-OEChem-03261011582D

 10  9  0     1  0  0  0  0  0999 V2000
    0.4875   -0.1542    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0958    0.4333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0667    0.4333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2000   -0.5667    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6583   -1.3792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9500   -2.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4792   -1.8042    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2250   -0.5667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2333   -1.3917    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.9458   -1.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  1  8  1  0  0  0  0
  5 10  2  0  0  0  0
  6 10  1  0  0  0  0
  7  9  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
85437198

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChEBI

> <PUBCHEM_EXT_DATASOURCE_REGID>
CHEBI:244030

> <PUBCHEM_SUBSTANCE_SYNONYM>
2-Amino-3-phosphono-propionic acid
CHEBI:244030

> <PUBCHEM_XREF_EXT_ID>
CHEBI:244030

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.ebi.ac.uk/chebi/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:244030

> <PUBCHEM_CID_ASSOCIATIONS>
3857  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$