COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.126  -0.352   0.988  1.00  0.00           O  
HETATM    2  C   UNL     1       6.470   0.098   0.072  1.00  0.00           C  
HETATM    3  C   UNL     1       7.149   0.516  -1.207  1.00  0.00           C  
HETATM    4  N   UNL     1       5.134   0.219   0.197  1.00  0.00           N  
HETATM    5  C   UNL     1       4.461  -0.190   1.436  1.00  0.00           C  
HETATM    6  C   UNL     1       3.651   0.996   1.973  1.00  0.00           C  
HETATM    7  C   UNL     1       4.330   0.769  -0.903  1.00  0.00           C  
HETATM    8  C   UNL     1       3.520   1.958  -0.376  1.00  0.00           C  
HETATM    9  C   UNL     1       2.746   1.526   0.863  1.00  0.00           C  
HETATM   10  C   UNL     1       1.734   2.572   1.349  1.00  0.00           C  
HETATM   11  C   UNL     1       1.551   0.615   0.551  1.00  0.00           C  
HETATM   12  C   UNL     1       0.713   1.898   0.416  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.687   1.782   1.022  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.609   1.240   0.021  1.00  0.00           N  
HETATM   15  C   UNL     1      -2.906   1.049   0.333  1.00  0.00           C  
HETATM   16  O   UNL     1      -3.292   1.240   1.467  1.00  0.00           O  
HETATM   17  C   UNL     1      -3.878   0.600  -0.728  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.095  -0.052  -0.064  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.341   1.810  -1.545  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.089   2.780  -0.627  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.606   3.963  -1.448  1.00  0.00           C  
HETATM   22  O   UNL     1      -6.191   2.104  -0.019  1.00  0.00           O  
HETATM   23  C   UNL     1      -5.815   0.989   0.798  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.067   0.364   1.417  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.225  -0.369  -1.612  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.734  -1.569  -1.092  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.259  -2.555  -1.947  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.773  -3.740  -1.431  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.760  -3.946  -0.062  1.00  0.00           C  
HETATM   30 CL   UNL     1      -1.149  -5.437   0.584  1.00  0.00          Cl  
HETATM   31  C   UNL     1      -2.233  -2.966   0.792  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.714  -1.776   0.282  1.00  0.00           C  
HETATM   33  H   UNL     1       6.753  -0.070  -2.036  1.00  0.00           H  
HETATM   34  H   UNL     1       6.963   1.575  -1.388  1.00  0.00           H  
HETATM   35 CL   UNL     1       8.924   0.234  -1.065  1.00  0.00          Cl  
HETATM   36  H   UNL     1       3.792  -1.026   1.230  1.00  0.00           H  
HETATM   37  H   UNL     1       5.205  -0.489   2.175  1.00  0.00           H  
HETATM   38  H   UNL     1       3.041   0.669   2.815  1.00  0.00           H  
HETATM   39  H   UNL     1       4.330   1.783   2.299  1.00  0.00           H  
HETATM   40  H   UNL     1       4.988   1.102  -1.706  1.00  0.00           H  
HETATM   41  H   UNL     1       3.654   0.002  -1.280  1.00  0.00           H  
HETATM   42  H   UNL     1       4.195   2.774  -0.119  1.00  0.00           H  
HETATM   43  H   UNL     1       2.820   2.291  -1.142  1.00  0.00           H  
HETATM   44  H   UNL     1       1.486   2.482   2.406  1.00  0.00           H  
HETATM   45  H   UNL     1       1.986   3.592   1.057  1.00  0.00           H  
HETATM   46  H   UNL     1       1.656   0.062  -0.382  1.00  0.00           H  
HETATM   47  H   UNL     1       1.254  -0.017   1.387  1.00  0.00           H  
HETATM   48  H   UNL     1       0.704   2.312  -0.593  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.655   1.116   1.884  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.030   2.767   1.336  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.286   1.019  -0.867  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.775  -0.421  -0.832  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.768  -0.882   0.563  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.474   2.311  -1.976  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.004   1.478  -2.344  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.412   3.143   0.147  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.283   3.600  -2.222  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.139   4.654  -0.795  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.765   4.478  -1.913  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.148   1.327   1.591  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.734   0.026   0.624  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.781  -0.484   2.038  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.579   1.107   2.029  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.134  -0.177  -2.558  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.269  -2.395  -3.015  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.404  -4.508  -2.095  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.222  -3.129   1.860  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.078  -1.009   0.949  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    4    1    1                                       
CONECT    3    2   33   34   35                                       
CONECT    4    2    7    5                                            
CONECT    5    4    6   36   37                                       
CONECT    6    9    5   38   39                                       
CONECT    7    8    4   40   41                                       
CONECT    8    7    9   42   43                                       
CONECT    9    8   10   11    6                                       
CONECT   10   12    9   44   45                                       
CONECT   11   12    9   46   47                                       
CONECT   12   10   13   11   48                                       
CONECT   13   12   14   49   50                                       
CONECT   14   13   15   51                                            
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   15   19   25   18                                       
CONECT   18   17   23   52   53                                       
CONECT   19   20   17   54   55                                       
CONECT   20   21   19   22   56                                       
CONECT   21   20   57   58   59                                       
CONECT   22   20   23                                                 
CONECT   23   22   18   24   60                                       
CONECT   24   23   61   62   63                                       
CONECT   25   17   26   64                                            
CONECT   26   25   27   27   32                                       
CONECT   27   26   26   28   65                                       
CONECT   28   27   29   29   66                                       
CONECT   29   28   28   31   30                                       
CONECT   30   29                                                      
CONECT   31   32   32   29   67                                       
CONECT   32   26   31   31   68                                       
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43    8                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   24                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   27                                                      
CONECT   66   28                                                      
CONECT   67   31                                                      
CONECT   68   32                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
