#------------------------------------------------------------------------------ #$Date: 2015-07-13 02:22:08 +0300 (Mon, 13 Jul 2015) $ #$Revision: 148565 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/52/71/1527181.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_1527181 loop_ _publ_author_name 'Brachtel, G.' 'Hoppe, R.' _publ_section_title ; Das erste Oxomanganat(II): Na14 Mn2 O9= Na14 (Mn O4)2 O ; _journal_name_full 'Zeitschrift fuer Anorganische und Allgemeine Chemie' _journal_page_first 97 _journal_page_last 104 _journal_volume 438 _journal_year 1978 _chemical_formula_sum 'Mn2 Na14 O9' _chemical_name_systematic 'Na14 Mn2 O9' _space_group_IT_number 147 _symmetry_space_group_name_Hall '-P 3' _symmetry_space_group_name_H-M 'P -3' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_formula_units_Z 1 _cell_length_a 6.669 _cell_length_b 6.669 _cell_length_c 9.353 _cell_volume 360.249 _citation_journal_id_ASTM ZAACAB _cod_data_source_file Brachtel_ZAACAB_1978_1585.cif _cod_data_source_block Mn2Na14O9 _cod_original_cell_volume 360.2492 _cod_database_code 1527181 loop_ _symmetry_equiv_pos_as_xyz x,y,z -y,x-y,z -x+y,-x,z -x,-y,-z y,-x+y,-z x-y,x,-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 Na1 Na+1 0 0 0.2517 1 0.0 Na2 Na+1 0.0673 0.3762 0.5911 1 0.0 O1 O-2 0.3333 0.6667 0.0389 1 0.0 O3 O-2 0.9469 0.6411 0.6629 1 0.0 Mn1 Mn+2 0.3333 0.6667 0.2618 1 0.0 Na3 Na+1 0.6808 0.6393 0.0911 1 0.0 O2 O-2 0 0 0 1 0.0