COMPND    HMDB0029835
HETATM    1  C1  UNL     1      -2.811  -1.752   0.998  1.00  0.00           C  
HETATM    2  C2  UNL     1      -2.145  -1.051  -0.172  1.00  0.00           C  
HETATM    3  N1  UNL     1      -2.970   0.012  -0.597  1.00  0.00           N  
HETATM    4  C3  UNL     1      -2.324   1.176  -1.094  1.00  0.00           C  
HETATM    5  C4  UNL     1      -0.999   0.864  -1.703  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.142   0.280  -0.630  1.00  0.00           C  
HETATM    7  C6  UNL     1      -0.755  -0.704   0.144  1.00  0.00           C  
HETATM    8  N2  UNL     1       0.183  -1.083   1.033  1.00  0.00           N  
HETATM    9  C7  UNL     1       1.329  -0.389   0.845  1.00  0.00           C  
HETATM   10  C8  UNL     1       2.567  -0.388   1.467  1.00  0.00           C  
HETATM   11  C9  UNL     1       3.587   0.463   1.042  1.00  0.00           C  
HETATM   12  O1  UNL     1       4.823   0.451   1.676  1.00  0.00           O  
HETATM   13  C10 UNL     1       3.399   1.330  -0.005  1.00  0.00           C  
HETATM   14  C11 UNL     1       2.149   1.318  -0.621  1.00  0.00           C  
HETATM   15  C12 UNL     1       1.144   0.477  -0.200  1.00  0.00           C  
HETATM   16  H1  UNL     1      -3.628  -1.136   1.431  1.00  0.00           H  
HETATM   17  H2  UNL     1      -3.223  -2.747   0.713  1.00  0.00           H  
HETATM   18  H3  UNL     1      -2.021  -1.949   1.769  1.00  0.00           H  
HETATM   19  H4  UNL     1      -2.104  -1.812  -1.006  1.00  0.00           H  
HETATM   20  H5  UNL     1      -3.829   0.168  -0.069  1.00  0.00           H  
HETATM   21  H6  UNL     1      -2.975   1.619  -1.901  1.00  0.00           H  
HETATM   22  H7  UNL     1      -2.151   1.957  -0.306  1.00  0.00           H  
HETATM   23  H8  UNL     1      -1.108   0.145  -2.539  1.00  0.00           H  
HETATM   24  H9  UNL     1      -0.520   1.783  -2.063  1.00  0.00           H  
HETATM   25  H10 UNL     1       0.034  -1.816   1.764  1.00  0.00           H  
HETATM   26  H11 UNL     1       2.754  -1.048   2.287  1.00  0.00           H  
HETATM   27  H12 UNL     1       5.580  -0.134   1.401  1.00  0.00           H  
HETATM   28  H13 UNL     1       4.198   1.985  -0.325  1.00  0.00           H  
HETATM   29  H14 UNL     1       1.960   1.981  -1.445  1.00  0.00           H  
CONECT    1    2   16   17   18
CONECT    2    3    7   19
CONECT    3    4   20
CONECT    4    5   21   22
CONECT    5    6   23   24
CONECT    6    7    7   15
CONECT    7    8
CONECT    8    9   25
CONECT    9   10   10   15
CONECT   10   11   26
CONECT   11   12   13   13
CONECT   12   27
CONECT   13   14   28
CONECT   14   15   15   29
END