#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/15/1511506.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_1511506 loop_ _publ_author_name 'Mykhalenko, S.I.' 'Zavalii, P.Yu.' 'Kuz'ma, Yu.B.' _publ_section_title ; New incommensurate structures of the borides Pr41(Mn4B4)35 and Pr7(Re4B4)6 ; _journal_name_full 'Journal of Alloys Compd.' _journal_page_first 55 _journal_page_last 59 _journal_paper_doi 10.1016/0925-8388(94)90714-5 _journal_volume 203 _journal_year 1994 _chemical_formula_sum 'B4 Re4' _chemical_name_systematic 'Re4 B4' _space_group_IT_number 141 _symmetry_space_group_name_Hall '-I 4bd 2' _symmetry_space_group_name_H-M 'I 41/a m d :2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 10.586 _cell_length_b 10.586 _cell_length_c 4.201 _cell_volume 470.778 _citation_journal_id_ASTM JALCEU _cod_data_source_file boron4-x_137.cif _cod_data_source_block B4Re4 _cod_original_cell_volume 470.7784 _cod_database_code 1511506 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 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 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 -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+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+1/2 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+1/2 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+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 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 Re1 Re 0 0.3781 0.625 1 0.0 B1 B 0 0.432 0.144 1 0.0