COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.772   0.115  -0.272  1.00  0.00           C  
HETATM    2  C   UNL     1       1.071  -1.360  -0.340  1.00  0.00           C  
HETATM    3  C   UNL     1       0.050  -2.262  -0.559  1.00  0.00           C  
HETATM    4  C   UNL     1       2.380  -1.815  -0.188  1.00  0.00           C  
HETATM    5  C   UNL     1       3.481  -0.849   0.042  1.00  0.00           C  
HETATM    6  C   UNL     1       4.344  -1.021   1.125  1.00  0.00           C  
HETATM    7  C   UNL     1       5.367  -0.127   1.341  1.00  0.00           C  
HETATM    8  C   UNL     1       5.542   0.956   0.474  1.00  0.00           C  
HETATM    9  C   UNL     1       6.639   1.916   0.704  1.00  0.00           C  
HETATM   10  C   UNL     1       4.677   1.128  -0.611  1.00  0.00           C  
HETATM   11  C   UNL     1       3.657   0.227  -0.827  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.402   0.260   0.818  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.868   0.357   0.761  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.291   0.317   1.956  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.417   0.532   1.217  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.331   0.802  -0.144  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.106   0.859  -0.772  1.00  0.00           C  
HETATM   18 CL   UNL     1      -8.781   1.071  -1.061  1.00  0.00          Cl  
HETATM   19  C   UNL     1      -4.942   0.644  -0.039  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.033   0.370   1.340  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.711   0.196   1.815  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.609   0.634  -0.373  1.00  0.00           N  
HETATM   23  O   UNL     1      -0.844   0.122   1.890  1.00  0.00           O  
HETATM   24  N   UNL     1      -0.677   0.323  -0.316  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.339   0.599  -1.594  1.00  0.00           C  
HETATM   26  C   UNL     1       2.650  -3.181  -0.252  1.00  0.00           C  
HETATM   27  C   UNL     1       1.619  -4.076  -0.467  1.00  0.00           C  
HETATM   28  F   UNL     1       1.878  -5.401  -0.529  1.00  0.00           F  
HETATM   29  C   UNL     1       0.321  -3.617  -0.622  1.00  0.00           C  
HETATM   30 CL   UNL     1       4.892   2.472  -1.689  1.00  0.00          Cl  
HETATM   31  O   UNL     1       6.791   2.856  -0.050  1.00  0.00           O  
HETATM   32  O   UNL     1       7.472   1.749   1.749  1.00  0.00           O  
HETATM   33  H   UNL     1       1.169   0.524   0.658  1.00  0.00           H  
HETATM   34  H   UNL     1       1.237   0.620  -1.118  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.964  -1.909  -0.682  1.00  0.00           H  
HETATM   36  H   UNL     1       4.209  -1.857   1.796  1.00  0.00           H  
HETATM   37  H   UNL     1       6.034  -0.261   2.180  1.00  0.00           H  
HETATM   38  H   UNL     1       2.988   0.358  -1.665  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.367   0.108   3.013  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.385   0.490   1.695  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.049   1.070  -1.829  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.423  -0.024   2.832  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.247   0.794  -1.258  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.604   0.571  -2.397  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.106  -0.154  -1.776  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.801   1.586  -1.558  1.00  0.00           H  
HETATM   47  H   UNL     1       3.662  -3.539  -0.135  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.481  -4.319  -0.794  1.00  0.00           H  
HETATM   49  H   UNL     1       8.176   2.404   1.859  1.00  0.00           H  
CONECT    1    2   24   33   34                                       
CONECT    2    4    1    3    3                                       
CONECT    3    2    2   29   35                                       
CONECT    4    5   26   26    2                                       
CONECT    5   11   11    6    4                                       
CONECT    6    7    7    5   36                                       
CONECT    7    8    6    6   37                                       
CONECT    8    9   10   10    7                                       
CONECT    9   31   31   32    8                                       
CONECT   10   30    8    8   11                                       
CONECT   11   10    5    5   38                                       
CONECT   12   24   23   23   13                                       
CONECT   13   12   21   21   22                                       
CONECT   14   20   15   15   39                                       
CONECT   15   14   14   16   40                                       
CONECT   16   17   17   15   18                                       
CONECT   17   19   16   16   41                                       
CONECT   18   16                                                      
CONECT   19   22   20   20   17                                       
CONECT   20   21   19   19   14                                       
CONECT   21   13   13   20   42                                       
CONECT   22   13   19   43                                            
CONECT   23   12   12                                                 
CONECT   24   25    1   12                                            
CONECT   25   24   44   45   46                                       
CONECT   26    4    4   27   47                                       
CONECT   27   26   28   29   29                                       
CONECT   28   27                                                      
CONECT   29   27   27    3   48                                       
CONECT   30   10                                                      
CONECT   31    9    9                                                 
CONECT   32    9   49                                                 
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   29                                                      
CONECT   49   32                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
