#------------------------------------------------------------------------------ #$Date: 2015-07-13 07:44:00 +0300 (Mon, 13 Jul 2015) $ #$Revision: 150139 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/81/1528176.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_1528176 loop_ _publ_author_name 'Wambach, K.R.' 'Hoppe, R.' _publ_section_title ; Koordinationszahl 3 bei Oxozincaten. Rb8 (O Zn O2 Zn O2 Zn O2 Zn O) und K2 (Zn6 O7) ; _journal_name_full 'Angewandte Chemie (German Edition)' _journal_page_first 498 _journal_page_last 499 _journal_volume 89 _journal_year 1977 _chemical_formula_sum 'K2 O7 Zn6' _chemical_name_systematic 'K2 (Zn6 O7)' _space_group_IT_number 102 _symmetry_space_group_name_Hall 'P 4n -2n' _symmetry_space_group_name_H-M 'P 42 n m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 10.912 _cell_length_b 10.912 _cell_length_c 3.325 _cell_volume 395.914 _citation_journal_id_ASTM ANCEAD _cod_data_source_file Wambach_ANCEAD_1977_602.cif _cod_data_source_block K2O7Zn6 _cod_original_cell_volume 395.9135 _cod_database_code 1528176 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y+1/2,x+1/2,z+1/2 -x,-y,z y+1/2,-x+1/2,z+1/2 -x+1/2,y+1/2,z+1/2 -y,-x,z x+1/2,-y+1/2,z+1/2 y,x,z 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 O2 O-2 0.1952 0.1952 0.0322 1 0.0 Zn1 Zn+2 0.3448 0.0847 0 1 0.0 O3 O-2 0 0 0.6231 1 0.0 K1 K+1 0.3475 0.3475 0.4709 1 0.0 Zn2 Zn+2 0.1199 0.1199 0.4846 1 0.0 O1 O-2 0.1869 0.4922 -0.0214 1 0.0