#------------------------------------------------------------------------------ #$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $ #$Revision: 14 $ #$URL: file:///home/coder/svn-repositories/cod/cif/8/8101055.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_8101055 _journal_name_full 'Zeitschrift fur Kristallographie - NCS' _journal_year 2001 _publ_section_title ; Crystal Structure of NaAuO~2 ; loop_ _publ_author_name 'Mudring, Anja-Verena' 'Jansen, Martin' _chemical_name_common 'sodiumoxoaurate(III)' _chemical_formula_moiety 'Na Au O2' _chemical_formula_structural 'Na Au O2' _chemical_formula_sum 'Na Au O2' _chemical_formula_weight 252.0 _symmetry_cell_setting orthorhombic _symmetry_space_group_name_H-M 'C m c m' _symmetry_Int_Tables_number 63 _cell_length_a 3.8956(9) _cell_length_b 11.373(4) _cell_length_c 5.685(2) _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 251.9(1) _cell_formula_units_Z 4 _cell_measurement_temperature 293(2) _exptl_crystal_density_diffrn 6.64 _diffrn_ambient_temperature 293(2) _pd_proc_ls_prof_R_factor 0.09237 _pd_proc_ls_prof_wR_factor 0.12888 _pd_proc_ls_prof_R_Bragg 0.08406 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_thermal_displace_type _atom_site_occupancy _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol Na NA 0.0000000 0.312(4) 0.2500000 0.0063326 Uiso 1.0000000 4 c Au AU 0.0000000 0.984(1) 0.2500000 0.092(7) Uiso 1.0000000 4 c O O 0.0000000 0.1180000 0.0000000 0.24(5) Uiso 1.0000000 8 f