COMPND    HMDB0000423
HETATM    1  O1  UNL     1      -3.767  -0.281  -1.930  1.00  0.00           O  
HETATM    2  C1  UNL     1      -3.515  -0.376  -0.708  1.00  0.00           C  
HETATM    3  O2  UNL     1      -4.564  -0.602   0.171  1.00  0.00           O  
HETATM    4  C2  UNL     1      -2.156  -0.263  -0.126  1.00  0.00           C  
HETATM    5  C3  UNL     1      -1.114  -0.017  -1.202  1.00  0.00           C  
HETATM    6  C4  UNL     1       0.196   0.079  -0.515  1.00  0.00           C  
HETATM    7  C5  UNL     1       0.607   1.320  -0.089  1.00  0.00           C  
HETATM    8  C6  UNL     1       1.822   1.428   0.551  1.00  0.00           C  
HETATM    9  C7  UNL     1       2.614   0.305   0.760  1.00  0.00           C  
HETATM   10  O3  UNL     1       3.841   0.398   1.404  1.00  0.00           O  
HETATM   11  C8  UNL     1       2.197  -0.937   0.330  1.00  0.00           C  
HETATM   12  O4  UNL     1       3.006  -2.044   0.551  1.00  0.00           O  
HETATM   13  C9  UNL     1       0.989  -1.026  -0.302  1.00  0.00           C  
HETATM   14  H1  UNL     1      -4.636  -0.111   1.071  1.00  0.00           H  
HETATM   15  H2  UNL     1      -2.124   0.604   0.562  1.00  0.00           H  
HETATM   16  H3  UNL     1      -1.891  -1.222   0.362  1.00  0.00           H  
HETATM   17  H4  UNL     1      -1.278   0.943  -1.732  1.00  0.00           H  
HETATM   18  H5  UNL     1      -1.131  -0.877  -1.927  1.00  0.00           H  
HETATM   19  H6  UNL     1      -0.010   2.213  -0.248  1.00  0.00           H  
HETATM   20  H7  UNL     1       2.179   2.397   0.903  1.00  0.00           H  
HETATM   21  H8  UNL     1       4.186   1.303   1.738  1.00  0.00           H  
HETATM   22  H9  UNL     1       3.880  -1.964   1.012  1.00  0.00           H  
HETATM   23  H10 UNL     1       0.669  -2.002  -0.636  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   14
CONECT    4    5   15   16
CONECT    5    6   17   18
CONECT    6    7    7   13
CONECT    7    8   19
CONECT    8    9    9   20
CONECT    9   10   11
CONECT   10   21
CONECT   11   12   13   13
CONECT   12   22
CONECT   13   23
END