COMPND    HMDB0040201
HETATM    1  C1  UNL     1       3.720   0.984  -1.002  1.00  0.00           C  
HETATM    2  C2  UNL     1       3.185   0.130   0.075  1.00  0.00           C  
HETATM    3  O1  UNL     1       3.815  -0.887   0.650  1.00  0.00           O  
HETATM    4  C3  UNL     1       3.059  -1.433   1.570  1.00  0.00           C  
HETATM    5  C4  UNL     1       1.865  -0.730   1.594  1.00  0.00           C  
HETATM    6  C5  UNL     1       1.947   0.268   0.638  1.00  0.00           C  
HETATM    7  S1  UNL     1       0.681   1.466   0.251  1.00  0.00           S  
HETATM    8  S2  UNL     1      -0.588   0.701  -1.271  1.00  0.00           S  
HETATM    9  C6  UNL     1      -1.956  -0.198  -0.557  1.00  0.00           C  
HETATM   10  C7  UNL     1      -1.995  -1.544  -0.255  1.00  0.00           C  
HETATM   11  C8  UNL     1      -3.256  -1.794   0.279  1.00  0.00           C  
HETATM   12  O2  UNL     1      -3.928  -0.657   0.293  1.00  0.00           O  
HETATM   13  C9  UNL     1      -3.174   0.311  -0.201  1.00  0.00           C  
HETATM   14  C10 UNL     1      -3.571   1.717  -0.350  1.00  0.00           C  
HETATM   15  H1  UNL     1       4.791   0.725  -1.219  1.00  0.00           H  
HETATM   16  H2  UNL     1       3.756   2.068  -0.688  1.00  0.00           H  
HETATM   17  H3  UNL     1       3.153   0.871  -1.947  1.00  0.00           H  
HETATM   18  H4  UNL     1       3.363  -2.277   2.170  1.00  0.00           H  
HETATM   19  H5  UNL     1       1.031  -0.933   2.244  1.00  0.00           H  
HETATM   20  H6  UNL     1      -1.182  -2.244  -0.416  1.00  0.00           H  
HETATM   21  H7  UNL     1      -3.571  -2.772   0.609  1.00  0.00           H  
HETATM   22  H8  UNL     1      -3.172   2.185  -1.278  1.00  0.00           H  
HETATM   23  H9  UNL     1      -3.284   2.264   0.558  1.00  0.00           H  
HETATM   24  H10 UNL     1      -4.691   1.780  -0.432  1.00  0.00           H  
CONECT    1    2   15   16   17
CONECT    2    3    6    6
CONECT    3    4
CONECT    4    5    5   18
CONECT    5    6   19
CONECT    6    7
CONECT    7    8
CONECT    8    9
CONECT    9   10   13   13
CONECT   10   11   11   20
CONECT   11   12   21
CONECT   12   13
CONECT   13   14
CONECT   14   22   23   24
END