#------------------------------------------------------------------------------ #$Date: 2015-07-10 12:19:23 +0300 (Fri, 10 Jul 2015) $ #$Revision: 141603 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/13/1521394.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_1521394 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 O2 Rb S' _chemical_name_systematic 'Rb (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 107.14 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 7.172 _cell_length_b 5.867 _cell_length_c 4.84 _cell_volume 194.613 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Kessler_ZAACAB_1999_873.cif _cod_data_source_block F1O2Rb1S1 _cod_original_cell_volume 194.6132 _cod_chemical_formula_sum_orig 'F1 O2 Rb1 S1' _cod_database_code 1521394 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 Rb1 Rb+1 0.2854 0.25 0.1543 1 0.0 F1 F-1 0.877 0.25 0.766 1 0.0 O1 O-2 0.6976 0.0422 0.3319 1 0.0 S1 S+4 0.8305 0.25 0.4221 1 0.0