COMPND    HMDB0060410
HETATM    1  N1  UNL     1       3.768   1.055  -1.395  1.00  0.00           N  
HETATM    2  C1  UNL     1       2.618   0.544  -0.720  1.00  0.00           C  
HETATM    3  N2  UNL     1       1.423   0.451  -1.331  1.00  0.00           N  
HETATM    4  C2  UNL     1       0.333  -0.030  -0.702  1.00  0.00           C  
HETATM    5  C3  UNL     1       0.401  -0.452   0.609  1.00  0.00           C  
HETATM    6  C4  UNL     1       1.629  -0.354   1.229  1.00  0.00           C  
HETATM    7  O1  UNL     1       1.718  -0.734   2.433  1.00  0.00           O  
HETATM    8  N3  UNL     1       2.690   0.134   0.559  1.00  0.00           N  
HETATM    9  N4  UNL     1      -0.754  -0.963   1.280  1.00  0.00           N  
HETATM   10  C5  UNL     1      -2.053  -0.733   0.675  1.00  0.00           C  
HETATM   11  C6  UNL     1      -2.415   0.723   0.727  1.00  0.00           C  
HETATM   12  O2  UNL     1      -1.663   1.588   1.236  1.00  0.00           O  
HETATM   13  O3  UNL     1      -3.622   1.119   0.193  1.00  0.00           O  
HETATM   14  C7  UNL     1      -1.886  -1.080  -0.811  1.00  0.00           C  
HETATM   15  N5  UNL     1      -0.936  -0.129  -1.350  1.00  0.00           N  
HETATM   16  H1  UNL     1       4.344   1.837  -1.062  1.00  0.00           H  
HETATM   17  H2  UNL     1       4.047   0.600  -2.294  1.00  0.00           H  
HETATM   18  H3  UNL     1       3.613   0.194   1.063  1.00  0.00           H  
HETATM   19  H4  UNL     1      -0.597  -1.470   2.164  1.00  0.00           H  
HETATM   20  H5  UNL     1      -2.809  -1.365   1.161  1.00  0.00           H  
HETATM   21  H6  UNL     1      -4.297   1.699   0.687  1.00  0.00           H  
HETATM   22  H7  UNL     1      -1.538  -2.129  -0.895  1.00  0.00           H  
HETATM   23  H8  UNL     1      -2.885  -0.984  -1.278  1.00  0.00           H  
HETATM   24  H9  UNL     1      -1.130   0.478  -2.175  1.00  0.00           H  
CONECT    1    2   16   17
CONECT    2    3    3    8
CONECT    3    4
CONECT    4    5    5   15
CONECT    5    6    9
CONECT    6    7    7    8
CONECT    8   18
CONECT    9   10   19
CONECT   10   11   14   20
CONECT   11   12   12   13
CONECT   13   21
CONECT   14   15   22   23
CONECT   15   24
END