COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      16.583  38.097  35.244  1.00  0.00           O  
HETATM    2  C   UNL     1      16.759  39.069  36.016  1.00  0.00           C  
HETATM    3  O   UNL     1      17.595  39.978  35.818  1.00  0.00           O  
HETATM    4  C   UNL     1      15.998  39.190  37.178  1.00  0.00           C  
HETATM    5  C   UNL     1      15.016  38.303  37.597  1.00  0.00           C  
HETATM    6  C   UNL     1      14.688  37.081  36.752  1.00  0.00           C  
HETATM    7  C   UNL     1      14.351  38.587  38.794  1.00  0.00           C  
HETATM    8  C   UNL     1      13.369  37.790  39.381  1.00  0.00           C  
HETATM    9  C   UNL     1      12.752  38.252  40.549  1.00  0.00           C  
HETATM   10  O   UNL     1      13.507  38.156  41.772  1.00  0.00           O  
HETATM   11  C   UNL     1      11.378  37.598  40.652  1.00  0.00           C  
HETATM   12  C   UNL     1      10.676  37.624  39.310  1.00  0.00           C  
HETATM   13  C   UNL     1       9.347  36.874  39.387  1.00  0.00           C  
HETATM   14  C   UNL     1       8.450  37.303  38.237  1.00  0.00           C  
HETATM   15  C   UNL     1       7.322  36.295  38.011  1.00  0.00           C  
HETATM   16  C   UNL     1      11.533  36.165  41.125  1.00  0.00           C  
HETATM   17  C   UNL     1      12.253  36.172  42.469  1.00  0.00           C  
HETATM   18  C   UNL     1      13.615  36.877  42.402  1.00  0.00           C  
HETATM   19  O   UNL     1      14.534  36.012  41.709  1.00  0.00           O  
HETATM   20  C   UNL     1      14.133  37.097  43.823  1.00  0.00           C  
HETATM   21  C   UNL     1      15.529  37.722  43.779  1.00  0.00           C  
HETATM   22  C   UNL     1      16.500  36.844  42.980  1.00  0.00           C  
HETATM   23  C   UNL     1      17.839  37.564  42.798  1.00  0.00           C  
HETATM   24  C   UNL     1      15.908  36.441  41.619  1.00  0.00           C  
HETATM   25  C   UNL     1      16.597  35.225  40.963  1.00  0.00           C  
HETATM   26  C   UNL     1      16.054  34.960  39.693  1.00  0.00           C  
HETATM   27  C   UNL     1      15.049  34.061  39.320  1.00  0.00           C  
HETATM   28  C   UNL     1      14.349  33.153  40.342  1.00  0.00           C  
HETATM   29  C   UNL     1      14.680  33.967  37.974  1.00  0.00           C  
HETATM   30  C   UNL     1      13.666  33.112  37.544  1.00  0.00           C  
HETATM   31  C   UNL     1      13.251  32.990  36.064  1.00  0.00           C  
HETATM   32  O   UNL     1      14.030  33.848  35.226  1.00  0.00           O  
HETATM   33  C   UNL     1      11.758  33.283  35.850  1.00  0.00           C  
HETATM   34  C   UNL     1      11.341  34.662  36.388  1.00  0.00           C  
HETATM   35  C   UNL     1      11.530  33.183  34.340  1.00  0.00           C  
HETATM   36  C   UNL     1      10.602  33.921  33.620  1.00  0.00           C  
HETATM   37  C   UNL     1      10.516  33.764  32.233  1.00  0.00           C  
HETATM   38  O   UNL     1      11.319  32.987  31.660  1.00  0.00           O  
HETATM   39  O   UNL     1       9.625  34.399  31.643  1.00  0.00           O  
HETATM   40  H   UNL     1      18.060  39.810  35.007  1.00  0.00           H  
HETATM   41  H   UNL     1      16.189  40.048  37.806  1.00  0.00           H  
HETATM   42  H   UNL     1      13.891  36.500  37.240  1.00  0.00           H  
HETATM   43  H   UNL     1      14.349  37.404  35.757  1.00  0.00           H  
HETATM   44  H   UNL     1      15.587  36.455  36.648  1.00  0.00           H  
HETATM   45  H   UNL     1      14.620  39.499  39.306  1.00  0.00           H  
HETATM   46  H   UNL     1      13.092  36.841  38.946  1.00  0.00           H  
HETATM   47  H   UNL     1      12.552  39.323  40.397  1.00  0.00           H  
HETATM   48  H   UNL     1      10.773  38.153  41.384  1.00  0.00           H  
HETATM   49  H   UNL     1      11.318  37.146  38.556  1.00  0.00           H  
HETATM   50  H   UNL     1      10.486  38.668  39.021  1.00  0.00           H  
HETATM   51  H   UNL     1       8.852  37.104  40.342  1.00  0.00           H  
HETATM   52  H   UNL     1       9.533  35.792  39.321  1.00  0.00           H  
HETATM   53  H   UNL     1       9.053  37.378  37.320  1.00  0.00           H  
HETATM   54  H   UNL     1       8.013  38.285  38.470  1.00  0.00           H  
HETATM   55  H   UNL     1       6.691  36.631  37.175  1.00  0.00           H  
HETATM   56  H   UNL     1       7.752  35.311  37.773  1.00  0.00           H  
HETATM   57  H   UNL     1       6.712  36.217  38.923  1.00  0.00           H  
HETATM   58  H   UNL     1      10.541  35.703  41.238  1.00  0.00           H  
HETATM   59  H   UNL     1      12.122  35.594  40.392  1.00  0.00           H  
HETATM   60  H   UNL     1      11.622  36.692  43.205  1.00  0.00           H  
HETATM   61  H   UNL     1      12.410  35.132  42.791  1.00  0.00           H  
HETATM   62  H   UNL     1      13.449  37.770  44.360  1.00  0.00           H  
HETATM   63  H   UNL     1      14.183  36.131  44.347  1.00  0.00           H  
HETATM   64  H   UNL     1      15.906  37.832  44.806  1.00  0.00           H  
HETATM   65  H   UNL     1      15.465  38.712  43.304  1.00  0.00           H  
HETATM   66  H   UNL     1      16.682  35.925  43.557  1.00  0.00           H  
HETATM   67  H   UNL     1      18.243  37.842  43.783  1.00  0.00           H  
HETATM   68  H   UNL     1      18.548  36.896  42.286  1.00  0.00           H  
HETATM   69  H   UNL     1      17.688  38.471  42.194  1.00  0.00           H  
HETATM   70  H   UNL     1      15.988  37.299  40.935  1.00  0.00           H  
HETATM   71  H   UNL     1      16.457  34.343  41.605  1.00  0.00           H  
HETATM   72  H   UNL     1      17.672  35.435  40.858  1.00  0.00           H  
HETATM   73  H   UNL     1      16.476  35.537  38.884  1.00  0.00           H  
HETATM   74  H   UNL     1      14.752  33.351  41.346  1.00  0.00           H  
HETATM   75  H   UNL     1      13.268  33.357  40.334  1.00  0.00           H  
HETATM   76  H   UNL     1      14.525  32.100  40.078  1.00  0.00           H  
HETATM   77  H   UNL     1      15.196  34.575  37.246  1.00  0.00           H  
HETATM   78  H   UNL     1      13.150  32.511  38.278  1.00  0.00           H  
HETATM   79  H   UNL     1      13.427  31.947  35.761  1.00  0.00           H  
HETATM   80  H   UNL     1      14.953  33.667  35.358  1.00  0.00           H  
HETATM   81  H   UNL     1      11.165  32.507  36.356  1.00  0.00           H  
HETATM   82  H   UNL     1      11.517  34.701  37.473  1.00  0.00           H  
HETATM   83  H   UNL     1      11.935  35.444  35.892  1.00  0.00           H  
HETATM   84  H   UNL     1      10.273  34.827  36.184  1.00  0.00           H  
HETATM   85  H   UNL     1      12.141  32.481  33.791  1.00  0.00           H  
HETATM   86  H   UNL     1       9.948  34.614  34.129  1.00  0.00           H  
HETATM   87  H   UNL     1      11.133  32.970  30.729  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   40                                                 
CONECT    4    2    5    5   41                                       
CONECT    5    6    4    4    7                                       
CONECT    6    5   42   43   44                                       
CONECT    7    5    8    8   45                                       
CONECT    8    7    7    9   46                                       
CONECT    9    8   11   10   47                                       
CONECT   10    9   18                                                 
CONECT   11   12    9   16   48                                       
CONECT   12   13   11   49   50                                       
CONECT   13   14   12   51   52                                       
CONECT   14   15   13   53   54                                       
CONECT   15   14   55   56   57                                       
CONECT   16   11   17   58   59                                       
CONECT   17   16   18   60   61                                       
CONECT   18   19   10   17   20                                       
CONECT   19   24   18                                                 
CONECT   20   18   21   62   63                                       
CONECT   21   22   20   64   65                                       
CONECT   22   24   23   21   66                                       
CONECT   23   22   67   68   69                                       
CONECT   24   25   19   22   70                                       
CONECT   25   26   24   71   72                                       
CONECT   26   27   27   25   73                                       
CONECT   27   29   26   26   28                                       
CONECT   28   27   74   75   76                                       
CONECT   29   30   30   27   77                                       
CONECT   30   31   29   29   78                                       
CONECT   31   32   33   30   79                                       
CONECT   32   31   80                                                 
CONECT   33   35   31   34   81                                       
CONECT   34   33   82   83   84                                       
CONECT   35   36   36   33   85                                       
CONECT   36   37   35   35   86                                       
CONECT   37   39   39   38   36                                       
CONECT   38   37   87                                                 
CONECT   39   37   37                                                 
CONECT   40    3                                                      
CONECT   41    4                                                      
CONECT   42    6                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    7                                                      
CONECT   46    8                                                      
CONECT   47    9                                                      
CONECT   48   11                                                      
CONECT   49   12                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   13                                                      
CONECT   53   14                                                      
CONECT   54   14                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   15                                                      
CONECT   58   16                                                      
CONECT   59   16                                                      
CONECT   60   17                                                      
CONECT   61   17                                                      
CONECT   62   20                                                      
CONECT   63   20                                                      
CONECT   64   21                                                      
CONECT   65   21                                                      
CONECT   66   22                                                      
CONECT   67   23                                                      
CONECT   68   23                                                      
CONECT   69   23                                                      
CONECT   70   24                                                      
CONECT   71   25                                                      
CONECT   72   25                                                      
CONECT   73   26                                                      
CONECT   74   28                                                      
CONECT   75   28                                                      
CONECT   76   28                                                      
CONECT   77   29                                                      
CONECT   78   30                                                      
CONECT   79   31                                                      
CONECT   80   32                                                      
CONECT   81   33                                                      
CONECT   82   34                                                      
CONECT   83   34                                                      
CONECT   84   34                                                      
CONECT   85   35                                                      
CONECT   86   36                                                      
CONECT   87   38                                                      
MASTER        0    0    0    0    0    0    0    0   87    0   87    0
END
