COMPND    HMDB0246378
HETATM    1  O1  UNL     1      -4.676  -0.319   1.762  1.00  0.00           O  
HETATM    2  C1  UNL     1      -4.471   0.346   0.712  1.00  0.00           C  
HETATM    3  O2  UNL     1      -4.890   1.653   0.654  1.00  0.00           O  
HETATM    4  C2  UNL     1      -3.781  -0.313  -0.398  1.00  0.00           C  
HETATM    5  C3  UNL     1      -2.289  -0.309  -0.206  1.00  0.00           C  
HETATM    6  C4  UNL     1      -1.675  -0.819   0.898  1.00  0.00           C  
HETATM    7  C5  UNL     1      -0.285  -0.792   1.007  1.00  0.00           C  
HETATM    8  C6  UNL     1       0.503  -0.261   0.028  1.00  0.00           C  
HETATM    9  C7  UNL     1       1.949  -0.151   0.064  1.00  0.00           C  
HETATM   10  C8  UNL     1       2.708  -0.227  -1.101  1.00  0.00           C  
HETATM   11  C9  UNL     1       4.084  -0.088  -1.101  1.00  0.00           C  
HETATM   12  C10 UNL     1       4.745   0.132   0.079  1.00  0.00           C  
HETATM   13  C11 UNL     1       4.020   0.211   1.247  1.00  0.00           C  
HETATM   14  C12 UNL     1       2.649   0.071   1.224  1.00  0.00           C  
HETATM   15  C13 UNL     1      -0.156   0.252  -1.089  1.00  0.00           C  
HETATM   16  C14 UNL     1      -1.513   0.231  -1.208  1.00  0.00           C  
HETATM   17  H1  UNL     1      -4.352   2.426   1.058  1.00  0.00           H  
HETATM   18  H2  UNL     1      -4.181  -1.352  -0.476  1.00  0.00           H  
HETATM   19  H3  UNL     1      -4.031   0.255  -1.312  1.00  0.00           H  
HETATM   20  H4  UNL     1      -2.287  -1.255   1.707  1.00  0.00           H  
HETATM   21  H5  UNL     1       0.213  -1.195   1.903  1.00  0.00           H  
HETATM   22  H6  UNL     1       2.212  -0.395  -2.042  1.00  0.00           H  
HETATM   23  H7  UNL     1       4.598  -0.161  -2.034  1.00  0.00           H  
HETATM   24  H8  UNL     1       5.853   0.237   0.082  1.00  0.00           H  
HETATM   25  H9  UNL     1       4.571   0.386   2.178  1.00  0.00           H  
HETATM   26  H10 UNL     1       2.063   0.135   2.160  1.00  0.00           H  
HETATM   27  H11 UNL     1       0.440   0.670  -1.870  1.00  0.00           H  
HETATM   28  H12 UNL     1      -2.020   0.631  -2.103  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   17
CONECT    4    5   18   19
CONECT    5    6    6   16
CONECT    6    7   20
CONECT    7    8    8   21
CONECT    8    9   15
CONECT    9   10   10   14
CONECT   10   11   22
CONECT   11   12   12   23
CONECT   12   13   24
CONECT   13   14   14   25
CONECT   14   26
CONECT   15   16   16   27
CONECT   16   28
END