COMPND    HMDB0245646
HETATM    1  C1  UNL     1      -3.149   1.392   0.046  1.00  0.00           C  
HETATM    2  C2  UNL     1      -3.217  -0.091  -0.104  1.00  0.00           C  
HETATM    3  C3  UNL     1      -4.455  -0.847   0.176  1.00  0.00           C  
HETATM    4  C4  UNL     1      -2.124  -0.710  -0.499  1.00  0.00           C  
HETATM    5  C5  UNL     1      -0.850  -0.017  -0.797  1.00  0.00           C  
HETATM    6  N1  UNL     1       0.233  -0.485   0.057  1.00  0.00           N  
HETATM    7  C6  UNL     1       1.536   0.069  -0.085  1.00  0.00           C  
HETATM    8  N2  UNL     1       1.784   1.022  -1.000  1.00  0.00           N  
HETATM    9  C7  UNL     1       2.984   1.583  -1.185  1.00  0.00           C  
HETATM   10  N3  UNL     1       3.991   1.159  -0.402  1.00  0.00           N  
HETATM   11  C8  UNL     1       3.802   0.194   0.545  1.00  0.00           C  
HETATM   12  N4  UNL     1       4.617  -0.397   1.438  1.00  0.00           N  
HETATM   13  C9  UNL     1       3.946  -1.306   2.164  1.00  0.00           C  
HETATM   14  N5  UNL     1       2.674  -1.286   1.716  1.00  0.00           N  
HETATM   15  C10 UNL     1       2.560  -0.376   0.725  1.00  0.00           C  
HETATM   16  H1  UNL     1      -4.174   1.792   0.294  1.00  0.00           H  
HETATM   17  H2  UNL     1      -2.788   1.864  -0.897  1.00  0.00           H  
HETATM   18  H3  UNL     1      -2.518   1.641   0.913  1.00  0.00           H  
HETATM   19  H4  UNL     1      -4.948  -0.514   1.129  1.00  0.00           H  
HETATM   20  H5  UNL     1      -5.200  -0.774  -0.666  1.00  0.00           H  
HETATM   21  H6  UNL     1      -4.230  -1.925   0.289  1.00  0.00           H  
HETATM   22  H7  UNL     1      -2.134  -1.786  -0.620  1.00  0.00           H  
HETATM   23  H8  UNL     1      -0.911   1.077  -0.728  1.00  0.00           H  
HETATM   24  H9  UNL     1      -0.589  -0.266  -1.857  1.00  0.00           H  
HETATM   25  H10 UNL     1       0.045  -1.217   0.761  1.00  0.00           H  
HETATM   26  H11 UNL     1       3.168   2.357  -1.933  1.00  0.00           H  
HETATM   27  H12 UNL     1       5.634  -0.204   1.577  1.00  0.00           H  
HETATM   28  H13 UNL     1       4.312  -1.950   2.962  1.00  0.00           H  
CONECT    1    2   16   17   18
CONECT    2    3    4    4
CONECT    3   19   20   21
CONECT    4    5   22
CONECT    5    6   23   24
CONECT    6    7   25
CONECT    7    8    8   15
CONECT    8    9
CONECT    9   10   10   26
CONECT   10   11
CONECT   11   12   15   15
CONECT   12   13   27
CONECT   13   14   14   28
CONECT   14   15
END