COMPND    HMDB0004096
HETATM    1  C1  UNL     1      -3.658   1.842  -1.035  1.00  0.00           C  
HETATM    2  O1  UNL     1      -2.375   1.349  -1.281  1.00  0.00           O  
HETATM    3  C2  UNL     1      -1.646   0.609  -0.367  1.00  0.00           C  
HETATM    4  C3  UNL     1      -2.151   0.311   0.875  1.00  0.00           C  
HETATM    5  C4  UNL     1      -1.381  -0.434   1.754  1.00  0.00           C  
HETATM    6  C5  UNL     1      -0.116  -0.908   1.461  1.00  0.00           C  
HETATM    7  N1  UNL     1       0.821  -1.635   2.108  1.00  0.00           N  
HETATM    8  C6  UNL     1       1.892  -1.794   1.299  1.00  0.00           C  
HETATM    9  C7  UNL     1       1.630  -1.154   0.113  1.00  0.00           C  
HETATM   10  C8  UNL     1       2.492  -1.030  -1.110  1.00  0.00           C  
HETATM   11  C9  UNL     1       3.065   0.323  -1.078  1.00  0.00           C  
HETATM   12  O2  UNL     1       3.718   0.700  -0.082  1.00  0.00           O  
HETATM   13  O3  UNL     1       2.890   1.187  -2.133  1.00  0.00           O  
HETATM   14  C10 UNL     1       0.353  -0.580   0.191  1.00  0.00           C  
HETATM   15  C11 UNL     1      -0.373   0.155  -0.711  1.00  0.00           C  
HETATM   16  H1  UNL     1      -4.237   1.097  -0.446  1.00  0.00           H  
HETATM   17  H2  UNL     1      -3.706   2.815  -0.517  1.00  0.00           H  
HETATM   18  H3  UNL     1      -4.199   1.983  -2.011  1.00  0.00           H  
HETATM   19  H4  UNL     1      -3.154   0.659   1.179  1.00  0.00           H  
HETATM   20  H5  UNL     1      -1.796  -0.665   2.723  1.00  0.00           H  
HETATM   21  H6  UNL     1       0.736  -2.011   3.067  1.00  0.00           H  
HETATM   22  H7  UNL     1       2.804  -2.326   1.522  1.00  0.00           H  
HETATM   23  H8  UNL     1       3.244  -1.851  -1.149  1.00  0.00           H  
HETATM   24  H9  UNL     1       1.841  -1.119  -2.028  1.00  0.00           H  
HETATM   25  H10 UNL     1       3.264   2.103  -2.243  1.00  0.00           H  
HETATM   26  H11 UNL     1       0.042   0.372  -1.671  1.00  0.00           H  
CONECT    1    2   16   17   18
CONECT    2    3
CONECT    3    4    4   15
CONECT    4    5   19
CONECT    5    6    6   20
CONECT    6    7   14
CONECT    7    8   21
CONECT    8    9    9   22
CONECT    9   10   14
CONECT   10   11   23   24
CONECT   11   12   12   13
CONECT   13   25
CONECT   14   15   15
CONECT   15   26
END