#------------------------------------------------------------------------------ #$Date: 2015-10-14 18:01:21 +0300 (Wed, 14 Oct 2015) $ #$Revision: 168755 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/97/1539743.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_1539743 loop_ _publ_author_name 'Che, G.C.' 'Ellner, M.' _publ_section_title ; Powder crystal data for the high-temperature phases Cu4 In, Cu9 In4(h) and Cu2 In(h) ; _journal_name_full 'Powder Diffraction' _journal_page_first 107 _journal_page_last 108 _journal_volume 7 _journal_year 1992 _chemical_formula_sum 'Cu2 In' _chemical_name_systematic 'Cu2 In' _space_group_IT_number 194 _symmetry_space_group_name_Hall '-P 6c 2c' _symmetry_space_group_name_H-M 'P 63/m m c' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 2 _cell_length_a 4.2943 _cell_length_b 4.2943 _cell_length_c 5.2328 _cell_volume 83.570 _citation_journal_id_ASTM PODIE2 _cod_data_source_file Che_PODIE2_1992_883.cif _cod_data_source_block Cu2In1 _cod_original_cell_volume 83.56983 _cod_chemical_formula_sum_orig 'Cu2 In1' _cod_database_code 1539743 loop_ _symmetry_equiv_pos_as_xyz x,y,z x-y,x,z+1/2 -y,x-y,z -x,-y,z+1/2 -x+y,-x,z y,-x+y,z+1/2 -y,-x,-z+1/2 x-y,-y,-z x,x-y,-z+1/2 y,x,-z -x+y,y,-z+1/2 -x,-x+y,-z -x,-y,-z -x+y,-x,-z-1/2 y,-x+y,-z x,y,-z-1/2 x-y,x,-z -y,x-y,-z-1/2 y,x,z-1/2 -x+y,y,z -x,-x+y,z-1/2 -y,-x,z x-y,-y,z-1/2 x,x-y,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 Cu2 Cu 0.3333 0.6667 0.25 1 0.0 Cu1 Cu 0 0 0 1 0.0 In1 In 0.3333 0.6667 0.75 1 0.0