#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/cod/cif/5/91/00/5910011.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_5910011 loop_ _publ_author_name 'Wyckoff, R. W. G.' _publ_section_title ; Page 273 from the second edition of Structure of Crystals by Wyckoff, R. W. G. Published by The Chemical Catalog Company, INC, New York in 1931 http://jcrystal.com/steffenweber/gallery/StructureTypes/st4.html ; _journal_name_full 'The second edition of Structure of Crystals' _journal_page_first 273 _journal_page_last 273 _journal_year 1931 _chemical_formula_structural NaNbO3 _chemical_formula_sum 'Na Nb O3' _chemical_name_systematic NaNbO3 _space_group_IT_number 221 _symmetry_cell_setting cubic _symmetry_Int_Tables_number 221 _symmetry_space_group_name_Hall '-P 4 2 3' _symmetry_space_group_name_H-M 'P m -3 m' _audit_creation_date 2005-04-11 _audit_creation_method ; Page 273 from the second edition of Structure of Crystals by Wyckoff, R. W. G. Published by The Chemical Catalog Company, INC, New York in 1931 http://jcrystal.com/steffenweber/gallery/StructureTypes/st4.html ; _audit_update_record 'created by Girish Upreti, Portland State University' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_length_a 3.89 _cell_length_b 3.89 _cell_length_c 3.89 _cell_volume 58.864 _cod_depositor_comments ; After consulting the original source Columbium symbol (Cb) was changed to Niobium symbol (Nb) since the first one is no longer recognised as an official name of the 41st atomic element. Antanas Vaitkus, 2014-07-14 ; _cod_original_formula_sum 'Nb Cb O3' _cod_database_code 5910011 loop_ _symmetry_equiv_pos_as_xyz x,y,z x,-z,y x,z,-y z,y,-x -z,y,x -y,x,z y,-x,z z,x,y y,z,x -y,-z,x z,-x,-y -y,z,-x -z,-x,y -z,x,-y y,-z,-x x,-y,-z -x,y,-z -x,-y,z y,x,-z -y,-x,-z z,-y,x -z,-y,-x -x,z,y -x,-z,-y -x,-y,-z -x,z,-y -x,-z,y -z,-y,x z,-y,-x y,-x,-z -y,x,-z -z,-x,-y -y,-z,-x y,z,-x -z,x,y y,-z,x z,x,-y z,-x,y -y,z,x -x,y,z x,-y,z x,y,-z -y,-x,z y,x,z -z,y,-x z,y,x x,-z,-y x,z,y loop_ _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_label 0.00000 0.00000 0.00000 Na 0.50000 0.50000 0.50000 Nb 0.50000 0.50000 0.00000 O