#------------------------------------------------------------------------------ #$Date: 2015-07-13 03:14:45 +0300 (Mon, 13 Jul 2015) $ #$Revision: 148846 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/73/1527332.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_1527332 loop_ _publ_author_name 'Eichler, W.' 'Seifert, H.J.' _publ_section_title ; Strukturelle und magnetische Untersuchungen an Hexachlorowolframaten(V) ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 123 _journal_page_last 133 _journal_volume 431 _journal_year 1977 _chemical_formula_sum 'Cl6 Cs W' _chemical_name_systematic 'Cs (W Cl6)' _space_group_IT_number 15 _symmetry_space_group_name_Hall '-C 2yc' _symmetry_space_group_name_H-M 'C 1 2/c 1' _cell_angle_alpha 90 _cell_angle_beta 128.4 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 12.097 _cell_length_b 6.327 _cell_length_c 15.3 _cell_volume 917.726 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Eichler_ZAACAB_1977_717.cif _cod_data_source_block Cl6Cs1W1 _cod_original_cell_volume 917.7264 _cod_chemical_formula_sum_orig 'Cl6 Cs1 W1' _cod_database_code 1527332 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y,-z+1/2 -x,-y,-z x,-y,z-1/2 x+1/2,y+1/2,z -x+1/2,y+1/2,-z+1/2 -x+1/2,-y+1/2,-z x+1/2,-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 Cl3 Cl-1 -0.066 -0.1327 0.1036 1 0.0 Cl1 Cl-1 0.1946 0.166 0.1587 1 0.0 Cs1 Cs+1 0 0.3692 0.25 1 0.0 W1 W+5 0 0 0 1 0.0 Cl2 Cl-1 0.1343 -0.2995 0.0403 1 0.0