#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/98/1539878.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_1539878 loop_ _publ_author_name 'Bronger, W.' 'Auffermann, G.' _publ_section_title ; Zur Synthese und Struktur von Rb3 Pd H3 und Rb 3Pd H5 ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first 235 _journal_page_last 240 _journal_volume 179 _journal_year 1992 _chemical_formula_sum 'D5 Pd Rb3' _chemical_name_systematic 'Pd Rb3 D5' _space_group_IT_number 127 _symmetry_space_group_name_Hall '-P 4 2ab' _symmetry_space_group_name_H-M 'P 4/m b m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 7.8 _cell_length_b 7.8 _cell_length_c 5.987 _cell_volume 364.249 _citation_journal_id_ASTM JALCEU _cod_data_source_file Bronger_JALCEU_1992_912.cif _cod_data_source_block D5Pd1Rb3 _cod_original_cell_volume 364.2491 _cod_original_formula_sum 'D5 Pd1 Rb3' _cod_database_code 1539878 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 y+1/2,x+1/2,-z -x+1/2,y+1/2,-z -y+1/2,-x+1/2,-z -x,-y,-z y,-x,-z x,y,-z -y,x,-z -x-1/2,y-1/2,z -y-1/2,-x-1/2,z x-1/2,-y-1/2,z y-1/2,x-1/2,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 Rb1 Rb 0 0 0 1 0.0 D1 D 0 0 0.5 1 0.0 D2 D 0.1079 0.6079 0.181 1 0.0 Rb2 Rb 0.684 0.184 0.5 1 0.0 Pd1 Pd 0 0.5 0 1 0.0