#------------------------------------------------------------------------------ #$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $ #$Revision: 176429 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/64/1526460.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_1526460 loop_ _publ_author_name 'Iwanaga, D.' 'Inaguma, Y.' 'Itoh, M.' _publ_section_title ; Structure and magnetic properties of Sr2 Ni A O6 ; _journal_name_full 'Materials Research Bulletin' _journal_page_first 449 _journal_page_last 457 _journal_volume 35 _journal_year 2000 _chemical_formula_sum 'Ni O6 Sr2 W' _chemical_name_systematic 'Sr2 Ni (W O6)' _space_group_IT_number 87 _symmetry_space_group_name_Hall '-I 4' _symmetry_space_group_name_H-M 'I 4/m' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 5.5571 _cell_length_b 5.5571 _cell_length_c 7.9131 _cell_volume 244.367 _citation_journal_id_ASTM MRBUAC _cod_data_source_file Iwanaga_MRBUAC_2000_319.cif _cod_data_source_block Ni1O6Sr2W1 _cod_original_cell_volume 244.3673 _cod_original_formula_sum 'Ni1 O6 Sr2 W1' _cod_database_code 1526460 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x,z -x,-y,z y,-x,z -x,-y,-z y,-x,-z x,y,-z -y,x,-z x+1/2,y+1/2,z+1/2 -y+1/2,x+1/2,z+1/2 -x+1/2,-y+1/2,z+1/2 y+1/2,-x+1/2,z+1/2 -x+1/2,-y+1/2,-z+1/2 y+1/2,-x+1/2,-z+1/2 x+1/2,y+1/2,-z+1/2 -y+1/2,x+1/2,-z+1/2 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 O1 O-2 0.289 0.227 0 1 0.0 O2 O-2 0 0 0.255 1 0.0 W1 W+6 0 0 0.5 1 0.0 Sr1 Sr+2 0 0.5 0.25 1 0.0 Ni1 Ni+2 0 0 0 1 0.0