-OEChem-07191013242D

 19 22  0     0  0  0  0  0  0999 V2000
   -6.0000  -47.0000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   36.0000  -45.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -37.0000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.0000   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000   24.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0000   24.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0000   43.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0000   43.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0000  -15.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.0000   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -35.0000   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0000  -15.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.0000   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0000   60.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.0000   60.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -35.0000   -5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0000   77.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0000   77.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0  0  0  0
  2  3  2  0  0  0  0
  3 10  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  9  2  0  0  0  0
  5  7  1  0  0  0  0
  5 11  2  0  0  0  0
  6  8  1  0  0  0  0
  6 12  2  0  0  0  0
  7  8  2  0  0  0  0
  7 15  1  0  0  0  0
  8 16  1  0  0  0  0
  9 10  1  0  0  0  0
  9 13  1  0  0  0  0
 10 14  2  0  0  0  0
 11 14  1  0  0  0  0
 12 17  1  0  0  0  0
 13 17  2  0  0  0  0
 15 18  2  0  0  0  0
 16 19  2  0  0  0  0
 18 19  1  0  0  0  0
M  CHG  2   1  -1   3   1
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
10462758

> <PUBCHEM_SUBSTANCE_VERSION>
1

> <PUBCHEM_EXT_DATASOURCE_NAME>
NIST

> <PUBCHEM_EXT_DATASOURCE_REGID>
1878872658

> <PUBCHEM_SUBSTANCE_SYNONYM>
3-Nitrofluoranthene
Fluoranthene, 3-nitro-

> <PUBCHEM_XREF_EXT_ID>
1878872658

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

> <PUBCHEM_CID_ASSOCIATIONS>
13462  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$