61848
  -OEChem-05072406392D

  9  4  0     0  0  0  0  0  0999 V2000
    3.7320    0.0000    0.0000 Co  0  0  0  0  0  0  0  0  0  0  0  0
    5.4641    1.0000    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.0000    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    2.7320    1.7320    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    4.7320   -1.7320    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    4.5981    0.5000    0.0000 C   0  5  0  0  0  0  0  0  0  0  0  0
    2.8660   -0.5000    0.0000 C   0  5  0  0  0  0  0  0  0  0  0  0
    3.2320    0.8660    0.0000 C   0  5  0  0  0  0  0  0  0  0  0  0
    4.2320   -0.8660    0.0000 C   0  5  0  0  0  0  0  0  0  0  0  0
  2  6  3  0  0  0  0
  3  7  3  0  0  0  0
  4  8  3  0  0  0  0
  5  9  3  0  0  0  0
M  CHG  8   2   1   3   1   4   1   5   1   6  -1   7  -1   8  -1   9  -1
M  END
> <PUBCHEM_COMPOUND_CID>
61848

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
10

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
4

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcQBgOAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
carbon monoxide;cobalt

> <PUBCHEM_IUPAC_CAS_NAME>
carbon monoxide;cobalt

> <PUBCHEM_IUPAC_NAME_MARKUP>
carbon monoxide;cobalt

> <PUBCHEM_IUPAC_NAME>
carbon monoxide;cobalt

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
carbon monoxide;cobalt

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
carbon monoxide;cobalt

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/4CO.Co/c4*1-2;

> <PUBCHEM_IUPAC_INCHIKEY>
OIQOECYRLBNNBQ-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
170.912852

> <PUBCHEM_MOLECULAR_FORMULA>
C4CoO4

> <PUBCHEM_MOLECULAR_WEIGHT>
170.97

> <PUBCHEM_OPENEYE_CAN_SMILES>
[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co]

> <PUBCHEM_OPENEYE_ISO_SMILES>
[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Co]

> <PUBCHEM_CACTVS_TPSA>
4

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
170.912852

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
9

> <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>
5

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

$$$$