COMPND    HMDB0253447
HETATM    1  C1  UNL     1      -4.273   2.550   0.308  1.00  0.00           C  
HETATM    2  N1  UNL     1      -3.370   1.396   0.282  1.00  0.00           N  
HETATM    3  C2  UNL     1      -2.041   1.423   0.091  1.00  0.00           C  
HETATM    4  C3  UNL     1      -1.516   0.150   0.130  1.00  0.00           C  
HETATM    5  C4  UNL     1      -0.246  -0.360  -0.004  1.00  0.00           C  
HETATM    6  N2  UNL     1       0.824   0.534  -0.235  1.00  0.00           N  
HETATM    7  C5  UNL     1       2.178   0.064  -0.385  1.00  0.00           C  
HETATM    8  N3  UNL     1       2.746  -0.390  -1.446  1.00  0.00           N  
HETATM    9  C6  UNL     1       4.116  -0.756  -1.171  1.00  0.00           C  
HETATM   10  C7  UNL     1       4.401   0.031   0.088  1.00  0.00           C  
HETATM   11  N4  UNL     1       3.091   0.060   0.703  1.00  0.00           N  
HETATM   12  C8  UNL     1      -0.086  -1.725   0.094  1.00  0.00           C  
HETATM   13  C9  UNL     1      -1.148  -2.577   0.321  1.00  0.00           C  
HETATM   14  C10 UNL     1      -2.411  -2.042   0.452  1.00  0.00           C  
HETATM   15  C11 UNL     1      -2.615  -0.681   0.360  1.00  0.00           C  
HETATM   16  N5  UNL     1      -3.690   0.128   0.440  1.00  0.00           N  
HETATM   17  H1  UNL     1      -5.224   2.218   0.744  1.00  0.00           H  
HETATM   18  H2  UNL     1      -4.487   2.861  -0.734  1.00  0.00           H  
HETATM   19  H3  UNL     1      -3.769   3.340   0.897  1.00  0.00           H  
HETATM   20  H4  UNL     1      -1.417   2.301  -0.075  1.00  0.00           H  
HETATM   21  H5  UNL     1       0.631   1.552  -0.299  1.00  0.00           H  
HETATM   22  H6  UNL     1       4.125  -1.846  -0.948  1.00  0.00           H  
HETATM   23  H7  UNL     1       4.805  -0.486  -1.995  1.00  0.00           H  
HETATM   24  H8  UNL     1       5.157  -0.459   0.729  1.00  0.00           H  
HETATM   25  H9  UNL     1       4.675   1.062  -0.202  1.00  0.00           H  
HETATM   26  H10 UNL     1       2.907   0.074   1.722  1.00  0.00           H  
HETATM   27  H11 UNL     1       0.924  -2.099  -0.015  1.00  0.00           H  
HETATM   28  H12 UNL     1      -1.013  -3.651   0.397  1.00  0.00           H  
HETATM   29  H13 UNL     1      -3.274  -2.672   0.630  1.00  0.00           H  
CONECT    1    2   17   18   19
CONECT    2    3   16
CONECT    3    4    4   20
CONECT    4    5   15
CONECT    5    6   12   12
CONECT    6    7   21
CONECT    7    8    8   11
CONECT    8    9
CONECT    9   10   22   23
CONECT   10   11   24   25
CONECT   11   26
CONECT   12   13   27
CONECT   13   14   14   28
CONECT   14   15   29
CONECT   15   16   16
END