COMPND    HMDB0246829
HETATM    1  O1  UNL     1      -2.630   0.687   0.256  1.00  0.00           O  
HETATM    2  N1  UNL     1      -1.925  -0.265  -0.112  1.00  0.00           N1+
HETATM    3  O2  UNL     1      -2.502  -1.415  -0.563  1.00  0.00           O1-
HETATM    4  C1  UNL     1      -0.490  -0.169  -0.068  1.00  0.00           C  
HETATM    5  C2  UNL     1       0.273   0.891   0.349  1.00  0.00           C  
HETATM    6  N2  UNL     1       1.562   0.758   0.303  1.00  0.00           N  
HETATM    7  C3  UNL     1       2.088  -0.375  -0.137  1.00  0.00           C  
HETATM    8  S1  UNL     1       0.706  -1.308  -0.507  1.00  0.00           S  
HETATM    9  H1  UNL     1      -0.244   1.809   0.704  1.00  0.00           H  
HETATM   10  H2  UNL     1       3.162  -0.615  -0.225  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    4    5    5    8
CONECT    5    6    9
CONECT    6    7    7
CONECT    7    8   10
END