#------------------------------------------------------------------------------ #$Date: 2013-03-28 18:17:04 +0200 (Thu, 28 Mar 2013) $ #$Revision: 77586 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/01/12/1011279.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_1011279 loop_ _publ_author_name 'Schrewelius, N' _publ_section_title ; Roentgenuntersuchung der Verbindungen Na Sb (O H)6, Na Sb F6, Na Sb O3 und gleichartiger Stoffe ; _journal_coden_ASTM ZAACAB _journal_name_full ; Zeitschrift fuer Anorganische und Allgemeine Chemie ; _journal_page_first 241 _journal_page_last 254 _journal_volume 238 _journal_year 1938 _chemical_compound_source synthetic _chemical_formula_structural 'Ag (Sb O3)' _chemical_formula_sum 'Ag O3 Sb' _chemical_name_mineral Stetefeldite _chemical_name_systematic 'Silver catena-antimonate' _space_group_IT_number 227 _symmetry_cell_setting cubic _symmetry_space_group_name_Hall '-F 4vw 2vw 3' _symmetry_space_group_name_H-M 'F d -3 m :2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 16 _cell_length_a 10.23 _cell_length_b 10.23 _cell_length_c 10.23 _cell_volume 1070.6 _exptl_crystal_density_meas 6.69 _[local]_cod_cif_authors_sg_H-M 'F d -3 m Z' _cod_database_code 1011279 loop_ _symmetry_equiv_pos_as_xyz x,y,z x,1/4-y,1/4-z 1/4-x,y,1/4-z 1/4-x,1/4-y,z y,z,x 1/4-y,1/4-z,x y,1/4-z,1/4-x 1/4-y,z,1/4-x z,x,y 1/4-z,x,1/4-y 1/4-z,1/4-x,y z,1/4-x,1/4-y x,z,y x,1/4-z,1/4-y 1/4-x,1/4-z,y 1/4-x,z,1/4-y y,x,z 1/4-y,x,1/4-z y,1/4-x,1/4-z 1/4-y,1/4-x,z z,y,x 1/4-z,1/4-y,x 1/4-z,y,1/4-x z,1/4-y,1/4-x -x,-y,-z -x,3/4+y,3/4+z 3/4+x,-y,3/4+z 3/4+x,3/4+y,-z -y,-z,-x 3/4+y,3/4+z,-x -y,3/4+z,3/4+x 3/4+y,-z,3/4+x -z,-x,-y 3/4+z,-x,3/4+y 3/4+z,3/4+x,-y -z,3/4+x,3/4+y -x,-z,-y -x,3/4+z,3/4+y 3/4+x,3/4+z,-y 3/4+x,-z,3/4+y -y,-x,-z 3/4+y,-x,3/4+z -y,3/4+x,3/4+z 3/4+y,3/4+x,-z -z,-y,-x 3/4+z,3/4+y,-x 3/4+z,-y,3/4+x -z,3/4+y,3/4+x x,1/2+y,1/2+z 1/2+x,y,1/2+z 1/2+x,1/2+y,z x,3/4-y,3/4-z 1/2+x,1/4-y,3/4-z 1/2+x,3/4-y,1/4-z 1/4-x,1/2+y,3/4-z 3/4-x,y,3/4-z 3/4-x,1/2+y,1/4-z 1/4-x,3/4-y,1/2+z 3/4-x,1/4-y,1/2+z 3/4-x,3/4-y,z y,1/2+z,1/2+x 1/2+y,z,1/2+x 1/2+y,1/2+z,x 1/4-y,3/4-z,1/2+x 3/4-y,1/4-z,1/2+x 3/4-y,3/4-z,x y,3/4-z,3/4-x 1/2+y,1/4-z,3/4-x 1/2+y,3/4-z,1/4-x 1/4-y,1/2+z,3/4-x 3/4-y,z,3/4-x 3/4-y,1/2+z,1/4-x z,1/2+x,1/2+y 1/2+z,x,1/2+y 1/2+z,1/2+x,y 1/4-z,1/2+x,3/4-y 3/4-z,x,3/4-y 3/4-z,1/2+x,1/4-y 1/4-z,3/4-x,1/2+y 3/4-z,1/4-x,1/2+y 3/4-z,3/4-x,y z,3/4-x,3/4-y 1/2+z,1/4-x,3/4-y 1/2+z,3/4-x,1/4-y x,1/2+z,1/2+y 1/2+x,z,1/2+y 1/2+x,1/2+z,y x,3/4-z,3/4-y 1/2+x,1/4-z,3/4-y 1/2+x,3/4-z,1/4-y 1/4-x,3/4-z,1/2+y 3/4-x,1/4-z,1/2+y 3/4-x,3/4-z,y 1/4-x,1/2+z,3/4-y 3/4-x,z,3/4-y 3/4-x,1/2+z,1/4-y y,1/2+x,1/2+z 1/2+y,x,1/2+z 1/2+y,1/2+x,z 1/4-y,1/2+x,3/4-z 3/4-y,x,3/4-z 3/4-y,1/2+x,1/4-z y,3/4-x,3/4-z 1/2+y,1/4-x,3/4-z 1/2+y,3/4-x,1/4-z 1/4-y,3/4-x,1/2+z 3/4-y,1/4-x,1/2+z 3/4-y,3/4-x,z z,1/2+y,1/2+x 1/2+z,y,1/2+x 1/2+z,1/2+y,x 1/4-z,3/4-y,1/2+x 3/4-z,1/4-y,1/2+x 3/4-z,3/4-y,x 1/4-z,1/2+y,3/4-x 3/4-z,y,3/4-x 3/4-z,1/2+y,1/4-x z,3/4-y,3/4-x 1/2+z,1/4-y,3/4-x 1/2+z,3/4-y,1/4-x -x,1/2-y,1/2-z 1/2-x,-y,1/2-z 1/2-x,1/2-y,-z -x,1/4+y,1/4+z 1/2-x,3/4+y,1/4+z 1/2-x,1/4+y,3/4+z 3/4+x,1/2-y,1/4+z 1/4+x,-y,1/4+z 1/4+x,1/2-y,3/4+z 3/4+x,1/4+y,1/2-z 1/4+x,3/4+y,1/2-z 1/4+x,1/4+y,-z -y,1/2-z,1/2-x 1/2-y,-z,1/2-x 1/2-y,1/2-z,-x 3/4+y,1/4+z,1/2-x 1/4+y,3/4+z,1/2-x 1/4+y,1/4+z,-x -y,1/4+z,1/4+x 1/2-y,3/4+z,1/4+x 1/2-y,1/4+z,3/4+x 3/4+y,1/2-z,1/4+x 1/4+y,-z,1/4+x 1/4+y,1/2-z,3/4+x -z,1/2-x,1/2-y 1/2-z,-x,1/2-y 1/2-z,1/2-x,-y 3/4+z,1/2-x,1/4+y 1/4+z,-x,1/4+y 1/4+z,1/2-x,3/4+y 3/4+z,1/4+x,1/2-y 1/4+z,3/4+x,1/2-y 1/4+z,1/4+x,-y -z,1/4+x,1/4+y 1/2-z,3/4+x,1/4+y 1/2-z,1/4+x,3/4+y -x,1/2-z,1/2-y 1/2-x,-z,1/2-y 1/2-x,1/2-z,-y -x,1/4+z,1/4+y 1/2-x,3/4+z,1/4+y 1/2-x,1/4+z,3/4+y 3/4+x,1/4+z,1/2-y 1/4+x,3/4+z,1/2-y 1/4+x,1/4+z,-y 3/4+x,1/2-z,1/4+y 1/4+x,-z,1/4+y 1/4+x,1/2-z,3/4+y -y,1/2-x,1/2-z 1/2-y,-x,1/2-z 1/2-y,1/2-x,-z 3/4+y,1/2-x,1/4+z 1/4+y,-x,1/4+z 1/4+y,1/2-x,3/4+z -y,1/4+x,1/4+z 1/2-y,3/4+x,1/4+z 1/2-y,1/4+x,3/4+z 3/4+y,1/4+x,1/2-z 1/4+y,3/4+x,1/2-z 1/4+y,1/4+x,-z -z,1/2-y,1/2-x 1/2-z,-y,1/2-x 1/2-z,1/2-y,-x 3/4+z,1/4+y,1/2-x 1/4+z,3/4+y,1/2-x 1/4+z,1/4+y,-x 3/4+z,1/2-y,1/4+x 1/4+z,-y,1/4+x 1/4+z,1/2-y,3/4+x -z,1/4+y,1/4+x 1/2-z,3/4+y,1/4+x 1/2-z,1/4+y,3/4+x loop_ _atom_site_label _atom_site_type_symbol _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_attached_hydrogens _atom_site_calc_flag Ag1 Ag1+ 16 c 0. 0. 0. 1. 0 d Sb1 Sb5+ 16 d 0.5 0.5 0.5 1. 0 d O1 O2- 48 f 0.29 0.125 0.125 1. 0 d loop_ _atom_type_symbol _atom_type_oxidation_number Ag1+ 1.000 Sb5+ 5.000 O2- -2.000