-OEChem-10191113482D

  7  6  0     1  0  0  0  0  0999 V2000
   17.0000   40.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.0000   10.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -34.0000    9.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000    9.0000    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   17.0000   19.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0000   19.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000  -11.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  2  0  0  0  0
  2  5  1  0  0  0  0
  3  6  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  7  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
10323833

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
NIST

> <PUBCHEM_EXT_DATASOURCE_REGID>
3416055009

> <PUBCHEM_SUBSTANCE_SYNONYM>
3-Aminoisobutyric acid
Propanoic acid, 3-amino-2-methyl-

> <PUBCHEM_XREF_EXT_ID>
3416055009

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

> <PUBCHEM_CID_ASSOCIATIONS>
64956  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$