COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -5.228   0.356   0.055  1.00  0.00           O  
HETATM    2  N   UNL     1      -3.983   0.783   0.011  1.00  0.00           N1+
HETATM    3  O   UNL     1      -3.731   2.075  -0.024  1.00  0.00           O1-
HETATM    4  C   UNL     1      -2.866  -0.189   0.006  1.00  0.00           C  
HETATM    5  O   UNL     1      -1.566   0.123  -0.036  1.00  0.00           O  
HETATM    6  C   UNL     1      -3.001  -1.569   0.050  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.730  -2.107   0.026  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.831  -1.011  -0.026  1.00  0.00           C  
HETATM    9  C   UNL     1       0.554  -1.088  -0.061  1.00  0.00           C  
HETATM   10  N   UNL     1       1.284   0.026  -0.108  1.00  0.00           N  
HETATM   11  N   UNL     1       2.570  -0.042  -0.042  1.00  0.00           N  
HETATM   12  C   UNL     1       3.418   1.004   0.014  1.00  0.00           C  
HETATM   13  O   UNL     1       3.104   2.176   0.016  1.00  0.00           O  
HETATM   14  C   UNL     1       3.314  -1.183  -0.022  1.00  0.00           C  
HETATM   15  C   UNL     1       4.613  -0.825   0.051  1.00  0.00           C  
HETATM   16  O   UNL     1       4.674   0.523   0.077  1.00  0.00           O  
HETATM   17  H   UNL     1      -3.929  -2.120   0.090  1.00  0.00           H  
HETATM   18  H   UNL     1      -1.472  -3.155   0.046  1.00  0.00           H  
HETATM   19  H   UNL     1       1.042  -2.052  -0.049  1.00  0.00           H  
HETATM   20  H   UNL     1       2.933  -2.193  -0.058  1.00  0.00           H  
HETATM   21  H   UNL     1       5.456  -1.499   0.084  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2                                                      
CONECT    4    2    5    6    6                                       
CONECT    5    4    8                                                 
CONECT    6    4    4    7   17                                       
CONECT    7    6    8    8   18                                       
CONECT    8    5    7    7    9                                       
CONECT    9    8   10   10   19                                       
CONECT   10    9    9   11                                            
CONECT   11   10   12   14                                            
CONECT   12   11   13   13   16                                       
CONECT   13   12   12                                                 
CONECT   14   11   15   15   20                                       
CONECT   15   14   14   16   21                                       
CONECT   16   12   15                                                 
CONECT   17    6                                                      
CONECT   18    7                                                      
CONECT   19    9                                                      
CONECT   20   14                                                      
CONECT   21   15                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
