59120906
  -OEChem-05062403322D

 19 16  0     1  0  0  0  0  0999 V2000
    5.1350    1.2315    0.0000 Am  0  0  0  0  0  0  0  0  0  0  0  0
    2.5369    0.7315    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030    0.2315    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.4030   -0.7685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690    0.7315    0.0000 C   0  5  0  0  0  0  0  0  0  0  0  0
    2.5369   -1.2685    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0010    0.7315    0.0000 C   0  5  0  0  0  0  0  0  0  0  0  0
    3.4030    0.8515    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6150   -1.3511    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0135   -0.6608    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5790    0.1946    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9590    1.2685    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2269   -0.7315    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -1.5785    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8469   -1.8054    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.4215    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5380    0.4215    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3110    1.2685    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6910    0.1946    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  8  1  0  0  0  0
  4  6  1  0  0  0  0
  4  9  1  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 14  1  0  0  0  0
  6 15  1  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  7 19  1  0  0  0  0
M  CHG  2   5  -1   7  -1
M  END
> <PUBCHEM_COMPOUND_CID>
59120906

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
24

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
3

> <PUBCHEM_CACTVS_HBOND_DONOR>
1

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
1

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccBgIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACBSggAICAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAEAAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
americium;butan-2-ol;carbanide

> <PUBCHEM_IUPAC_CAS_NAME>
americium;2-butanol;carbanide

> <PUBCHEM_IUPAC_NAME_MARKUP>
americium;butan-2-ol;carbanide

> <PUBCHEM_IUPAC_NAME>
americium;butan-2-ol;carbanide

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
americium;butan-2-ol;carbanide

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
americium;butan-2-ol;carbanide

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C4H9O.CH3.Am/c1-3-4(2)5;;/h4-5H,2-3H2,1H3;1H3;/q2*-1;

> <PUBCHEM_IUPAC_INCHIKEY>
UCLSAODMKKBFLF-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
331.15019

> <PUBCHEM_MOLECULAR_FORMULA>
C5H12AmO-2

> <PUBCHEM_MOLECULAR_WEIGHT>
331.21

> <PUBCHEM_OPENEYE_CAN_SMILES>
[CH3-].CCC([CH2-])O.[Am]

> <PUBCHEM_OPENEYE_ISO_SMILES>
[CH3-].CCC([CH2-])O.[Am]

> <PUBCHEM_CACTVS_TPSA>
20.2

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
331.15019

> <PUBCHEM_TOTAL_CHARGE>
-2

> <PUBCHEM_HEAVY_ATOM_COUNT>
7

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
1

> <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  5  6
1  7  6

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
3  2  3

$$$$