#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/31/1533167.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_1533167 loop_ _publ_author_name 'Fischer, P.' 'Haelg, W.' 'Schwarzenbach, D.' 'Gamsjaeger, H.' _publ_section_title ; Magnetic and crystal structure of copper(II) fluoride ; _journal_name_full 'Journal of Physics and Chemistry of Solids' _journal_page_first 1683 _journal_page_last 1689 _journal_volume 35 _journal_year 1974 _chemical_formula_sum 'Cu F2' _chemical_name_systematic 'Cu F2' _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 121.11 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 3.309 _cell_length_b 4.569 _cell_length_c 5.362 _cell_volume 69.408 _citation_journal_id_ASTM JPCSAW _cod_data_source_file Fischer_JPCSAW_1974_472.cif _cod_data_source_block Cu1F2 _cod_original_cell_volume 69.40779 _cod_original_formula_sum 'Cu1 F2' _cod_database_code 1533167 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 Cu1 Cu+2 0 0 0 1 0.0 F1 F-1 0.2558 0.2968 0.2951 1 0.0