COMPND    HMDB0001004
HETATM    1  C1  UNL     1       5.026   0.187   0.001  1.00  0.00           C  
HETATM    2  N1  UNL     1       3.838  -0.614   0.318  1.00  0.00           N  
HETATM    3  C2  UNL     1       2.546  -0.107   0.073  1.00  0.00           C  
HETATM    4  O1  UNL     1       2.408   1.027  -0.416  1.00  0.00           O  
HETATM    5  C3  UNL     1       1.364  -0.919   0.396  1.00  0.00           C  
HETATM    6  C4  UNL     1       0.129  -0.137   0.034  1.00  0.00           C  
HETATM    7  C5  UNL     1      -1.119  -0.878   0.325  1.00  0.00           C  
HETATM    8  O2  UNL     1      -1.105  -2.030   0.818  1.00  0.00           O  
HETATM    9  C6  UNL     1      -2.384  -0.225   0.018  1.00  0.00           C  
HETATM   10  C7  UNL     1      -2.451   1.040  -0.525  1.00  0.00           C  
HETATM   11  C8  UNL     1      -3.658   1.652  -0.812  1.00  0.00           C  
HETATM   12  C9  UNL     1      -4.802   0.923  -0.525  1.00  0.00           C  
HETATM   13  N2  UNL     1      -4.742  -0.318   0.008  1.00  0.00           N  
HETATM   14  C10 UNL     1      -3.572  -0.893   0.279  1.00  0.00           C  
HETATM   15  H1  UNL     1       5.792  -0.478  -0.398  1.00  0.00           H  
HETATM   16  H2  UNL     1       5.339   0.763   0.898  1.00  0.00           H  
HETATM   17  H3  UNL     1       4.782   0.931  -0.783  1.00  0.00           H  
HETATM   18  H4  UNL     1       4.034  -1.553   0.724  1.00  0.00           H  
HETATM   19  H5  UNL     1       1.337  -1.087   1.494  1.00  0.00           H  
HETATM   20  H6  UNL     1       1.409  -1.901  -0.128  1.00  0.00           H  
HETATM   21  H7  UNL     1       0.186   0.825   0.604  1.00  0.00           H  
HETATM   22  H8  UNL     1       0.170   0.089  -1.059  1.00  0.00           H  
HETATM   23  H9  UNL     1      -1.518   1.544  -0.720  1.00  0.00           H  
HETATM   24  H10 UNL     1      -3.695   2.647  -1.239  1.00  0.00           H  
HETATM   25  H11 UNL     1      -5.749   1.410  -0.753  1.00  0.00           H  
HETATM   26  H12 UNL     1      -3.565  -1.898   0.709  1.00  0.00           H  
CONECT    1    2   15   16   17
CONECT    2    3   18
CONECT    3    4    4    5
CONECT    5    6   19   20
CONECT    6    7   21   22
CONECT    7    8    8    9
CONECT    9   10   10   14
CONECT   10   11   23
CONECT   11   12   12   24
CONECT   12   13   25
CONECT   13   14   14
CONECT   14   26
END