#------------------------------------------------------------------------------ #$Date: 2015-10-11 14:23:20 +0300 (Sun, 11 Oct 2015) $ #$Revision: 165545 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/74/1537408.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_1537408 loop_ _publ_author_name 'Hestermann, K.' 'Hoppe, R.' _publ_section_title ; Notiz ueber K Cu O ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 113 _journal_page_last 116 _journal_volume 360 _journal_year 1968 _chemical_formula_sum 'Cu K O' _chemical_name_systematic 'K Cu O' _space_group_IT_number 82 _symmetry_space_group_name_Hall 'I -4' _symmetry_space_group_name_H-M 'I -4' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 9.32 _cell_length_b 9.32 _cell_length_c 5.46 _cell_volume 474.269 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Hestermann_ZAACAB_1968_904.cif _cod_data_source_block Cu1K1O1 _cod_original_cell_volume 474.2687 _cod_chemical_formula_sum_orig 'Cu1 K1 O1' _cod_database_code 1537408 loop_ _symmetry_equiv_pos_as_xyz 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 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 K1 K+1 0.184 0 0.25 1 0.0 Cu1 Cu+1 0.35 0.147 0.75 1 0.0 O1 O-2 0.18 0 0.75 1 0.0