COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.190  -0.345   1.049  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.292   1.188   0.581  1.00  0.00           C  
HETATM    3  C   UNL     1       1.808   3.497  -0.866  1.00  0.00           C  
HETATM    4  C   UNL     1       1.920   5.024  -0.879  1.00  0.00           C  
HETATM    5  C   UNL     1       4.210   4.912   0.070  1.00  0.00           C  
HETATM    6  C   UNL     1       2.251   4.961   1.594  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.593  -0.186  -1.369  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.433  -0.357  -2.429  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.723  -0.848  -2.249  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.183  -1.171  -1.009  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.345  -1.008   0.108  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.788  -1.332   1.403  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.959  -1.161   2.470  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.666  -0.676   2.306  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.812   0.170   0.883  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.766  -0.729   0.726  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.468  -0.220   0.569  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.408   2.013   0.746  1.00  0.00           C  
HETATM   19  C   UNL     1       1.018   1.699   0.417  1.00  0.00           C  
HETATM   20  C   UNL     1       2.826   5.474   0.270  1.00  0.00           C  
HETATM   21  C   UNL     1       2.130   3.437   1.535  1.00  0.00           C  
HETATM   22  C   UNL     1       1.801  -0.475   0.257  1.00  0.00           C  
HETATM   23  C   UNL     1       2.594  -2.706   0.094  1.00  0.00           C  
HETATM   24  C   UNL     1       3.903  -3.474  -0.102  1.00  0.00           C  
HETATM   25  C   UNL     1       4.146  -5.481  -1.393  1.00  0.00           C  
HETATM   26  C   UNL     1       4.116  -4.284  -2.374  1.00  0.00           C  
HETATM   27  C   UNL     1       4.552  -3.114  -1.454  1.00  0.00           C  
HETATM   28  C   UNL     1       4.421  -5.534   1.010  1.00  0.00           C  
HETATM   29  C   UNL     1       5.585  -4.527   1.289  1.00  0.00           C  
HETATM   30  C   UNL     1       4.897  -3.161   1.034  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.034  -0.509  -0.076  1.00  0.00           C  
HETATM   32  F   UNL     1      -1.993  -2.061   0.723  1.00  0.00           F  
HETATM   33  N   UNL     1      -2.602   1.488   0.888  1.00  0.00           N  
HETATM   34  N   UNL     1       1.253   3.057   0.420  1.00  0.00           N  
HETATM   35  N   UNL     1       2.013   0.836   0.262  1.00  0.00           N  
HETATM   36  N   UNL     1       3.661  -4.933  -0.108  1.00  0.00           N  
HETATM   37  N   UNL     1       0.603  -1.007   0.410  1.00  0.00           N  
HETATM   38  O   UNL     1       2.479   5.451  -2.123  1.00  0.00           O  
HETATM   39  O   UNL     1       5.154   5.657  -0.040  1.00  0.00           O  
HETATM   40  O   UNL     1       2.861  -1.302   0.093  1.00  0.00           O  
HETATM   41 CL   UNL     1      -2.988   0.427  -1.616  1.00  0.00          Cl  
HETATM   42  H   UNL     1       1.152   3.175  -1.674  1.00  0.00           H  
HETATM   43  H   UNL     1       2.797   3.060  -1.004  1.00  0.00           H  
HETATM   44  H   UNL     1       0.929   5.462  -0.755  1.00  0.00           H  
HETATM   45  H   UNL     1       4.357   3.843   0.026  1.00  0.00           H  
HETATM   46  H   UNL     1       2.915   5.242   2.412  1.00  0.00           H  
HETATM   47  H   UNL     1       1.266   5.398   1.757  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.092  -0.108  -3.423  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.369  -0.975  -3.105  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.186  -1.551  -0.884  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.787  -1.713   1.552  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.310  -1.413   3.460  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.027  -0.558   3.168  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.287   3.087   0.757  1.00  0.00           H  
HETATM   55  H   UNL     1       2.874   6.563   0.291  1.00  0.00           H  
HETATM   56  H   UNL     1       3.118   2.999   1.386  1.00  0.00           H  
HETATM   57  H   UNL     1       1.708   3.069   2.470  1.00  0.00           H  
HETATM   58  H   UNL     1       1.907  -2.946  -0.718  1.00  0.00           H  
HETATM   59  H   UNL     1       2.145  -2.990   1.046  1.00  0.00           H  
HETATM   60  H   UNL     1       3.483  -6.273  -1.741  1.00  0.00           H  
HETATM   61  H   UNL     1       5.163  -5.858  -1.284  1.00  0.00           H  
HETATM   62  H   UNL     1       4.828  -4.427  -3.187  1.00  0.00           H  
HETATM   63  H   UNL     1       3.111  -4.122  -2.762  1.00  0.00           H  
HETATM   64  H   UNL     1       4.166  -2.165  -1.826  1.00  0.00           H  
HETATM   65  H   UNL     1       5.638  -3.079  -1.362  1.00  0.00           H  
HETATM   66  H   UNL     1       4.802  -6.515   0.726  1.00  0.00           H  
HETATM   67  H   UNL     1       3.792  -5.614   1.897  1.00  0.00           H  
HETATM   68  H   UNL     1       5.945  -4.620   2.314  1.00  0.00           H  
HETATM   69  H   UNL     1       6.399  -4.665   0.577  1.00  0.00           H  
HETATM   70  H   UNL     1       5.626  -2.417   0.713  1.00  0.00           H  
HETATM   71  H   UNL     1       4.369  -2.823   1.926  1.00  0.00           H  
HETATM   72  H   UNL     1       1.957   5.197  -2.896  1.00  0.00           H  
CONECT    1   14   14   15   31                                       
CONECT    2   17   17   18   19                                       
CONECT    3    4   34   42   43                                       
CONECT    4    3   20   38   44                                       
CONECT    5   20   39   39   45                                       
CONECT    6   20   21   46   47                                       
CONECT    7    8    8   31   41                                       
CONECT    8    7    7    9   48                                       
CONECT    9    8   10   10   49                                       
CONECT   10    9    9   11   50                                       
CONECT   11   10   12   31   31                                       
CONECT   12   11   13   13   51                                       
CONECT   13   12   12   14   52                                       
CONECT   14    1    1   13   53                                       
CONECT   15    1   16   16   33                                       
CONECT   16   15   15   17   32                                       
CONECT   17    2    2   16   37                                       
CONECT   18    2   33   33   54                                       
CONECT   19    2   34   35   35                                       
CONECT   20    4    5    6   55                                       
CONECT   21    6   34   56   57                                       
CONECT   22   35   37   37   40                                       
CONECT   23   24   40   58   59                                       
CONECT   24   23   27   30   36                                       
CONECT   25   26   36   60   61                                       
CONECT   26   25   27   62   63                                       
CONECT   27   24   26   64   65                                       
CONECT   28   36   66   67   29                                       
CONECT   29   30   68   69   28                                       
CONECT   30   24   29   70   71                                       
CONECT   31    1    7   11   11                                       
CONECT   32   16                                                      
CONECT   33   15   18   18                                            
CONECT   34    3   19   21                                            
CONECT   35   19   19   22                                            
CONECT   36   24   25   28                                            
CONECT   37   17   22   22                                            
CONECT   38    4   72                                                 
CONECT   39    5    5                                                 
CONECT   40   22   23                                                 
CONECT   41    7                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48    8                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   12                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   18                                                      
CONECT   55   20                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   23                                                      
CONECT   59   23                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   26                                                      
CONECT   64   27                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   28                                                      
CONECT   68   29                                                      
CONECT   69   29                                                      
CONECT   70   30                                                      
CONECT   71   30                                                      
CONECT   72   38                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
