#------------------------------------------------------------------------------
#$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $
#$Revision: 14 $
#$URL: svn://www.crystallography.net/cod/cif/2/2005118.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_2005118
_journal_name_full  'Acta Crystallographica'
_journal_year      1996
_journal_volume    'C52'
_journal_page_first     1829
_journal_page_last     1831
_publ_section_title
;
A cis-Fused Decalone and a Bicyclo[4.3.1]decanone Ring System
;
_chemical_formula_moiety     'C11 H18 O2'
_chemical_formula_sum     'C11 H18 O2'
_chemical_formula_weight     182.25
_symmetry_cell_setting    'Monoclinic'
loop_
_symmetry_equiv_pos_as_xyz
'x,y,z'
'-x,-y,-z'
'-x,1/2+y,1/2-z'
'x,1/2-y,1/2+z'
_symmetry_space_group_name_H-M     'P 21/c'
_cell_length_a     12.010
_cell_length_b     7.553
_cell_length_c     12.134
_cell_angle_alpha     90
_cell_angle_beta     110.34
_cell_angle_gamma     90
_cell_volume     1032.1(3)
_cell_formula_units_Z     4
_exptl_crystal_density_diffrn     1.173
_cell_measurement_temperature     298
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
O1  .45520(10)
              .4714(2)  .81260(10)
                                  .0637(7)
O8  .6174(2)  .6958(3) 1.01350(10)
                                  .0697(8)
C1  .5548(2)  .4712(3)  .8071(2)  .0443(8)
C2  .5729(2)  .5054(3)  .6932(2)  .0532(8)
C3  .6679(2)  .3886(3)  .6754(2)  .0545(9)
C4  .7856(2)  .3917(3)  .7790(2)  .0519(8)
C5  .8435(2)  .5773(3)  .7890(2)  .0652(10)
C6  .8713(2)  .6834(3)  .9020(2)  .0616(9)
C7  .7648(2)  .7450(3)  .9314(2)  .0546(8)
C8  .7092(2)  .6083(3)  .9865(2)  .0508(8)
C8a  .6622(2)  .4372(3)  .9152(2)  .0449(8)
C9  .7592(2)  .3337(3)  .8881(2)  .0536(9)
C10  .8685(2)  .2535(4)  .7569(2)  .0922(14)
H8a  .590(3)  .626(4) 1.055(3)  .117(12)
H2a  .4993  .4840  .6302  .08
H2b  .5956  .6269  .6916  .08
H3a  .6391  .2690  .6640  .08
H3b  .6823  .4283  .6064  .08
H5a  .7909  .6484  .7271  .08
H5b  .9172  .5615  .7759  .08
H6a  .9155  .7863  .8956  .08
H6b  .9193  .6107  .9658  .08
H7a  .7052  .7842  .8598  .08
H7b  .7895  .8427  .9850  .08
H8b  .7713  .5635 1.0543  .08
H8c  .6362  .3617  .9652  .08
H9a  .7355  .2116  .8779  .08
H9b  .8312  .3450  .9546  .08
H10a  .8868  .2862  .6887  .08
H10b  .8302  .1400  .7443  .08
H10c  .9405  .2475  .8239  .08