COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.713   2.909  -0.745  1.00  0.00           C  
HETATM    2  C   UNL     1       4.568   2.076   0.530  1.00  0.00           C  
HETATM    3  C   UNL     1       3.102   1.676   0.715  1.00  0.00           C  
HETATM    4  O   UNL     1       2.707   0.781  -0.352  1.00  0.00           O  
HETATM    5  C   UNL     1       1.777   1.124  -1.253  1.00  0.00           C  
HETATM    6  O   UNL     1       1.336   2.245  -1.308  1.00  0.00           O  
HETATM    7  C   UNL     1       1.253   0.069  -2.202  1.00  0.00           C  
HETATM    8  C   UNL     1       0.298   0.728  -3.206  1.00  0.00           C  
HETATM    9  C   UNL     1       0.478  -0.968  -1.388  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.923  -0.823  -1.657  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.493  -0.153  -0.530  1.00  0.00           C  
HETATM   12  O   UNL     1      -1.083   1.213  -0.534  1.00  0.00           O  
HETATM   13  C   UNL     1      -1.518   1.798   0.691  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.938   3.208   0.816  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.047   1.874   0.715  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.619   0.455   0.623  1.00  0.00           C  
HETATM   17  N   UNL     1      -5.081   0.521   0.491  1.00  0.00           N  
HETATM   18  C   UNL     1      -5.598   1.011   1.775  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.368   1.561  -0.505  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.019  -0.235  -0.607  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.423  -1.606  -0.631  1.00  0.00           O  
HETATM   22  C   UNL     1       0.904  -2.396  -1.706  1.00  0.00           C  
HETATM   23  C   UNL     1       2.418  -2.572  -1.648  1.00  0.00           C  
HETATM   24  C   UNL     1       0.216  -3.371  -0.749  1.00  0.00           C  
HETATM   25  C   UNL     1       0.875  -3.405   0.624  1.00  0.00           C  
HETATM   26  C   UNL     1       0.166  -4.467   1.484  1.00  0.00           C  
HETATM   27  C   UNL     1       0.743  -2.073   1.317  1.00  0.00           C  
HETATM   28  O   UNL     1      -0.315  -1.750   1.814  1.00  0.00           O  
HETATM   29  C   UNL     1       1.891  -1.165   1.382  1.00  0.00           C  
HETATM   30  C   UNL     1       1.783   0.009   2.001  1.00  0.00           C  
HETATM   31  C   UNL     1       2.940   0.968   2.064  1.00  0.00           C  
HETATM   32  C   UNL     1       4.228   0.218   2.409  1.00  0.00           C  
HETATM   33  H   UNL     1       4.386   2.320  -1.602  1.00  0.00           H  
HETATM   34  H   UNL     1       4.099   3.806  -0.665  1.00  0.00           H  
HETATM   35  H   UNL     1       5.757   3.193  -0.877  1.00  0.00           H  
HETATM   36  H   UNL     1       5.182   1.179   0.450  1.00  0.00           H  
HETATM   37  H   UNL     1       4.895   2.665   1.387  1.00  0.00           H  
HETATM   38  H   UNL     1       2.483   2.574   0.705  1.00  0.00           H  
HETATM   39  H   UNL     1       2.079  -0.370  -2.744  1.00  0.00           H  
HETATM   40  H   UNL     1       0.820   1.528  -3.732  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.044  -0.017  -3.925  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.559   1.141  -2.675  1.00  0.00           H  
HETATM   43  H   UNL     1       0.639  -0.762  -0.329  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.150  -0.631   0.387  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.173   1.189   1.527  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.281   3.818  -0.020  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.271   3.656   1.753  1.00  0.00           H  
HETATM   48  H   UNL     1       0.151   3.156   0.805  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.374   2.340   1.645  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.396   2.464  -0.133  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.357  -0.104   1.521  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.685   1.078   1.727  1.00  0.00           H  
HETATM   53  H   UNL     1      -5.311   0.323   2.570  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.183   1.998   1.982  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.788   1.370  -1.408  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.431   1.549  -0.747  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.099   2.536  -0.100  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.367   0.264  -1.512  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.025  -2.001  -1.419  1.00  0.00           H  
HETATM   60  H   UNL     1       0.574  -2.636  -2.727  1.00  0.00           H  
HETATM   61  H   UNL     1       2.775  -2.327  -0.647  1.00  0.00           H  
HETATM   62  H   UNL     1       2.673  -3.606  -1.881  1.00  0.00           H  
HETATM   63  H   UNL     1       2.889  -1.909  -2.374  1.00  0.00           H  
HETATM   64  H   UNL     1      -0.833  -3.074  -0.633  1.00  0.00           H  
HETATM   65  H   UNL     1       0.235  -4.375  -1.185  1.00  0.00           H  
HETATM   66  H   UNL     1       1.923  -3.683   0.559  1.00  0.00           H  
HETATM   67  H   UNL     1       0.257  -5.442   1.006  1.00  0.00           H  
HETATM   68  H   UNL     1       0.628  -4.502   2.471  1.00  0.00           H  
HETATM   69  H   UNL     1      -0.888  -4.209   1.585  1.00  0.00           H  
HETATM   70  H   UNL     1       2.815  -1.451   0.906  1.00  0.00           H  
HETATM   71  H   UNL     1       0.846   0.281   2.470  1.00  0.00           H  
HETATM   72  H   UNL     1       2.747   1.716   2.838  1.00  0.00           H  
HETATM   73  H   UNL     1       4.428  -0.533   1.645  1.00  0.00           H  
HETATM   74  H   UNL     1       5.059   0.923   2.452  1.00  0.00           H  
HETATM   75  H   UNL     1       4.116  -0.270   3.377  1.00  0.00           H  
CONECT    1    2   33   34   35                                       
CONECT    2    1    3   36   37                                       
CONECT    3    2    4   31   38                                       
CONECT    4    3    5                                                 
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5    8    9   39                                       
CONECT    8    7   40   41   42                                       
CONECT    9    7   10   22   43                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   20   44                                       
CONECT   12   11   13                                                 
CONECT   13   12   14   15   45                                       
CONECT   14   13   46   47   48                                       
CONECT   15   13   16   49   50                                       
CONECT   16   15   17   20   51                                       
CONECT   17   16   18   19                                            
CONECT   18   17   52   53   54                                       
CONECT   19   17   55   56   57                                       
CONECT   20   11   16   21   58                                       
CONECT   21   20   59                                                 
CONECT   22    9   23   24   60                                       
CONECT   23   22   61   62   63                                       
CONECT   24   22   25   64   65                                       
CONECT   25   24   26   27   66                                       
CONECT   26   25   67   68   69                                       
CONECT   27   25   28   28   29                                       
CONECT   28   27   27                                                 
CONECT   29   27   30   30   70                                       
CONECT   30   29   29   31   71                                       
CONECT   31    3   30   32   72                                       
CONECT   32   31   73   74   75                                       
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44   11                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   14                                                      
CONECT   48   14                                                      
CONECT   49   15                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   19                                                      
CONECT   58   20                                                      
CONECT   59   21                                                      
CONECT   60   22                                                      
CONECT   61   23                                                      
CONECT   62   23                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   24                                                      
CONECT   66   25                                                      
CONECT   67   26                                                      
CONECT   68   26                                                      
CONECT   69   26                                                      
CONECT   70   29                                                      
CONECT   71   30                                                      
CONECT   72   31                                                      
CONECT   73   32                                                      
CONECT   74   32                                                      
CONECT   75   32                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
