#------------------------------------------------------------------------------ #$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $ #$Revision: 19 $ #$URL: file:///home/coder/svn-repositories/cod/cif/9/9007842.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_9007842 _chemical_name 'K3Na(CrO4)2' loop_ _publ_author_name 'Madariaga G' 'Breczewski T' _journal_name_full "Acta Crystallographica, Section C" _journal_volume 46 _journal_year 1990 _journal_page_first 2019 _journal_page_last 2021 _publ_section_title ; Structure and phase transition of K3Na(CrO4)2 ; _chemical_formula_sum 'O8 Cr2 K3 Na' _cell_length_a 5.8580 _cell_length_b 5.8580 _cell_length_c 7.523 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 223.574 _symmetry_space_group_name_H-M 'P -3 m 1' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '-y,-x,z' 'y,-x+y,-z' '-x,-x+y,-z' '-x+y,-x,z' '-x+y,y,z' '-x,-y,-z' 'y,x,-z' '-y,x-y,z' 'x,x-y,z' 'x-y,x,-z' 'x-y,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_Uiso_or_equiv O2 -0.81880 0.81880 0.30250 0.02880 O1 0.33333 0.66667 0.01140 0.03850 Cr 0.33333 0.66667 0.22657 0.00825 K1 0.33333 0.66667 0.66767 0.01571 Na 0.00000 0.00000 0.50000 0.01170 K2 0.00000 0.00000 0.00000 0.03250