COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -4.862  -3.049   0.659  1.00  0.00           O  
HETATM    2  C   UNL     1      -4.425  -1.930   0.452  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.182  -0.667   0.354  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.238   0.341   0.109  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.537  -0.357   0.455  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.959   0.950   0.313  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.044   1.956   0.072  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.684   1.666  -0.032  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.715   2.749  -0.290  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.529   2.494  -0.381  1.00  0.00           O  
HETATM   11  N   UNL     1      -4.143   4.019  -0.424  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.024  -1.534   0.252  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.003  -0.196   0.052  1.00  0.00           O  
HETATM   14  C   UNL     1      -1.947  -2.362   0.262  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.616  -1.837  -0.067  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.431  -0.463  -0.265  1.00  0.00           C  
HETATM   17  C   UNL     1       0.819   0.023  -0.572  1.00  0.00           C  
HETATM   18  C   UNL     1       1.898  -0.847  -0.687  1.00  0.00           C  
HETATM   19  C   UNL     1       1.720  -2.212  -0.491  1.00  0.00           C  
HETATM   20  C   UNL     1       0.475  -2.709  -0.177  1.00  0.00           C  
HETATM   21  O   UNL     1       3.128  -0.362  -0.991  1.00  0.00           O  
HETATM   22  C   UNL     1       4.192  -1.311  -1.094  1.00  0.00           C  
HETATM   23  C   UNL     1       5.493  -0.583  -1.441  1.00  0.00           C  
HETATM   24  N   UNL     1       5.868   0.304  -0.331  1.00  0.00           N  
HETATM   25  C   UNL     1       6.218  -0.471   0.868  1.00  0.00           C  
HETATM   26  C   UNL     1       6.544   0.491   2.013  1.00  0.00           C  
HETATM   27  O   UNL     1       7.600   1.366   1.608  1.00  0.00           O  
HETATM   28  C   UNL     1       7.293   2.137   0.443  1.00  0.00           C  
HETATM   29  C   UNL     1       6.974   1.192  -0.718  1.00  0.00           C  
HETATM   30  H   UNL     1      -7.257  -1.140   0.644  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.010   1.187   0.393  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.384   2.975  -0.037  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.089   4.222  -0.352  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.506   4.731  -0.594  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.069  -3.405   0.512  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.268   0.214  -0.176  1.00  0.00           H  
HETATM   37  H   UNL     1       0.963   1.082  -0.726  1.00  0.00           H  
HETATM   38  H   UNL     1       2.561  -2.884  -0.582  1.00  0.00           H  
HETATM   39  H   UNL     1       0.340  -3.769  -0.021  1.00  0.00           H  
HETATM   40  H   UNL     1       4.309  -1.830  -0.142  1.00  0.00           H  
HETATM   41  H   UNL     1       3.961  -2.034  -1.876  1.00  0.00           H  
HETATM   42  H   UNL     1       6.285  -1.314  -1.606  1.00  0.00           H  
HETATM   43  H   UNL     1       5.348   0.007  -2.345  1.00  0.00           H  
HETATM   44  H   UNL     1       5.376  -1.103   1.151  1.00  0.00           H  
HETATM   45  H   UNL     1       7.087  -1.095   0.657  1.00  0.00           H  
HETATM   46  H   UNL     1       5.659   1.077   2.260  1.00  0.00           H  
HETATM   47  H   UNL     1       6.859  -0.079   2.888  1.00  0.00           H  
HETATM   48  H   UNL     1       6.429   2.771   0.644  1.00  0.00           H  
HETATM   49  H   UNL     1       8.149   2.759   0.182  1.00  0.00           H  
HETATM   50  H   UNL     1       7.855   0.595  -0.954  1.00  0.00           H  
HETATM   51  H   UNL     1       6.684   1.775  -1.593  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   12                                       
CONECT    3    5    5    4    2                                       
CONECT    4    8    8    3   13                                       
CONECT    5    6    3    3   30                                       
CONECT    6    7    7    5   31                                       
CONECT    7    6    6    8   32                                       
CONECT    8    7    9    4    4                                       
CONECT    9   10   10    8   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   33   34                                            
CONECT   12   13    2   14   14                                       
CONECT   13    4   12                                                 
CONECT   14   12   12   15   35                                       
CONECT   15   14   20   20   16                                       
CONECT   16   15   17   17   36                                       
CONECT   17   18   16   16   37                                       
CONECT   18   19   19   21   17                                       
CONECT   19   20   18   18   38                                       
CONECT   20   15   15   19   39                                       
CONECT   21   18   22                                                 
CONECT   22   21   23   40   41                                       
CONECT   23   24   22   42   43                                       
CONECT   24   25   29   23                                            
CONECT   25   26   24   44   45                                       
CONECT   26   27   25   46   47                                       
CONECT   27   26   28                                                 
CONECT   28   27   29   48   49                                       
CONECT   29   28   24   50   51                                       
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   14                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   23                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   26                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
