COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.114   3.237   0.533  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.563   1.992   0.537  1.00  0.00           N  
HETATM    3  N   UNL     1      -0.837   3.535   0.486  1.00  0.00           N  
HETATM    4  C   UNL     1      -1.735   0.956   0.491  1.00  0.00           C  
HETATM    5  C   UNL     1       0.087   2.563   0.437  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.345   1.213   0.439  1.00  0.00           C  
HETATM    7  C   UNL     1       1.940   0.489   0.340  1.00  0.00           C  
HETATM    8  C   UNL     1       0.599   0.180   0.389  1.00  0.00           C  
HETATM    9  C   UNL     1       2.363   1.828   0.339  1.00  0.00           C  
HETATM   10  C   UNL     1       1.457   2.849   0.387  1.00  0.00           C  
HETATM   11  N   UNL     1      -2.217  -0.337   0.496  1.00  0.00           N  
HETATM   12  C   UNL     1      -5.759   0.016  -0.428  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.320  -1.037   0.277  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.398   0.249  -0.358  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.519  -1.855   1.056  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.595  -0.570   0.423  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.160  -1.622   1.133  1.00  0.00           C  
HETATM   18  F   UNL     1      -7.649  -1.266   0.203  1.00  0.00           F  
HETATM   19 CL   UNL     1      -6.765   1.040  -1.405  1.00  0.00          Cl  
HETATM   20  O   UNL     1       3.691   2.111   0.290  1.00  0.00           O  
HETATM   21  C   UNL     1       4.061   3.491   0.301  1.00  0.00           C  
HETATM   22  C   UNL     1       4.025   4.082  -1.125  1.00  0.00           C  
HETATM   23  O   UNL     1       5.161   4.943  -1.265  1.00  0.00           O  
HETATM   24  C   UNL     1       5.900   4.985  -0.034  1.00  0.00           C  
HETATM   25  C   UNL     1       5.555   3.660   0.691  1.00  0.00           C  
HETATM   26  N   UNL     1       2.889  -0.539   0.291  1.00  0.00           N  
HETATM   27  C   UNL     1       2.545  -1.750  -0.190  1.00  0.00           C  
HETATM   28  C   UNL     1       3.507  -2.862  -0.137  1.00  0.00           C  
HETATM   29  O   UNL     1       1.440  -1.924  -0.667  1.00  0.00           O  
HETATM   30  C   UNL     1       3.168  -4.057  -0.612  1.00  0.00           C  
HETATM   31  C   UNL     1       4.153  -5.196  -0.557  1.00  0.00           C  
HETATM   32  N   UNL     1       3.544  -6.338   0.139  1.00  0.00           N  
HETATM   33  C   UNL     1       2.419  -6.885  -0.632  1.00  0.00           C  
HETATM   34  C   UNL     1       4.544  -7.377   0.421  1.00  0.00           C  
HETATM   35  H   UNL     1      -2.831   4.044   0.567  1.00  0.00           H  
HETATM   36  H   UNL     1       0.277  -0.851   0.390  1.00  0.00           H  
HETATM   37  H   UNL     1       1.796   3.875   0.385  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.601  -1.084   0.549  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.961   1.067  -0.911  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.958  -2.675   1.605  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.536  -2.260   1.741  1.00  0.00           H  
HETATM   42  H   UNL     1       3.416   4.058   0.973  1.00  0.00           H  
HETATM   43  H   UNL     1       4.078   3.278  -1.859  1.00  0.00           H  
HETATM   44  H   UNL     1       3.108   4.653  -1.265  1.00  0.00           H  
HETATM   45  H   UNL     1       6.970   5.038  -0.236  1.00  0.00           H  
HETATM   46  H   UNL     1       5.586   5.839   0.567  1.00  0.00           H  
HETATM   47  H   UNL     1       5.671   3.760   1.770  1.00  0.00           H  
HETATM   48  H   UNL     1       6.156   2.835   0.308  1.00  0.00           H  
HETATM   49  H   UNL     1       3.793  -0.380   0.603  1.00  0.00           H  
HETATM   50  H   UNL     1       4.488  -2.707   0.287  1.00  0.00           H  
HETATM   51  H   UNL     1       2.187  -4.212  -1.035  1.00  0.00           H  
HETATM   52  H   UNL     1       4.424  -5.491  -1.571  1.00  0.00           H  
HETATM   53  H   UNL     1       5.047  -4.878  -0.021  1.00  0.00           H  
HETATM   54  H   UNL     1       2.775  -7.219  -1.606  1.00  0.00           H  
HETATM   55  H   UNL     1       1.987  -7.729  -0.094  1.00  0.00           H  
HETATM   56  H   UNL     1       1.662  -6.113  -0.766  1.00  0.00           H  
HETATM   57  H   UNL     1       5.331  -6.962   1.051  1.00  0.00           H  
HETATM   58  H   UNL     1       4.066  -8.210   0.936  1.00  0.00           H  
HETATM   59  H   UNL     1       4.976  -7.729  -0.516  1.00  0.00           H  
CONECT    1    2    2    3   35                                       
CONECT    2    1    1    4                                            
CONECT    3    1    5    5                                            
CONECT    4    2   11    6    6                                       
CONECT    5    3    3    6   10                                       
CONECT    6    4    4    5    8                                       
CONECT    7    8    8    9   26                                       
CONECT    8    6    7    7   36                                       
CONECT    9    7   10   10   20                                       
CONECT   10    5    9    9   37                                       
CONECT   11    4   16   38                                            
CONECT   12   13   13   14   19                                       
CONECT   13   12   12   15   18                                       
CONECT   14   12   16   16   39                                       
CONECT   15   13   17   17   40                                       
CONECT   16   11   14   14   17                                       
CONECT   17   15   15   16   41                                       
CONECT   18   13                                                      
CONECT   19   12                                                      
CONECT   20    9   21                                                 
CONECT   21   20   22   25   42                                       
CONECT   22   21   23   43   44                                       
CONECT   23   22   24                                                 
CONECT   24   23   25   45   46                                       
CONECT   25   21   24   47   48                                       
CONECT   26    7   27   49                                            
CONECT   27   26   29   29   28                                       
CONECT   28   27   30   30   50                                       
CONECT   29   27   27                                                 
CONECT   30   28   28   31   51                                       
CONECT   31   30   32   52   53                                       
CONECT   32   31   33   34                                            
CONECT   33   32   54   55   56                                       
CONECT   34   32   57   58   59                                       
CONECT   35    1                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
CONECT   53   31                                                      
CONECT   54   33                                                      
CONECT   55   33                                                      
CONECT   56   33                                                      
CONECT   57   34                                                      
CONECT   58   34                                                      
CONECT   59   34                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
