#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/00/1530019.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_1530019 loop_ _publ_author_name 'Greaves, C.' 'Katib, S.M.A.' _publ_section_title ; The Structures of Li5 Bi O5 and Li5 Sb O5 From Powder Neutron Diffraction ; _journal_name_full 'Materials Research Bulletin' _journal_page_first 973 _journal_page_last 980 _journal_volume 24 _journal_year 1989 _chemical_formula_sum 'Li5 O5 Sb' _chemical_name_systematic 'Li5 Sb O5' _space_group_IT_number 12 _symmetry_space_group_name_Hall '-C 2y' _symmetry_space_group_name_H-M 'C 1 2/m 1' _cell_angle_alpha 90 _cell_angle_beta 109.04 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 9.724 _cell_length_b 3.984 _cell_length_c 5.792 _cell_volume 212.109 _citation_journal_id_ASTM MRBUAC _cod_data_source_file Greaves_MRBUAC_1989_1848.cif _cod_data_source_block Li5O5Sb1 _cod_original_cell_volume 212.1086 _cod_original_formula_sum 'Li5 O5 Sb1' _cod_database_code 1530019 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y,-z -x,-y,-z x,-y,z x+1/2,y+1/2,z -x+1/2,y+1/2,-z -x+1/2,-y+1/2,-z x+1/2,-y+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 Li2 Li+1 0.307 0 0.147 1 0.0 O3 O-2 0.1426 0 0.8264 1 0.0 Sb1 Sb+5 0 0 0 1 0.0 O2 O-2 0.1576 0 0.314 1 0.0 Li1 Li+1 0 0 0.5 1 0.0 Li3 Li+1 0.286 0 0.654 1 0.0 O1 O-2 0.5 0 0 1 0.0