COMPND    HMDB0256869
HETATM    1  C1  UNL     1      -3.244   0.347  -0.583  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.849  -0.434   0.624  1.00  0.00           C  
HETATM    3  C3  UNL     1      -1.527  -1.128   0.492  1.00  0.00           C  
HETATM    4  C4  UNL     1      -0.406  -0.200   0.250  1.00  0.00           C  
HETATM    5  C5  UNL     1       0.864  -0.770   0.115  1.00  0.00           C  
HETATM    6  C6  UNL     1       1.980   0.001  -0.113  1.00  0.00           C  
HETATM    7  C7  UNL     1       3.325  -0.522  -0.263  1.00  0.00           C  
HETATM    8  N1  UNL     1       3.564  -1.766  -0.191  1.00  0.00           N  
HETATM    9  S1  UNL     1       4.692   0.598  -0.558  1.00  0.00           S  
HETATM   10  C8  UNL     1       1.799   1.376  -0.206  1.00  0.00           C  
HETATM   11  C9  UNL     1       0.558   1.898  -0.070  1.00  0.00           C  
HETATM   12  N2  UNL     1      -0.506   1.110   0.152  1.00  0.00           N  
HETATM   13  H1  UNL     1      -2.910  -0.083  -1.542  1.00  0.00           H  
HETATM   14  H2  UNL     1      -2.969   1.439  -0.498  1.00  0.00           H  
HETATM   15  H3  UNL     1      -4.372   0.364  -0.639  1.00  0.00           H  
HETATM   16  H4  UNL     1      -2.904   0.185   1.516  1.00  0.00           H  
HETATM   17  H5  UNL     1      -3.619  -1.245   0.756  1.00  0.00           H  
HETATM   18  H6  UNL     1      -1.558  -1.956  -0.244  1.00  0.00           H  
HETATM   19  H7  UNL     1      -1.322  -1.622   1.480  1.00  0.00           H  
HETATM   20  H8  UNL     1       0.976  -1.842   0.191  1.00  0.00           H  
HETATM   21  H9  UNL     1       2.816  -2.451  -0.024  1.00  0.00           H  
HETATM   22  H10 UNL     1       4.619   1.721   0.284  1.00  0.00           H  
HETATM   23  H11 UNL     1       2.651   2.009  -0.383  1.00  0.00           H  
HETATM   24  H12 UNL     1       0.342   2.972  -0.132  1.00  0.00           H  
CONECT    1    2   13   14   15
CONECT    2    3   16   17
CONECT    3    4   18   19
CONECT    4    5    5   12
CONECT    5    6   20
CONECT    6    7   10   10
CONECT    7    8    8    9
CONECT    8   21
CONECT    9   22
CONECT   10   11   23
CONECT   11   12   12   24
END