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#$Date: 2015-09-17 22:55:57 +0300 (Thu, 17 Sep 2015) $
#$Revision: 156812 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/30/05/2300535.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2300535
loop_
_publ_author_name
'Heiba, Z.K.'
'El Sayed, K.'
_publ_section_title
;
 Structural and anisotropic thermal expansion correlation of Li2 Zr O3 at
 different temperatures
;
_journal_name_full               'Journal of Applied Crystallography'
_journal_page_first              634
_journal_page_last               636
_journal_volume                  35
_journal_year                    2002
_chemical_formula_sum            'Li2 O3 Zr'
_chemical_name_systematic        'Li2 (Zr O3)'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 112.498
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.4089
_cell_length_b                   9.0309
_cell_length_c                   5.4144
_cell_volume                     244.350
_citation_journal_id_ASTM        JACGAR
_cod_data_source_file            Heiba_JACGAR_2002_314.cif
_cod_data_source_block           Li2O3Zr1
_cod_original_cell_volume        244.3498
_cod_chemical_formula_sum_orig   'Li2 O3 Zr1'
_cod_database_code               2300535
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,z-1/2
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
Li2 Li+1 0 0.733 0.25 1 0.0
O1 O-2 0.25 0.25 0.5 1 0.0
Zr1 Zr+4 0 0.0919 0.25 1 0.0
O2 O-2 0.2578 0.5816 0.4779 1 0.0
Li1 Li+1 0 0.4195 0.25 1 0.0