COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.700   2.597   0.481  1.00  0.00           O  
HETATM    2  O   UNL     1      -8.289   1.101  -1.010  1.00  0.00           O  
HETATM    3  O   UNL     1       3.489   2.760   0.875  1.00  0.00           O  
HETATM    4  C   UNL     1      -5.480   1.810   1.383  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.925   1.730   0.881  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.962   1.040  -0.483  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.540  -0.425  -0.335  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.154  -0.463   0.276  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.180  -1.250  -0.227  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.852  -1.259   0.391  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.891  -2.036  -0.106  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.112  -2.935  -1.314  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.920   0.403   1.450  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.010  -2.728  -2.351  1.00  0.00           C  
HETATM   15  C   UNL     1       0.389  -2.774  -1.714  1.00  0.00           C  
HETATM   16  C   UNL     1       0.450  -1.685  -0.669  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.511  -2.082   0.481  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.174  -1.019   1.528  1.00  0.00           C  
HETATM   19  C   UNL     1       1.377  -0.941   1.451  1.00  0.00           C  
HETATM   20  C   UNL     1       1.770  -1.445   0.048  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.024  -0.367  -1.283  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.248  -0.031   2.516  1.00  0.00           C  
HETATM   23  C   UNL     1       2.582  -0.373  -0.680  1.00  0.00           C  
HETATM   24  C   UNL     1       2.995  -0.893  -2.058  1.00  0.00           C  
HETATM   25  C   UNL     1       3.833  -0.040   0.135  1.00  0.00           C  
HETATM   26  C   UNL     1       4.579   1.121  -0.526  1.00  0.00           C  
HETATM   27  C   UNL     1       3.708   2.378  -0.484  1.00  0.00           C  
HETATM   28  C   UNL     1       4.415   3.514  -1.226  1.00  0.00           C  
HETATM   29  C   UNL     1       3.544   4.771  -1.183  1.00  0.00           C  
HETATM   30  C   UNL     1       5.759   3.802  -0.554  1.00  0.00           C  
HETATM   31  C   UNL     1       4.746  -1.266   0.193  1.00  0.00           C  
HETATM   32  C   UNL     1       5.935  -0.974   1.110  1.00  0.00           C  
HETATM   33  C   UNL     1       6.848  -2.201   1.168  1.00  0.00           C  
HETATM   34  C   UNL     1       8.038  -1.909   2.085  1.00  0.00           C  
HETATM   35  H   UNL     1      -3.772   2.688   0.740  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.388   0.681  -1.876  1.00  0.00           H  
HETATM   37  H   UNL     1       4.299   2.958   1.364  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.460   2.261   2.375  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.525   1.161   1.591  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.333   2.737   0.789  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.278   1.546  -1.164  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.242  -0.946   0.316  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.523  -0.904  -1.314  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.380  -1.873  -1.086  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.653  -0.636   1.251  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.110  -3.976  -0.992  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.077  -2.701  -1.764  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.082  -3.509  -3.107  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.151  -1.758  -2.830  1.00  0.00           H  
HETATM   50  H   UNL     1       0.551  -3.745  -1.247  1.00  0.00           H  
HETATM   51  H   UNL     1       1.148  -2.597  -2.477  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.282  -3.083   0.848  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.622  -0.061   1.265  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.496  -1.337   2.520  1.00  0.00           H  
HETATM   55  H   UNL     1       1.708   0.088   1.592  1.00  0.00           H  
HETATM   56  H   UNL     1       1.823  -1.584   2.210  1.00  0.00           H  
HETATM   57  H   UNL     1       2.338  -2.372   0.114  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.081  -0.444  -1.538  1.00  0.00           H  
HETATM   59  H   UNL     1       0.118   0.441  -0.565  1.00  0.00           H  
HETATM   60  H   UNL     1       0.552  -0.157  -2.184  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.092   0.625   3.360  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.860  -1.038   2.536  1.00  0.00           H  
HETATM   63  H   UNL     1       1.976   0.525  -0.798  1.00  0.00           H  
HETATM   64  H   UNL     1       3.526  -1.839  -1.945  1.00  0.00           H  
HETATM   65  H   UNL     1       2.106  -1.046  -2.670  1.00  0.00           H  
HETATM   66  H   UNL     1       3.648  -0.166  -2.541  1.00  0.00           H  
HETATM   67  H   UNL     1       3.543   0.245   1.147  1.00  0.00           H  
HETATM   68  H   UNL     1       5.511   1.306   0.009  1.00  0.00           H  
HETATM   69  H   UNL     1       4.800   0.867  -1.563  1.00  0.00           H  
HETATM   70  H   UNL     1       2.750   2.172  -0.963  1.00  0.00           H  
HETATM   71  H   UNL     1       4.583   3.222  -2.263  1.00  0.00           H  
HETATM   72  H   UNL     1       3.377   5.062  -0.147  1.00  0.00           H  
HETATM   73  H   UNL     1       4.048   5.580  -1.712  1.00  0.00           H  
HETATM   74  H   UNL     1       2.586   4.565  -1.662  1.00  0.00           H  
HETATM   75  H   UNL     1       6.380   2.907  -0.584  1.00  0.00           H  
HETATM   76  H   UNL     1       6.263   4.612  -1.082  1.00  0.00           H  
HETATM   77  H   UNL     1       5.592   4.094   0.483  1.00  0.00           H  
HETATM   78  H   UNL     1       4.187  -2.117   0.582  1.00  0.00           H  
HETATM   79  H   UNL     1       5.108  -1.497  -0.809  1.00  0.00           H  
HETATM   80  H   UNL     1       6.494  -0.123   0.720  1.00  0.00           H  
HETATM   81  H   UNL     1       5.574  -0.743   2.112  1.00  0.00           H  
HETATM   82  H   UNL     1       6.289  -3.052   1.557  1.00  0.00           H  
HETATM   83  H   UNL     1       7.210  -2.432   0.166  1.00  0.00           H  
HETATM   84  H   UNL     1       8.688  -2.783   2.126  1.00  0.00           H  
HETATM   85  H   UNL     1       8.596  -1.058   1.695  1.00  0.00           H  
HETATM   86  H   UNL     1       7.676  -1.678   3.086  1.00  0.00           H  
CONECT    1    4   35                                                 
CONECT    2    6   36                                                 
CONECT    3   27   37                                                 
CONECT    4    1    5   13   38                                       
CONECT    5    4    6   39   40                                       
CONECT    6    2    5    7   41                                       
CONECT    7    6    8   42   43                                       
CONECT    8    7    9    9   13                                       
CONECT    9    8    8   10   44                                       
CONECT   10    9   11   11   45                                       
CONECT   11   10   10   12   17                                       
CONECT   12   11   14   46   47                                       
CONECT   13    4    8   22   22                                       
CONECT   14   12   15   48   49                                       
CONECT   15   14   16   50   51                                       
CONECT   16   15   17   20   21                                       
CONECT   17   11   16   18   52                                       
CONECT   18   17   19   53   54                                       
CONECT   19   18   20   55   56                                       
CONECT   20   16   19   23   57                                       
CONECT   21   16   58   59   60                                       
CONECT   22   13   13   61   62                                       
CONECT   23   20   24   25   63                                       
CONECT   24   23   64   65   66                                       
CONECT   25   23   26   31   67                                       
CONECT   26   25   27   68   69                                       
CONECT   27    3   26   28   70                                       
CONECT   28   27   29   30   71                                       
CONECT   29   28   72   73   74                                       
CONECT   30   28   75   76   77                                       
CONECT   31   25   32   78   79                                       
CONECT   32   31   33   80   81                                       
CONECT   33   32   34   82   83                                       
CONECT   34   33   84   85   86                                       
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    9                                                      
CONECT   45   10                                                      
CONECT   46   12                                                      
CONECT   47   12                                                      
CONECT   48   14                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   15                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   19                                                      
CONECT   56   19                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   21                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   22                                                      
CONECT   63   23                                                      
CONECT   64   24                                                      
CONECT   65   24                                                      
CONECT   66   24                                                      
CONECT   67   25                                                      
CONECT   68   26                                                      
CONECT   69   26                                                      
CONECT   70   27                                                      
CONECT   71   28                                                      
CONECT   72   29                                                      
CONECT   73   29                                                      
CONECT   74   29                                                      
CONECT   75   30                                                      
CONECT   76   30                                                      
CONECT   77   30                                                      
CONECT   78   31                                                      
CONECT   79   31                                                      
CONECT   80   32                                                      
CONECT   81   32                                                      
CONECT   82   33                                                      
CONECT   83   33                                                      
CONECT   84   34                                                      
CONECT   85   34                                                      
CONECT   86   34                                                      
MASTER        0    0    0    0    0    0    0    0   86    0   86    0
END
