#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/52/38/1523841.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_1523841
loop_
_publ_author_name
'Hoppe, R.'
'Koenig, H.'
_publ_section_title
;
 Zur Kristallstruktur von beta - Li5 Al O4
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              211
_journal_page_last               217
_journal_volume                  430
_journal_year                    1977
_chemical_formula_sum            'Al Li5 O4'
_chemical_name_systematic        'Li5 Al O4'
_space_group_IT_number           59
_symmetry_space_group_name_Hall  '-P 2ab 2a'
_symmetry_space_group_name_H-M   'P m m n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   6.42
_cell_length_b                   6.302
_cell_length_c                   4.62
_cell_volume                     186.920
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Hoppe_ZAACAB_1977_120.cif
_cod_data_source_block           Al1Li5O4
_cod_original_cell_volume        186.9198
_cod_original_formula_sum        'Al1 Li5 O4'
_cod_database_code               1523841
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y+1/2,z
x+1/2,-y,-z
-x,y+1/2,-z
-x,-y,-z
x-1/2,y-1/2,-z
-x-1/2,y,z
x,-y-1/2,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
Li2 Li+1 0.25 0.75 0.212 1 0.0
Li1 Li+1 0.555 0.551 0.254 1 0.0
O2 O-2 0.018 0.25 0.015 1 0.0
O1 O-2 0.25 0.016 0.43 1 0.0
Al1 Al+3 0.25 0.25 0.226 1 0.0
