#------------------------------------------------------------------------------ #$Date: 2015-09-08 22:56:24 +0300 (Tue, 08 Sep 2015) $ #$Revision: 155358 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/53/02/1530286.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_1530286 loop_ _publ_author_name 'Lii, K.-H.' 'Wang, C.-C.' 'Chiang, R.K.' 'Wang, S.-L.' _publ_section_title ; The Structure of Cs V (M O4)2 ; _journal_name_full 'Journal of Solid State Chemistry' _journal_page_first 144 _journal_page_last 148 _journal_volume 80 _journal_year 1989 _chemical_formula_sum 'Cs Mo2 O8 V' _chemical_name_systematic 'Cs V (Mo O4)2' _space_group_IT_number 164 _symmetry_space_group_name_Hall '-P 3 2"' _symmetry_space_group_name_H-M 'P -3 m 1' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 1 _cell_length_a 5.662 _cell_length_b 5.662 _cell_length_c 7.976 _cell_volume 221.440 _citation_journal_id_ASTM JSSCBI _cod_data_source_file Lii_JSSCBI_1989_1791.cif _cod_data_source_block Cs1Mo2O8V1 _cod_original_cell_volume 221.4397 _cod_chemical_formula_sum_orig 'Cs1 Mo2 O8 V1' _cod_database_code 1530286 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x-y,z -x+y,-x,z y,x,-z -x,-x+y,-z x-y,-y,-z -x,-y,-z y,-x+y,-z x-y,x,-z -y,-x,z x,x-y,z -x+y,y,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 Mo1 Mo+6 0.6667 0.3333 0.28729 1 0.0 V1 V+3 0 0 0.5 1 0.0 O2 O-2 0.6667 0.3333 0.0735 1 0.0 Cs1 Cs+1 0 0 0 1 0.0 O1 O-2 0.1627 -0.1627 0.6445 1 0.0