COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.055  -0.513   7.695  1.00  0.00           C  
HETATM    2  O   UNL     1       1.768  -1.679   7.562  1.00  0.00           O  
HETATM    3  O   UNL     1       2.895  -0.136   8.671  1.00  0.00           O  
HETATM    4  C   UNL     1       1.469   0.516   6.764  1.00  0.00           C  
HETATM    5  C   UNL     1       0.552  -0.172   5.751  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.041   0.873   4.806  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.958   0.184   3.794  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.552   1.230   2.849  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.469   0.541   1.837  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.054   1.571   0.906  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.946   1.420  -0.390  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.341   0.159  -0.953  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.284  -0.442  -1.962  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.854  -0.744  -3.162  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.384  -0.650  -3.482  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.913  -1.954  -4.070  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.265  -1.963  -5.208  1.00  0.00           C  
HETATM   18  C   UNL     1       0.160  -0.664  -5.843  1.00  0.00           C  
HETATM   19  C   UNL     1       1.657  -0.713  -6.151  1.00  0.00           C  
HETATM   20  C   UNL     1       2.089   0.604  -6.796  1.00  0.00           C  
HETATM   21  C   UNL     1       3.587   0.555  -7.104  1.00  0.00           C  
HETATM   22  C   UNL     1       4.018   1.874  -7.749  1.00  0.00           C  
HETATM   23  H   UNL     1       3.270  -0.797   9.268  1.00  0.00           H  
HETATM   24  H   UNL     1       2.274   1.028   6.235  1.00  0.00           H  
HETATM   25  H   UNL     1       0.895   1.242   7.340  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.252  -0.683   6.280  1.00  0.00           H  
HETATM   27  H   UNL     1       1.127  -0.897   5.175  1.00  0.00           H  
HETATM   28  H   UNL     1       0.763   1.385   4.278  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.616   1.599   5.382  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.763  -0.326   4.322  1.00  0.00           H  
HETATM   31  H   UNL     1      -0.383  -0.540   3.218  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.747   1.742   2.321  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.127   1.955   3.425  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.274   0.030   2.365  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.894  -0.183   1.261  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.563   2.435   1.308  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.290   2.198  -1.055  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.169  -0.552  -0.146  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.394   0.396  -1.437  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.315  -0.625  -1.696  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.553  -1.060  -3.923  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.827  -0.441  -2.568  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.219   0.153  -4.200  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.111  -2.882  -3.554  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.034  -2.901  -5.692  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.043   0.158  -5.158  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.396  -0.513  -6.768  1.00  0.00           H  
HETATM   48  H   UNL     1       1.861  -1.536  -6.837  1.00  0.00           H  
HETATM   49  H   UNL     1       2.214  -0.865  -5.227  1.00  0.00           H  
HETATM   50  H   UNL     1       1.886   1.427  -6.111  1.00  0.00           H  
HETATM   51  H   UNL     1       1.533   0.756  -7.721  1.00  0.00           H  
HETATM   52  H   UNL     1       3.790  -0.267  -7.789  1.00  0.00           H  
HETATM   53  H   UNL     1       4.143   0.404  -6.179  1.00  0.00           H  
HETATM   54  H   UNL     1       5.086   1.839  -7.968  1.00  0.00           H  
HETATM   55  H   UNL     1       3.462   2.026  -8.674  1.00  0.00           H  
HETATM   56  H   UNL     1       3.815   2.697  -7.064  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    2    1    1                                                 
CONECT    3    1   23                                                 
CONECT    4    1    5   24   25                                       
CONECT    5    4    6   26   27                                       
CONECT    6    5    7   28   29                                       
CONECT    7    6    8   30   31                                       
CONECT    8    7    9   32   33                                       
CONECT    9    8   10   34   35                                       
CONECT   10    9   11   11   36                                       
CONECT   11   10   10   12   37                                       
CONECT   12   11   13   38   39                                       
CONECT   13   12   14   14   40                                       
CONECT   14   13   13   15   41                                       
CONECT   15   14   16   42   43                                       
CONECT   16   15   17   17   44                                       
CONECT   17   16   16   18   45                                       
CONECT   18   17   19   46   47                                       
CONECT   19   18   20   48   49                                       
CONECT   20   19   21   50   51                                       
CONECT   21   20   22   52   53                                       
CONECT   22   21   54   55   56                                       
CONECT   23    3                                                      
CONECT   24    4                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
