#------------------------------------------------------------------------------ #$Date: 2014-07-11 17:35:18 +0300 (Fri, 11 Jul 2014) $ #$Revision: 120071 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/50/93/1509329.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_1509329 loop_ _publ_author_name 'Cameron, T.S.' 'Decken, A.' 'Passmore, J.' 'Dionne, I.' 'Min Fang' 'Krossing, I.' _publ_section_title ; Approaching the gas phase structures of AgS8+ and AgS16+ in the solid state ; _journal_name_full 'Chemistry - A European Journal' _journal_page_first 3386 _journal_page_last 3401 _journal_volume 8 _journal_year 2002 _chemical_formula_sum 'Ag F6 S16 Sb' _chemical_name_systematic 'Ag (S8)2 (Sb F6)' _space_group_IT_number 15 _symmetry_space_group_name_Hall '-C 2yc' _symmetry_space_group_name_H-M 'C 1 2/c 1' _cell_angle_alpha 90 _cell_angle_beta 102.652 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 17.535 _cell_length_b 7.8465 _cell_length_c 15.675 _cell_volume 2104.330 _citation_journal_id_ASTM CEUJED _[local]_cod_data_source_file silver1-2_246.cif _[local]_cod_data_source_block Ag1F6S16Sb1 _[local]_cod_chemical_formula_sum_orig 'Ag1 F6 S16 Sb1' _cod_original_cell_volume 2104.33 _cod_database_code 1509329 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y,-z+1/2 -x,-y,-z x,-y,z-1/2 x+1/2,y+1/2,z -x+1/2,y+1/2,-z+1/2 -x+1/2,-y+1/2,-z 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 Sb1 Sb+5 0.5 1 1 1 0.0 Ag1 Ag+1 0.5 0.33404 0.75 1 0.0 S3 S 0.5835 0.48799 0.64237 1 0.0 S2 S 0.66839 0.30109 0.66481 1 0.0 S5 S 0.59636 0.70835 0.82738 1 0.0 S6 S 0.6837 0.59846 0.92132 1 0.0 F2 F-1 0.60836 1.0346 1.03722 1 0.0 F1 F-1 0.5069 1.0566 0.88467 1 0.0 F3 F-1 0.51762 0.7687 0.97922 1 0.0 S7 S 0.64506 0.35681 0.93899 1 0.0 S4 S 0.62918 0.70483 0.70987 1 0.0 S8 S 0.70497 0.19059 0.87677 1 0.0 S1 S 0.63524 0.1428 0.75527 1 0.0 _journal_paper_doi 10.1002/1521-3765(20020802)8:15<3386::AID-CHEM3386>3.0.CO;2-9