#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/51/16/1511634.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_1511634 loop_ _publ_author_name 'Gubich, I.B.' _publ_section_title ; A new boride Yb2Ni3B6 and its structure ; _journal_name_full 'Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy' _journal_page_first 630 _journal_page_last 631 _journal_volume 27 _journal_year 1991 _chemical_formula_sum 'B6 Ni3 Yb2' _chemical_name_systematic 'Yb2 Ni3 B6' _space_group_IT_number 65 _symmetry_space_group_name_Hall '-C 2 2' _symmetry_space_group_name_H-M 'C m m m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 7.627 _cell_length_b 8.604 _cell_length_c 3.443 _cell_volume 225.939 _citation_journal_id_ASTM IVNMAW _cod_data_source_file boron4-x_288.cif _cod_data_source_block B6Ni3Yb2 _cod_database_code 1511634 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,-y,z x,-y,-z -x,y,-z -x,-y,-z x,y,-z -x,y,z x,-y,z x+1/2,y+1/2,z -x+1/2,-y+1/2,z x+1/2,-y+1/2,-z -x+1/2,y+1/2,-z -x+1/2,-y+1/2,-z x+1/2,y+1/2,-z -x+1/2,y+1/2,z x+1/2,-y+1/2,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 Ni2 Ni 0.236 0 0 1 0.0 B1 B 0.234 0.157 0.5 1 0.0 B2 B 0.376 0 0.5 1 0.0 Yb1 Yb 0 0.274 0 1 0.0 Ni1 Ni 0 0 0.5 1 0.0