-OEChem-08271216092D

 15 17  0     0  0  0  0  0  0999 V2000
 -999.0000  107.2460    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -47.3318  126.8960    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  662.4720  275.2690    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  169.8840  535.5070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -260.2380  535.5070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  169.8840  275.2690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -260.2380  249.4480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  416.1950  133.0670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -507.5840  679.6060    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  416.1950  701.8410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -507.5840  107.5570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -752.6890  249.4480    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 -752.6890  535.5070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  662.4720  559.6730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  416.1950 -151.3370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  2  6  1  0  0  0  0
  2  7  1  0  0  0  0
  3  8  2  0  0  0  0
  3 14  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4 10  1  0  0  0  0
  5  7  2  0  0  0  0
  5  9  1  0  0  0  0
  6  8  1  0  0  0  0
  7 11  1  0  0  0  0
  8 15  1  0  0  0  0
  9 13  2  0  0  0  0
 10 14  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_ID_TYPE>
0

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_SUBSTANCE_ID>
57389470

> <PUBCHEM_SUBSTANCE_VERSION>
2

> <PUBCHEM_EXT_DATASOURCE_NAME>
BioCyc

> <PUBCHEM_EXT_DATASOURCE_REGID>
CPD-9938

> <PUBCHEM_SUBSTANCE_COMMENT>
TYPES: ALKALOID

> <PUBCHEM_SUBSTANCE_SYNONYM>
CPD-9938
harmalol

> <PUBCHEM_XREF_EXT_ID>
CPD-9938

> <PUBCHEM_EXT_DATASOURCE_URL>
http://www.biocyc.org

> <PUBCHEM_EXT_SUBSTANCE_URL>
http://biocyc.org/META/NEW-IMAGE?type=COMPOUND&object=CPD-9938

> <PUBCHEM_CID_ASSOCIATIONS>
5353656  1

> <PUBCHEM_COORDINATE_TYPE>
1
3

$$$$