COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.791   0.746   0.253  1.00  0.00           O  
HETATM    2  C   UNL     1       5.374   0.889   0.409  1.00  0.00           C  
HETATM    3  C   UNL     1       4.773  -0.466   0.780  1.00  0.00           C  
HETATM    4  C   UNL     1       5.185  -0.737   2.248  1.00  0.00           C  
HETATM    5  C   UNL     1       5.404  -1.569  -0.071  1.00  0.00           C  
HETATM    6  C   UNL     1       3.264  -0.459   0.708  1.00  0.00           C  
HETATM    7  C   UNL     1       2.645  -1.836   0.946  1.00  0.00           C  
HETATM    8  C   UNL     1       1.168  -1.617   1.310  1.00  0.00           C  
HETATM    9  C   UNL     1       0.426  -0.907   0.186  1.00  0.00           C  
HETATM   10  C   UNL     1       0.235  -1.907  -0.969  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.979  -0.499   0.655  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.826   0.359   1.918  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.803  -1.722   1.032  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.269  -1.362   1.259  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.882  -0.738   0.007  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.773  -1.695  -1.155  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.174  -1.369  -2.152  1.00  0.00           O  
HETATM   18  O   UNL     1      -4.343  -2.908  -1.081  1.00  0.00           O  
HETATM   19  C   UNL     1      -5.340  -0.459   0.260  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.823   0.715   0.500  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.011   1.974   0.573  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.267   2.827  -0.668  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.433   2.764   1.818  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.521   1.640   0.680  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.161   0.561  -0.336  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.663   0.347  -0.376  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.019   0.953  -1.340  1.00  0.00           C  
HETATM   28  C   UNL     1       0.461   0.861  -1.570  1.00  0.00           C  
HETATM   29  C   UNL     1       1.153   0.331  -0.315  1.00  0.00           C  
HETATM   30  C   UNL     1       2.656   0.158  -0.544  1.00  0.00           C  
HETATM   31  C   UNL     1       2.938  -0.663  -1.796  1.00  0.00           C  
HETATM   32  C   UNL     1       3.262   1.558  -0.747  1.00  0.00           C  
HETATM   33  C   UNL     1       4.779   1.447  -0.878  1.00  0.00           C  
HETATM   34  O   UNL     1       5.317   2.759  -1.107  1.00  0.00           O  
HETATM   35  H   UNL     1       7.249   1.571   0.042  1.00  0.00           H  
HETATM   36  H   UNL     1       5.186   1.594   1.226  1.00  0.00           H  
HETATM   37  H   UNL     1       4.792   0.054   2.888  1.00  0.00           H  
HETATM   38  H   UNL     1       4.780  -1.697   2.568  1.00  0.00           H  
HETATM   39  H   UNL     1       6.272  -0.758   2.323  1.00  0.00           H  
HETATM   40  H   UNL     1       6.457  -1.672   0.191  1.00  0.00           H  
HETATM   41  H   UNL     1       4.889  -2.511   0.116  1.00  0.00           H  
HETATM   42  H   UNL     1       5.315  -1.309  -1.126  1.00  0.00           H  
HETATM   43  H   UNL     1       2.912   0.178   1.560  1.00  0.00           H  
HETATM   44  H   UNL     1       2.724  -2.473   0.077  1.00  0.00           H  
HETATM   45  H   UNL     1       3.130  -2.327   1.793  1.00  0.00           H  
HETATM   46  H   UNL     1       0.711  -2.596   1.487  1.00  0.00           H  
HETATM   47  H   UNL     1       1.148  -1.052   2.239  1.00  0.00           H  
HETATM   48  H   UNL     1       1.207  -2.279  -1.292  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.379  -2.741  -0.629  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.259  -1.408  -1.803  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.235   1.245   1.686  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.811   0.663   2.273  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.324  -0.220   2.693  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.743  -2.522   0.302  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.407  -2.127   1.981  1.00  0.00           H  
HETATM   56  H   UNL     1      -3.822  -2.276   1.503  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.363  -0.674   2.098  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.246  -3.486  -1.850  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.025  -1.295   0.239  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.889   0.797   0.659  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.325   3.084  -0.721  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.675   3.740  -0.610  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.984   2.267  -1.559  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.259   2.161   2.708  1.00  0.00           H  
HETATM   65  H   UNL     1      -4.848   3.682   1.881  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.492   3.012   1.748  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.932   2.539   0.490  1.00  0.00           H  
HETATM   68  H   UNL     1      -3.316   1.285   1.693  1.00  0.00           H  
HETATM   69  H   UNL     1      -3.483   0.884  -1.334  1.00  0.00           H  
HETATM   70  H   UNL     1      -1.600   1.559  -2.023  1.00  0.00           H  
HETATM   71  H   UNL     1       0.645   0.238  -2.439  1.00  0.00           H  
HETATM   72  H   UNL     1       0.838   1.869  -1.786  1.00  0.00           H  
HETATM   73  H   UNL     1       1.062   1.126   0.456  1.00  0.00           H  
HETATM   74  H   UNL     1       2.373  -0.254  -2.634  1.00  0.00           H  
HETATM   75  H   UNL     1       4.003  -0.624  -2.023  1.00  0.00           H  
HETATM   76  H   UNL     1       2.639  -1.697  -1.627  1.00  0.00           H  
HETATM   77  H   UNL     1       2.847   1.997  -1.653  1.00  0.00           H  
HETATM   78  H   UNL     1       3.011   2.180   0.111  1.00  0.00           H  
HETATM   79  H   UNL     1       5.052   0.820  -1.724  1.00  0.00           H  
HETATM   80  H   UNL     1       6.279   2.777  -1.203  1.00  0.00           H  
CONECT    1    2   35                                                 
CONECT    2    3   33    1   36                                       
CONECT    3    5    6    2    4                                       
CONECT    4    3   37   38   39                                       
CONECT    5    3   40   41   42                                       
CONECT    6    7   30    3   43                                       
CONECT    7    8    6   44   45                                       
CONECT    8    7    9   46   47                                       
CONECT    9   10   29    8   11                                       
CONECT   10    9   48   49   50                                       
CONECT   11    9   26   13   12                                       
CONECT   12   11   51   52   53                                       
CONECT   13   11   14   54   55                                       
CONECT   14   15   13   56   57                                       
CONECT   15   16   19   25   14                                       
CONECT   16   17   17   18   15                                       
CONECT   17   16   16                                                 
CONECT   18   16   58                                                 
CONECT   19   15   20   20   59                                       
CONECT   20   19   19   21   60                                       
CONECT   21   22   20   24   23                                       
CONECT   22   21   61   62   63                                       
CONECT   23   21   64   65   66                                       
CONECT   24   25   21   67   68                                       
CONECT   25   15   26   24   69                                       
CONECT   26   27   27   25   11                                       
CONECT   27   28   26   26   70                                       
CONECT   28   27   29   71   72                                       
CONECT   29   28    9   30   73                                       
CONECT   30   31   29    6   32                                       
CONECT   31   30   74   75   76                                       
CONECT   32   30   33   77   78                                       
CONECT   33   32    2   34   79                                       
CONECT   34   33   80                                                 
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    5                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44    7                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    8                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   10                                                      
CONECT   51   12                                                      
CONECT   52   12                                                      
CONECT   53   12                                                      
CONECT   54   13                                                      
CONECT   55   13                                                      
CONECT   56   14                                                      
CONECT   57   14                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   20                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   22                                                      
CONECT   64   23                                                      
CONECT   65   23                                                      
CONECT   66   23                                                      
CONECT   67   24                                                      
CONECT   68   24                                                      
CONECT   69   25                                                      
CONECT   70   27                                                      
CONECT   71   28                                                      
CONECT   72   28                                                      
CONECT   73   29                                                      
CONECT   74   31                                                      
CONECT   75   31                                                      
CONECT   76   31                                                      
CONECT   77   32                                                      
CONECT   78   32                                                      
CONECT   79   33                                                      
CONECT   80   34                                                      
MASTER        0    0    0    0    0    0    0    0   80    0   80    0
END
