COMPND    HMDB0302401
HETATM    1  C1  UNL     1      -3.335   0.371   0.315  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.785  -0.884   0.491  1.00  0.00           C  
HETATM    3  C3  UNL     1      -1.417  -1.054   0.370  1.00  0.00           C  
HETATM    4  C4  UNL     1      -0.568  -0.010   0.076  1.00  0.00           C  
HETATM    5  C5  UNL     1       0.863  -0.215  -0.047  1.00  0.00           C  
HETATM    6  C6  UNL     1       1.743   0.798   0.297  1.00  0.00           C  
HETATM    7  C7  UNL     1       3.105   0.580   0.169  1.00  0.00           C  
HETATM    8  C8  UNL     1       3.624  -0.618  -0.293  1.00  0.00           C  
HETATM    9  N1  UNL     1       2.726  -1.578  -0.616  1.00  0.00           N  
HETATM   10  C9  UNL     1       1.394  -1.386  -0.499  1.00  0.00           C  
HETATM   11  C10 UNL     1      -1.145   1.231  -0.094  1.00  0.00           C  
HETATM   12  C11 UNL     1      -2.515   1.426   0.024  1.00  0.00           C  
HETATM   13  H1  UNL     1      -4.402   0.534   0.403  1.00  0.00           H  
HETATM   14  H2  UNL     1      -3.409  -1.753   0.726  1.00  0.00           H  
HETATM   15  H3  UNL     1      -1.034  -2.041   0.513  1.00  0.00           H  
HETATM   16  H4  UNL     1       1.376   1.745   0.662  1.00  0.00           H  
HETATM   17  H5  UNL     1       3.838   1.346   0.429  1.00  0.00           H  
HETATM   18  H6  UNL     1       4.689  -0.790  -0.395  1.00  0.00           H  
HETATM   19  H7  UNL     1       0.769  -2.216  -0.783  1.00  0.00           H  
HETATM   20  H8  UNL     1      -0.558   2.102  -0.325  1.00  0.00           H  
HETATM   21  H9  UNL     1      -2.958   2.410  -0.111  1.00  0.00           H  
CONECT    1    2    2   12   13
CONECT    2    3   14
CONECT    3    4    4   15
CONECT    4    5   11
CONECT    5    6    6   10
CONECT    6    7   16
CONECT    7    8    8   17
CONECT    8    9   18
CONECT    9   10   10
CONECT   10   19
CONECT   11   12   12   20
CONECT   12   21
END