#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/45/1534561.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_1534561
loop_
_publ_author_name
'Amann, P.'
'Moeller, A.'
_publ_section_title
;
 Reactivity, syntheses and crystal structures of Na5 (M O2) (X) with M =
 Co(+), Ni(+), Cu(+); X = (C O3)(2-), (S O4)(2-), (S O3)(2-), S(2-) and
 Na25 (Cu O2)5 (S O4)4 (S)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              1643
_journal_page_last               1650
_journal_volume                  629
_journal_year                    2003
_chemical_formula_sum            'Co Na5 O2 S'
_chemical_name_systematic        'Na5 (Co O2) S'
_space_group_IT_number           123
_symmetry_space_group_name_Hall  '-P 4 2'
_symmetry_space_group_name_H-M   'P 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   4.5977
_cell_length_b                   4.5977
_cell_length_c                   8.0555
_cell_volume                     170.284
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Amann_ZAACAB_2003_961.cif
_cod_data_source_block           Co1Na5O2S1
_cod_original_formula_sum        'Co1 Na5 O2 S1'
_cod_database_code               1534561
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,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
Na2 Na+1 0 0 0.5 1 0.0
S1 S-2 0.5 0.5 0.5 1 0.0
Na1 Na+1 0 0.5 0.2558 1 0.0
Co1 Co+1 0 0 0 1 0.0
O1 O-2 0 0 0.2187 1 0.0
