COMPND    HMDB0240742
HETATM    1  O1  UNL     1      -1.028  -0.548  -2.395  1.00  0.00           O  
HETATM    2  C1  UNL     1      -1.445  -0.313  -1.246  1.00  0.00           C  
HETATM    3  C2  UNL     1      -0.666  -0.031  -0.056  1.00  0.00           C  
HETATM    4  C3  UNL     1       0.659   0.035   0.054  1.00  0.00           C  
HETATM    5  N1  UNL     1       1.527  -0.176  -1.047  1.00  0.00           N  
HETATM    6  C4  UNL     1       2.870  -0.027  -0.555  1.00  0.00           C  
HETATM    7  C5  UNL     1       4.104  -0.122  -1.174  1.00  0.00           C  
HETATM    8  C6  UNL     1       5.283   0.063  -0.491  1.00  0.00           C  
HETATM    9  C7  UNL     1       5.285   0.353   0.848  1.00  0.00           C  
HETATM   10  C8  UNL     1       4.067   0.451   1.478  1.00  0.00           C  
HETATM   11  C9  UNL     1       2.860   0.264   0.792  1.00  0.00           C  
HETATM   12  C10 UNL     1       1.466   0.316   1.233  1.00  0.00           C  
HETATM   13  O2  UNL     1       1.008   0.548   2.373  1.00  0.00           O  
HETATM   14  N2  UNL     1      -1.573   0.175   1.027  1.00  0.00           N  
HETATM   15  C11 UNL     1      -2.895   0.019   0.500  1.00  0.00           C  
HETATM   16  C12 UNL     1      -4.125   0.124   1.164  1.00  0.00           C  
HETATM   17  C13 UNL     1      -5.309  -0.060   0.487  1.00  0.00           C  
HETATM   18  C14 UNL     1      -5.235  -0.349  -0.858  1.00  0.00           C  
HETATM   19  C15 UNL     1      -4.032  -0.454  -1.520  1.00  0.00           C  
HETATM   20  C16 UNL     1      -2.840  -0.270  -0.844  1.00  0.00           C  
HETATM   21  H1  UNL     1       1.279  -0.396  -2.028  1.00  0.00           H  
HETATM   22  H2  UNL     1       4.086  -0.352  -2.238  1.00  0.00           H  
HETATM   23  H3  UNL     1       6.229  -0.018  -1.009  1.00  0.00           H  
HETATM   24  H4  UNL     1       6.229   0.493   1.354  1.00  0.00           H  
HETATM   25  H5  UNL     1       4.054   0.679   2.535  1.00  0.00           H  
HETATM   26  H6  UNL     1      -1.305   0.398   2.018  1.00  0.00           H  
HETATM   27  H7  UNL     1      -4.158   0.353   2.231  1.00  0.00           H  
HETATM   28  H8  UNL     1      -6.282   0.020   0.999  1.00  0.00           H  
HETATM   29  H9  UNL     1      -6.164  -0.494  -1.393  1.00  0.00           H  
HETATM   30  H10 UNL     1      -3.949  -0.681  -2.581  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   20
CONECT    3    4    4   14
CONECT    4    5   12
CONECT    5    6   21
CONECT    6    7    7   11
CONECT    7    8   22
CONECT    8    9    9   23
CONECT    9   10   24
CONECT   10   11   11   25
CONECT   11   12
CONECT   12   13   13
CONECT   14   15   26
CONECT   15   16   16   20
CONECT   16   17   27
CONECT   17   18   18   28
CONECT   18   19   29
CONECT   19   20   20   30
END