#------------------------------------------------------------------------------ #$Date: 2015-07-11 16:08:09 +0300 (Sat, 11 Jul 2015) $ #$Revision: 144805 $ #$URL: file:///home/coder/svn-repositories/cod/cif/7/22/11/7221194.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_7221194 loop_ _publ_author_name 'Burschka, C.' _publ_section_title ; Na3 Cu4 S4 - ein Thiocuprat mit unverknuepften (Cu4 S4)-Ketten ; _journal_name_full ; Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986) ; _journal_page_first 396 _journal_page_last 397 _journal_volume 34 _journal_year 1979 _chemical_formula_sum 'Cu4 Na3 S4' _chemical_name_systematic 'Na3 Cu4 S4' _space_group_IT_number 55 _symmetry_space_group_name_Hall '-P 2 2ab' _symmetry_space_group_name_H-M 'P b a m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 14.624 _cell_length_b 7.163 _cell_length_c 3.771 _cell_volume 395.019 _citation_journal_id_ASTM ZNBAD2 _cod_data_source_file Burschka_ZNBAD2_1979_141.cif _cod_data_source_block Cu4Na3S4 _cod_original_cell_volume 395.0187 _cod_database_code 7221194 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,z x+1/2,-y+1/2,-z -x+1/2,y+1/2,-z -x,-y,-z x,y,-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 Cu1 Cu 0.4067 0.0795 0.5 1 0.0 S2 S 0.4119 0.2514 0 1 0.0 Na1 Na 0.2666 0.5155 0 1 0.0 S1 S 0.1532 0.2834 0.5 1 0.0 Na2 Na 0.5 0.5 0.5 1 0.0 Cu2 Cu 0.0647 0.3321 0 1 0.0