-OEChem-07191013262D

 11 11  0     0  0  0  0  0  0999 V2000
   -8.0000  -10.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  -25.0000  -20.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0000  -20.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -27.0000   -5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   27.0000   10.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0000   10.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0000   20.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -25.0000   20.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0000   40.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -25.0000   40.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0000   50.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  1  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  2  0  0  0  0
  7  9  2  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 11  2  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
10374637

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
NIST

> <PUBCHEM_EXT_DATASOURCE_REGID>
3771043088

> <PUBCHEM_SUBSTANCE_SYNONYM>
Aniline-o-sulfonic acid
o-Aminobenzenesulfonic acid

> <PUBCHEM_XREF_EXT_ID>
3771043088

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.nist.gov/srd/nist1a.htm

> <PUBCHEM_CID_ASSOCIATIONS>
6926  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$