COMPND    HMDB0038835
HETATM    1  O1  UNL     1       0.039   0.025   0.981  1.00  0.00           O  
HETATM    2  C1  UNL     1       0.522   0.164  -0.159  1.00  0.00           C  
HETATM    3  C2  UNL     1      -0.251   0.166  -1.345  1.00  0.00           C  
HETATM    4  C3  UNL     1      -1.516   0.094  -1.441  1.00  0.00           C  
HETATM    5  C4  UNL     1      -2.454   0.016  -0.380  1.00  0.00           C  
HETATM    6  C5  UNL     1      -3.595  -0.791  -0.635  1.00  0.00           C  
HETATM    7  C6  UNL     1      -4.653  -0.888   0.217  1.00  0.00           C  
HETATM    8  C7  UNL     1      -4.673  -0.192   1.398  1.00  0.00           C  
HETATM    9  C8  UNL     1      -3.594   0.607   1.694  1.00  0.00           C  
HETATM   10  C9  UNL     1      -2.520   0.689   0.799  1.00  0.00           C  
HETATM   11  N1  UNL     1       1.952   0.328  -0.214  1.00  0.00           N  
HETATM   12  C10 UNL     1       2.876   0.349   0.916  1.00  0.00           C  
HETATM   13  C11 UNL     1       4.142  -0.313   0.371  1.00  0.00           C  
HETATM   14  C12 UNL     1       3.829  -0.607  -1.079  1.00  0.00           C  
HETATM   15  C13 UNL     1       2.795   0.497  -1.361  1.00  0.00           C  
HETATM   16  H1  UNL     1       0.353   0.241  -2.305  1.00  0.00           H  
HETATM   17  H2  UNL     1      -1.917   0.097  -2.502  1.00  0.00           H  
HETATM   18  H3  UNL     1      -3.578  -1.351  -1.585  1.00  0.00           H  
HETATM   19  H4  UNL     1      -5.499  -1.514  -0.019  1.00  0.00           H  
HETATM   20  H5  UNL     1      -5.514  -0.256   2.100  1.00  0.00           H  
HETATM   21  H6  UNL     1      -3.610   1.150   2.616  1.00  0.00           H  
HETATM   22  H7  UNL     1      -1.781   1.401   1.100  1.00  0.00           H  
HETATM   23  H8  UNL     1       2.492  -0.241   1.766  1.00  0.00           H  
HETATM   24  H9  UNL     1       3.097   1.373   1.237  1.00  0.00           H  
HETATM   25  H10 UNL     1       4.407  -1.214   0.941  1.00  0.00           H  
HETATM   26  H11 UNL     1       4.971   0.423   0.389  1.00  0.00           H  
HETATM   27  H12 UNL     1       3.291  -1.563  -1.214  1.00  0.00           H  
HETATM   28  H13 UNL     1       4.707  -0.507  -1.738  1.00  0.00           H  
HETATM   29  H14 UNL     1       2.331   0.364  -2.334  1.00  0.00           H  
HETATM   30  H15 UNL     1       3.348   1.455  -1.257  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   11
CONECT    3    4    4   16
CONECT    4    5   17
CONECT    5    6    6   10
CONECT    6    7   18
CONECT    7    8    8   19
CONECT    8    9   20
CONECT    9   10   10   21
CONECT   10   22
CONECT   11   12   15
CONECT   12   13   23   24
CONECT   13   14   25   26
CONECT   14   15   27   28
CONECT   15   29   30
END