COMPND    HMDB0246379
HETATM    1  O1  UNL     1       4.663  -1.221  -1.157  1.00  0.00           O  
HETATM    2  C1  UNL     1       4.161  -0.450  -0.290  1.00  0.00           C  
HETATM    3  O2  UNL     1       4.976   0.263   0.559  1.00  0.00           O  
HETATM    4  C2  UNL     1       2.714  -0.337  -0.213  1.00  0.00           C  
HETATM    5  C3  UNL     1       2.175   0.513   0.740  1.00  0.00           C  
HETATM    6  C4  UNL     1       0.785   0.605   0.799  1.00  0.00           C  
HETATM    7  C5  UNL     1      -0.031  -0.101  -0.036  1.00  0.00           C  
HETATM    8  C6  UNL     1      -1.464   0.033   0.073  1.00  0.00           C  
HETATM    9  C7  UNL     1      -1.939   1.278   0.477  1.00  0.00           C  
HETATM   10  C8  UNL     1      -3.272   1.489   0.609  1.00  0.00           C  
HETATM   11  C9  UNL     1      -4.168   0.490   0.349  1.00  0.00           C  
HETATM   12  C10 UNL     1      -3.685  -0.752  -0.056  1.00  0.00           C  
HETATM   13  C11 UNL     1      -2.341  -0.978  -0.193  1.00  0.00           C  
HETATM   14  C12 UNL     1       0.498  -0.940  -0.977  1.00  0.00           C  
HETATM   15  C13 UNL     1       1.887  -1.050  -1.056  1.00  0.00           C  
HETATM   16  H1  UNL     1       5.967   0.278   0.555  1.00  0.00           H  
HETATM   17  H2  UNL     1       2.803   1.080   1.409  1.00  0.00           H  
HETATM   18  H3  UNL     1       0.416   1.284   1.562  1.00  0.00           H  
HETATM   19  H4  UNL     1      -1.239   2.092   0.691  1.00  0.00           H  
HETATM   20  H5  UNL     1      -3.594   2.482   0.930  1.00  0.00           H  
HETATM   21  H6  UNL     1      -5.211   0.661   0.454  1.00  0.00           H  
HETATM   22  H7  UNL     1      -4.408  -1.551  -0.264  1.00  0.00           H  
HETATM   23  H8  UNL     1      -1.930  -1.940  -0.509  1.00  0.00           H  
HETATM   24  H9  UNL     1      -0.113  -1.528  -1.670  1.00  0.00           H  
HETATM   25  H10 UNL     1       2.349  -1.701  -1.783  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   16
CONECT    4    5    5   15
CONECT    5    6   17
CONECT    6    7    7   18
CONECT    7    8   14
CONECT    8    9    9   13
CONECT    9   10   19
CONECT   10   11   11   20
CONECT   11   12   21
CONECT   12   13   13   22
CONECT   13   23
CONECT   14   15   15   24
CONECT   15   25
END