COMPND    HMDB0259195
HETATM    1  C1  UNL     1       0.571   3.185   2.539  1.00  0.00           C  
HETATM    2  C2  UNL     1       1.900   2.980   1.968  1.00  0.00           C  
HETATM    3  N1  UNL     1       0.720   2.123   1.592  1.00  0.00           N  
HETATM    4  C3  UNL     1       0.343   1.022   0.769  1.00  0.00           C  
HETATM    5  N2  UNL     1      -0.932   0.579   0.776  1.00  0.00           N  
HETATM    6  C4  UNL     1      -1.331  -0.456   0.016  1.00  0.00           C  
HETATM    7  N3  UNL     1      -2.688  -0.869   0.073  1.00  0.00           N  
HETATM    8  C5  UNL     1      -3.724  -1.765  -0.378  1.00  0.00           C  
HETATM    9  C6  UNL     1      -4.036  -0.704   0.618  1.00  0.00           C  
HETATM   10  N4  UNL     1      -0.443  -1.091  -0.791  1.00  0.00           N  
HETATM   11  C7  UNL     1       0.826  -0.663  -0.809  1.00  0.00           C  
HETATM   12  N5  UNL     1       1.781  -1.301  -1.638  1.00  0.00           N  
HETATM   13  C8  UNL     1       2.258  -2.272  -2.608  1.00  0.00           C  
HETATM   14  C9  UNL     1       3.211  -1.326  -2.088  1.00  0.00           C  
HETATM   15  N6  UNL     1       1.190   0.374  -0.036  1.00  0.00           N  
HETATM   16  H1  UNL     1      -0.019   4.049   2.158  1.00  0.00           H  
HETATM   17  H2  UNL     1       0.451   2.939   3.627  1.00  0.00           H  
HETATM   18  H3  UNL     1       2.298   3.611   1.144  1.00  0.00           H  
HETATM   19  H4  UNL     1       2.666   2.365   2.471  1.00  0.00           H  
HETATM   20  H5  UNL     1      -3.764  -2.806   0.031  1.00  0.00           H  
HETATM   21  H6  UNL     1      -4.142  -1.654  -1.401  1.00  0.00           H  
HETATM   22  H7  UNL     1      -4.636   0.150   0.256  1.00  0.00           H  
HETATM   23  H8  UNL     1      -4.208  -0.962   1.678  1.00  0.00           H  
HETATM   24  H9  UNL     1       1.920  -2.203  -3.655  1.00  0.00           H  
HETATM   25  H10 UNL     1       2.333  -3.333  -2.243  1.00  0.00           H  
HETATM   26  H11 UNL     1       3.490  -0.461  -2.754  1.00  0.00           H  
HETATM   27  H12 UNL     1       3.964  -1.511  -1.317  1.00  0.00           H  
CONECT    1    2    3   16   17
CONECT    2    3   18   19
CONECT    3    4
CONECT    4    5    5   15
CONECT    5    6
CONECT    6    7   10   10
CONECT    7    8    9
CONECT    8    9   20   21
CONECT    9   22   23
CONECT   10   11
CONECT   11   12   15   15
CONECT   12   13   14
CONECT   13   14   24   25
CONECT   14   26   27
END