#------------------------------------------------------------------------------ #$Date: 2010-01-30 13:59:17 +0000 (Sat, 30 Jan 2010) $ #$Revision: 966 $ #$URL: svn://www.crystallography.net/cod/cif/1/1010668.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_1010668 _chemical_name_systematic 'Ammonium dodecatungstoborate 66-hydrate' _chemical_formula_structural '(N H4)5 B W12 O40 (H2 O)26' _chemical_formula_sum 'H72 B N5 O66 W12' _publ_section_title ; Untersuchungen ueber das Kristallgitter von Heteropoly-saeuren und deren Salzen ; loop_ _publ_author_name 'Kraus, O' _journal_name_full ; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) ; _journal_coden_ASTM ZEKGAX _journal_volume 91 _journal_year 1935 _journal_page_first 402 _journal_page_last 409 _cell_length_a 12.8 _cell_length_b 12.8 _cell_length_c 18.4 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 3014.7 _cell_formula_units_Z 2 _exptl_crystal_density_meas 3.76 _symmetry_space_group_name_H-M 'P 4/m n c' _symmetry_Int_Tables_number 128 _symmetry_cell_setting tetragonal loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '-x,-y,z' '1/2+x,1/2-y,1/2+z' '1/2-x,1/2+y,1/2+z' '-y,x,z' 'y,-x,z' '1/2+y,1/2+x,1/2+z' '1/2-y,1/2-x,1/2+z' '-x,-y,-z' 'x,y,-z' '1/2-x,1/2+y,1/2-z' '1/2+x,1/2-y,1/2-z' 'y,-x,-z' '-y,x,-z' '1/2-y,1/2-x,1/2-z' '1/2+y,1/2+x,1/2-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z ? ? ? ? _cod_database_code 1010668