#------------------------------------------------------------------------------
#$Date: 2015-07-12 16:25:31 +0200 (dom 12 de jul de 2015) $
#$Revision: 146785 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/57/1525740.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_1525740
loop_
_publ_author_name
'Carlier, D.'
'Saadoune, I.'
'Menetrier, M.'
'Croguennec, L.'
'Suard, E.'
'Delmas, C.'
_publ_section_title
;
 On the metastable O2-type Li Co O2
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              263
_journal_page_last               276
_journal_volume                  144
_journal_year                    2001
_chemical_formula_sum            'Co0.94 Li1.03 O1.88'
_chemical_name_systematic        'Li1.03 Co0.94 O1.88'
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   2.80247
_cell_length_b                   2.80247
_cell_length_c                   9.5358
_cell_volume                     64.859
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Carlier_SSIOD3_2001_1949.cif
_cod_data_source_block           Co0.94Li1.03O1.88
_cod_original_cell_volume        64.85892
_cod_database_code               1525740
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
y,x,z+1/2
-x+y,y,z
-x,-x+y,z+1/2
-y,-x,z
x-y,-y,z+1/2
x,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
O2 O-2 0 0 0.1081 0.95 0.0
O1 O-2 0.6667 0.3333 0.3916 0.93 0.0
Li1 Li+1 0.3333 0.6667 0.241 1 0.0
Co1 Co+3 0.6667 0.3333 0 0.94 0.0
Li2 Li+1 0 0 0.26 0.03 0.0
