-OEChem-11021115562D

  8  8  0     0  0  0  0  0  0999 V2000
    0.0000   -2.6654    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.9782   -0.7137    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7842    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2644   -2.2512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6741   -0.9868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0442   -3.3306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -3.9959    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2644   -4.4056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  7  1  0  0  0  0
  2  5  2  0  0  0  0
  3  5  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  6  8  1  0  0  0  0
  7  8  2  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
38329611

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChemSpider

> <PUBCHEM_EXT_DATASOURCE_REGID>
11232245

> <PUBCHEM_XREF_EXT_ID>
11232245

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.chemspider.com

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.chemspider.com/Chemical-Structure.11232245.html

> <PUBCHEM_CID_ASSOCIATIONS>
10700  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$