COMPND    HMDB0036186
HETATM    1  S1  UNL     1       2.802   0.322   0.759  1.00  0.00           S  
HETATM    2  C1  UNL     1       1.756  -0.883  -0.105  1.00  0.00           C  
HETATM    3  C2  UNL     1       0.359  -0.358  -0.091  1.00  0.00           C  
HETATM    4  C3  UNL     1      -0.132   0.450  -1.089  1.00  0.00           C  
HETATM    5  N1  UNL     1      -1.387   0.896  -1.035  1.00  0.00           N  
HETATM    6  C4  UNL     1      -2.223   0.576  -0.007  1.00  0.00           C  
HETATM    7  C5  UNL     1      -1.727  -0.231   0.987  1.00  0.00           C  
HETATM    8  N2  UNL     1      -0.466  -0.674   0.924  1.00  0.00           N  
HETATM    9  H1  UNL     1       2.243   1.607   0.496  1.00  0.00           H  
HETATM   10  H2  UNL     1       2.115  -1.053  -1.141  1.00  0.00           H  
HETATM   11  H3  UNL     1       1.767  -1.865   0.450  1.00  0.00           H  
HETATM   12  H4  UNL     1       0.497   0.728  -1.923  1.00  0.00           H  
HETATM   13  H5  UNL     1      -3.224   0.970  -0.025  1.00  0.00           H  
HETATM   14  H6  UNL     1      -2.379  -0.487   1.799  1.00  0.00           H  
CONECT    1    2    9
CONECT    2    3   10   11
CONECT    3    4    4    8
CONECT    4    5   12
CONECT    5    6    6
CONECT    6    7   13
CONECT    7    8    8   14
END