COMPND    HMDB0030819
HETATM    1  O1  UNL     1       3.920  -1.503  -0.433  1.00  0.00           O  
HETATM    2  C1  UNL     1       2.841  -0.843  -0.231  1.00  0.00           C  
HETATM    3  C2  UNL     1       2.881   0.458   0.210  1.00  0.00           C  
HETATM    4  C3  UNL     1       1.716   1.152   0.422  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.523   0.497   0.178  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.680   1.118   0.365  1.00  0.00           C  
HETATM    7  C6  UNL     1      -1.856   0.435   0.111  1.00  0.00           C  
HETATM    8  O2  UNL     1      -3.061   1.069   0.303  1.00  0.00           O  
HETATM    9  C7  UNL     1      -1.880  -0.872  -0.331  1.00  0.00           C  
HETATM   10  O3  UNL     1      -3.078  -1.555  -0.585  1.00  0.00           O  
HETATM   11  C8  UNL     1      -0.665  -1.501  -0.520  1.00  0.00           C  
HETATM   12  C9  UNL     1       0.521  -0.810  -0.264  1.00  0.00           C  
HETATM   13  O4  UNL     1       1.674  -1.391  -0.438  1.00  0.00           O  
HETATM   14  H1  UNL     1       3.832   0.946   0.393  1.00  0.00           H  
HETATM   15  H2  UNL     1       1.741   2.195   0.775  1.00  0.00           H  
HETATM   16  H3  UNL     1      -0.666   2.149   0.714  1.00  0.00           H  
HETATM   17  H4  UNL     1      -3.165   2.026   0.624  1.00  0.00           H  
HETATM   18  H5  UNL     1      -3.946  -1.061  -0.434  1.00  0.00           H  
HETATM   19  H6  UNL     1      -0.650  -2.508  -0.860  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   13
CONECT    3    4    4   14
CONECT    4    5   15
CONECT    5    6    6   12
CONECT    6    7   16
CONECT    7    8    9    9
CONECT    8   17
CONECT    9   10   11
CONECT   10   18
CONECT   11   12   12   19
CONECT   12   13
END