COMPND    HMDB0029988
HETATM    1  C1  UNL     1       4.769   0.557  -0.973  1.00  0.00           C  
HETATM    2  C2  UNL     1       4.364  -0.759  -1.053  1.00  0.00           C  
HETATM    3  O1  UNL     1       3.254  -0.910  -0.372  1.00  0.00           O  
HETATM    4  C3  UNL     1       2.892   0.207   0.155  1.00  0.00           C  
HETATM    5  C4  UNL     1       1.713   0.451   0.984  1.00  0.00           C  
HETATM    6  S1  UNL     1       0.253   0.914   0.012  1.00  0.00           S  
HETATM    7  S2  UNL     1      -0.461  -0.685  -1.165  1.00  0.00           S  
HETATM    8  C5  UNL     1      -1.692  -1.685  -0.301  1.00  0.00           C  
HETATM    9  C6  UNL     1      -2.946  -0.935  -0.062  1.00  0.00           C  
HETATM   10  C7  UNL     1      -3.280  -0.157   1.045  1.00  0.00           C  
HETATM   11  C8  UNL     1      -4.547   0.328   0.794  1.00  0.00           C  
HETATM   12  C9  UNL     1      -4.883  -0.190  -0.439  1.00  0.00           C  
HETATM   13  O2  UNL     1      -3.934  -0.924  -0.920  1.00  0.00           O  
HETATM   14  C10 UNL     1       3.826   1.181  -0.198  1.00  0.00           C  
HETATM   15  H1  UNL     1       5.649   1.003  -1.428  1.00  0.00           H  
HETATM   16  H2  UNL     1       4.860  -1.555  -1.583  1.00  0.00           H  
HETATM   17  H3  UNL     1       1.843   1.215   1.770  1.00  0.00           H  
HETATM   18  H4  UNL     1       1.402  -0.485   1.543  1.00  0.00           H  
HETATM   19  H5  UNL     1      -1.288  -1.957   0.710  1.00  0.00           H  
HETATM   20  H6  UNL     1      -1.899  -2.578  -0.915  1.00  0.00           H  
HETATM   21  H7  UNL     1      -2.696   0.038   1.913  1.00  0.00           H  
HETATM   22  H8  UNL     1      -5.180   0.964   1.381  1.00  0.00           H  
HETATM   23  H9  UNL     1      -5.829  -0.022  -0.980  1.00  0.00           H  
HETATM   24  H10 UNL     1       3.809   2.207   0.081  1.00  0.00           H  
CONECT    1    2    2   14   15
CONECT    2    3   16
CONECT    3    4
CONECT    4    5   14   14
CONECT    5    6   17   18
CONECT    6    7
CONECT    7    8
CONECT    8    9   19   20
CONECT    9   10   10   13
CONECT   10   11   21
CONECT   11   12   12   22
CONECT   12   13   23
CONECT   14   24
END