COMPND    HMDB0036168
HETATM    1  C1  UNL     1      -5.296   1.396  -0.550  1.00  0.00           C  
HETATM    2  C2  UNL     1      -4.848   0.159   0.149  1.00  0.00           C  
HETATM    3  O1  UNL     1      -5.601  -0.879   0.424  1.00  0.00           O  
HETATM    4  C3  UNL     1      -4.933  -1.810   1.041  1.00  0.00           C  
HETATM    5  C4  UNL     1      -3.640  -1.352   1.186  1.00  0.00           C  
HETATM    6  C5  UNL     1      -3.583  -0.101   0.620  1.00  0.00           C  
HETATM    7  S1  UNL     1      -2.223   1.004   0.483  1.00  0.00           S  
HETATM    8  S2  UNL     1      -0.435   0.306   1.303  1.00  0.00           S  
HETATM    9  S3  UNL     1       0.779  -0.786  -0.014  1.00  0.00           S  
HETATM   10  S4  UNL     1       2.138   0.420  -1.096  1.00  0.00           S  
HETATM   11  C6  UNL     1       3.685   0.616  -0.243  1.00  0.00           C  
HETATM   12  C7  UNL     1       4.041   1.596   0.668  1.00  0.00           C  
HETATM   13  C8  UNL     1       5.337   1.295   1.028  1.00  0.00           C  
HETATM   14  O2  UNL     1       5.721   0.221   0.381  1.00  0.00           O  
HETATM   15  C9  UNL     1       4.764  -0.229  -0.398  1.00  0.00           C  
HETATM   16  C10 UNL     1       4.805  -1.416  -1.287  1.00  0.00           C  
HETATM   17  H1  UNL     1      -4.540   1.770  -1.256  1.00  0.00           H  
HETATM   18  H2  UNL     1      -5.505   2.149   0.252  1.00  0.00           H  
HETATM   19  H3  UNL     1      -6.228   1.199  -1.139  1.00  0.00           H  
HETATM   20  H4  UNL     1      -5.361  -2.757   1.363  1.00  0.00           H  
HETATM   21  H5  UNL     1      -2.838  -1.872   1.650  1.00  0.00           H  
HETATM   22  H6  UNL     1       3.398   2.390   0.983  1.00  0.00           H  
HETATM   23  H7  UNL     1       5.933   1.865   1.734  1.00  0.00           H  
HETATM   24  H8  UNL     1       5.352  -1.181  -2.200  1.00  0.00           H  
HETATM   25  H9  UNL     1       3.782  -1.770  -1.506  1.00  0.00           H  
HETATM   26  H10 UNL     1       5.295  -2.233  -0.685  1.00  0.00           H  
CONECT    1    2   17   18   19
CONECT    2    3    6    6
CONECT    3    4
CONECT    4    5    5   20
CONECT    5    6   21
CONECT    6    7
CONECT    7    8
CONECT    8    9
CONECT    9   10
CONECT   10   11
CONECT   11   12   15   15
CONECT   12   13   13   22
CONECT   13   14   23
CONECT   14   15
CONECT   15   16
CONECT   16   24   25   26
END