COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.953  -0.111   0.612  1.00  0.00           C  
HETATM    2  C   UNL     1       0.990  -2.770  -1.162  1.00  0.00           C  
HETATM    3  C   UNL     1       0.353  -3.766  -1.878  1.00  0.00           C  
HETATM    4  O   UNL     1      -0.981   1.109  -0.320  1.00  0.00           O  
HETATM    5  C   UNL     1      -2.284   1.099  -0.702  1.00  0.00           C  
HETATM    6  O   UNL     1       3.365  -0.370   2.539  1.00  0.00           O  
HETATM    7  C   UNL     1       3.725  -0.513   1.395  1.00  0.00           C  
HETATM    8  O   UNL     1       4.953  -0.119   1.023  1.00  0.00           O  
HETATM    9  C   UNL     1       2.794  -1.134   0.384  1.00  0.00           C  
HETATM   10  C   UNL     1       1.428  -1.530   0.967  1.00  0.00           C  
HETATM   11  C   UNL     1       0.729  -2.612   0.186  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.175  -3.447   0.817  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.816  -4.440   0.100  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.545  -4.605  -1.246  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.449  -0.063   0.061  1.00  0.00           C  
HETATM   16  O   UNL     1      -1.094  -1.080  -0.036  1.00  0.00           O  
HETATM   17  C   UNL     1      -2.612   1.062  -2.028  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.944   1.052  -2.436  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.957   1.079  -1.528  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.662   1.117  -0.154  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.683   1.146   0.811  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.359   1.182   2.133  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.029   1.191   2.545  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.014   1.164   1.638  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.309   1.121   0.267  1.00  0.00           C  
HETATM   26  C   UNL     1       2.042  -0.101  -0.474  1.00  0.00           C  
HETATM   27  C   UNL     1       2.760   1.218  -0.600  1.00  0.00           C  
HETATM   28  C   UNL     1       3.275   1.610  -1.821  1.00  0.00           C  
HETATM   29  C   UNL     1       3.934   2.820  -1.937  1.00  0.00           C  
HETATM   30  C   UNL     1       4.078   3.637  -0.831  1.00  0.00           C  
HETATM   31  C   UNL     1       3.562   3.245   0.390  1.00  0.00           C  
HETATM   32  C   UNL     1       2.899   2.037   0.504  1.00  0.00           C  
HETATM   33  H   UNL     1       1.121   0.617   1.405  1.00  0.00           H  
HETATM   34  H   UNL     1       1.695  -2.117  -1.656  1.00  0.00           H  
HETATM   35  H   UNL     1       0.558  -3.890  -2.931  1.00  0.00           H  
HETATM   36  H   UNL     1       5.514   0.273   1.706  1.00  0.00           H  
HETATM   37  H   UNL     1       3.267  -1.926  -0.196  1.00  0.00           H  
HETATM   38  H   UNL     1       1.451  -1.728   2.039  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.379  -3.323   1.870  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.521  -5.092   0.593  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.046  -5.381  -1.806  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.828   1.041  -2.770  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.176   1.023  -3.491  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.984   1.071  -1.861  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.719   1.139   0.506  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.146   1.204   2.873  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.799   1.221   3.600  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.987   1.172   1.973  1.00  0.00           H  
HETATM   49  H   UNL     1       1.704  -0.494  -1.433  1.00  0.00           H  
HETATM   50  H   UNL     1       3.163   0.972  -2.685  1.00  0.00           H  
HETATM   51  H   UNL     1       4.337   3.127  -2.891  1.00  0.00           H  
HETATM   52  H   UNL     1       4.593   4.582  -0.921  1.00  0.00           H  
HETATM   53  H   UNL     1       3.675   3.883   1.254  1.00  0.00           H  
HETATM   54  H   UNL     1       2.493   1.732   1.458  1.00  0.00           H  
CONECT    1   10   26   15   33                                       
CONECT    2    3    3   11   34                                       
CONECT    3   14    2    2   35                                       
CONECT    4   15    5                                                 
CONECT    5   25    4   17   17                                       
CONECT    6    7    7                                                 
CONECT    7    6    6    8    9                                       
CONECT    8    7   36                                                 
CONECT    9    7   10   26   37                                       
CONECT   10   11    9    1   38                                       
CONECT   11   12   12    2   10                                       
CONECT   12   13   11   11   39                                       
CONECT   13   14   14   12   40                                       
CONECT   14   13   13    3   41                                       
CONECT   15   16   16    1    4                                       
CONECT   16   15   15                                                 
CONECT   17    5    5   18   42                                       
CONECT   18   19   19   17   43                                       
CONECT   19   20   18   18   44                                       
CONECT   20   21   21   25   19                                       
CONECT   21   22   20   20   45                                       
CONECT   22   23   23   21   46                                       
CONECT   23   22   22   24   47                                       
CONECT   24   23   25   25   48                                       
CONECT   25   24   24   20    5                                       
CONECT   26    9    1   27   49                                       
CONECT   27   26   32   32   28                                       
CONECT   28   27   29   29   50                                       
CONECT   29   28   28   30   51                                       
CONECT   30   31   31   29   52                                       
CONECT   31   32   30   30   53                                       
CONECT   32   27   27   31   54                                       
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
CONECT   54   32                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
