#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/13/1521393.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_1521393 loop_ _publ_author_name 'Kessler, U.' 'Jansen, M.' _publ_section_title ; Kristallstrukturen der Monofluorosulfite M S O2 F (M = K, Rb) ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 385 _journal_page_last 388 _journal_volume 625 _journal_year 1999 _chemical_formula_sum 'F K O2 S' _chemical_name_systematic 'K (S O2 F)' _space_group_IT_number 11 _symmetry_space_group_name_Hall '-P 2yb' _symmetry_space_group_name_H-M 'P 1 21/m 1' _cell_angle_alpha 90 _cell_angle_beta 107.73 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 6.962 _cell_length_b 5.663 _cell_length_c 4.658 _cell_volume 174.923 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Kessler_ZAACAB_1999_872.cif _cod_data_source_block F1K1O2S1 _cod_original_cell_volume 174.9226 _cod_original_formula_sum 'F1 K1 O2 S1' _cod_database_code 1521393 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y+1/2,-z -x,-y,-z x,-y-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 O1 O-2 0.6891 0.0363 0.3323 1 0.0 K1 K+1 0.2894 0.25 0.1517 1 0.0 F1 F-1 0.8814 0.25 0.7818 1 0.0 S1 S+4 0.8278 0.25 0.4245 1 0.0