#------------------------------------------------------------------------------ #$Date: 2011-09-10 04:16:28 +0100 (Sat, 10 Sep 2011) $ #$Revision: 25271 $ #$URL: svn://www.crystallography.net/cod/cif/2/2000337.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2000337 loop_ _publ_author_name 'Teller, R. G.' _publ_section_title ; Refinement of some Na~0.5{-~x}M'~0.5+x~/3\\square ~2x~/3MoO~4~, M' = Bi, Ce, La, scheelite structures with powder neutron and X-ray diffraction data ; _journal_issue 12 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 2101 _journal_page_last 2104 _journal_volume 48 _journal_year 1992 _chemical_formula_sum 'Bi Mo Na O4' _chemical_formula_weight 275.92 _symmetry_cell_setting tetragonal _symmetry_space_group_name_Hall 'I 4bw -1bw' _symmetry_space_group_name_H-M 'I 41/a {origin @ -4}' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 5.27170(10) _cell_length_b 5.27170(10) _cell_length_c 11.5801(2) _cell_volume 321.820(10) _diffrn_radiation_type Cu _diffrn_radiation_wavelength 1.54154 _exptl_crystal_density_diffrn 5.69 _[local]_cod_data_source_file cr0345.cif _[local]_cod_data_source_block cr0345a _[local]_cod_chemical_formula_sum_orig 'Bi1 Mo1 Na1 O4' _cod_original_cell_volume 321.824(5) _cod_database_code 2000337 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z O .1488(2) .0094(2) .20900(10) Mo .0 .25 .125 Bi .0 0.25 .625 loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance Mo O 1.7810(10) Bi O 2.4860(10)