#------------------------------------------------------------------------------ #$Date: 2009-04-21 15:31:11 +0100 (Tue, 21 Apr 2009) $ #$Revision: 665 $ #$URL: svn://www.crystallography.net/cod/cif/2/2000504.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_2000504 loop_ _publ_author_name 'Leclaire, A.' 'Borel, M. M.' 'Chardon, J.' 'Grandin, A.' 'Raveau, B.' _publ_section_title ; A niobium silicophosphate belonging to the niobium phosphate bronze series: K~4~Nb~8~P~4~SiO~34~ ; _journal_issue 10 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 1744 _journal_page_last 1747 _journal_volume 48 _journal_year 1992 _chemical_formula_sum 'K4 Nb8 O34 P4 Si1' _chemical_formula_weight 1595.6 _symmetry_cell_setting tetragonal _symmetry_space_group_name_Hall 'P -4 -2' _symmetry_space_group_name_H-M 'P -4 m 2' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 1 _cell_length_a 10.6050(9) _cell_length_b 10.6050(9) _cell_length_c 6.4099(5) _cell_volume 720.90(10) _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71073 _exptl_absorpt_coefficient_mu 3.90 _exptl_crystal_density_diffrn 3.67 _exptl_crystal_F_000 750 _[local]_cod_data_source_file du0309.cif _[local]_cod_data_source_block du0309a loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Nb(1) .500 .18470(10) .20350(10) Nb(2) .17750(5) .178 .000 Si .500 .500 .000 P .23970(10) .240 .500 K(1) .000 .000 .500 K(2) .000 .500 .2923(8) K(3) .500 .500 .500 O(1) .500 .000 .261(2) O(2) .3638(4) .1747(5) .0215(8) O(3) .3790(4) .2154(5) .4530(7) O(4) .500 .3819(7) .1450(10) O(5) .1756(8) .000 .0320(10) O(6) .1586(4) .1982(4) .3115(6)