#------------------------------------------------------------------------------ #$Date: 2008-01-26 13:05:32 +0000 (Sat, 26 Jan 2008) $ #$Revision: 19 $ #$URL: svn://www.crystallography.net/cod/cif/2/2002945.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_2002945 _journal_name_full 'Acta Crystallographica, Section B' _journal_year 1999 _journal_volume B55 _journal_page_first 24 _journal_page_last 30 _chemical_formula_moiety 'Na1 O3 Ta1 ' _chemical_formula_sum 'Na1 O3 Ta1 ' _chemical_formula_weight ? _symmetry_cell_setting tetragonal _symmetry_space_group_name_H-M 'P 4/m b m' _symmetry_space_group_name_Hall '-P 4 2ab' loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-y, x, z' '-x, -y, z' 'y, -x, z' 'x+1/2, -y+1/2, -z' '-x+1/2, y+1/2, -z' 'y+1/2, x+1/2, -z' '-y+1/2, -x+1/2, -z' _cell_length_a 5.55465(2) _cell_length_b 5.55465(2) _cell_length_c 3.93426(2) _cell_angle_alpha 90.00 _cell_angle_beta 90.00 _cell_angle_gamma 90.00 _cell_volume ? _cell_formula_units_Z 2 _cell_measurement_temperature 878 _diffrn_radiation_type neutron _diffrn_radiation_wavelength ? _refine_ls_R_factor_all ? loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Ta .0 .0 .0 Na .0 .5 .5 O1 .0 .0 .5 O2 .2713(2) .2287(2) .0