COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.848   0.091  -0.570  1.00  0.00           C  
HETATM    2  C   UNL     1       6.341  -0.757   0.419  1.00  0.00           C  
HETATM    3  C   UNL     1       5.484  -1.632   1.067  1.00  0.00           C  
HETATM    4  C   UNL     1       4.143  -1.661   0.733  1.00  0.00           C  
HETATM    5  C   UNL     1       3.653  -0.820  -0.249  1.00  0.00           C  
HETATM    6  C   UNL     1       4.503   0.056  -0.899  1.00  0.00           C  
HETATM    7  C   UNL     1       7.923   0.741  -0.063  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.911  -0.198   1.166  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.081   0.120  -0.080  1.00  0.00           C  
HETATM   10  C   UNL     1       1.424   0.136   0.266  1.00  0.00           C  
HETATM   11  C   UNL     1       2.191  -0.857  -0.610  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.377   1.524  -0.568  1.00  0.00           C  
HETATM   13  C   UNL     1       1.841   1.587  -0.060  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.372  -0.248   0.797  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.138   0.901   0.855  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.482   0.859   0.517  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.058  -0.342   0.118  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.285  -1.495   0.061  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.940  -1.443   0.396  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.990  -3.816  -0.364  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.710  -0.150  -1.583  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.576   3.187   0.993  1.00  0.00           C  
HETATM   23  O   UNL     1       6.877   0.850  -1.047  1.00  0.00           O  
HETATM   24  O   UNL     1       7.681  -0.534   0.556  1.00  0.00           O  
HETATM   25  O   UNL     1       0.591   2.338  -0.109  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.318   1.854  -1.250  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.845  -2.671  -0.329  1.00  0.00           O  
HETATM   28  O   UNL     1      -6.377  -0.387  -0.214  1.00  0.00           O  
HETATM   29  O   UNL     1      -5.235   1.990   0.575  1.00  0.00           O  
HETATM   30  H   UNL     1       5.864  -2.291   1.833  1.00  0.00           H  
HETATM   31  H   UNL     1       3.477  -2.344   1.239  1.00  0.00           H  
HETATM   32  H   UNL     1       4.117   0.713  -1.665  1.00  0.00           H  
HETATM   33  H   UNL     1       8.902   0.754  -0.542  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.605  -1.162   1.570  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.753   0.578   1.915  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.285  -0.607  -0.866  1.00  0.00           H  
HETATM   37  H   UNL     1       1.579  -0.081   1.323  1.00  0.00           H  
HETATM   38  H   UNL     1       2.069  -0.586  -1.658  1.00  0.00           H  
HETATM   39  H   UNL     1       1.801  -1.861  -0.446  1.00  0.00           H  
HETATM   40  H   UNL     1       2.488   1.980   0.725  1.00  0.00           H  
HETATM   41  H   UNL     1       2.346   1.628  -1.025  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.689   1.833   1.165  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.337  -2.337   0.347  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.171  -3.636  -1.061  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.586  -3.999   0.631  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.560  -4.686  -0.691  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.370   0.845  -1.873  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.224  -0.897  -2.211  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.791  -0.215  -1.712  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.176   3.049   1.998  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.761   3.412   0.305  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.288   4.011   0.996  1.00  0.00           H  
HETATM   53  H   UNL     1       7.843   1.544   0.669  1.00  0.00           H  
CONECT    1   23    2    2    6                                       
CONECT    2   24    1    1    3                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    5   31                                       
CONECT    5    6    6    4   11                                       
CONECT    6    1    5    5   32                                       
CONECT    7   24   23   33   53                                       
CONECT    8   14    9   34   35                                       
CONECT    9   10    8   12   36                                       
CONECT   10   11   13    9   37                                       
CONECT   11    5   10   38   39                                       
CONECT   12    9   25   26   26                                       
CONECT   13   10   25   40   41                                       
CONECT   14   15    8   19   19                                       
CONECT   15   16   16   14   42                                       
CONECT   16   29   15   15   17                                       
CONECT   17   16   28   18   18                                       
CONECT   18   17   17   19   27                                       
CONECT   19   14   14   18   43                                       
CONECT   20   27   44   45   46                                       
CONECT   21   28   47   48   49                                       
CONECT   22   29   50   51   52                                       
CONECT   23    7    1                                                 
CONECT   24    7    2                                                 
CONECT   25   13   12                                                 
CONECT   26   12   12                                                 
CONECT   27   18   20                                                 
CONECT   28   21   17                                                 
CONECT   29   22   16                                                 
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   15                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53    7                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
