-OEChem-05171211432D

 10 10  0     0  0  0  0  0  0999 V2000
   30.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   70.0000   68.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   17.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   30.0000   33.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   40.0000   16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   40.0000   51.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   60.0000   51.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   60.0000   16.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   70.0000   33.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0000   33.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  2  7  1  0  0  0  0
  3 10  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4 10  1  0  0  0  0
  5  8  2  0  0  0  0
  6  7  1  0  0  0  0
  7  9  2  0  0  0  0
  8  9  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
10505314

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
NIST Chemistry WebBook

> <PUBCHEM_EXT_DATASOURCE_REGID>
2016801733

> <PUBCHEM_SUBSTANCE_SYNONYM>
2,5-Dihydroxybenzaldehyde
Gentisaldehyde

> <PUBCHEM_XREF_EXT_ID>
2016801733

> <PUBCHEM_EXT_DATASOURCE_URL>
http://webbook.nist.gov/chemistry/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://webbook.nist.gov/cgi/cbook.cgi?InChI=InChI%3D1/C7H6O3/c8-4-5-3-6%289%291-2-7%285%2910/h1-4%2C9-10H%0A

> <PUBCHEM_CID_ASSOCIATIONS>
70949  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$