#------------------------------------------------------------------------------ #$Date: 2012-02-03 19:16:24 +0200 (Fri, 03 Feb 2012) $ #$Revision: 32112 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/10/13/2101317.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_2101317 loop_ _publ_author_name 'Marsh, R. E.' 'Bernal, I.' _publ_section_title ; More space-group changes ; _journal_issue 3 _journal_name_full 'Acta Crystallographica Section B' _journal_page_first 300 _journal_page_last 307 _journal_volume 51 _journal_year 1995 _chemical_formula_sum 'Cs6 O36 W11' _symmetry_cell_setting hexagonal _symmetry_space_group_name_Hall '-P 3* 2n' _symmetry_space_group_name_H-M 'R -3 cr {rhombohedral axes}' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 37.097 _cell_length_b 37.097 _cell_length_c 37.097 _cell_volume 51052.424 _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71073 _[local]_cod_data_source_file cr0484.cif _[local]_cod_data_source_block cr0484ka _cod_database_code 2101317 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv W(1) .5306(2) .0 .75 .0109(3) W(2) .0 .0 .44461(2) .0109(3) W(3) .4865(2) .4805(2) .138380(10) .0127(2) Cs(1) .0 .0 .34300(3) .0302(6) Cs(2) .0 .0 .38338(3) .0319(5) Cs(3) .0 .0 .77106(3) .0269(5) O(1) .201(4) .422(3) .09918(14) 1.2(3)* O(2) .110(4) .247(3) .02735(15) 1.6(3)* O(3) .463(4) .914(3) .11939(14) 1.3(3)* O(4) .543(4) .062(3) .15346(15) 1.7(3)* O(5) .465(4) .913(2) .07949(12) 0.7(2)* O(6) .422(3) .197(4) .13361(13) 0.9(3)*