#------------------------------------------------------------------------------ #$Date: 2016-02-14 06:40:26 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176432 $ #$URL: file:///home/coder/svn-repositories/cod/cif/8/10/33/8103397.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_8103397 loop_ _publ_author_name 'Chang, F.M.' 'Jansen, M.' _publ_section_title ; Crystal structure refinement of silver permanganate ; _journal_name_full 'Zeitschrift fuer Kristallographie (149,1979-)' _journal_page_first 295 _journal_page_last 298 _journal_volume 169 _journal_year 1984 _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 92.44 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 5.623 _cell_length_b 8.349 _cell_length_c 7.14 _cell_volume 334.894 _citation_journal_id_ASTM ZEKRDZ _cod_data_source_file silver1-2_419.cif _cod_data_source_block Ag1Mn1O4 _cod_original_cell_volume 334.8936 _cod_original_sg_symbol_Hall '-P 2ybc (x-z,y,z)' _cod_original_formula_sum 'Ag1 Mn1 O4' _cod_database_code 8103397 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 Ag1 Ag+1 0.2495 0.0327 0.1648 1 0.0 O2 O-2 -0.0138 0.2239 0.7168 1 0.0 O3 O-2 0.4058 0.1185 0.8456 1 0.0 O1 O-2 0.3864 0.3504 0.5918 1 0.0 Mn1 Mn+7 0.2572 0.1869 0.6613 1 0.0 O4 O-2 0.2526 0.0564 0.4963 1 0.0