-OEChem-01131113482D

 10 10  0     0  0  0  0  0  0999 V2000
    8.0000   45.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   43.0000  -15.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -43.0000   15.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.0000   15.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0000  -15.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0000   25.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0000   15.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.0000   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0000   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -25.0000   25.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  8  1  0  0  0  0
  3 10  1  0  0  0  0
  4  6  1  0  0  0  0
  4  8  2  0  0  0  0
  5  8  1  0  0  0  0
  5  9  2  0  0  0  0
  6  7  2  0  0  0  0
  7  9  1  0  0  0  0
  7 10  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
10414222

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
NIST

> <PUBCHEM_EXT_DATASOURCE_REGID>
211913310

> <PUBCHEM_SUBSTANCE_SYNONYM>
2,4(1H,3H)-Pyrimidinedione, 5-(hydroxymethyl)-
5-Hydroxymethyl uracil

> <PUBCHEM_XREF_EXT_ID>
211913310

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

> <PUBCHEM_CID_ASSOCIATIONS>
78168  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$