COMPND    HMDB0250588
HETATM    1  C1  UNL     1      -1.723  -0.399   1.265  1.00  0.00           C  
HETATM    2  C2  UNL     1      -1.077   0.156   0.010  1.00  0.00           C  
HETATM    3  C3  UNL     1      -1.591  -0.560  -1.209  1.00  0.00           C  
HETATM    4  O1  UNL     1      -1.345   1.508  -0.143  1.00  0.00           O  
HETATM    5  O2  UNL     1      -2.607   1.814  -0.229  1.00  0.00           O  
HETATM    6  C4  UNL     1       0.401  -0.002   0.054  1.00  0.00           C  
HETATM    7  C5  UNL     1       1.203   0.982  -0.480  1.00  0.00           C  
HETATM    8  C6  UNL     1       2.587   0.918  -0.475  1.00  0.00           C  
HETATM    9  C7  UNL     1       3.176  -0.201   0.100  1.00  0.00           C  
HETATM   10  C8  UNL     1       2.376  -1.174   0.628  1.00  0.00           C  
HETATM   11  C9  UNL     1       0.988  -1.104   0.621  1.00  0.00           C  
HETATM   12  H1  UNL     1      -2.725   0.079   1.423  1.00  0.00           H  
HETATM   13  H2  UNL     1      -1.137  -0.260   2.170  1.00  0.00           H  
HETATM   14  H3  UNL     1      -1.944  -1.493   1.147  1.00  0.00           H  
HETATM   15  H4  UNL     1      -0.996  -0.264  -2.099  1.00  0.00           H  
HETATM   16  H5  UNL     1      -2.668  -0.316  -1.422  1.00  0.00           H  
HETATM   17  H6  UNL     1      -1.529  -1.659  -1.016  1.00  0.00           H  
HETATM   18  H7  UNL     1      -2.838   2.564   0.413  1.00  0.00           H  
HETATM   19  H8  UNL     1       0.779   1.870  -0.940  1.00  0.00           H  
HETATM   20  H9  UNL     1       3.184   1.721  -0.901  1.00  0.00           H  
HETATM   21  H10 UNL     1       4.257  -0.212   0.093  1.00  0.00           H  
HETATM   22  H11 UNL     1       2.837  -2.046   1.083  1.00  0.00           H  
HETATM   23  H12 UNL     1       0.392  -1.921   1.060  1.00  0.00           H  
CONECT    1    2   12   13   14
CONECT    2    3    4    6
CONECT    3   15   16   17
CONECT    4    5
CONECT    5   18
CONECT    6    7    7   11
CONECT    7    8   19
CONECT    8    9    9   20
CONECT    9   10   21
CONECT   10   11   11   22
CONECT   11   23
END