#------------------------------------------------------------------------------
#$Date: 2015-09-18 23:11:19 +0200 (vie 18 de sep de 2015) $
#$Revision: 157929 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/22/1532248.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_1532248
loop_
_publ_author_name
'Shilov, G.V.'
'Nalbandyan, V.B.'
'Atovmyan, L.O.'
'Volochaev, V.A.'
_publ_section_title
;
 Crystal growth and crystal structures of the layered ionic conductors -
 sodium lithium titanium oxides
;
_journal_name_full
'International Journal of Inorganic Materials'
_journal_page_first              443
_journal_page_last               449
_journal_volume                  2
_journal_year                    2000
_chemical_formula_sum            'Li0.56 Na0.73 O2 Ti0.68'
_chemical_name_systematic        '(Na0.73 Li0.24) (Li0.32 Ti0.68) O2'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   2.993
_cell_length_b                   2.993
_cell_length_c                   16.045
_cell_volume                     124.475
_citation_journal_id_ASTM        IJIMCR
_cod_data_source_file            Shilov_IJIMCR_2000_1703.cif
_cod_data_source_block           Li0.56Na0.73O2Ti0.68
_cod_original_cell_volume        124.4755
_cod_database_code               1532248
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+1/3
-x+2/3,-x+y+1/3,-z+1/3
x-y+2/3,-y+1/3,-z+1/3
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+2/3
-x+1/3,-x+y+2/3,-z+2/3
x-y+1/3,-y+2/3,-z+2/3
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Li1 Li+1 0 0 0 0.32 0.0
Ti1 Ti+4 0 0 0 0.68 0.0
O1 O-2 0 0 0.2661 1 0.0
Na1 Na+1 0.3333 0.6667 0.1667 0.73 0.0
Li2 Li+1 0.3333 0.6667 0.1667 0.24 0.0
