9851553
  -OEChem-04232420272D

 81 78  0     0  0  0  0  0  0999 V2000
    6.5010    3.5369    0.0000 Sn  0  3  0  0  0  0  0  0  0  0  0  0
    6.5010   10.0488    0.0000 Sn  0  3  0  0  0  0  0  0  0  0  0  0
    0.0000    5.2619    0.0000 O   0  6  0  0  0  0  0  0  0  0  0  0
    7.3671    4.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6350    4.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5010    2.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3671   10.5488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6350   10.5488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5010    9.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2331    3.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7690    3.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6350    2.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2331   10.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7690   10.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6350    8.5488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0991    4.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9030    4.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6350    1.0369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0991   10.5488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9030   10.5488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6350    7.5488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9651    3.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0369    3.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7690    0.5369    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9651   10.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0369   10.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7690    7.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7656    4.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9685    4.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0335    4.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2365    4.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7131    1.9543    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1116    2.6446    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7656   11.0238    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9685   11.0238    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0335   11.0238    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2365   11.0238    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7131    8.4662    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1116    9.1565    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8346    3.0620    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6316    3.0620    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3705    3.0620    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1675    3.0620    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4230    2.6196    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0244    1.9293    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8346    9.5739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6316    9.5739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3705    9.5739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1675    9.5739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4230    9.1314    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0244    8.4412    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4976    4.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7006    4.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3015    4.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5044    4.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8471    0.4543    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2456    1.1446    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4976   11.0238    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7006   11.0238    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3015   11.0238    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5044   11.0238    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8471    6.9662    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2456    7.6565    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6551    3.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5021    3.2269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2751    4.0739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7269    4.0739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000    3.2269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3469    3.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4590    1.0739    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2320    0.2269    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0790    0.0000    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6551    9.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.5021    9.7388    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2751   10.5858    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7269   10.5858    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000    9.7388    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3469    9.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4590    7.5858    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2320    6.7388    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0790    6.5119    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  2  7  1  0  0  0  0
  2  8  1  0  0  0  0
  2  9  1  0  0  0  0
  4 10  1  0  0  0  0
  4 28  1  0  0  0  0
  4 29  1  0  0  0  0
  5 11  1  0  0  0  0
  5 30  1  0  0  0  0
  5 31  1  0  0  0  0
  6 12  1  0  0  0  0
  6 32  1  0  0  0  0
  6 33  1  0  0  0  0
  7 13  1  0  0  0  0
  7 34  1  0  0  0  0
  7 35  1  0  0  0  0
  8 14  1  0  0  0  0
  8 36  1  0  0  0  0
  8 37  1  0  0  0  0
  9 15  1  0  0  0  0
  9 38  1  0  0  0  0
  9 39  1  0  0  0  0
 10 16  1  0  0  0  0
 10 40  1  0  0  0  0
 10 41  1  0  0  0  0
 11 17  1  0  0  0  0
 11 42  1  0  0  0  0
 11 43  1  0  0  0  0
 12 18  1  0  0  0  0
 12 44  1  0  0  0  0
 12 45  1  0  0  0  0
 13 19  1  0  0  0  0
 13 46  1  0  0  0  0
 13 47  1  0  0  0  0
 14 20  1  0  0  0  0
 14 48  1  0  0  0  0
 14 49  1  0  0  0  0
 15 21  1  0  0  0  0
 15 50  1  0  0  0  0
 15 51  1  0  0  0  0
 16 22  1  0  0  0  0
 16 52  1  0  0  0  0
 16 53  1  0  0  0  0
 17 23  1  0  0  0  0
 17 54  1  0  0  0  0
 17 55  1  0  0  0  0
 18 24  1  0  0  0  0
 18 56  1  0  0  0  0
 18 57  1  0  0  0  0
 19 25  1  0  0  0  0
 19 58  1  0  0  0  0
 19 59  1  0  0  0  0
 20 26  1  0  0  0  0
 20 60  1  0  0  0  0
 20 61  1  0  0  0  0
 21 27  1  0  0  0  0
 21 62  1  0  0  0  0
 21 63  1  0  0  0  0
 22 64  1  0  0  0  0
 22 65  1  0  0  0  0
 22 66  1  0  0  0  0
 23 67  1  0  0  0  0
 23 68  1  0  0  0  0
 23 69  1  0  0  0  0
 24 70  1  0  0  0  0
 24 71  1  0  0  0  0
 24 72  1  0  0  0  0
 25 73  1  0  0  0  0
 25 74  1  0  0  0  0
 25 75  1  0  0  0  0
 26 76  1  0  0  0  0
 26 77  1  0  0  0  0
 26 78  1  0  0  0  0
 27 79  1  0  0  0  0
 27 80  1  0  0  0  0
 27 81  1  0  0  0  0
M  CHG  3   1   1   2   1   3  -2
M  END
> <PUBCHEM_COMPOUND_CID>
9851553

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
72.1

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
1

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
18

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADcfB4IAAAAAAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGAAAAAAACACAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
oxygen(2-);tributylstannanylium

> <PUBCHEM_IUPAC_CAS_NAME>
oxygen(2-);tributylstannanylium

> <PUBCHEM_IUPAC_NAME_MARKUP>
oxygen(2-);tributylstannanylium

> <PUBCHEM_IUPAC_NAME>
oxygen(2-);tributylstannanylium

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
oxygen(2-);tributylstannanylium

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
oxygen(2-);tributylstannanylium

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/6C4H9.O.2Sn/c6*1-3-4-2;;;/h6*1,3-4H2,2H3;;;/q;;;;;;-2;2*+1

> <PUBCHEM_IUPAC_INCHIKEY>
VFWHRLHTRNDINW-UHFFFAOYSA-N

> <PUBCHEM_EXACT_MASS>
596.22128

> <PUBCHEM_MOLECULAR_FORMULA>
C24H54OSn2

> <PUBCHEM_MOLECULAR_WEIGHT>
596.1

> <PUBCHEM_OPENEYE_CAN_SMILES>
CCCC[Sn+](CCCC)CCCC.CCCC[Sn+](CCCC)CCCC.[O-2]

> <PUBCHEM_OPENEYE_ISO_SMILES>
CCCC[Sn+](CCCC)CCCC.CCCC[Sn+](CCCC)CCCC.[O-2]

> <PUBCHEM_CACTVS_TPSA>
1

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
598.22187

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
27

> <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_COORDINATE_TYPE>
1
5
255

$$$$