COMPND    HMDB0240441
HETATM    1  O1  UNL     1      -2.577  -0.841  -1.792  1.00  0.00           O  
HETATM    2  C1  UNL     1      -2.206  -1.519  -0.831  1.00  0.00           C  
HETATM    3  O2  UNL     1      -2.796  -2.757  -0.569  1.00  0.00           O  
HETATM    4  C2  UNL     1      -1.141  -1.116   0.117  1.00  0.00           C  
HETATM    5  C3  UNL     1      -0.693   0.263   0.075  1.00  0.00           C  
HETATM    6  C4  UNL     1      -1.554   1.294  -0.352  1.00  0.00           C  
HETATM    7  C5  UNL     1      -1.072   2.576  -0.301  1.00  0.00           C  
HETATM    8  C6  UNL     1       0.178   2.905   0.135  1.00  0.00           C  
HETATM    9  C7  UNL     1       1.001   1.852   0.550  1.00  0.00           C  
HETATM   10  C8  UNL     1       0.578   0.557   0.520  1.00  0.00           C  
HETATM   11  O3  UNL     1       1.409  -0.464   0.933  1.00  0.00           O  
HETATM   12  S1  UNL     1       2.503  -1.317  -0.035  1.00  0.00           S  
HETATM   13  O4  UNL     1       2.258  -1.159  -1.500  1.00  0.00           O  
HETATM   14  O5  UNL     1       2.342  -2.792   0.277  1.00  0.00           O  
HETATM   15  O6  UNL     1       4.111  -0.935   0.275  1.00  0.00           O  
HETATM   16  H1  UNL     1      -3.166  -2.929   0.397  1.00  0.00           H  
HETATM   17  H2  UNL     1      -0.224  -1.762  -0.050  1.00  0.00           H  
HETATM   18  H3  UNL     1      -1.460  -1.354   1.187  1.00  0.00           H  
HETATM   19  H4  UNL     1      -2.560   1.122  -0.705  1.00  0.00           H  
HETATM   20  H5  UNL     1      -1.753   3.385  -0.638  1.00  0.00           H  
HETATM   21  H6  UNL     1       0.568   3.899   0.194  1.00  0.00           H  
HETATM   22  H7  UNL     1       1.973   2.076   0.901  1.00  0.00           H  
HETATM   23  H8  UNL     1       4.281  -0.982   1.215  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   16
CONECT    4    5   17   18
CONECT    5    6    6   10
CONECT    6    7   19
CONECT    7    8    8   20
CONECT    8    9   21
CONECT    9   10   10   22
CONECT   10   11
CONECT   11   12
CONECT   12   13   13   14   14
CONECT   12   15
CONECT   15   23
END