COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.944  -2.478  -0.554  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.096  -1.094   0.337  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.967  -0.383   1.164  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.595  -0.197   2.506  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.953   3.319  -0.424  1.00  0.00           C  
HETATM    6  C   UNL     1      -9.156   5.364  -0.683  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.210  -3.850   0.153  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.094  -4.365  -0.984  1.00  0.00           C  
HETATM    9  C   UNL     1       0.029  -2.349  -0.027  1.00  0.00           C  
HETATM   10  C   UNL     1       7.688   0.804  -0.185  1.00  0.00           C  
HETATM   11  C   UNL     1       8.733   1.693  -0.370  1.00  0.00           C  
HETATM   12 CL   UNL     1      10.319   1.101  -0.756  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -4.898  -0.295  -0.467  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.249   0.176   0.681  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.842   1.198   1.434  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.009   1.789   1.008  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.613   1.370  -0.173  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.058   0.332  -0.904  1.00  0.00           C  
HETATM   19  N   UNL     1      -4.429  -1.394  -1.193  1.00  0.00           N  
HETATM   20  N   UNL     1      -7.779   1.997  -0.622  1.00  0.00           N  
HETATM   21  C   UNL     1      -0.917  -1.582   0.860  1.00  0.00           C  
HETATM   22  N   UNL     1       1.411  -2.027   0.338  1.00  0.00           N  
HETATM   23  N   UNL     1      -0.604  -1.384   2.127  1.00  0.00           N  
HETATM   24  C   UNL     1      -1.397  -0.719   2.945  1.00  0.00           C  
HETATM   25  O   UNL     1      -7.135   3.950   0.214  1.00  0.00           O  
HETATM   26  O   UNL     1      -9.033   3.939  -0.935  1.00  0.00           O  
HETATM   27  C   UNL     1      -2.532  -4.516  -0.485  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.464  -3.665  -1.350  1.00  0.00           C  
HETATM   29  O   UNL     1      -3.889  -2.497   0.658  1.00  0.00           O  
HETATM   30  C   UNL     1      -4.665  -4.506  -1.786  1.00  0.00           C  
HETATM   31  C   UNL     1       2.010  -0.940  -0.186  1.00  0.00           C  
HETATM   32  O   UNL     1       1.403  -0.225  -0.961  1.00  0.00           O  
HETATM   33  C   UNL     1       7.252   3.529   0.060  1.00  0.00           C  
HETATM   34  C   UNL     1       8.514   3.054  -0.248  1.00  0.00           C  
HETATM   35  C   UNL     1       6.418   1.281   0.118  1.00  0.00           C  
HETATM   36  C   UNL     1       6.203   2.648   0.235  1.00  0.00           C  
HETATM   37  N   UNL     1       5.357   0.384   0.306  1.00  0.00           N  
HETATM   38  C   UNL     1       4.141   0.466  -0.278  1.00  0.00           C  
HETATM   39  C   UNL     1       3.394  -0.617   0.179  1.00  0.00           C  
HETATM   40  C   UNL     1       4.224  -1.348   1.062  1.00  0.00           C  
HETATM   41  N   UNL     1       5.380  -0.750   1.124  1.00  0.00           N  
HETATM   42  N   UNL     1       3.719   1.440  -1.160  1.00  0.00           N  
HETATM   43  F   UNL     1       7.901  -0.525  -0.305  1.00  0.00           F  
HETATM   44  H   UNL     1      -2.342  -1.260  -0.701  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.238   0.345   3.183  1.00  0.00           H  
HETATM   46  H   UNL     1     -10.068   5.738  -1.148  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.197   5.541   0.392  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.294   5.883  -1.103  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.706  -4.027   1.107  1.00  0.00           H  
HETATM   50  H   UNL     1       0.745  -4.374   0.138  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.069  -3.658  -1.813  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.723  -5.333  -1.322  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.146  -2.076  -1.067  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.381   1.523   2.355  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.457   2.580   1.592  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.531   0.008  -1.819  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.453  -1.376  -2.162  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.463   1.480  -1.076  1.00  0.00           H  
HETATM   59  H   UNL     1       1.894  -2.597   0.956  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.103  -0.580   3.975  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.832  -5.562  -0.549  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.594  -4.184   0.551  1.00  0.00           H  
HETATM   63  H   UNL     1      -2.924  -3.317  -2.231  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.329  -3.899  -2.403  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.318  -5.364  -2.362  1.00  0.00           H  
HETATM   66  H   UNL     1      -5.204  -4.854  -0.905  1.00  0.00           H  
HETATM   67  H   UNL     1       7.085   4.592   0.154  1.00  0.00           H  
HETATM   68  H   UNL     1       9.330   3.746  -0.393  1.00  0.00           H  
HETATM   69  H   UNL     1       5.219   3.021   0.475  1.00  0.00           H  
HETATM   70  H   UNL     1       3.948  -2.249   1.591  1.00  0.00           H  
HETATM   71  H   UNL     1       4.293   2.195  -1.360  1.00  0.00           H  
HETATM   72  H   UNL     1       2.848   1.369  -1.580  1.00  0.00           H  
CONECT    1   29   29   28   19                                       
CONECT    2   21   21    3   44                                       
CONECT    3    4    4    2   14                                       
CONECT    4   24    3    3   45                                       
CONECT    5   25   25   20   26                                       
CONECT    6   26   46   47   48                                       
CONECT    7    8    9   49   50                                       
CONECT    8    7   27   51   52                                       
CONECT    9    7   22   21   53                                       
CONECT   10   35   35   11   43                                       
CONECT   11   34   34   10   12                                       
CONECT   12   11                                                      
CONECT   13   14   19   18   18                                       
CONECT   14    3   15   15   13                                       
CONECT   15   14   14   16   54                                       
CONECT   16   15   17   17   55                                       
CONECT   17   16   16   18   20                                       
CONECT   18   13   13   17   56                                       
CONECT   19    1   13   57                                            
CONECT   20   17    5   58                                            
CONECT   21   23    9    2    2                                       
CONECT   22    9   31   59                                            
CONECT   23   24   24   21                                            
CONECT   24   23   23    4   60                                       
CONECT   25    5    5                                                 
CONECT   26    5    6                                                 
CONECT   27    8   28   61   62                                       
CONECT   28   30   27    1   63                                       
CONECT   29    1    1                                                 
CONECT   30   28   64   65   66                                       
CONECT   31   22   39   32   32                                       
CONECT   32   31   31                                                 
CONECT   33   36   36   34   67                                       
CONECT   34   33   11   11   68                                       
CONECT   35   36   37   10   10                                       
CONECT   36   33   33   35   69                                       
CONECT   37   41   35   38                                            
CONECT   38   37   39   39   42                                       
CONECT   39   40   31   38   38                                       
CONECT   40   41   41   39   70                                       
CONECT   41   40   40   37                                            
CONECT   42   38   71   72                                            
CONECT   43   10                                                      
CONECT   44    2                                                      
CONECT   45    4                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    6                                                      
CONECT   49    7                                                      
CONECT   50    7                                                      
CONECT   51    8                                                      
CONECT   52    8                                                      
CONECT   53    9                                                      
CONECT   54   15                                                      
CONECT   55   16                                                      
CONECT   56   18                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   22                                                      
CONECT   60   24                                                      
CONECT   61   27                                                      
CONECT   62   27                                                      
CONECT   63   28                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
CONECT   69   36                                                      
CONECT   70   40                                                      
CONECT   71   42                                                      
CONECT   72   42                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
