COMPND    HMDB0032026
HETATM    1  C1  UNL     1       2.772   1.909  -0.282  1.00  0.00           C  
HETATM    2  O1  UNL     1       1.608   1.775   0.502  1.00  0.00           O  
HETATM    3  N1  UNL     1       0.829   0.665   0.311  1.00  0.00           N  
HETATM    4  C2  UNL     1      -0.488   0.524   0.246  1.00  0.00           C  
HETATM    5  C3  UNL     1      -1.459   1.513   0.362  1.00  0.00           C  
HETATM    6  C4  UNL     1      -2.766   1.135   0.262  1.00  0.00           C  
HETATM    7  C5  UNL     1      -3.113  -0.172   0.055  1.00  0.00           C  
HETATM    8  C6  UNL     1      -2.130  -1.122  -0.054  1.00  0.00           C  
HETATM    9  C7  UNL     1      -0.804  -0.799   0.038  1.00  0.00           C  
HETATM   10  C8  UNL     1       0.403  -1.529  -0.031  1.00  0.00           C  
HETATM   11  C9  UNL     1       0.824  -2.814  -0.209  1.00  0.00           C  
HETATM   12  N2  UNL     1       2.133  -3.031  -0.198  1.00  0.00           N  
HETATM   13  S1  UNL     1       2.805  -1.516   0.050  1.00  0.00           S  
HETATM   14  C10 UNL     1       1.369  -0.586   0.142  1.00  0.00           C  
HETATM   15  H1  UNL     1       3.534   2.461   0.326  1.00  0.00           H  
HETATM   16  H2  UNL     1       2.480   2.524  -1.181  1.00  0.00           H  
HETATM   17  H3  UNL     1       3.113   0.930  -0.611  1.00  0.00           H  
HETATM   18  H4  UNL     1      -1.168   2.555   0.527  1.00  0.00           H  
HETATM   19  H5  UNL     1      -3.531   1.880   0.348  1.00  0.00           H  
HETATM   20  H6  UNL     1      -4.146  -0.469  -0.023  1.00  0.00           H  
HETATM   21  H7  UNL     1      -2.390  -2.153  -0.217  1.00  0.00           H  
HETATM   22  H8  UNL     1       0.125  -3.681  -0.362  1.00  0.00           H  
CONECT    1    2   15   16   17
CONECT    2    3
CONECT    3    4   14
CONECT    4    5    5    9
CONECT    5    6   18
CONECT    6    7    7   19
CONECT    7    8   20
CONECT    8    9    9   21
CONECT    9   10
CONECT   10   11   14   14
CONECT   11   12   12   22
CONECT   12   13
CONECT   13   14
END