COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.529  -3.488   0.844  1.00  0.00           O  
HETATM    2  C   UNL     1       8.189  -2.343   0.301  1.00  0.00           C  
HETATM    3  C   UNL     1       8.612  -1.411   1.438  1.00  0.00           C  
HETATM    4  C   UNL     1       9.427  -2.790  -0.480  1.00  0.00           C  
HETATM    5  C   UNL     1       7.234  -1.602  -0.637  1.00  0.00           C  
HETATM    6  C   UNL     1       6.057  -1.047   0.168  1.00  0.00           C  
HETATM    7  C   UNL     1       5.102  -0.306  -0.771  1.00  0.00           C  
HETATM    8  C   UNL     1       3.925   0.249   0.034  1.00  0.00           C  
HETATM    9  C   UNL     1       4.432   1.308   1.015  1.00  0.00           C  
HETATM   10  C   UNL     1       2.909   0.881  -0.919  1.00  0.00           C  
HETATM   11  C   UNL     1       2.329  -0.192  -1.877  1.00  0.00           C  
HETATM   12  C   UNL     1       0.787  -0.167  -1.679  1.00  0.00           C  
HETATM   13  C   UNL     1       0.537   1.247  -1.149  1.00  0.00           C  
HETATM   14  C   UNL     1       1.712   1.408  -0.141  1.00  0.00           C  
HETATM   15  C   UNL     1       1.463   0.507   1.070  1.00  0.00           C  
HETATM   16  C   UNL     1       1.728   2.848   0.316  1.00  0.00           C  
HETATM   17  C   UNL     1       0.465   3.079   1.163  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.809   2.795   0.369  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.015   3.903  -0.666  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.265   5.210   0.040  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.515   6.252  -0.224  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.712   1.455  -0.346  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.667   0.534  -0.264  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.872   0.794   0.540  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.764  -0.172   0.730  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.085   0.123   1.403  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.219  -0.335   0.477  1.00  0.00           C  
HETATM   28  O   UNL     1      -6.291   0.532  -0.658  1.00  0.00           O  
HETATM   29  C   UNL     1      -3.479  -1.584   0.271  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.617  -2.037  -0.653  1.00  0.00           C  
HETATM   31  O   UNL     1      -4.505  -3.441  -0.898  1.00  0.00           O  
HETATM   32  C   UNL     1      -5.932  -1.748   0.023  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.812  -2.700   0.210  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.184  -2.365   0.735  1.00  0.00           C  
HETATM   35  O   UNL     1      -9.167  -3.089  -0.009  1.00  0.00           O  
HETATM   36  H   UNL     1       8.077  -4.007   1.449  1.00  0.00           H  
HETATM   37  H   UNL     1       9.292  -1.939   2.106  1.00  0.00           H  
HETATM   38  H   UNL     1       9.115  -0.538   1.024  1.00  0.00           H  
HETATM   39  H   UNL     1       7.731  -1.093   1.994  1.00  0.00           H  
HETATM   40  H   UNL     1       9.125  -3.454  -1.290  1.00  0.00           H  
HETATM   41  H   UNL     1       9.930  -1.916  -0.894  1.00  0.00           H  
HETATM   42  H   UNL     1      10.107  -3.318   0.188  1.00  0.00           H  
HETATM   43  H   UNL     1       7.764  -0.780  -1.120  1.00  0.00           H  
HETATM   44  H   UNL     1       6.863  -2.290  -1.396  1.00  0.00           H  
HETATM   45  H   UNL     1       5.527  -1.869   0.650  1.00  0.00           H  
HETATM   46  H   UNL     1       6.428  -0.359   0.927  1.00  0.00           H  
HETATM   47  H   UNL     1       5.632   0.516  -1.253  1.00  0.00           H  
HETATM   48  H   UNL     1       4.731  -0.994  -1.530  1.00  0.00           H  
HETATM   49  H   UNL     1       3.449  -0.561   0.587  1.00  0.00           H  
HETATM   50  H   UNL     1       4.907   2.117   0.462  1.00  0.00           H  
HETATM   51  H   UNL     1       3.593   1.702   1.589  1.00  0.00           H  
HETATM   52  H   UNL     1       5.155   0.857   1.694  1.00  0.00           H  
HETATM   53  H   UNL     1       3.374   1.686  -1.488  1.00  0.00           H  
HETATM   54  H   UNL     1       2.577   0.055  -2.909  1.00  0.00           H  
HETATM   55  H   UNL     1       2.724  -1.175  -1.622  1.00  0.00           H  
HETATM   56  H   UNL     1       0.272  -0.320  -2.628  1.00  0.00           H  
HETATM   57  H   UNL     1       0.480  -0.913  -0.947  1.00  0.00           H  
HETATM   58  H   UNL     1       0.613   1.980  -1.953  1.00  0.00           H  
HETATM   59  H   UNL     1       1.537  -0.538   0.767  1.00  0.00           H  
HETATM   60  H   UNL     1       2.208   0.716   1.838  1.00  0.00           H  
HETATM   61  H   UNL     1       0.467   0.701   1.468  1.00  0.00           H  
HETATM   62  H   UNL     1       2.617   3.034   0.919  1.00  0.00           H  
HETATM   63  H   UNL     1       1.722   3.511  -0.548  1.00  0.00           H  
HETATM   64  H   UNL     1       0.495   2.423   2.033  1.00  0.00           H  
HETATM   65  H   UNL     1       0.448   4.115   1.500  1.00  0.00           H  
HETATM   66  H   UNL     1      -1.660   2.777   1.050  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.123   3.990  -1.287  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.872   3.659  -1.293  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.062   5.289   0.765  1.00  0.00           H  
HETATM   70  H   UNL     1       0.282   6.173  -0.949  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.695   7.188   0.282  1.00  0.00           H  
HETATM   72  H   UNL     1      -1.559  -0.404  -0.787  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.030   1.769   0.976  1.00  0.00           H  
HETATM   74  H   UNL     1      -5.143  -0.419   2.347  1.00  0.00           H  
HETATM   75  H   UNL     1      -5.170   1.193   1.589  1.00  0.00           H  
HETATM   76  H   UNL     1      -7.166  -0.309   1.017  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.461   1.457  -0.436  1.00  0.00           H  
HETATM   78  H   UNL     1      -2.534  -1.609  -0.273  1.00  0.00           H  
HETATM   79  H   UNL     1      -3.421  -2.245   1.135  1.00  0.00           H  
HETATM   80  H   UNL     1      -4.559  -1.496  -1.597  1.00  0.00           H  
HETATM   81  H   UNL     1      -3.675  -3.702  -1.321  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.553  -3.725  -0.011  1.00  0.00           H  
HETATM   83  H   UNL     1      -8.248  -2.642   1.787  1.00  0.00           H  
HETATM   84  H   UNL     1      -8.363  -1.295   0.628  1.00  0.00           H  
HETATM   85  H   UNL     1     -10.076  -2.921   0.275  1.00  0.00           H  
CONECT    1    2   36                                                 
CONECT    2    4    5    1    3                                       
CONECT    3    2   37   38   39                                       
CONECT    4    2   40   41   42                                       
CONECT    5    2    6   43   44                                       
CONECT    6    5    7   45   46                                       
CONECT    7    6    8   47   48                                       
CONECT    8   10    7    9   49                                       
CONECT    9    8   50   51   52                                       
CONECT   10   11   14    8   53                                       
CONECT   11   12   10   54   55                                       
CONECT   12   13   11   56   57                                       
CONECT   13   12   22   14   58                                       
CONECT   14   13   15   10   16                                       
CONECT   15   14   59   60   61                                       
CONECT   16   14   17   62   63                                       
CONECT   17   18   16   64   65                                       
CONECT   18   22   19   17   66                                       
CONECT   19   18   20   67   68                                       
CONECT   20   19   21   21   69                                       
CONECT   21   20   20   70   71                                       
CONECT   22   23   23   13   18                                       
CONECT   23   24   22   22   72                                       
CONECT   24   25   25   23   73                                       
CONECT   25   26   29   24   24                                       
CONECT   26   27   25   74   75                                       
CONECT   27   28   32   26   76                                       
CONECT   28   27   77                                                 
CONECT   29   30   25   78   79                                       
CONECT   30   32   31   29   80                                       
CONECT   31   30   81                                                 
CONECT   32   33   33   27   30                                       
CONECT   33   34   32   32   82                                       
CONECT   34   35   33   83   84                                       
CONECT   35   34   85                                                 
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    5                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51    9                                                      
CONECT   52    9                                                      
CONECT   53   10                                                      
CONECT   54   11                                                      
CONECT   55   11                                                      
CONECT   56   12                                                      
CONECT   57   12                                                      
CONECT   58   13                                                      
CONECT   59   15                                                      
CONECT   60   15                                                      
CONECT   61   15                                                      
CONECT   62   16                                                      
CONECT   63   16                                                      
CONECT   64   17                                                      
CONECT   65   17                                                      
CONECT   66   18                                                      
CONECT   67   19                                                      
CONECT   68   19                                                      
CONECT   69   20                                                      
CONECT   70   21                                                      
CONECT   71   21                                                      
CONECT   72   23                                                      
CONECT   73   24                                                      
CONECT   74   26                                                      
CONECT   75   26                                                      
CONECT   76   27                                                      
CONECT   77   28                                                      
CONECT   78   29                                                      
CONECT   79   29                                                      
CONECT   80   30                                                      
CONECT   81   31                                                      
CONECT   82   33                                                      
CONECT   83   34                                                      
CONECT   84   34                                                      
CONECT   85   35                                                      
MASTER        0    0    0    0    0    0    0    0   85    0   85    0
END
