#------------------------------------------------------------------------------ #$Date: 2015-07-10 13:35:24 +0300 (Fri, 10 Jul 2015) $ #$Revision: 141851 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/16/1521638.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_1521638 loop_ _publ_author_name 'Mueller-Bunz, H.' 'Schleid, T.' _publ_section_title ; Ueber die Oxidsilicate M2 O (Si O4) der schweren Lanthanoide (M = Dy - Lu) im A-Typ ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 613 _journal_page_last 618 _journal_volume 625 _journal_year 1999 _chemical_formula_sum 'Lu2 O5 Si' _chemical_name_systematic 'Lu2 O (Si O4)' _space_group_IT_number 14 _symmetry_space_group_name_Hall '-P 2ybc' _symmetry_space_group_name_H-M 'P 1 21/c 1' _cell_angle_alpha 90 _cell_angle_beta 104.18 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 8.987 _cell_length_b 6.706 _cell_length_c 6.5951 _cell_volume 385.355 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Mueller-Bunz_ZAACAB_1999_892.cif _cod_data_source_block Lu2O5Si1 _cod_original_cell_volume 385.3553 _cod_chemical_formula_sum_orig 'Lu2 O5 Si1' _cod_database_code 1521638 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y+1/2,-z+1/2 -x,-y,-z x,-y-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 O4 O-2 0.1038 0.7941 0.4911 1 0.0 Lu2 Lu+3 0.5282 0.62378 0.23054 1 0.0 Lu1 Lu+3 0.13391 0.13876 0.46162 1 0.0 O1 O-2 0.2128 0.4445 0.6916 1 0.0 O3 O-2 0.3821 0.6411 0.5137 1 0.0 O2 O-2 0.1361 0.4272 0.2977 1 0.0 O5 O-2 0.3974 0.3771 0.0714 1 0.0 Si1 Si+4 0.1979 0.5938 0.4795 1 0.0