COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.712  -0.501   3.252  1.00  0.00           C  
HETATM    2  O   UNL     1      -7.157  -0.466   1.895  1.00  0.00           O  
HETATM    3  C   UNL     1      -6.252  -0.079   0.960  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.965   0.260   1.337  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.616  -0.027  -0.395  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.980  -0.391  -0.808  1.00  0.00           C  
HETATM    7  O   UNL     1      -8.795  -0.738   0.024  1.00  0.00           O  
HETATM    8  O   UNL     1      -8.327  -0.339  -2.110  1.00  0.00           O  
HETATM    9  C   UNL     1      -5.676   0.374  -1.351  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.411   0.711  -0.967  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.043   0.656   0.375  1.00  0.00           C  
HETATM   12  N   UNL     1      -2.750   1.003   0.756  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.684   0.732  -0.087  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.479   1.168   0.240  1.00  0.00           N  
HETATM   15  N   UNL     1      -1.898   0.039  -1.196  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.904  -0.243  -2.022  1.00  0.00           C  
HETATM   17  C   UNL     1       0.374   0.198  -1.715  1.00  0.00           C  
HETATM   18  C   UNL     1       1.513  -0.135  -2.636  1.00  0.00           C  
HETATM   19  N   UNL     1       2.470  -0.989  -1.940  1.00  0.00           N  
HETATM   20  C   UNL     1       0.572   0.924  -0.552  1.00  0.00           C  
HETATM   21  C   UNL     1       1.893   1.459  -0.158  1.00  0.00           C  
HETATM   22  C   UNL     1       1.923   2.730   0.428  1.00  0.00           C  
HETATM   23  C   UNL     1       3.117   3.295   0.816  1.00  0.00           C  
HETATM   24  C   UNL     1       4.305   2.608   0.627  1.00  0.00           C  
HETATM   25 CL   UNL     1       5.809   3.325   1.115  1.00  0.00          Cl  
HETATM   26  C   UNL     1       4.295   1.355   0.053  1.00  0.00           C  
HETATM   27  C   UNL     1       3.088   0.762  -0.344  1.00  0.00           C  
HETATM   28  C   UNL     1       3.154  -0.582  -0.933  1.00  0.00           C  
HETATM   29  C   UNL     1       4.088  -1.546  -0.314  1.00  0.00           C  
HETATM   30  C   UNL     1       5.408  -1.635  -0.764  1.00  0.00           C  
HETATM   31  F   UNL     1       5.836  -0.839  -1.768  1.00  0.00           F  
HETATM   32  C   UNL     1       6.275  -2.539  -0.181  1.00  0.00           C  
HETATM   33  C   UNL     1       5.840  -3.358   0.848  1.00  0.00           C  
HETATM   34  C   UNL     1       4.537  -3.279   1.301  1.00  0.00           C  
HETATM   35  C   UNL     1       3.656  -2.373   0.731  1.00  0.00           C  
HETATM   36  O   UNL     1       2.378  -2.291   1.181  1.00  0.00           O  
HETATM   37  C   UNL     1       2.009  -3.165   2.249  1.00  0.00           C  
HETATM   38  H   UNL     1      -7.531  -0.827   3.894  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.880  -1.199   3.344  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.387   0.494   3.554  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.677   0.218   2.377  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.234  -0.587  -2.333  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.953   0.416  -2.395  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.689   1.020  -1.709  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.595   1.434   1.611  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.085  -0.809  -2.924  1.00  0.00           H  
HETATM   47  H   UNL     1       1.130  -0.658  -3.513  1.00  0.00           H  
HETATM   48  H   UNL     1       2.007   0.784  -2.950  1.00  0.00           H  
HETATM   49  H   UNL     1       1.000   3.271   0.578  1.00  0.00           H  
HETATM   50  H   UNL     1       3.128   4.276   1.268  1.00  0.00           H  
HETATM   51  H   UNL     1       5.225   0.824  -0.092  1.00  0.00           H  
HETATM   52  H   UNL     1       7.295  -2.608  -0.528  1.00  0.00           H  
HETATM   53  H   UNL     1       6.523  -4.062   1.299  1.00  0.00           H  
HETATM   54  H   UNL     1       4.206  -3.921   2.103  1.00  0.00           H  
HETATM   55  H   UNL     1       0.964  -2.998   2.511  1.00  0.00           H  
HETATM   56  H   UNL     1       2.144  -4.200   1.935  1.00  0.00           H  
HETATM   57  H   UNL     1       2.638  -2.964   3.117  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    3    1                                                 
CONECT    3    4    4    5    2                                       
CONECT    4   11    3    3   41                                       
CONECT    5    9    9    3    6                                       
CONECT    6    5    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6   42                                                 
CONECT    9   10    5    5   43                                       
CONECT   10   11   11    9   44                                       
CONECT   11   12   10   10    4                                       
CONECT   12   13   11   45                                            
CONECT   13   15   12   14   14                                       
CONECT   14   13   13   20                                            
CONECT   15   16   16   13                                            
CONECT   16   15   15   17   46                                       
CONECT   17   16   18   20   20                                       
CONECT   18   17   19   47   48                                       
CONECT   19   18   28   28                                            
CONECT   20   17   17   14   21                                       
CONECT   21   20   22   22   27                                       
CONECT   22   21   21   23   49                                       
CONECT   23   22   24   24   50                                       
CONECT   24   23   23   26   25                                       
CONECT   25   24                                                      
CONECT   26   27   27   24   51                                       
CONECT   27   21   28   26   26                                       
CONECT   28   19   19   27   29                                       
CONECT   29   28   35   35   30                                       
CONECT   30   29   31   32   32                                       
CONECT   31   30                                                      
CONECT   32   30   30   33   52                                       
CONECT   33   34   34   32   53                                       
CONECT   34   35   33   33   54                                       
CONECT   35   36   29   29   34                                       
CONECT   36   37   35                                                 
CONECT   37   36   55   56   57                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    4                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   26                                                      
CONECT   52   32                                                      
CONECT   53   33                                                      
CONECT   54   34                                                      
CONECT   55   37                                                      
CONECT   56   37                                                      
CONECT   57   37                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
