#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/50/99/1509958.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_1509958 loop_ _publ_author_name 'Huster, J.' _publ_section_title ; Darstellung und Struktur der silberreichen Alkalimetallsilbersulfide, Cs Ag7 S4 und Rb Ag7 S4 ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first 377 _journal_page_last 384 _journal_paper_doi 10.1016/0925-8388(92)90759-3 _journal_volume 183 _journal_year 1992 _chemical_formula_sum 'Ag7 Cs S4' _chemical_name_systematic 'Cs Ag7 S4' _space_group_IT_number 85 _symmetry_space_group_name_Hall '-P 4a' _symmetry_space_group_name_H-M 'P 4/n :2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 11.091 _cell_length_b 11.091 _cell_length_c 8.523 _cell_volume 1048.417 _citation_journal_id_ASTM JALCEU _cod_data_source_file silver3-x_254.cif _cod_data_source_block Ag7Cs1S4 _cod_original_formula_sum 'Ag7 Cs1 S4' _cod_database_code 1509958 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y+1/2,x,z -x+1/2,-y+1/2,z y,-x+1/2,z -x,-y,-z y-1/2,-x,-z x-1/2,y-1/2,-z -y,x-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 S2 S-2 0.005 0.8072 0.3781 1 0.0 Ag1 Ag+1 0 0 0 1 0.0 Ag4 Ag+1 0.28685 0.60728 0.3811 1 0.0 Ag2 Ag+1 0.47698 0.957 0.3411 1 0.0 Cs1 Cs+1 0.25 0.25 0.3737 1 0.0 S1 S-2 0.9889 0.1913 0.1311 1 0.0 Ag3 Ag+1 0.73589 0.38747 0.1244 1 0.0 Cs2 Cs+1 0.25 0.25 0.8777 1 0.0