#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/01/1510101.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_1510101 loop_ _publ_author_name 'Hoppe, R.' 'Wagner, G.' _publ_section_title ; Oxydation intermetallischer Phasen: CsK2(AuO2) aus CsAu und K2O2 ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 41 _journal_page_last 49 _journal_paper_doi 10.1002/zaac.19875500706 _journal_volume 550 _journal_year 1987 _chemical_formula_sum 'Au Cs K2 O2' _chemical_name_systematic 'Cs K2 Au O2' _space_group_IT_number 62 _symmetry_space_group_name_Hall '-P 2ac 2n' _symmetry_space_group_name_H-M 'P n m a' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 12.565 _cell_length_b 7.273 _cell_length_c 6.279 _cell_volume 573.808 _citation_journal_id_ASTM ZAACAB _cod_data_source_file gold_155.cif _cod_data_source_block Au1Cs1K2O2 _cod_original_cell_volume 573.8079 _cod_original_formula_sum 'Au1 Cs1 K2 O2' _cod_database_code 1510101 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x+1/2,-y,z+1/2 x+1/2,-y+1/2,-z+1/2 -x,y+1/2,-z -x,-y,-z x-1/2,y,-z-1/2 -x-1/2,y-1/2,z-1/2 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 Cs1 Cs+1 0.4064 0.25 0.6809 1 0.0 Au1 Au+1 0.1233 0.25 0.171 1 0.0 O1 O-2 0.5144 0.25 0.0847 1 0.0 O2 O-2 0.7272 0.25 0.5793 1 0.0 K1 K+1 0.1391 0.0014 0.6394 1 0.0