#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/15/1511512.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_1511512 loop_ _publ_author_name 'Rogl, P.' _publ_section_title ; The crystal structure of La Ir4 B4, Th Os4 B4, Th Ir4 B4 ( Nd Co4 B4 - type ) and U Ru4 B4, U Os4 B4 ( Lu Ru4 B4 - type) ; _journal_name_full ; Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-) ; _journal_page_first 517 _journal_page_last 527 _journal_volume 111 _journal_year 1980 _chemical_formula_sum 'B4 Ru4 U' _chemical_name_systematic 'U Ru4 B4' _space_group_IT_number 142 _symmetry_space_group_name_Hall '-I 4bd 2c' _symmetry_space_group_name_H-M 'I 41/a c d :2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 7.459 _cell_length_b 7.459 _cell_length_c 14.986 _cell_volume 833.771 _citation_journal_id_ASTM MOCMB7 _cod_data_source_file boron4-x_142.cif _cod_data_source_block B4Ru4U1 _cod_original_cell_volume 833.7713 _cod_original_formula_sum 'B4 Ru4 U1' _cod_database_code 1511512 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y+1/4,x+3/4,z+1/4 -x+1/2,-y,z+1/2 y+1/4,-x+1/4,z+3/4 x,-y,-z+1/2 y+1/4,x+3/4,-z+3/4 -x+1/2,y,-z -y+1/4,-x+1/4,-z+1/4 -x,-y,-z y-1/4,-x-3/4,-z-1/4 x-1/2,y,-z-1/2 -y-1/4,x-1/4,-z-3/4 -x,y,z-1/2 -y-1/4,-x-3/4,z-3/4 x-1/2,-y,z y-1/4,x-1/4,z-1/4 x+1/2,y+1/2,z+1/2 -y+3/4,x+5/4,z+3/4 -x+1,-y+1/2,z+1 y+3/4,-x+3/4,z+5/4 x+1/2,-y+1/2,-z+1 y+3/4,x+5/4,-z+5/4 -x+1,y+1/2,-z+1/2 -y+3/4,-x+3/4,-z+3/4 -x+1/2,-y+1/2,-z+1/2 y+1/4,-x-1/4,-z+1/4 x,y+1/2,-z -y+1/4,x+1/4,-z-1/4 -x+1/2,y+1/2,z -y+1/4,-x-1/4,z-1/4 x,-y+1/2,z+1/2 y+1/4,x+1/4,z+1/4 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 U1 U 0 0.25 0.125 1 0.0 Ru1 Ru 0.112 0.1 0.9375 1 0.0 B1 B 0.826 0.101 0.955 1 0.0