COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.865  -0.058  -0.001  1.00  0.00           C  
HETATM    2  O   UNL     1       3.555   1.099  -0.001  1.00  0.00           O  
HETATM    3  O   UNL     1       3.458  -1.118   0.000  1.00  0.00           O  
HETATM    4  C   UNL     1       1.388  -0.037   0.000  1.00  0.00           C  
HETATM    5  C   UNL     1       0.704   1.180   0.005  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.676   1.192  -0.001  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.381   0.001   0.000  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.709  -1.208   0.001  1.00  0.00           C  
HETATM    9  C   UNL     1       0.670  -1.235   0.000  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.861   0.022   0.000  1.00  0.00           N1+
HETATM   11  O   UNL     1      -3.485  -1.024   0.000  1.00  0.00           O1-
HETATM   12  O   UNL     1      -3.455   1.085  -0.001  1.00  0.00           O  
HETATM   13  H   UNL     1       4.522   1.086  -0.002  1.00  0.00           H  
HETATM   14  H   UNL     1       1.253   2.109   0.004  1.00  0.00           H  
HETATM   15  H   UNL     1      -1.206   2.132  -0.002  1.00  0.00           H  
HETATM   16  H   UNL     1      -1.266  -2.134   0.001  1.00  0.00           H  
HETATM   17  H   UNL     1       1.193  -2.180   0.001  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    2    1   13                                                 
CONECT    3    1    1                                                 
CONECT    4    1    5    9    9                                       
CONECT    5    4    6    6   14                                       
CONECT    6    5    5    7   15                                       
CONECT    7    6    8    8   10                                       
CONECT    8    7    7    9   16                                       
CONECT    9    4    4    8   17                                       
CONECT   10    7   11   12   12                                       
CONECT   11   10                                                      
CONECT   12   10   10                                                 
CONECT   13    2                                                      
CONECT   14    5                                                      
CONECT   15    6                                                      
CONECT   16    8                                                      
CONECT   17    9                                                      
MASTER        0    0    0    0    0    0    0    0   17    0   17    0
END
