#------------------------------------------------------------------------------ #$Date: 2013-04-29 19:19:38 +0100 (Mon, 29 Apr 2013) $ #$Revision: 82405 $ #$URL: svn://www.crystallography.net/cod/cif/2/10/53/2105345.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2105345 loop_ _publ_author_name 'Boonstra, E.G.' _publ_section_title ; The crystal structure of silver permanganate ; _journal_name_full 'Acta Crystallographica B (24,1968-38,1982)' _journal_page_first 1053 _journal_page_last 1062 _journal_volume 24 _journal_year 1968 _chemical_formula_sum 'Ag Mn O4' _chemical_name_systematic 'Ag Mn O4' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2yn' _symmetry_space_group_name_H-M 'P 1 21/n 1' _cell_angle_alpha 90 _cell_angle_beta 92.25 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 5.64 _cell_length_b 8.33 _cell_length_c 7.12 _cell_volume 334.248 _citation_journal_id_ASTM ACBCAR _[local]_cod_data_source_file silver1-2_420.cif _[local]_cod_data_source_block Ag1Mn1O4 _[local]_cod_cif_authors_sg_Hall '-P 2ybc (x-z,y,z)' _[local]_cod_chemical_formula_sum_orig 'Ag1 Mn1 O4' _cod_original_cell_volume 334.2482 _cod_database_code 2105345 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x+1/2,y+1/2,-z+1/2 -x,-y,-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 O1 O-2 0.384 0.3497 0.5923 1 0.0 O2 O-2 -0.0145 0.2226 0.7156 1 0.0 Ag1 Ag+1 0.2494 0.0327 0.1647 1 0.0 O4 O-2 0.2554 0.0594 0.4971 1 0.0 Mn1 Mn+7 0.2572 0.1867 0.6608 1 0.0 O3 O-2 0.405 0.1189 0.8444 1 0.0