#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/47/1534780.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_1534780 loop_ _publ_author_name 'Gromilov, S.A.' 'Emel'yanov, V.A.' 'Baidina, I.A.' 'Alekseev, V.I.' 'Belyaev, A.V.' _publ_section_title ; Synthesis and crystal structure of lithium and potassium hexanitroruthenates(II) ; _journal_name_full 'Zhurnal Strukturnoi Khimii (Issue-No. from 1981)' _journal_page_first 171 _journal_page_last 177 _journal_volume 35 _journal_year 1994 _chemical_formula_sum 'K4 N6 O12 Ru' _chemical_name_systematic 'K4 (Ru (N O2)6)' _space_group_IT_number 148 _symmetry_space_group_name_Hall '-P 3*' _symmetry_space_group_name_H-M 'R -3 :R' _cell_angle_alpha 52.23 _cell_angle_beta 52.23 _cell_angle_gamma 52.23 _cell_formula_units_Z 1 _cell_length_a 8.595 _cell_length_b 8.595 _cell_length_c 8.595 _cell_volume 367.012 _citation_journal_id_ASTM ZSTKAI _cod_data_source_file Gromilov_ZSTKAI_1994_1458.cif _cod_data_source_block K4N6O12Ru1 _cod_original_cell_volume 367.0123 _cod_original_sg_symbol_Hall '-R 3 (-y+z,x+z,-x+y+z)' _cod_original_formula_sum 'K4 N6 O12 Ru1' _cod_database_code 1534780 loop_ _symmetry_equiv_pos_as_xyz x,y,z z,x,y y,z,x -x,-y,-z -z,-x,-y -y,-z,-x 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 0.1929 0.1929 0.1929 1 0.0 O2 O-2 0.0656 -0.1387 0.368 1 0.0 Ru1 Ru+2 0 0 0 1 0.0 N1 N+3 -0.0738 -0.0712 0.308 1 0.0 K2 K+1 0.3806 0.3806 0.3806 1 0.0 O1 O-2 -0.2591 -0.045 0.4426 1 0.0