#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/10/53/2105388.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2105388 loop_ _publ_author_name 'Bonamico, M.' 'Dessy, G.' _publ_section_title ; The crystal structure of anhydrous potassium tetrachloroaurate(III) ; _journal_name_full 'Acta Crystallographica B (24,1968-38,1982)' _journal_page_first 1735 _journal_page_last 1736 _journal_paper_doi 10.1107/S0567740873005406 _journal_volume 29 _journal_year 1973 _chemical_formula_sum 'Au Cl4 K' _chemical_name_systematic 'K Au Cl4' _space_group_IT_number 7 _symmetry_space_group_name_Hall 'P -2yc' _symmetry_space_group_name_H-M 'P 1 c 1' _cell_angle_alpha 90 _cell_angle_beta 95.37 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 8.671 _cell_length_b 6.386 _cell_length_c 12.243 _cell_volume 674.956 _citation_journal_id_ASTM ACBCAR _cod_data_source_file gold_137.cif _cod_data_source_block Au1Cl4K1 _cod_original_cell_volume 674.9563 _cod_original_formula_sum 'Au1 Cl4 K1' _cod_database_code 2105388 loop_ _symmetry_equiv_pos_as_xyz x,y,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 Cl3 Cl-1 0.1105 0.195 0.1788 1 0.0 Cl5 Cl-1 0.5197 0.4023 0.1777 1 0.0 Au2 Au+3 0.4983 0.2446 0.0028 1 0.0 Cl4 Cl-1 -0.0825 0.2936 -0.1784 1 0.0 Cl7 Cl-1 0.6774 -0.0104 0.0762 1 0.0 Cl8 Cl-1 0.3516 0.5059 -0.0618 1 0.0 Cl6 Cl-1 0.5101 0.1017 -0.1593 1 0.0 Au1 Au+3 0 0.248 0 1 0.0 K2 K+1 0.2286 0.7041 0.1838 1 0.0 Cl1 Cl-1 -0.1068 0.5406 0.0517 1 0.0 Cl2 Cl-1 0.1453 -0.0484 -0.0466 1 0.0 K1 K+1 0.7985 0.2042 0.3204 1 0.0