COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      18.769   0.605   0.110  1.00  0.00           O  
HETATM    2  C   UNL     1      17.914   1.429  -0.684  1.00  0.00           C  
HETATM    3  C   UNL     1      16.953   0.546  -1.484  1.00  0.00           C  
HETATM    4  O   UNL     1      16.084  -0.147  -0.586  1.00  0.00           O  
HETATM    5  C   UNL     1      15.216  -0.950  -1.388  1.00  0.00           C  
HETATM    6  C   UNL     1      14.254  -1.722  -0.483  1.00  0.00           C  
HETATM    7  O   UNL     1      13.397  -0.802   0.196  1.00  0.00           O  
HETATM    8  C   UNL     1      12.527  -1.580   1.021  1.00  0.00           C  
HETATM    9  C   UNL     1      11.578  -0.650   1.780  1.00  0.00           C  
HETATM   10  O   UNL     1      10.722   0.018   0.852  1.00  0.00           O  
HETATM   11  C   UNL     1       9.864   0.866   1.618  1.00  0.00           C  
HETATM   12  C   UNL     1       8.916   1.615   0.679  1.00  0.00           C  
HETATM   13  O   UNL     1       8.047   0.681   0.035  1.00  0.00           O  
HETATM   14  C   UNL     1       7.191   1.437  -0.824  1.00  0.00           C  
HETATM   15  C   UNL     1       6.230   0.491  -1.547  1.00  0.00           C  
HETATM   16  O   UNL     1       5.361  -0.125  -0.595  1.00  0.00           O  
HETATM   17  C   UNL     1       4.493  -0.991  -1.328  1.00  0.00           C  
HETATM   18  C   UNL     1       3.531  -1.686  -0.362  1.00  0.00           C  
HETATM   19  O   UNL     1       2.675  -0.713   0.240  1.00  0.00           O  
HETATM   20  C   UNL     1       1.805  -1.421   1.127  1.00  0.00           C  
HETATM   21  C   UNL     1       0.857  -0.432   1.808  1.00  0.00           C  
HETATM   22  O   UNL     1       0.000   0.158   0.828  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.857   1.067   1.522  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.805   1.736   0.525  1.00  0.00           C  
HETATM   25  O   UNL     1      -2.675   0.752  -0.039  1.00  0.00           O  
HETATM   26  C   UNL     1      -3.531   1.435  -0.957  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.493   0.433  -1.599  1.00  0.00           C  
HETATM   28  O   UNL     1      -5.361  -0.103  -0.599  1.00  0.00           O  
HETATM   29  C   UNL     1      -6.230  -1.026  -1.257  1.00  0.00           C  
HETATM   30  C   UNL     1      -7.191  -1.639  -0.237  1.00  0.00           C  
HETATM   31  O   UNL     1      -8.047  -0.620   0.283  1.00  0.00           O  
HETATM   32  C   UNL     1      -8.916  -1.252   1.226  1.00  0.00           C  
HETATM   33  C   UNL     1      -9.864  -0.210   1.823  1.00  0.00           C  
HETATM   34  O   UNL     1     -10.722   0.297   0.799  1.00  0.00           O  
HETATM   35  C   UNL     1     -11.578   1.260   1.416  1.00  0.00           C  
HETATM   36  C   UNL     1     -12.527   1.845   0.368  1.00  0.00           C  
HETATM   37  O   UNL     1     -13.397   0.818  -0.112  1.00  0.00           O  
HETATM   38  C   UNL     1     -14.254   1.424  -1.082  1.00  0.00           C  
HETATM   39  C   UNL     1     -15.216   0.373  -1.640  1.00  0.00           C  
HETATM   40  O   UNL     1     -16.084  -0.079  -0.598  1.00  0.00           O  
HETATM   41  C   UNL     1     -16.953  -1.053  -1.178  1.00  0.00           C  
HETATM   42  C   UNL     1     -17.914  -1.580  -0.110  1.00  0.00           C  
HETATM   43  O   UNL     1     -18.769  -0.522   0.325  1.00  0.00           O  
HETATM   44  H   UNL     1      19.357   1.199   0.596  1.00  0.00           H  
HETATM   45  H   UNL     1      17.342   2.092  -0.035  1.00  0.00           H  
HETATM   46  H   UNL     1      18.517   2.024  -1.370  1.00  0.00           H  
HETATM   47  H   UNL     1      16.362   1.168  -2.155  1.00  0.00           H  
HETATM   48  H   UNL     1      17.524  -0.177  -2.067  1.00  0.00           H  
HETATM   49  H   UNL     1      14.646  -0.309  -2.061  1.00  0.00           H  
HETATM   50  H   UNL     1      15.809  -1.654  -1.972  1.00  0.00           H  
HETATM   51  H   UNL     1      13.652  -2.401  -1.087  1.00  0.00           H  
HETATM   52  H   UNL     1      14.824  -2.295   0.248  1.00  0.00           H  
HETATM   53  H   UNL     1      11.947  -2.260   0.397  1.00  0.00           H  
HETATM   54  H   UNL     1      13.119  -2.155   1.733  1.00  0.00           H  
HETATM   55  H   UNL     1      10.975  -1.235   2.475  1.00  0.00           H  
HETATM   56  H   UNL     1      12.159   0.087   2.335  1.00  0.00           H  
HETATM   57  H   UNL     1       9.283   0.262   2.314  1.00  0.00           H  
HETATM   58  H   UNL     1      10.466   1.584   2.174  1.00  0.00           H  
HETATM   59  H   UNL     1       8.323   2.327   1.253  1.00  0.00           H  
HETATM   60  H   UNL     1       9.497   2.149  -0.074  1.00  0.00           H  
HETATM   61  H   UNL     1       6.620   2.151  -0.230  1.00  0.00           H  
HETATM   62  H   UNL     1       7.794   1.973  -1.557  1.00  0.00           H  
HETATM   63  H   UNL     1       5.638   1.056  -2.267  1.00  0.00           H  
HETATM   64  H   UNL     1       6.801  -0.277  -2.069  1.00  0.00           H  
HETATM   65  H   UNL     1       3.923  -0.408  -2.050  1.00  0.00           H  
HETATM   66  H   UNL     1       5.086  -1.741  -1.852  1.00  0.00           H  
HETATM   67  H   UNL     1       2.929  -2.412  -0.908  1.00  0.00           H  
HETATM   68  H   UNL     1       4.102  -2.197   0.414  1.00  0.00           H  
HETATM   69  H   UNL     1       1.225  -2.150   0.561  1.00  0.00           H  
HETATM   70  H   UNL     1       2.398  -1.935   1.883  1.00  0.00           H  
HETATM   71  H   UNL     1       0.255  -0.957   2.548  1.00  0.00           H  
HETATM   72  H   UNL     1       1.438   0.349   2.299  1.00  0.00           H  
HETATM   73  H   UNL     1      -1.438   0.522   2.266  1.00  0.00           H  
HETATM   74  H   UNL     1      -0.254   1.828   2.017  1.00  0.00           H  
HETATM   75  H   UNL     1      -2.398   2.492   1.039  1.00  0.00           H  
HETATM   76  H   UNL     1      -1.225   2.206  -0.269  1.00  0.00           H  
HETATM   77  H   UNL     1      -4.102   2.196  -0.424  1.00  0.00           H  
HETATM   78  H   UNL     1      -2.929   1.909  -1.732  1.00  0.00           H  
HETATM   79  H   UNL     1      -5.086   0.937  -2.363  1.00  0.00           H  
HETATM   80  H   UNL     1      -3.923  -0.376  -2.056  1.00  0.00           H  
HETATM   81  H   UNL     1      -6.801  -0.504  -2.025  1.00  0.00           H  
HETATM   82  H   UNL     1      -5.638  -1.816  -1.719  1.00  0.00           H  
HETATM   83  H   UNL     1      -7.794  -2.407  -0.721  1.00  0.00           H  
HETATM   84  H   UNL     1      -6.620  -2.085   0.578  1.00  0.00           H  
HETATM   85  H   UNL     1      -9.497  -2.025   0.723  1.00  0.00           H  
HETATM   86  H   UNL     1      -8.323  -1.702   2.021  1.00  0.00           H  
HETATM   87  H   UNL     1     -10.466  -0.673   2.605  1.00  0.00           H  
HETATM   88  H   UNL     1      -9.283   0.608   2.249  1.00  0.00           H  
HETATM   89  H   UNL     1     -12.158   0.778   2.203  1.00  0.00           H  
HETATM   90  H   UNL     1     -10.975   2.059   1.847  1.00  0.00           H  
HETATM   91  H   UNL     1     -13.119   2.642   0.819  1.00  0.00           H  
HETATM   92  H   UNL     1     -11.947   2.248  -0.462  1.00  0.00           H  
HETATM   93  H   UNL     1     -14.824   2.226  -0.613  1.00  0.00           H  
HETATM   94  H   UNL     1     -13.652   1.832  -1.894  1.00  0.00           H  
HETATM   95  H   UNL     1     -15.809   0.812  -2.442  1.00  0.00           H  
HETATM   96  H   UNL     1     -14.647  -0.471  -2.029  1.00  0.00           H  
HETATM   97  H   UNL     1     -17.524  -0.596  -1.986  1.00  0.00           H  
HETATM   98  H   UNL     1     -16.362  -1.879  -1.573  1.00  0.00           H  
HETATM   99  H   UNL     1     -18.517  -2.386  -0.529  1.00  0.00           H  
HETATM  100  H   UNL     1     -17.342  -1.958   0.738  1.00  0.00           H  
HETATM  101  H   UNL     1     -19.357  -0.895   0.996  1.00  0.00           H  
CONECT    1    2   44                                                 
CONECT    2    1    3   45   46                                       
CONECT    3    2    4   47   48                                       
CONECT    4    3    5                                                 
CONECT    5    4    6   49   50                                       
CONECT    6    5    7   51   52                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   53   54                                       
CONECT    9    8   10   55   56                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   57   58                                       
CONECT   12   11   13   59   60                                       
CONECT   13   12   14                                                 
CONECT   14   13   15   61   62                                       
CONECT   15   14   16   63   64                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   65   66                                       
CONECT   18   17   19   67   68                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   69   70                                       
CONECT   21   20   22   71   72                                       
CONECT   22   21   23                                                 
CONECT   23   22   24   73   74                                       
CONECT   24   23   25   75   76                                       
CONECT   25   24   26                                                 
CONECT   26   25   27   77   78                                       
CONECT   27   26   28   79   80                                       
CONECT   28   27   29                                                 
CONECT   29   28   30   81   82                                       
CONECT   30   29   31   83   84                                       
CONECT   31   30   32                                                 
CONECT   32   31   33   85   86                                       
CONECT   33   32   34   87   88                                       
CONECT   34   33   35                                                 
CONECT   35   34   36   89   90                                       
CONECT   36   35   37   91   92                                       
CONECT   37   36   38                                                 
CONECT   38   37   39   93   94                                       
CONECT   39   38   40   95   96                                       
CONECT   40   39   41                                                 
CONECT   41   40   42   97   98                                       
CONECT   42   41   43   99  100                                       
CONECT   43   42  101                                                 
CONECT   44    1                                                      
CONECT   45    2                                                      
CONECT   46    2                                                      
CONECT   47    3                                                      
CONECT   48    3                                                      
CONECT   49    5                                                      
CONECT   50    5                                                      
CONECT   51    6                                                      
CONECT   52    6                                                      
CONECT   53    8                                                      
CONECT   54    8                                                      
CONECT   55    9                                                      
CONECT   56    9                                                      
CONECT   57   11                                                      
CONECT   58   11                                                      
CONECT   59   12                                                      
CONECT   60   12                                                      
CONECT   61   14                                                      
CONECT   62   14                                                      
CONECT   63   15                                                      
CONECT   64   15                                                      
CONECT   65   17                                                      
CONECT   66   17                                                      
CONECT   67   18                                                      
CONECT   68   18                                                      
CONECT   69   20                                                      
CONECT   70   20                                                      
CONECT   71   21                                                      
CONECT   72   21                                                      
CONECT   73   23                                                      
CONECT   74   23                                                      
CONECT   75   24                                                      
CONECT   76   24                                                      
CONECT   77   26                                                      
CONECT   78   26                                                      
CONECT   79   27                                                      
CONECT   80   27                                                      
CONECT   81   29                                                      
CONECT   82   29                                                      
CONECT   83   30                                                      
CONECT   84   30                                                      
CONECT   85   32                                                      
CONECT   86   32                                                      
CONECT   87   33                                                      
CONECT   88   33                                                      
CONECT   89   35                                                      
CONECT   90   35                                                      
CONECT   91   36                                                      
CONECT   92   36                                                      
CONECT   93   38                                                      
CONECT   94   38                                                      
CONECT   95   39                                                      
CONECT   96   39                                                      
CONECT   97   41                                                      
CONECT   98   41                                                      
CONECT   99   42                                                      
CONECT  100   42                                                      
CONECT  101   43                                                      
MASTER        0    0    0    0    0    0    0    0  101    0  101    0
END
