COMPND    HMDB0041931
HETATM    1  C1  UNL     1      -2.067  -1.592  -0.144  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.561  -0.275   0.469  1.00  0.00           C  
HETATM    3  N1  UNL     1      -2.924   0.675  -0.531  1.00  0.00           N  
HETATM    4  C3  UNL     1      -1.516   0.194   1.423  1.00  0.00           C  
HETATM    5  C4  UNL     1      -0.203   0.444   0.838  1.00  0.00           C  
HETATM    6  C5  UNL     1       0.186   1.660   0.326  1.00  0.00           C  
HETATM    7  C6  UNL     1       1.447   1.802  -0.206  1.00  0.00           C  
HETATM    8  C7  UNL     1       2.319   0.749  -0.233  1.00  0.00           C  
HETATM    9  C8  UNL     1       1.967  -0.485   0.270  1.00  0.00           C  
HETATM   10  C9  UNL     1       0.698  -0.600   0.797  1.00  0.00           C  
HETATM   11  O1  UNL     1       3.036  -1.378   0.120  1.00  0.00           O  
HETATM   12  C10 UNL     1       4.166  -0.604  -0.196  1.00  0.00           C  
HETATM   13  O2  UNL     1       3.629   0.618  -0.704  1.00  0.00           O  
HETATM   14  H1  UNL     1      -1.904  -2.272   0.720  1.00  0.00           H  
HETATM   15  H2  UNL     1      -1.129  -1.385  -0.659  1.00  0.00           H  
HETATM   16  H3  UNL     1      -2.865  -1.957  -0.824  1.00  0.00           H  
HETATM   17  H4  UNL     1      -3.480  -0.547   1.029  1.00  0.00           H  
HETATM   18  H5  UNL     1      -2.907   1.635  -0.177  1.00  0.00           H  
HETATM   19  H6  UNL     1      -3.895   0.460  -0.851  1.00  0.00           H  
HETATM   20  H7  UNL     1      -1.419  -0.497   2.283  1.00  0.00           H  
HETATM   21  H8  UNL     1      -1.871   1.167   1.873  1.00  0.00           H  
HETATM   22  H9  UNL     1      -0.496   2.510   0.339  1.00  0.00           H  
HETATM   23  H10 UNL     1       1.736   2.768  -0.606  1.00  0.00           H  
HETATM   24  H11 UNL     1       0.444  -1.594   1.191  1.00  0.00           H  
HETATM   25  H12 UNL     1       4.796  -0.428   0.709  1.00  0.00           H  
HETATM   26  H13 UNL     1       4.815  -1.068  -0.954  1.00  0.00           H  
CONECT    1    2   14   15   16
CONECT    2    3    4   17
CONECT    3   18   19
CONECT    4    5   20   21
CONECT    5    6    6   10
CONECT    6    7   22
CONECT    7    8    8   23
CONECT    8    9   13
CONECT    9   10   10   11
CONECT   10   24
CONECT   11   12
CONECT   12   13   25   26
END