COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.540   4.287  -0.676  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.259   3.133  -0.068  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.379   0.678   0.102  1.00  0.00           C  
HETATM    4  C   UNL     1       0.785  -0.383   0.170  1.00  0.00           C  
HETATM    5  C   UNL     1       6.377  -0.197   1.093  1.00  0.00           C  
HETATM    6  C   UNL     1       7.161  -1.116   0.421  1.00  0.00           C  
HETATM    7  C   UNL     1       6.570  -2.129  -0.311  1.00  0.00           C  
HETATM    8 CL   UNL     1       4.453  -3.501  -1.293  1.00  0.00          Cl  
HETATM    9  C   UNL     1       5.193  -2.227  -0.374  1.00  0.00           C  
HETATM   10  C   UNL     1       4.998  -0.291   1.039  1.00  0.00           C  
HETATM   11  F   UNL     1       4.232   0.605   1.700  1.00  0.00           F  
HETATM   12  C   UNL     1       4.401  -1.306   0.299  1.00  0.00           C  
HETATM   13  N   UNL     1       3.005  -1.401   0.238  1.00  0.00           N  
HETATM   14  C   UNL     1       2.254  -0.283   0.194  1.00  0.00           C  
HETATM   15  O   UNL     1       2.790   0.809   0.176  1.00  0.00           O  
HETATM   16  C   UNL     1       0.001   0.779   0.125  1.00  0.00           C  
HETATM   17  O   UNL     1       0.594   2.000   0.103  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.818   3.560   1.291  1.00  0.00           C  
HETATM   19  F   UNL     1       1.051   3.896  -1.919  1.00  0.00           F  
HETATM   20  F   UNL     1      -0.295   5.396  -0.843  1.00  0.00           F  
HETATM   21  F   UNL     1       1.597   4.623   0.177  1.00  0.00           F  
HETATM   22  C   UNL     1       0.167  -1.638   0.192  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.207  -1.727   0.169  1.00  0.00           C  
HETATM   24  F   UNL     1      -1.804  -2.940   0.189  1.00  0.00           F  
HETATM   25  C   UNL     1      -1.985  -0.571   0.123  1.00  0.00           C  
HETATM   26  N   UNL     1      -3.378  -0.669   0.100  1.00  0.00           N  
HETATM   27  N   UNL     1      -4.221  -0.790   1.213  1.00  0.00           N  
HETATM   28  C   UNL     1      -4.162  -0.660  -0.998  1.00  0.00           C  
HETATM   29  O   UNL     1      -3.785  -0.564  -2.152  1.00  0.00           O  
HETATM   30  N   UNL     1      -5.439  -0.776  -0.583  1.00  0.00           N  
HETATM   31  C   UNL     1      -6.622  -0.809  -1.446  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.931  -2.257  -1.832  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.442  -0.854   0.789  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.667  -0.989   1.657  1.00  0.00           C  
HETATM   35  O   UNL     1      -6.274  -1.035   3.030  1.00  0.00           O  
HETATM   36  H   UNL     1      -1.082   2.871  -0.733  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.985   1.571   0.071  1.00  0.00           H  
HETATM   38  H   UNL     1       6.841   0.594   1.664  1.00  0.00           H  
HETATM   39  H   UNL     1       8.237  -1.042   0.468  1.00  0.00           H  
HETATM   40  H   UNL     1       7.186  -2.845  -0.835  1.00  0.00           H  
HETATM   41  H   UNL     1       2.579  -2.273   0.226  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.469   4.425   1.161  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.387   2.738   1.725  1.00  0.00           H  
HETATM   44  H   UNL     1       0.005   3.822   1.956  1.00  0.00           H  
HETATM   45  H   UNL     1       0.766  -2.536   0.226  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.473  -0.386  -0.913  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.431  -0.225  -2.347  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.080  -2.680  -2.366  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.122  -2.841  -0.932  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.811  -2.282  -2.475  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.323  -0.133   1.495  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.196  -1.906   1.399  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.013  -1.121   3.648  1.00  0.00           H  
CONECT    1   20   21    2   19                                       
CONECT    2   18    1   17   36                                       
CONECT    3   16   16   25   37                                       
CONECT    4   16   14   22   22                                       
CONECT    5    6    6   10   38                                       
CONECT    6    7    5    5   39                                       
CONECT    7    9    9    6   40                                       
CONECT    8    9                                                      
CONECT    9    8    7    7   12                                       
CONECT   10   12   12    5   11                                       
CONECT   11   10                                                      
CONECT   12    9   13   10   10                                       
CONECT   13   12   14   41                                            
CONECT   14   13    4   15   15                                       
CONECT   15   14   14                                                 
CONECT   16   17    3    3    4                                       
CONECT   17    2   16                                                 
CONECT   18    2   42   43   44                                       
CONECT   19    1                                                      
CONECT   20    1                                                      
CONECT   21    1                                                      
CONECT   22    4    4   23   45                                       
CONECT   23   25   25   22   24                                       
CONECT   24   23                                                      
CONECT   25    3   26   23   23                                       
CONECT   26   27   25   28                                            
CONECT   27   33   33   26                                            
CONECT   28   26   30   29   29                                       
CONECT   29   28   28                                                 
CONECT   30   33   31   28                                            
CONECT   31   30   32   46   47                                       
CONECT   32   31   48   49   50                                       
CONECT   33   34   27   27   30                                       
CONECT   34   35   33   51   52                                       
CONECT   35   34   53                                                 
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41   13                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   22                                                      
CONECT   46   31                                                      
CONECT   47   31                                                      
CONECT   48   32                                                      
CONECT   49   32                                                      
CONECT   50   32                                                      
CONECT   51   34                                                      
CONECT   52   34                                                      
CONECT   53   35                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
