COMPND    HMDB0250763
HETATM    1  N1  UNL     1      -2.263  -1.186  -1.151  1.00  0.00           N  
HETATM    2  C1  UNL     1      -1.443  -0.152  -0.447  1.00  0.00           C  
HETATM    3  C2  UNL     1      -0.041  -0.563  -0.721  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.025   0.286  -0.205  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.955   1.538   0.364  1.00  0.00           C  
HETATM    6  N2  UNL     1       2.233   1.859   0.692  1.00  0.00           N  
HETATM    7  C5  UNL     1       3.052   0.859   0.344  1.00  0.00           C  
HETATM    8  N3  UNL     1       2.332  -0.120  -0.209  1.00  0.00           N  
HETATM    9  C6  UNL     1      -1.823  -0.303   0.981  1.00  0.00           C  
HETATM   10  O1  UNL     1      -2.706  -1.136   1.284  1.00  0.00           O  
HETATM   11  O2  UNL     1      -1.239   0.437   1.979  1.00  0.00           O  
HETATM   12  H1  UNL     1      -1.920  -1.133  -2.137  1.00  0.00           H  
HETATM   13  H2  UNL     1      -1.861  -2.098  -0.778  1.00  0.00           H  
HETATM   14  H3  UNL     1      -1.694   0.841  -0.823  1.00  0.00           H  
HETATM   15  H4  UNL     1       0.071  -0.671  -1.831  1.00  0.00           H  
HETATM   16  H5  UNL     1       0.102  -1.594  -0.285  1.00  0.00           H  
HETATM   17  H6  UNL     1       0.090   2.181   0.522  1.00  0.00           H  
HETATM   18  H7  UNL     1       4.145   0.829   0.484  1.00  0.00           H  
HETATM   19  H8  UNL     1       2.711  -1.032  -0.578  1.00  0.00           H  
HETATM   20  H9  UNL     1      -1.727   1.157   2.514  1.00  0.00           H  
CONECT    1    2   12   13
CONECT    2    3    9   14
CONECT    3    4   15   16
CONECT    4    5    5    8
CONECT    5    6   17
CONECT    6    7    7
CONECT    7    8   18
CONECT    8   19
CONECT    9   10   10   11
CONECT   11   20
END