HETATM   16  C   UNL     1       5.215  -2.527  -0.289  1.00  0.00           C  
HETATM   17  C   UNL     1       6.022  -2.917  -1.346  1.00  0.00           C  
HETATM   18  C   UNL     1       6.011  -2.200  -2.528  1.00  0.00           C  
HETATM   19  C   UNL     1       5.191  -1.092  -2.668  1.00  0.00           C  
HETATM   20  N   UNL     1       5.226  -3.251   0.908  1.00  0.00           N  
HETATM   21  N   UNL     1       4.582  -4.331   2.668  1.00  0.00           N  
HETATM   22  N   UNL     1       4.116  -3.715   1.636  1.00  0.00           N  
HETATM   23  O   UNL     1       1.890  -0.092   2.714  1.00  0.00           O  
HETATM   24  N   UNL     1      -1.784   1.290   3.628  1.00  0.00           N  
HETATM   25  N   UNL     1      -1.461   1.078   1.500  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.526  -0.256   0.855  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.471  -1.121   1.427  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.200  -1.788  -0.756  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.282  -0.926  -1.333  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.447  -0.139  -0.530  1.00  0.00           C  
HETATM   31  N   UNL     1      -6.026  -2.575  -1.567  1.00  0.00           N  
HETATM   32  C   UNL     1      -6.401  -3.803  -1.158  1.00  0.00           C  
HETATM   33  O   UNL     1      -5.946  -4.266  -0.130  1.00  0.00           O  
HETATM   34  O   UNL     1      -7.278  -4.518  -1.887  1.00  0.00           O  
HETATM   35  C   UNL     1      -7.636  -5.833  -1.386  1.00  0.00           C  
HETATM   36  C   UNL     1       0.331   4.165   1.281  1.00  0.00           C  
HETATM   37  N   UNL     1      -0.765   4.124   0.549  1.00  0.00           N  
HETATM   38  C   UNL     1      -0.771   4.510  -0.713  1.00  0.00           C  
HETATM   39  C   UNL     1       0.380   4.989  -1.313  1.00  0.00           C  
HETATM   40  C   UNL     1       1.552   5.049  -0.569  1.00  0.00           C  
HETATM   41  C   UNL     1       1.520   4.626   0.751  1.00  0.00           C  
HETATM   42  C   UNL     1      -2.050   4.409  -1.504  1.00  0.00           C  
HETATM   43  C   UNL     1      -2.157   3.000  -2.088  1.00  0.00           C  
HETATM   44  C   UNL     1      -2.797   2.072  -1.087  1.00  0.00           C  
HETATM   45  N   UNL     1      -2.593   0.739  -1.210  1.00  0.00           N  
HETATM   46  O   UNL     1      -3.482   2.512  -0.187  1.00  0.00           O  
HETATM   47  F   UNL     1       0.364   5.392  -2.602  1.00  0.00           F  
HETATM   48  H   UNL     1       7.341  -3.479   1.356  1.00  0.00           H  
HETATM   49  H   UNL     1       0.880   1.871   3.684  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.685   3.974   3.149  1.00  0.00           H  
HETATM   51  H   UNL     1       1.082   4.151   3.281  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.735   0.295   3.662  1.00  0.00           H  
HETATM   53  H   UNL     1       3.752   0.183  -1.737  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.031  -2.530   1.076  1.00  0.00           H  
HETATM   55  H   UNL     1       1.348   2.299   0.833  1.00  0.00           H  
HETATM   56  H   UNL     1       2.906   0.788  -0.281  1.00  0.00           H  
HETATM   57  H   UNL     1       3.452  -1.589   1.577  1.00  0.00           H  
HETATM   58  H   UNL     1       6.660  -3.782  -1.246  1.00  0.00           H  
HETATM   59  H   UNL     1       6.641  -2.509  -3.348  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.654   1.547   4.554  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.549  -1.196   2.502  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.210  -0.860  -2.408  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.329  -2.236  -2.424  1.00  0.00           H  
HETATM   64  H   UNL     1      -8.087  -5.734  -0.399  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.348  -6.300  -2.066  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.741  -6.451  -1.316  1.00  0.00           H  
HETATM   67  H   UNL     1       2.468   5.417  -1.009  1.00  0.00           H  
HETATM   68  H   UNL     1       2.413   4.656   1.357  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.901   4.599  -0.849  1.00  0.00           H  
HETATM   70  H   UNL     1      -2.039   5.140  -2.312  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.764   3.029  -2.993  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.160   2.633  -2.333  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.868   0.398  -1.758  1.00  0.00           H  
CONECT    1    2    2   21                                            
CONECT    2    1    1   20   48                                       
CONECT    3    4   11    5   49                                       
CONECT    4   36    3   50   51                                       
CONECT    5   24    3   25   25                                       
CONECT    6   24    7    7   52                                       
CONECT    7    6    6   25   26                                       
CONECT    8   15   15   19   53                                       
CONECT    9   27   28   28   54                                       
CONECT   10   19                                                      
CONECT   11    3   12   55                                            
CONECT   12   11   13   23   23                                       
CONECT   13   14   14   12   56                                       
CONECT   14   15   13   13   57                                       
CONECT   15   16   14    8    8                                       
CONECT   16   20   17   17   15                                       
CONECT   17   16   16   18   58                                       
CONECT   18   17   19   19   59                                       
CONECT   19   18   18    8   10                                       
CONECT   20    2   22   16                                            
CONECT   21    1   22   22                                            
CONECT   22   21   21   20                                            
CONECT   23   12   12                                                 
CONECT   24    6    5   60                                            
CONECT   25    5    5    7                                            
CONECT   26    7   27   27   30                                       
CONECT   27   26   26    9   61                                       
CONECT   28    9    9   29   31                                       
CONECT   29   30   30   28   62                                       
CONECT   30   26   45   29   29                                       
CONECT   31   28   32   63                                            
CONECT   32   33   33   31   34                                       
CONECT   33   32   32                                                 
CONECT   34   32   35                                                 
CONECT   35   34   64   65   66                                       
CONECT   36   41    4   37   37                                       
CONECT   37   36   36   38                                            
CONECT   38   39   39   37   42                                       
CONECT   39   40   47   38   38                                       
CONECT   40   41   41   39   67                                       
CONECT   41   40   40   36   68                                       
CONECT   42   38   43   69   70                                       
CONECT   43   42   44   71   72                                       
CONECT   44   46   46   43   45                                       
CONECT   45   44   30   73                                            
CONECT   46   44   44                                                 
CONECT   47   39                                                      
CONECT   48    2                                                      
CONECT   49    3                                                      
CONECT   50    4                                                      
CONECT   51    4                                                      
CONECT   52    6                                                      
CONECT   53    8                                                      
CONECT   54    9                                                      
CONECT   55   11                                                      
CONECT   56   13                                                      
CONECT   57   14                                                      
CONECT   58   17                                                      
CONECT   59   18                                                      
CONECT   60   24                                                      
CONECT   61   27                                                      
CONECT   62   29                                                      
CONECT   63   31                                                      
CONECT   64   35                                                      
CONECT   65   35                                                      
CONECT   66   35                                                      
CONECT   67   40                                                      
CONECT   68   41                                                      
CONECT   69   42                                                      
CONECT   70   42                                                      
CONECT   71   43                                                      
CONECT   72   43                                                      
CONECT   73   45                                                      
MASTER        0    0    0    0    0    0    0    0   73    0   73    0
END
