COMPND    HMDB0037296
HETATM    1  C1  UNL     1       3.784  -0.094   0.417  1.00  0.00           C  
HETATM    2  C2  UNL     1       2.639   0.737  -0.022  1.00  0.00           C  
HETATM    3  O1  UNL     1       2.852   1.893  -0.451  1.00  0.00           O  
HETATM    4  C3  UNL     1       1.287   0.193   0.054  1.00  0.00           C  
HETATM    5  C4  UNL     1       0.189   0.934  -0.346  1.00  0.00           C  
HETATM    6  C5  UNL     1      -1.098   0.440  -0.283  1.00  0.00           C  
HETATM    7  C6  UNL     1      -2.206   1.173  -0.680  1.00  0.00           C  
HETATM    8  C7  UNL     1      -3.485   0.675  -0.615  1.00  0.00           C  
HETATM    9  N1  UNL     1      -3.670  -0.570  -0.148  1.00  0.00           N  
HETATM   10  C8  UNL     1      -2.610  -1.330   0.255  1.00  0.00           C  
HETATM   11  C9  UNL     1      -1.328  -0.842   0.194  1.00  0.00           C  
HETATM   12  C10 UNL     1      -0.215  -1.561   0.586  1.00  0.00           C  
HETATM   13  N2  UNL     1       1.042  -1.044   0.511  1.00  0.00           N  
HETATM   14  H1  UNL     1       3.602  -1.119   0.002  1.00  0.00           H  
HETATM   15  H2  UNL     1       3.682  -0.211   1.523  1.00  0.00           H  
HETATM   16  H3  UNL     1       4.751   0.294   0.102  1.00  0.00           H  
HETATM   17  H4  UNL     1       0.360   1.933  -0.718  1.00  0.00           H  
HETATM   18  H5  UNL     1      -2.064   2.171  -1.055  1.00  0.00           H  
HETATM   19  H6  UNL     1      -4.369   1.220  -0.916  1.00  0.00           H  
HETATM   20  H7  UNL     1      -2.751  -2.329   0.630  1.00  0.00           H  
HETATM   21  H8  UNL     1      -0.392  -2.563   0.959  1.00  0.00           H  
CONECT    1    2   14   15   16
CONECT    2    3    3    4
CONECT    4    5    5   13
CONECT    5    6   17
CONECT    6    7    7   11
CONECT    7    8   18
CONECT    8    9    9   19
CONECT    9   10
CONECT   10   11   11   20
CONECT   11   12
CONECT   12   13   13   21
END