#------------------------------------------------------------------------------ #$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $ #$Revision: 211196 $ #$URL: file:///home/coder/svn-repositories/cod/cif/8/10/33/8103389.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_8103389 loop_ _publ_author_name 'Pocza, J.' 'Naray-Szabo, S.' _publ_section_title ; Die Struktur des Silberchlorats Ag Cl O3 ; _journal_name_full ; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) ; _journal_page_first 28 _journal_page_last 38 _journal_volume 104 _journal_year 1942 _chemical_formula_sum 'Ag Cl O3' _space_group_IT_number 87 _symmetry_space_group_name_Hall '-I 4' _symmetry_space_group_name_H-M 'I 4/m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 7.486 _cell_length_b 7.486 _cell_length_c 7.89 _cell_volume 442.157 _citation_journal_id_ASTM ZEKGAX _cod_data_source_file silver1-2_164.cif _cod_data_source_block Ag1Cl1O3 _cod_original_cell_volume 442.1571 _cod_original_formula_sum 'Ag1 Cl1 O3' _cod_database_code 8103389 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 O1 O-2 0.12 0.25 0.152 1 0.0 Ag1 Ag+1 0 0.5 0.25 1 0.0 O2 O-2 0.34 0.35 0 1 0.0 Ag2 Ag+1 0 0 0.277 1 0.0 Cl1 Cl+5 0.215 0.235 0 1 0.0