COMPND    HMDB0254278
HETATM    1  C1  UNL     1       5.760   2.076  -0.368  1.00  0.00           C  
HETATM    2  O1  UNL     1       4.333   1.992  -0.370  1.00  0.00           O  
HETATM    3  C2  UNL     1       3.720   0.748  -0.275  1.00  0.00           C  
HETATM    4  C3  UNL     1       4.401  -0.432  -0.178  1.00  0.00           C  
HETATM    5  C4  UNL     1       3.756  -1.645  -0.085  1.00  0.00           C  
HETATM    6  C5  UNL     1       2.383  -1.647  -0.093  1.00  0.00           C  
HETATM    7  C6  UNL     1       1.641  -0.466  -0.191  1.00  0.00           C  
HETATM    8  C7  UNL     1       0.204  -0.488  -0.198  1.00  0.00           C  
HETATM    9  C8  UNL     1      -1.010  -0.522  -0.218  1.00  0.00           C  
HETATM   10  C9  UNL     1      -2.454  -0.573  -0.265  1.00  0.00           C  
HETATM   11  C10 UNL     1      -3.113  -1.749  -0.628  1.00  0.00           C  
HETATM   12  C11 UNL     1      -4.489  -1.829  -0.682  1.00  0.00           C  
HETATM   13  C12 UNL     1      -5.202  -0.692  -0.361  1.00  0.00           C  
HETATM   14  C13 UNL     1      -4.541   0.469  -0.003  1.00  0.00           C  
HETATM   15  C14 UNL     1      -5.384   1.645   0.327  1.00  0.00           C  
HETATM   16  N1  UNL     1      -3.200   0.485   0.031  1.00  0.00           N  
HETATM   17  C15 UNL     1       2.336   0.707  -0.280  1.00  0.00           C  
HETATM   18  H1  UNL     1       6.077   3.099  -0.618  1.00  0.00           H  
HETATM   19  H2  UNL     1       6.108   1.363  -1.161  1.00  0.00           H  
HETATM   20  H3  UNL     1       6.148   1.739   0.609  1.00  0.00           H  
HETATM   21  H4  UNL     1       5.489  -0.384  -0.175  1.00  0.00           H  
HETATM   22  H5  UNL     1       4.271  -2.582  -0.008  1.00  0.00           H  
HETATM   23  H6  UNL     1       1.813  -2.579  -0.023  1.00  0.00           H  
HETATM   24  H7  UNL     1      -2.536  -2.630  -0.876  1.00  0.00           H  
HETATM   25  H8  UNL     1      -5.027  -2.724  -0.959  1.00  0.00           H  
HETATM   26  H9  UNL     1      -6.299  -0.714  -0.392  1.00  0.00           H  
HETATM   27  H10 UNL     1      -6.141   1.289   1.084  1.00  0.00           H  
HETATM   28  H11 UNL     1      -4.836   2.468   0.786  1.00  0.00           H  
HETATM   29  H12 UNL     1      -5.977   1.951  -0.577  1.00  0.00           H  
HETATM   30  H13 UNL     1       1.770   1.625  -0.356  1.00  0.00           H  
CONECT    1    2   18   19   20
CONECT    2    3
CONECT    3    4    4   17
CONECT    4    5   21
CONECT    5    6    6   22
CONECT    6    7   23
CONECT    7    8   17   17
CONECT    8    9    9    9
CONECT    9   10
CONECT   10   11   11   16
CONECT   11   12   24
CONECT   12   13   13   25
CONECT   13   14   26
CONECT   14   15   16   16
CONECT   15   27   28   29
CONECT   17   30
END