COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.777  -0.396  -0.047  1.00  0.00           C  
HETATM    2  C   UNL     1       4.570  -1.507  -0.318  1.00  0.00           C  
HETATM    3  C   UNL     1       5.941  -1.409  -0.217  1.00  0.00           C  
HETATM    4  C   UNL     1       6.530  -0.209   0.152  1.00  0.00           C  
HETATM    5  C   UNL     1       5.757   0.899   0.423  1.00  0.00           C  
HETATM    6  C   UNL     1       4.372   0.820   0.327  1.00  0.00           C  
HETATM    7  N   UNL     1       3.360   1.737   0.530  1.00  0.00           N  
HETATM    8  C   UNL     1       2.151   1.171   0.307  1.00  0.00           C  
HETATM    9  C   UNL     1       2.322  -0.149  -0.061  1.00  0.00           C  
HETATM   10  C   UNL     1       1.306  -1.078  -0.384  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.022  -0.692  -0.351  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.513   0.543  -0.029  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.193  -1.520  -0.661  1.00  0.00           C  
HETATM   14  O   UNL     1      -1.202  -2.691  -0.999  1.00  0.00           O  
HETATM   15  N   UNL     1      -2.260  -0.708  -0.490  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.663  -1.084  -0.682  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.225  -1.607   0.615  1.00  0.00           C  
HETATM   18  O   UNL     1      -3.526  -1.660   1.599  1.00  0.00           O  
HETATM   19  O   UNL     1      -5.503  -2.013   0.677  1.00  0.00           O  
HETATM   20  C   UNL     1      -1.807   0.524  -0.110  1.00  0.00           C  
HETATM   21  CA  UNL     1      -2.695   1.707   0.175  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.114   2.505   1.263  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.815   2.570  -1.083  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.748   3.627  -0.849  1.00  0.00           O  
HETATM   25  H   UNL     1       4.113  -2.443  -0.605  1.00  0.00           H  
HETATM   26  H   UNL     1       6.559  -2.270  -0.426  1.00  0.00           H  
HETATM   27  H   UNL     1       7.606  -0.142   0.229  1.00  0.00           H  
HETATM   28  H   UNL     1       6.227   1.829   0.710  1.00  0.00           H  
HETATM   29  H   UNL     1       3.497   2.660   0.798  1.00  0.00           H  
HETATM   30  H   UNL     1       1.200   1.675   0.398  1.00  0.00           H  
HETATM   31  H   UNL     1       1.567  -2.090  -0.657  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.233  -0.211  -0.999  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.730  -1.859  -1.446  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.818  -2.341   1.531  1.00  0.00           H  
HETATM   35  HA  UNL     1      -3.684   1.356   0.470  1.00  0.00           H  
HETATM   36  H1  UNL     1      -2.084   1.977   2.122  1.00  0.00           H  
HETATM   37  H2  UNL     1      -1.196   2.842   1.014  1.00  0.00           H  
HETATM   38  H1  UNL     1      -1.840   2.993  -1.327  1.00  0.00           H  
HETATM   39  H2  UNL     1      -3.162   1.956  -1.913  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.874   4.215  -1.605  1.00  0.00           H  
CONECT    1    2    6    6    9                                       
CONECT    2    1    3    3   25                                       
CONECT    3    2    2    4   26                                       
CONECT    4    3    5    5   27                                       
CONECT    5    4    4    6   28                                       
CONECT    6    1    1    5    7                                       
CONECT    7    6    8   29                                            
CONECT    8    7    9    9   30                                       
CONECT    9    1    8    8   10                                       
CONECT   10    9   11   11   31                                       
CONECT   11   10   10   12   13                                       
CONECT   12   11   20   20                                            
CONECT   13   11   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   20                                            
CONECT   16   15   17   32   33                                       
CONECT   17   16   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   34                                                 
CONECT   20   12   12   15   21                                       
CONECT   21   20   22   23   35                                       
CONECT   22   21   36   37                                            
CONECT   23   21   24   38   39                                       
CONECT   24   23   40                                                 
CONECT   25    2                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31   10                                                      
CONECT   32   16                                                      
CONECT   33   16                                                      
CONECT   34   19                                                      
CONECT   35   21                                                      
CONECT   36   22                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   23                                                      
CONECT   40   24                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
