COMPND    HMDB0258111
HETATM    1  C1  UNL     1      -2.798   0.960   1.339  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.461   0.604  -0.097  1.00  0.00           C  
HETATM    3  N1  UNL     1      -3.181   0.994  -1.097  1.00  0.00           N  
HETATM    4  C3  UNL     1      -2.837   0.653  -2.332  1.00  0.00           C  
HETATM    5  S1  UNL     1      -1.423  -0.268  -2.070  1.00  0.00           S  
HETATM    6  C4  UNL     1      -1.354  -0.159  -0.366  1.00  0.00           C  
HETATM    7  C5  UNL     1      -0.353  -0.741   0.599  1.00  0.00           C  
HETATM    8  N2  UNL     1      -0.383  -2.201   0.519  1.00  0.00           N  
HETATM    9  C6  UNL     1       1.015  -0.304   0.256  1.00  0.00           C  
HETATM   10  C7  UNL     1       2.080  -0.979   0.813  1.00  0.00           C  
HETATM   11  C8  UNL     1       3.358  -0.578   0.500  1.00  0.00           C  
HETATM   12  C9  UNL     1       3.520   0.490  -0.364  1.00  0.00           C  
HETATM   13  C10 UNL     1       2.454   1.150  -0.908  1.00  0.00           C  
HETATM   14  C11 UNL     1       1.153   0.764  -0.607  1.00  0.00           C  
HETATM   15  H1  UNL     1      -2.047   1.677   1.714  1.00  0.00           H  
HETATM   16  H2  UNL     1      -3.797   1.381   1.442  1.00  0.00           H  
HETATM   17  H3  UNL     1      -2.782  -0.003   1.928  1.00  0.00           H  
HETATM   18  H4  UNL     1      -3.345   0.905  -3.283  1.00  0.00           H  
HETATM   19  H5  UNL     1      -0.608  -0.358   1.588  1.00  0.00           H  
HETATM   20  H6  UNL     1      -0.155  -2.634   1.442  1.00  0.00           H  
HETATM   21  H7  UNL     1       0.324  -2.516  -0.205  1.00  0.00           H  
HETATM   22  H8  UNL     1       1.927  -1.826   1.498  1.00  0.00           H  
HETATM   23  H9  UNL     1       4.240  -1.074   0.910  1.00  0.00           H  
HETATM   24  H10 UNL     1       4.542   0.784  -0.593  1.00  0.00           H  
HETATM   25  H11 UNL     1       2.602   1.988  -1.585  1.00  0.00           H  
HETATM   26  H12 UNL     1       0.310   1.290  -1.040  1.00  0.00           H  
CONECT    1    2   15   16   17
CONECT    2    3    6    6
CONECT    3    4    4
CONECT    4    5   18
CONECT    5    6
CONECT    6    7
CONECT    7    8    9   19
CONECT    8   20   21
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
END