#------------------------------------------------------------------------------ #$Date: 2014-02-06 12:55:10 +0200 (Thu, 06 Feb 2014) $ #$Revision: 100679 $ #$URL: file:///home/coder/svn-repositories/cod/cif/8/10/11/8101135.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_8101135 loop_ _publ_author_name 'Mudring, Anja-Verena' 'Jansen, Martin' _publ_section_title ; Crystal Structure of RbAuO ; _journal_name_full 'Zeitschrift f\"ur Kristallographie - New Crystal Structures' _journal_volume 216 _journal_year 2001 _chemical_formula_moiety 'Rb Au O' _chemical_formula_structural 'Rb Au O' _chemical_formula_sum 'Au O Rb' _chemical_formula_weight 298.43 _chemical_name_common rubidiumoxoaurate(I) _symmetry_cell_setting orthorhombic _symmetry_Int_Tables_number 139 _symmetry_space_group_name_H-M 'I 4/m m m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 9.937(1) _cell_length_b 9.937(1) _cell_length_c 5.8193(9) _cell_measurement_temperature 293(2) _diffrn_ambient_temperature 293(2) _exptl_crystal_density_diffrn 6.90 _pd_proc_ls_prof_R_factor 0.06201 _pd_proc_ls_prof_wR_factor 0.08341 _[local]_cod_chemical_formula_sum_orig 'Rb Au O' _cod_database_code 8101135 #BEGIN Tags that were not found in dictionaries: _pd_proc_ls_prof_r_bragg 0.03291 #END Tags that were not found in dictionaries 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 Au AU 0.1482(5) 0.1482(5) 0.0000000 0.008(2) Uiso 1.0000000 8 h Rb RB 0.182(1) 0.5000000 0.0000000 0.001(3) Uiso 1.0000000 8 j O O 0.378(5) 0.0000000 0.0000000 0.01(2) Uiso 1.0000000 8 i