COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.062   0.743   0.734  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.162  -0.172  -0.138  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.477  -1.592   0.337  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.419  -2.608  -0.063  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.041  -2.141   0.398  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.687  -0.827  -0.323  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.722   0.228   0.066  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.624  -0.003  -1.586  1.00  0.00           C  
HETATM    9  O   UNL     1      -5.622  -1.586   1.764  1.00  0.00           O  
HETATM   10  C   UNL     1      -3.343   1.558  -0.583  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.022   2.030   0.049  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.907   1.030  -0.255  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.316  -0.375   0.175  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.670  -1.112  -1.820  1.00  0.00           C  
HETATM   15  C   UNL     1       0.358   1.390   0.507  1.00  0.00           C  
HETATM   16  C   UNL     1       1.469   0.373   0.145  1.00  0.00           C  
HETATM   17  C   UNL     1       2.711   0.996   0.790  1.00  0.00           C  
HETATM   18  C   UNL     1       2.472   2.526   0.698  1.00  0.00           C  
HETATM   19  C   UNL     1       1.043   2.710   0.112  1.00  0.00           C  
HETATM   20  C   UNL     1       1.081  -1.012   0.605  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.229  -1.402  -0.114  1.00  0.00           C  
HETATM   22  C   UNL     1       3.974   0.613  -0.013  1.00  0.00           C  
HETATM   23  O   UNL     1       4.151  -0.784   0.094  1.00  0.00           O  
HETATM   24  C   UNL     1       5.390  -1.412  -0.163  1.00  0.00           C  
HETATM   25  C   UNL     1       6.548  -0.649   0.486  1.00  0.00           C  
HETATM   26  C   UNL     1       6.475   0.826   0.082  1.00  0.00           C  
HETATM   27  C   UNL     1       5.146   1.400   0.571  1.00  0.00           C  
HETATM   28  C   UNL     1       3.739   1.041  -1.464  1.00  0.00           C  
HETATM   29  C   UNL     1       0.115   1.415   2.021  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.592   1.109  -1.757  1.00  0.00           C  
HETATM   31  C   UNL     1       5.649  -1.578  -1.660  1.00  0.00           C  
HETATM   32  C   UNL     1       5.352  -2.822   0.464  1.00  0.00           C  
HETATM   33  O   UNL     1       2.102  -1.952   0.247  1.00  0.00           O  
HETATM   34  O   UNL     1      -4.319   2.572  -0.335  1.00  0.00           O  
HETATM   35  H   UNL     1      -5.921   1.782   0.436  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.107   0.464   0.596  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.791   0.626   1.783  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.440  -1.894  -0.099  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.642  -3.562   0.442  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.443  -2.797  -1.130  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.049  -1.964   1.472  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.298  -2.897   0.153  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.590   0.384   1.166  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.580   1.051  -1.861  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.973  -0.578  -2.245  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.649  -0.362  -1.685  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.823  -2.452   2.143  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.219   1.453  -1.655  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.762   3.003  -0.367  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.176   2.124   1.122  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.426  -0.369   1.284  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.604  -1.594  -2.109  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.559  -0.176  -2.367  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.833  -1.771  -2.055  1.00  0.00           H  
HETATM   55  H   UNL     1       1.644   0.353  -0.936  1.00  0.00           H  
HETATM   56  H   UNL     1       2.807   0.679   1.823  1.00  0.00           H  
HETATM   57  H   UNL     1       2.539   2.980   1.684  1.00  0.00           H  
HETATM   58  H   UNL     1       3.206   2.976   0.028  1.00  0.00           H  
HETATM   59  H   UNL     1       1.092   2.846  -0.962  1.00  0.00           H  
HETATM   60  H   UNL     1       0.541   3.552   0.591  1.00  0.00           H  
HETATM   61  H   UNL     1       0.933  -1.047   1.682  1.00  0.00           H  
HETATM   62  H   UNL     1      -0.544  -2.377   0.260  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.036  -1.476  -1.179  1.00  0.00           H  
HETATM   64  H   UNL     1       6.476  -0.734   1.571  1.00  0.00           H  
HETATM   65  H   UNL     1       7.495  -1.073   0.152  1.00  0.00           H  
HETATM   66  H   UNL     1       7.298   1.367   0.559  1.00  0.00           H  
HETATM   67  H   UNL     1       6.564   0.932  -0.995  1.00  0.00           H  
HETATM   68  H   UNL     1       5.069   2.446   0.266  1.00  0.00           H  
HETATM   69  H   UNL     1       5.109   1.349   1.662  1.00  0.00           H  
HETATM   70  H   UNL     1       3.412   2.081  -1.488  1.00  0.00           H  
HETATM   71  H   UNL     1       4.666   0.939  -2.028  1.00  0.00           H  
HETATM   72  H   UNL     1       2.971   0.409  -1.910  1.00  0.00           H  
HETATM   73  H   UNL     1       1.037   1.690   2.533  1.00  0.00           H  
HETATM   74  H   UNL     1      -0.661   2.145   2.252  1.00  0.00           H  
HETATM   75  H   UNL     1      -0.205   0.428   2.354  1.00  0.00           H  
HETATM   76  H   UNL     1      -0.128   2.069  -1.981  1.00  0.00           H  
HETATM   77  H   UNL     1       0.090   0.303  -2.027  1.00  0.00           H  
HETATM   78  H   UNL     1      -1.516   1.009  -2.327  1.00  0.00           H  
HETATM   79  H   UNL     1       5.659  -0.599  -2.138  1.00  0.00           H  
HETATM   80  H   UNL     1       6.612  -2.066  -1.811  1.00  0.00           H  
HETATM   81  H   UNL     1       4.860  -2.189  -2.100  1.00  0.00           H  
HETATM   82  H   UNL     1       4.541  -3.397   0.018  1.00  0.00           H  
HETATM   83  H   UNL     1       6.300  -3.328   0.279  1.00  0.00           H  
HETATM   84  H   UNL     1       5.189  -2.738   1.539  1.00  0.00           H  
HETATM   85  H   UNL     1       1.898  -2.865   0.488  1.00  0.00           H  
HETATM   86  H   UNL     1      -4.107   3.427  -0.734  1.00  0.00           H  
CONECT    1    2   35   36   37                                       
CONECT    2    1    3    7    8                                       
CONECT    3    4    9    2   38                                       
CONECT    4    5    3   39   40                                       
CONECT    5    4    6   41   42                                       
CONECT    6    5   13    7   14                                       
CONECT    7    2    6   10   43                                       
CONECT    8    2   44   45   46                                       
CONECT    9    3   47                                                 
CONECT   10    7   11   34   48                                       
CONECT   11   12   10   49   50                                       
CONECT   12   13   15   11   30                                       
CONECT   13   21    6   12   51                                       
CONECT   14    6   52   53   54                                       
CONECT   15   29   16   12   19                                       
CONECT   16   20   17   15   55                                       
CONECT   17   16   22   18   56                                       
CONECT   18   17   19   57   58                                       
CONECT   19   15   18   59   60                                       
CONECT   20   21   33   16   61                                       
CONECT   21   20   13   62   63                                       
CONECT   22   23   17   27   28                                       
CONECT   23   24   22                                                 
CONECT   24   32   25   23   31                                       
CONECT   25   24   26   64   65                                       
CONECT   26   25   27   66   67                                       
CONECT   27   26   22   68   69                                       
CONECT   28   22   70   71   72                                       
CONECT   29   15   73   74   75                                       
CONECT   30   12   76   77   78                                       
CONECT   31   24   79   80   81                                       
CONECT   32   24   82   83   84                                       
CONECT   33   20   85                                                 
CONECT   34   10   86                                                 
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    1                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    5                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   11                                                      
CONECT   50   11                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   16                                                      
CONECT   56   17                                                      
CONECT   57   18                                                      
CONECT   58   18                                                      
CONECT   59   19                                                      
CONECT   60   19                                                      
CONECT   61   20                                                      
CONECT   62   21                                                      
CONECT   63   21                                                      
CONECT   64   25                                                      
CONECT   65   25                                                      
CONECT   66   26                                                      
CONECT   67   26                                                      
CONECT   68   27                                                      
CONECT   69   27                                                      
CONECT   70   28                                                      
CONECT   71   28                                                      
CONECT   72   28                                                      
CONECT   73   29                                                      
CONECT   74   29                                                      
CONECT   75   29                                                      
CONECT   76   30                                                      
CONECT   77   30                                                      
CONECT   78   30                                                      
CONECT   79   31                                                      
CONECT   80   31                                                      
CONECT   81   31                                                      
CONECT   82   32                                                      
CONECT   83   32                                                      
CONECT   84   32                                                      
CONECT   85   33                                                      
CONECT   86   34                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
