#------------------------------------------------------------------------------ #$Date: 2015-10-14 12:39:43 +0300 (Wed, 14 Oct 2015) $ #$Revision: 168259 $ #$URL: file:///home/coder/svn-repositories/cod/cif/8/10/42/8104284.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_8104284 loop_ _publ_author_name 'Toraya, H.' 'Marumo, F.' 'Iwai, S.I.' 'Daimon, M.' 'Kondo, R.' _publ_section_title ; The crystal structure of tetrasilicic potassium fluor mica, K Mg2.5 Si4 O10 F2 ; _journal_name_full ; Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) ; _journal_page_first 42 _journal_page_last 52 _journal_volume 144 _journal_year 1976 _chemical_formula_sum 'F2 K0.88 Mg2.5 O10 Si4' _chemical_name_systematic 'K0.88 Mg2.5 Si4 O10 F2' _space_group_IT_number 12 _symmetry_space_group_name_Hall '-C 2y' _symmetry_space_group_name_H-M 'C 1 2/m 1' _cell_angle_alpha 90 _cell_angle_beta 99.89 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 5.253 _cell_length_b 9.086 _cell_length_c 10.159 _cell_volume 477.671 _citation_journal_id_ASTM ZEKGAX _cod_data_source_file Toraya_ZEKGAX_1976_625.cif _cod_data_source_block F2K0.88Mg2.5O10Si4 _cod_original_cell_volume 477.6709 _cod_database_code 8104284 loop_ _symmetry_equiv_pos_as_xyz x,y,z -x,y,-z -x,-y,-z x,-y,z x+1/2,y+1/2,z -x+1/2,y+1/2,-z -x+1/2,-y+1/2,-z x+1/2,-y+1/2,z loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv K1 K+1 0 0.5 0 0.884 0.0 O2 O-2 0.3088 0.2466 0.1666 1 0.0 O1 O-2 0.0476 0 0.1669 1 0.0 O3 O-2 0.1291 0.1667 0.3873 1 0.0 F1 F-1 0.6333 0 0.3978 1 0.0 Mg2 Mg+2 0 0.3336 0.5 0.852 0.0 Si1 Si+4 0.0757 0.16665 0.22724 1 0.0 Mg1 Mg+2 0 0 0.5 0.852 0.0