COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.649   2.931   0.035  1.00  0.00           C  
HETATM    2  C   UNL     1       5.452   3.303   0.618  1.00  0.00           C  
HETATM    3  C   UNL     1       4.425   2.387   0.738  1.00  0.00           C  
HETATM    4  C   UNL     1       6.822   1.641  -0.431  1.00  0.00           C  
HETATM    5  C   UNL     1       5.797   0.715  -0.309  1.00  0.00           C  
HETATM    6  C   UNL     1       4.593   1.090   0.275  1.00  0.00           C  
HETATM    7  O   UNL     1       3.575   0.196   0.407  1.00  0.00           O  
HETATM    8  C   UNL     1       3.645  -0.983  -0.401  1.00  0.00           C  
HETATM    9  C   UNL     1       5.069  -1.548  -0.306  1.00  0.00           C  
HETATM   10  O   UNL     1       5.980  -0.550  -0.776  1.00  0.00           O  
HETATM   11  C   UNL     1       2.643  -2.020   0.112  1.00  0.00           C  
HETATM   12  N   UNL     1       1.281  -1.512  -0.065  1.00  0.00           N  
HETATM   13  C   UNL     1       0.227  -2.261   0.318  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.146  -1.749   0.140  1.00  0.00           C  
HETATM   15  O   UNL     1       0.408  -3.358   0.811  1.00  0.00           O  
HETATM   16  C   UNL     1      -2.239  -2.524   0.536  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.518  -2.043   0.368  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.723  -0.789  -0.196  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.638  -0.016  -0.592  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.355  -0.487  -0.421  1.00  0.00           C  
HETATM   21  O   UNL     1      -4.985  -0.319  -0.361  1.00  0.00           O  
HETATM   22  C   UNL     1      -5.124   0.977  -0.946  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.608   1.334  -1.051  1.00  0.00           C  
HETATM   24  N   UNL     1      -7.185   1.426   0.297  1.00  0.00           N1+
HETATM   25  C   UNL     1      -6.585   2.561   1.010  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.637   1.623   0.195  1.00  0.00           C  
HETATM   27  H   UNL     1       7.449   3.650  -0.060  1.00  0.00           H  
HETATM   28  H   UNL     1       5.320   4.312   0.979  1.00  0.00           H  
HETATM   29  H   UNL     1       3.490   2.681   1.193  1.00  0.00           H  
HETATM   30  H   UNL     1       7.757   1.354  -0.890  1.00  0.00           H  
HETATM   31  H   UNL     1       3.416  -0.733  -1.437  1.00  0.00           H  
HETATM   32  H   UNL     1       5.298  -1.793   0.731  1.00  0.00           H  
HETATM   33  H   UNL     1       5.151  -2.443  -0.922  1.00  0.00           H  
HETATM   34  H   UNL     1       2.761  -2.947  -0.449  1.00  0.00           H  
HETATM   35  H   UNL     1       2.826  -2.210   1.169  1.00  0.00           H  
HETATM   36  H   UNL     1       1.136  -0.637  -0.458  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.081  -3.499   0.974  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.364  -2.641   0.675  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.801   0.958  -1.029  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.513   0.115  -0.729  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.616   1.713  -0.323  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.680   0.975  -1.942  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.716   2.292  -1.559  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.128   0.561  -1.617  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.997   0.573   0.803  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.789   3.482   0.464  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.014   2.630   2.010  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.508   2.414   1.086  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.841   2.540  -0.358  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.084   0.777  -0.327  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.065   1.700   1.195  1.00  0.00           H  
CONECT    1    2    4    4   27                                       
CONECT    2    3    3    1   28                                       
CONECT    3    2    2    6   29                                       
CONECT    4    1    1    5   30                                       
CONECT    5    6    6    4   10                                       
CONECT    6    3    7    5    5                                       
CONECT    7    8    6                                                 
CONECT    8    7   11    9   31                                       
CONECT    9    8   10   32   33                                       
CONECT   10    5    9                                                 
CONECT   11    8   12   34   35                                       
CONECT   12   11   13   36                                            
CONECT   13   12   14   15   15                                       
CONECT   14   20   13   16   16                                       
CONECT   15   13   13                                                 
CONECT   16   14   14   17   37                                       
CONECT   17   18   18   16   38                                       
CONECT   18   19   21   17   17                                       
CONECT   19   20   20   18   39                                       
CONECT   20   19   19   14   40                                       
CONECT   21   22   18                                                 
CONECT   22   23   21   41   42                                       
CONECT   23   22   24   43   44                                       
CONECT   24   26   23   25   45                                       
CONECT   25   24   46   47   48                                       
CONECT   26   24   49   50   51                                       
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   22                                                      
CONECT   42   22                                                      
CONECT   43   23                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
