-OEChem-06231013072D

 11 11  0     0  0  0  0  0  0999 V2000
    8.0000   41.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   19.0000   23.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0000   58.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.0000   51.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0000   10.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0000   30.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -25.0000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -25.0000  -19.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0000  -19.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0000  -29.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  2  0  0  0  0
  1  6  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  2  0  0  0  0
 10 11  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
10372413

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
NIST

> <PUBCHEM_EXT_DATASOURCE_REGID>
217428180

> <PUBCHEM_SUBSTANCE_SYNONYM>
.alpha.-Toluenesulfonyl fluoride
Benzenemethanesulfonyl fluoride

> <PUBCHEM_XREF_EXT_ID>
217428180

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

> <PUBCHEM_CID_ASSOCIATIONS>
4784  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$