COMPND    HMDB0003447
HETATM    1  O1  UNL     1       2.015  -0.541   1.727  1.00  0.00           O  
HETATM    2  C1  UNL     1       2.694   0.092   0.708  1.00  0.00           C  
HETATM    3  C2  UNL     1       2.042  -0.075  -0.651  1.00  0.00           C  
HETATM    4  C3  UNL     1       0.672   0.463  -0.686  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.307   1.695  -1.196  1.00  0.00           C  
HETATM    6  N1  UNL     1      -1.020   1.846  -1.034  1.00  0.00           N  
HETATM    7  C5  UNL     1      -1.500   0.740  -0.435  1.00  0.00           C  
HETATM    8  C6  UNL     1      -2.759   0.348  -0.035  1.00  0.00           C  
HETATM    9  C7  UNL     1      -2.981  -0.874   0.567  1.00  0.00           C  
HETATM   10  C8  UNL     1      -1.955  -1.763   0.800  1.00  0.00           C  
HETATM   11  C9  UNL     1      -0.688  -1.378   0.402  1.00  0.00           C  
HETATM   12  C10 UNL     1      -0.458  -0.154  -0.202  1.00  0.00           C  
HETATM   13  H1  UNL     1       2.619  -0.584   2.512  1.00  0.00           H  
HETATM   14  H2  UNL     1       2.764   1.174   0.945  1.00  0.00           H  
HETATM   15  H3  UNL     1       3.719  -0.338   0.657  1.00  0.00           H  
HETATM   16  H4  UNL     1       2.686   0.339  -1.453  1.00  0.00           H  
HETATM   17  H5  UNL     1       2.047  -1.191  -0.838  1.00  0.00           H  
HETATM   18  H6  UNL     1       0.939   2.451  -1.658  1.00  0.00           H  
HETATM   19  H7  UNL     1      -1.561   2.703  -1.337  1.00  0.00           H  
HETATM   20  H8  UNL     1      -3.578   1.044  -0.214  1.00  0.00           H  
HETATM   21  H9  UNL     1      -3.981  -1.182   0.883  1.00  0.00           H  
HETATM   22  H10 UNL     1      -2.138  -2.732   1.277  1.00  0.00           H  
HETATM   23  H11 UNL     1       0.116  -2.083   0.579  1.00  0.00           H  
CONECT    1    2   13
CONECT    2    3   14   15
CONECT    3    4   16   17
CONECT    4    5    5   12
CONECT    5    6   18
CONECT    6    7   19
CONECT    7    8    8   12
CONECT    8    9   20
CONECT    9   10   10   21
CONECT   10   11   22
CONECT   11   12   12   23
END