#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/08/1510802.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_1510802 loop_ _publ_author_name 'Rogl, P.' 'Rudy, E.' _publ_section_title ; New complex borides with Re B2- and Mo2 Ir B2-type structure ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 175 _journal_page_last 181 _journal_paper_doi 10.1016/0022-4596(78)90007-5 _journal_volume 24 _journal_year 1978 _chemical_formula_sum 'B2 Os0.6 V0.4' _chemical_name_systematic 'V0.4 Os0.6 B2' _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 2.9 _cell_length_b 2.9 _cell_length_c 7.333 _cell_volume 53.408 _citation_journal_id_ASTM JSSCBI _cod_data_source_file boron_306.cif _cod_data_source_block B2Os0.6V0.4 _cod_original_cell_volume 53.40825 _cod_database_code 1510802 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 Os1 Os 0.3333 0.6667 0.25 0.6 0.0 B1 B 0.3333 0.6667 0.55 1 0.0 V1 V 0.3333 0.6667 0.25 0.4 0.0