6379269
  -OEChem-05092401122D

  5  2  0     0  0  0  0  0  0999 V2000
    4.5981    0.2500    0.0000 Bi  0  4  0  0  0  0  0  0  0  0  0  0
    2.8660    0.2500    0.0000 Bi  0  4  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.2500    0.0000 Se  0  0  0  0  0 15  0  0  0  0  0  0
    5.4641   -0.2500    0.0000 Se  0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.2500    0.0000 Se  0  0  0  0  0  0  0  0  0  0  0  0
  1  4  2  0  0  0  0
  2  5  2  0  0  0  0
M  RAD  2   1   2   2   2
M  END
> <PUBCHEM_COMPOUND_CID>
6379269

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
6.9

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
0

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQAAAAAAAAAAIAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/2Bi.3Se

> <PUBCHEM_IUPAC_INCHIKEY>
OMEPJWROJCQMMU-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
655.71115

> <PUBCHEM_MOLECULAR_FORMULA>
Bi2Se3

> <PUBCHEM_MOLECULAR_WEIGHT>
654.9

> <PUBCHEM_OPENEYE_CAN_SMILES>
[Se].[Se]=[Bi].[Se]=[Bi]

> <PUBCHEM_OPENEYE_ISO_SMILES>
[Se].[Se]=[Bi].[Se]=[Bi]

> <PUBCHEM_CACTVS_TPSA>
0

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
657.71036

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
5

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
3

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_NONSTANDARDBOND>
1  3  6
2  3  6

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$