HEADER
REMARK citraconic_acid_5291
HETATM    1  C           1       0.550  -0.826   0.000                       C
HETATM    2  C           1      -0.801  -0.767   0.000                       C
HETATM    3  C           1       1.561   0.288   0.000                       C
HETATM    4  O           1       2.760   0.076   0.000                       O
HETATM    5  O           1       1.065   1.535   0.000                       O
HETATM    6  H           1       1.844   2.123   0.000                       H
HETATM    7  C           1      -1.872   0.267   0.000                       C
HETATM    8  O           1      -3.039  -0.085   0.000                       O
HETATM    9  O           1      -1.526   1.566   0.000                       O
HETATM   10  H           1      -2.375   2.048   0.000                       H
HETATM   11  C           1       1.185  -2.208   0.000                       C
HETATM   12  H           1      -1.297  -1.736   0.000                       H
HETATM   13  H           1       0.871  -2.775   0.883                       H
HETATM   14  H           1       0.871  -2.775  -0.883                       H
HETATM   15  H           1       2.271  -2.135   0.000                       H
CONECT    1    2    3   11
CONECT    2    1    7   12
CONECT    3    1    4    5
CONECT    4    3
CONECT    5    3    6
CONECT    6    5
CONECT    7    2    8    9
CONECT    8    7
CONECT    9    7   10
CONECT   10    9
CONECT   11    1   13   14   15
CONECT   12    2
CONECT   13   11
CONECT   14   11
CONECT   15   11
END