#------------------------------------------------------------------------------ #$Date: 2013-05-02 18:37:25 +0300 (Thu, 02 May 2013) $ #$Revision: 84135 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/08/1510852.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_1510852 loop_ _publ_author_name 'Lundstroem, T.' _publ_section_title ; The structure of Ru2 B3 and W B2.0, as determined by single-crystal diffractometry, and some notes on the W - B system ; _journal_name_full 'Arkiv foer Kemi' _journal_page_first 115 _journal_page_last 127 _journal_volume 30 _journal_year 1969 _chemical_formula_sum 'B2 W' _chemical_name_systematic 'W B2.0' _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 4 _cell_length_a 2.9831 _cell_length_b 2.9831 _cell_length_c 13.879 _cell_volume 106.961 _citation_journal_id_ASTM ARKEAD _[local]_cod_data_source_file boron_360.cif _[local]_cod_data_source_block B2W1 _[local]_cod_chemical_formula_sum_orig 'B2 W1' _cod_original_cell_volume 106.9607 _cod_database_code 1510852 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 B1 B-3 0.3333 0.6667 0.9757 1 0.0 B2 B-3 0.3333 0.6667 0.75 1 0.0 B3 B-3 0 0 0.25 1 0.0 W1 W+6 0.3333 0.6667 0.13759 1 0.0