#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/94/1539497.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_1539497
loop_
_publ_author_name
'Vielhaber, E.'
'Hoppe, R.'
_publ_section_title
;
 Ueber Oxocadmate: Die Kristallstruktur von K2 Cd O2
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              209
_journal_page_last               217
_journal_volume                  392
_journal_year                    1972
_chemical_formula_sum            'Cd K2 O2'
_chemical_name_systematic        'K2 Cd O2'
_space_group_IT_number           60
_symmetry_space_group_name_Hall  '-P 2n 2ab'
_symmetry_space_group_name_H-M   'P b c n'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.089
_cell_length_b                   6.186
_cell_length_c                   6.152
_cell_volume                     383.950
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Vielhaber_ZAACAB_1972_442.cif
_cod_data_source_block           Cd1K2O2
_cod_original_cell_volume        383.9497
_cod_original_formula_sum        'Cd1 K2 O2'
_cod_database_code               1539497
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x,y,-z+1/2
-x,-y,-z
x-1/2,y-1/2,-z-1/2
-x-1/2,y-1/2,z
x,-y,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
Cd1 Cd+2 0 0.0329 0.25 1 0.0
O1 O-2 0.3997 0.3017 0.4784 1 0.0
K1 K+1 0.3446 0.1033 0.109 1 0.0
