COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.679   1.415   0.186  1.00  0.00           O  
HETATM    2  C   UNL     1       6.767   0.442  -0.526  1.00  0.00           C  
HETATM    3  O   UNL     1       7.954   0.098  -1.048  1.00  0.00           O  
HETATM    4  C   UNL     1       5.544  -0.388  -0.822  1.00  0.00           C  
HETATM    5  C   UNL     1       4.334   0.213  -0.104  1.00  0.00           C  
HETATM    6  O   UNL     1       4.523   0.118   1.309  1.00  0.00           O  
HETATM    7  C   UNL     1       3.072  -0.554  -0.503  1.00  0.00           C  
HETATM    8  C   UNL     1       1.847   0.122   0.116  1.00  0.00           C  
HETATM    9  O   UNL     1       1.916   0.023   1.539  1.00  0.00           O  
HETATM   10  C   UNL     1       0.576  -0.569  -0.383  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.651   0.184   0.135  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.921  -0.508  -0.364  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.109  -0.087   0.505  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.753  -2.025  -0.263  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.237  -2.378   1.133  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.047  -2.742  -0.502  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.237  -2.177  -0.399  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.343  -0.744  -0.041  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.480  -0.108  -0.255  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.600   1.374  -0.011  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.665   1.967  -0.936  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.236   2.010  -0.315  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.204   1.414   0.641  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.926   1.989   0.362  1.00  0.00           O  
HETATM   25  H   UNL     1       5.362  -0.397  -1.896  1.00  0.00           H  
HETATM   26  H   UNL     1       5.705  -1.408  -0.472  1.00  0.00           H  
HETATM   27  H   UNL     1       4.227   1.260  -0.387  1.00  0.00           H  
HETATM   28  H   UNL     1       4.625  -0.787   1.633  1.00  0.00           H  
HETATM   29  H   UNL     1       2.976  -0.557  -1.588  1.00  0.00           H  
HETATM   30  H   UNL     1       3.141  -1.580  -0.141  1.00  0.00           H  
HETATM   31  H   UNL     1       1.827   1.173  -0.175  1.00  0.00           H  
HETATM   32  H   UNL     1       1.937  -0.885   1.870  1.00  0.00           H  
HETATM   33  H   UNL     1       0.568  -0.571  -1.473  1.00  0.00           H  
HETATM   34  H   UNL     1       0.554  -1.596  -0.017  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.642   0.186   1.225  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.628   1.210  -0.231  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.108  -0.226  -1.400  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.940  -0.485   1.505  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.024  -2.352  -1.005  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.953  -2.037   1.882  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.115  -3.458   1.213  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.277  -1.890   1.300  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.004  -3.785  -0.777  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.130  -2.759  -0.575  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.338  -0.660  -0.612  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.870   1.556   1.029  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.625   1.490  -0.736  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.748   3.038  -0.755  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.383   1.794  -1.974  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.951   1.793  -1.344  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.293   3.088  -0.168  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.486   1.660   1.665  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.905   2.953   0.429  1.00  0.00           H  
HETATM   54  H   UNL     1       8.710   0.659  -0.827  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   54                                                 
CONECT    4    2    5   25   26                                       
CONECT    5    4    6    7   27                                       
CONECT    6    5   28                                                 
CONECT    7    5    8   29   30                                       
CONECT    8    7    9   10   31                                       
CONECT    9    8   32                                                 
CONECT   10    8   11   33   34                                       
CONECT   11   10   12   35   36                                       
CONECT   12   11   13   14   37                                       
CONECT   13   12   18   23   38                                       
CONECT   14   12   15   16   39                                       
CONECT   15   14   40   41   42                                       
CONECT   16   14   17   17   43                                       
CONECT   17   16   16   18   44                                       
CONECT   18   13   17   19   19                                       
CONECT   19   18   18   20   45                                       
CONECT   20   19   21   22   46                                       
CONECT   21   20   47   48   49                                       
CONECT   22   20   23   50   51                                       
CONECT   23   13   22   24   52                                       
CONECT   24   23   53                                                 
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54    3                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
