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#$Date: 2016-02-13 13:50:18 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176428 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/24/7222412.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_7222412
loop_
_publ_author_name
'Alexander, A.'
'Grey, C.P.'
'Burley, J.C.'
'Battle, P.D.'
'Gallon, D.J.'
'Kim Sang-Hwan'
_publ_section_title
;
 Structural and magnetic properties of Li3 Ru O4
;
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              2612
_journal_page_last               2616
_journal_volume                  13
_journal_year                    2003
_chemical_formula_sum            'Li2.81 O4 Ru1.04'
_chemical_name_systematic        'Li2.81 Ru0.04 (Ru O4)'
_space_group_IT_number           13
_symmetry_space_group_name_Hall  '-P 2ya'
_symmetry_space_group_name_H-M   'P 1 2/a 1'
_cell_angle_alpha                90
_cell_angle_beta                 110.039
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.1057
_cell_length_b                   5.8545
_cell_length_c                   5.1062
_cell_volume                     143.391
_citation_journal_id_ASTM        JMACEP
_cod_data_source_file            Alexander_JMACEP_2003_1579.cif
_cod_data_source_block           Li2.81O4Ru1.04
_cod_original_cell_volume        143.3907
_cod_original_sg_symbol_Hall     '-P 2yc (z,y,-x)'
_cod_database_code               7222412
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y,-z
-x,-y,-z
x-1/2,-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 0.0181 0.64 0.7555 1 0.0
Li1 Li+1 0.75 0.614 0 0.951 0.0
Ru2 Ru+5 0.75 0.883 0.5 0.012 0.0
Li2 Li+1 0.75 0.883 0.5 0.94 0.0
O2 O-2 0.5028 0.1107 0.2235 1 0.0
Ru4 Ru+5 0.25 0.8671 0 1 0.0
Li3 Li+1 0.75 0.368 0.5 0.917 0.0
Ru3 Ru+5 0.75 0.368 0.5 0.017 0.0
Ru1 Ru+5 0.75 0.614 0 0.01 0.0
