#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/50/96/1509661.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_1509661 loop_ _publ_author_name 'Sironi, A.' 'Li, J.' 'Guo, H.-Y.' 'Proserpio, D.M.' _publ_section_title ; Exploring tellurides: synthesis and characterization of new binary,ternary and quaternary compounds ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 247 _journal_page_last 255 _journal_paper_doi 10.1006/jssc.1995.1270 _journal_volume 117 _journal_year 1995 _chemical_formula_sum 'Ag2 K2 Sn Te4' _chemical_name_systematic 'K2 Ag2 Sn Te4' _space_group_IT_number 121 _symmetry_space_group_name_Hall 'I -4 2' _symmetry_space_group_name_H-M 'I -4 2 m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 8.732 _cell_length_b 8.732 _cell_length_c 7.425 _cell_volume 566.140 _citation_journal_id_ASTM JSSCBI _cod_data_source_file silver2-3_117.cif _cod_data_source_block Ag2K2Sn1Te4 _cod_original_cell_volume 566.1401 _cod_original_formula_sum 'Ag2 K2 Sn1 Te4' _cod_database_code 1509661 loop_ _symmetry_equiv_pos_as_xyz x,y,z y,-x,-z -x,-y,z -y,x,-z x,-y,-z -y,-x,z -x,y,-z y,x,z x+1/2,y+1/2,z+1/2 y+1/2,-x+1/2,-z+1/2 -x+1/2,-y+1/2,z+1/2 -y+1/2,x+1/2,-z+1/2 x+1/2,-y+1/2,-z+1/2 -y+1/2,-x+1/2,z+1/2 -x+1/2,y+1/2,-z+1/2 y+1/2,x+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 Ag1 Ag+1 0.1217 0.1217 0.5802 0.454 0.0 Te1 Te-2 0.32561 0.32561 0.7293 1 0.0 K1 K+1 0.5 0 0 1 0.0 Sn1 Sn+4 0 0 0 1 0.0 Ag2 Ag+1 0 0 0.5 0.184 0.0