COMPND    HMDB0002017
HETATM    1  C1  UNL     1      -2.148   0.969   0.071  1.00  0.00           C  
HETATM    2  C2  UNL     1      -1.365  -0.145   0.683  1.00  0.00           C  
HETATM    3  N1  UNL     1      -1.820  -1.400   0.139  1.00  0.00           N  
HETATM    4  C3  UNL     1       0.088  -0.029   0.351  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.929  -1.119   0.535  1.00  0.00           C  
HETATM    6  C5  UNL     1       2.274  -1.084   0.251  1.00  0.00           C  
HETATM    7  C6  UNL     1       2.775   0.119  -0.241  1.00  0.00           C  
HETATM    8  C7  UNL     1       1.964   1.218  -0.434  1.00  0.00           C  
HETATM    9  C8  UNL     1       0.638   1.141  -0.140  1.00  0.00           C  
HETATM   10  H1  UNL     1      -1.982   0.956  -1.020  1.00  0.00           H  
HETATM   11  H2  UNL     1      -1.900   1.963   0.488  1.00  0.00           H  
HETATM   12  H3  UNL     1      -3.220   0.795   0.301  1.00  0.00           H  
HETATM   13  H4  UNL     1      -1.431  -0.121   1.801  1.00  0.00           H  
HETATM   14  H5  UNL     1      -2.711  -1.348  -0.364  1.00  0.00           H  
HETATM   15  H6  UNL     1      -1.719  -2.194   0.788  1.00  0.00           H  
HETATM   16  H7  UNL     1       0.480  -2.036   0.924  1.00  0.00           H  
HETATM   17  H8  UNL     1       2.929  -1.939   0.396  1.00  0.00           H  
HETATM   18  H9  UNL     1       3.833   0.138  -0.462  1.00  0.00           H  
HETATM   19  H10 UNL     1       2.399   2.121  -0.815  1.00  0.00           H  
HETATM   20  H11 UNL     1      -0.012   1.997  -0.287  1.00  0.00           H  
CONECT    1    2   10   11   12
CONECT    2    3    4   13
CONECT    3   14   15
CONECT    4    5    5    9
CONECT    5    6   16
CONECT    6    7    7   17
CONECT    7    8   18
CONECT    8    9    9   19
CONECT    9   20
END