#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/8/10/35/8103518.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_8103518
loop_
_publ_author_name
'Zhukov, S.G.'
'Yatsenko, A.V.'
'Schenk, H.'
'Chernyshev, V.V.'
'D'yakov, V.A.'
'le Loux, R.'
_publ_section_title
;
 X-ray high temperature powder diffraction study and computer simulation
 of gamma-(Li Na C O3)
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              255
_journal_page_last               258
_journal_volume                  214
_journal_year                    1999
_chemical_formula_sum            'C Li Na O3'
_chemical_name_systematic        'Li Na (C O3)'
_space_group_IT_number           174
_symmetry_space_group_name_Hall  'P -6'
_symmetry_space_group_name_H-M   'P -6'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   8.12
_cell_length_b                   8.12
_cell_length_c                   3.05
_cell_volume                     174.158
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Zhukov_ZEKRDZ_1999_905.cif
_cod_data_source_block           C1Li1Na1O3
_cod_original_cell_volume        174.1576
_cod_original_formula_sum        'C1 Li1 Na1 O3'
_cod_database_code               8103518
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+y,-x,-z
-y,x-y,z
x,y,-z
-x+y,-x,z
-y,x-y,-z
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
O1 O-2 0.813 -0.085 0 1 0.0
C1 C+4 0 0 0 1 0.0
C2 C+4 0.3333 0.6667 0.5 1 0.0
O3 O-2 0.483 0.241 0 1 0.0
Na1 Na+1 0.323 0.3 0.5 1 0.0
C3 C+4 0.6667 0.3333 0 1 0.0
O2 O-2 0.459 0.612 0.5 1 0.0
Li1 Li+1 0.634 0.658 0 1 0.0
