#------------------------------------------------------------------------------ #$Date: 2013-04-29 23:52:22 +0300 (Mon, 29 Apr 2013) $ #$Revision: 82720 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/50/97/1509717.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_1509717 loop_ _publ_author_name 'Teske, C.L.' 'Vetter, O.' _publ_section_title ; Ergebnisse einer Roentgenstrukturanalyse von SilberBarium-Thiostannat(IV), Ag2 Ba Sn S4 ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 200 _journal_page_last 204 _journal_volume 427 _journal_year 1976 _chemical_formula_sum 'Ag2 Ba S4 Sn' _chemical_name_systematic 'Ag2 Ba (Sn S4)' _space_group_IT_number 23 _symmetry_space_group_name_Hall 'I 2 2' _symmetry_space_group_name_H-M 'I 2 2 2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 7.127 _cell_length_b 8.117 _cell_length_c 6.854 _cell_volume 396.503 _citation_journal_id_ASTM ZAACAB _[local]_cod_data_source_file silver2-3_19.cif _[local]_cod_data_source_block Ag2Ba1S4Sn1 _[local]_cod_chemical_formula_sum_orig 'Ag2 Ba1 S4 Sn1' _cod_original_cell_volume 396.5029 _cod_database_code 1509717 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,z x,-y,-z -x,y,-z x+1/2,y+1/2,z+1/2 -x+1/2,-y+1/2,z+1/2 x+1/2,-y+1/2,-z+1/2 -x+1/2,y+1/2,-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 Ba1 Ba+2 0 0 0 1 0.0 Sn1 Sn+4 0 0.5 0 1 0.0 Ag1 Ag+1 0.5 0.2041 0 1 0.0 S1 S-2 0.1943 0.3319 0.2016 1 0.0