11831840
  -OEChem-05042406522D

 30 35  0     0  0  0  0  0  0999 V2000
    5.2158   -0.5118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9068    0.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4068   -1.0996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9068    0.4393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5978   -0.5118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2206   -0.5855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4414    1.3332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7487   -2.0231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3721    1.3332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5929   -0.5855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8860    2.2393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9276    2.2393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7096   -2.2393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4141   -1.5512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1040   -2.2393    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3994   -1.5512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3791    1.1626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    0.2291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8136    0.2291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4344    1.1626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5739    2.7750    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8786   -2.8358    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2397    2.7750    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0065   -1.7342    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9081   -2.8275    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9904    1.6457    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8071   -1.7342    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3846    0.1539    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4290    0.1539    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8231    1.6457    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1  6  2  0  0  0  0
  2  4  1  0  0  0  0
  2  7  2  0  0  0  0
  3  5  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  1  0  0  0  0
  4  9  2  0  0  0  0
  5 10  2  0  0  0  0
  6 14  1  0  0  0  0
  6 19  1  0  0  0  0
  7 12  1  0  0  0  0
  7 20  1  0  0  0  0
  8 13  1  0  0  0  0
  8 15  1  0  0  0  0
  9 11  1  0  0  0  0
  9 17  1  0  0  0  0
 10 16  1  0  0  0  0
 10 18  1  0  0  0  0
 11 12  2  0  0  0  0
 11 21  1  0  0  0  0
 12 23  1  0  0  0  0
 13 14  2  0  0  0  0
 13 22  1  0  0  0  0
 14 24  1  0  0  0  0
 15 16  2  0  0  0  0
 15 25  1  0  0  0  0
 16 27  1  0  0  0  0
 17 18  2  0  0  0  0
 17 26  1  0  0  0  0
 18 28  1  0  0  0  0
 19 20  2  0  0  0  0
 19 29  1  0  0  0  0
 20 30  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
11831840

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
303

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
0

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
0

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADccB4AAAAAAAAAAAAAAAAAAAAAYAAAAAwYMGDAAAAAADBVAAAGAAAAAAADACAGAAwAMAAAACAAiBCAAACAAAgAAAIiAAAAIgIICKAERCAIAAggAAIiAcAgMAOwAACAAAQAACAAAQAACAAAQAACAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
hexacyclo[11.5.2.04,17.07,16.010,15.014,18]icosa-1(18),2,4(17),5,7(16),8,10(15),11,13,19-decaene

> <PUBCHEM_IUPAC_CAS_NAME>
hexacyclo[11.5.2.04,17.07,16.010,15.014,18]eicosa-1(18),2,4(17),5,7(16),8,10(15),11,13,19-decaene

> <PUBCHEM_IUPAC_NAME_MARKUP>
hexacyclo[11.5.2.0<SUP>4,17</SUP>.0<SUP>7,16</SUP>.0<SUP>10,15</SUP>.0<SUP>14,18</SUP>]icosa-1(18),2,4(17),5,7(16),8,10(15),11,13,19-decaene

> <PUBCHEM_IUPAC_NAME>
hexacyclo[11.5.2.04,17.07,16.010,15.014,18]icosa-1(18),2,4(17),5,7(16),8,10(15),11,13,19-decaene

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
hexacyclo[11.5.2.04,17.07,16.010,15.014,18]icosa-1(18),2,4(17),5,7(16),8,10(15),11,13,19-decaene

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
hexacyclo[11.5.2.04,17.07,16.010,15.014,18]eicosa-1(18),2,4(17),5,7(16),8,10(15),11,13,19-decaene

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C20H10/c1-2-12-5-6-14-9-10-15-8-7-13-4-3-11(1)16-17(12)19(14)20(15)18(13)16/h1-10H

> <PUBCHEM_IUPAC_INCHIKEY>
VXRUJZQPKRBJKH-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3>
6

> <PUBCHEM_EXACT_MASS>
250.078250319

> <PUBCHEM_MOLECULAR_FORMULA>
C20H10

> <PUBCHEM_MOLECULAR_WEIGHT>
250.3

> <PUBCHEM_OPENEYE_CAN_SMILES>
C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC(=C36)C=C2

> <PUBCHEM_OPENEYE_ISO_SMILES>
C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC(=C36)C=C2

> <PUBCHEM_CACTVS_TPSA>
0

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
250.078250319

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
20

> <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>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
-1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
1  2  8
1  3  8
1  6  8
10  16  8
10  18  8
11  12  8
13  14  8
15  16  8
17  18  8
19  20  8
2  4  8
2  7  8
3  5  8
3  8  8
4  5  8
4  9  8
5  10  8
6  14  8
6  19  8
7  12  8
7  20  8
8  13  8
8  15  8
9  11  8
9  17  8

$$$$