COMPND    HMDB0038925
HETATM    1  C1  UNL     1      -2.711   1.945   0.046  1.00  0.00           C  
HETATM    2  O1  UNL     1      -2.731   0.601   0.456  1.00  0.00           O  
HETATM    3  C2  UNL     1      -1.593  -0.166   0.284  1.00  0.00           C  
HETATM    4  C3  UNL     1      -0.462   0.379  -0.280  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.636  -0.450  -0.420  1.00  0.00           C  
HETATM    6  C5  UNL     1       1.863   0.098  -1.017  1.00  0.00           C  
HETATM    7  C6  UNL     1       2.775   0.690   0.062  1.00  0.00           C  
HETATM    8  O2  UNL     1       3.921   1.196  -0.545  1.00  0.00           O  
HETATM    9  C7  UNL     1       0.625  -1.776  -0.018  1.00  0.00           C  
HETATM   10  C8  UNL     1      -0.529  -2.289   0.543  1.00  0.00           C  
HETATM   11  C9  UNL     1      -1.646  -1.489   0.698  1.00  0.00           C  
HETATM   12  O3  UNL     1      -2.809  -1.996   1.262  1.00  0.00           O  
HETATM   13  H1  UNL     1      -3.661   2.417   0.394  1.00  0.00           H  
HETATM   14  H2  UNL     1      -1.829   2.432   0.471  1.00  0.00           H  
HETATM   15  H3  UNL     1      -2.694   2.056  -1.069  1.00  0.00           H  
HETATM   16  H4  UNL     1      -0.419   1.422  -0.607  1.00  0.00           H  
HETATM   17  H5  UNL     1       2.448  -0.702  -1.525  1.00  0.00           H  
HETATM   18  H6  UNL     1       1.656   0.934  -1.720  1.00  0.00           H  
HETATM   19  H7  UNL     1       2.245   1.515   0.572  1.00  0.00           H  
HETATM   20  H8  UNL     1       3.009  -0.146   0.749  1.00  0.00           H  
HETATM   21  H9  UNL     1       4.624   0.487  -0.453  1.00  0.00           H  
HETATM   22  H10 UNL     1       1.492  -2.424  -0.131  1.00  0.00           H  
HETATM   23  H11 UNL     1      -0.598  -3.330   0.880  1.00  0.00           H  
HETATM   24  H12 UNL     1      -3.612  -1.406   1.368  1.00  0.00           H  
CONECT    1    2   13   14   15
CONECT    2    3
CONECT    3    4    4   11
CONECT    4    5   16
CONECT    5    6    9    9
CONECT    6    7   17   18
CONECT    7    8   19   20
CONECT    8   21
CONECT    9   10   22
CONECT   10   11   11   23
CONECT   11   12
CONECT   12   24
END