-OEChem-10311114442D

 15 14  0     0  0  0  0  0  0999 V2000
    5.1310   -1.2897    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1138   -1.2483    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1345    0.4759    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1414    0.5241    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1241   -0.1690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1138   -0.0690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0966    0.4103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0966    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0552   -0.1690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0690   -0.0793    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0483    0.4276    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0345    0.4759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0069   -0.1448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0241   -0.1034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.4586    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  2  0  0  0  0
  2  6  2  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 12  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  1  0  0  0  0
 14 15  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
159111

> <PUBCHEM_SUBSTANCE_VERSION>
4

> <PUBCHEM_EXT_DATASOURCE_NAME>
ChemIDplus

> <PUBCHEM_EXT_DATASOURCE_REGID>
001852046

> <PUBCHEM_SUBSTANCE_SYNONYM>
1,9-Nonanedicarboxylic acid
138950-82-0
1852-04-6
EINECS 217-440-6
NSC 400241
Undecanedioic acid

> <PUBCHEM_GENERIC_REGISTRY_NAME>
138950-82-0
1852-04-6

> <PUBCHEM_XREF_EXT_ID>
001852046

> <PUBCHEM_EXT_DATASOURCE_URL>
http://chem.sis.nlm.nih.gov/chemidplus/

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://chem.sis.nlm.nih.gov/chemidplus/direct.jsp?result=advanced&regno=001852046

> <PUBCHEM_CID_ASSOCIATIONS>
15816  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$