#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/09/1510953.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_1510953 loop_ _publ_author_name 'Aronsson, B.' _publ_section_title ; The crystal structure of Ru7 B3 ; _journal_name_full 'Acta Chemica Scandinavica (1-27,1973-42,1988)' _journal_page_first 109 _journal_page_last 114 _journal_paper_doi 10.3891/acta.chem.scand.13-0109 _journal_volume 13 _journal_year 1959 _chemical_formula_sum 'B3 Ru7' _chemical_name_systematic 'Ru7 B3' _space_group_IT_number 186 _symmetry_space_group_name_Hall 'P 6c -2c' _symmetry_space_group_name_H-M 'P 63 m c' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 2 _cell_length_a 7.467 _cell_length_b 7.467 _cell_length_c 4.71 _cell_volume 227.428 _citation_journal_id_ASTM ACSAA4 _cod_data_source_file boron_486.cif _cod_data_source_block B3Ru7 _cod_original_cell_volume 227.4279 _cod_database_code 1510953 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 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 Ru3 Ru 0.3333 0.6667 0.068 1 0.0 B1 B 0.813 0.187 0.33 1 0.0 Ru1 Ru 0.5437 0.4563 0.068 1 0.0 Ru2 Ru 0.1219 -0.1219 0.25 1 0.0