COMPND    HMDB0245323
HETATM    1  O1  UNL     1      -1.831  -1.807   0.172  1.00  0.00           O  
HETATM    2  C1  UNL     1      -0.907  -0.749   0.158  1.00  0.00           C  
HETATM    3  C2  UNL     1      -1.307   0.542  -0.125  1.00  0.00           C  
HETATM    4  C3  UNL     1      -0.393   1.574  -0.137  1.00  0.00           C  
HETATM    5  N1  UNL     1       0.896   1.303   0.132  1.00  0.00           N  
HETATM    6  C4  UNL     1       1.302   0.050   0.409  1.00  0.00           C  
HETATM    7  S1  UNL     1       3.042  -0.284   0.765  1.00  0.00           S  
HETATM    8  N2  UNL     1       0.396  -0.945   0.416  1.00  0.00           N  
HETATM    9  H1  UNL     1      -1.796  -2.438  -0.637  1.00  0.00           H  
HETATM   10  H2  UNL     1      -2.368   0.704  -0.335  1.00  0.00           H  
HETATM   11  H3  UNL     1      -0.744   2.567  -0.361  1.00  0.00           H  
HETATM   12  H4  UNL     1       3.709  -0.517  -0.457  1.00  0.00           H  
CONECT    1    2    9
CONECT    2    3    3    8
CONECT    3    4   10
CONECT    4    5    5   11
CONECT    5    6
CONECT    6    7    8    8
CONECT    7   12
END