-OEChem-01131113492D

 10 10  0     0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9889   -2.3040    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.3040    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9968   -1.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6656   -1.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6577   -2.3040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6577    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6545   -1.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9889    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6545   -3.4536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  2  0  0  0  0
  2  6  1  0  0  0  0
  2  8  2  0  0  0  0
  2 10  1  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
  4  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>
33903490

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChemSpider

> <PUBCHEM_EXT_DATASOURCE_REGID>
19462240

> <PUBCHEM_XREF_EXT_ID>
19462240

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

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.chemspider.com/Chemical-Structure.19462240.html

> <PUBCHEM_CID_ASSOCIATIONS>
457  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$