#------------------------------------------------------------------------------ #$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $ #$Revision: 14 $ #$URL: svn://www.crystallography.net/cod/cif/9/9007719.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_9007719 _chemical_name 'Namansilite' loop_ _publ_author_name 'Ohashi H' 'Osawa T' 'Tsukimura K' _journal_name_full "Acta Crystallographica, Section C" _journal_volume 43 _journal_year 1987 _journal_page_first 605 _journal_page_last 607 _publ_section_title ; Refinement of the structure of manganese sodium dimetasilicate Locality: synthetic Note: pyroxene Note: anisoB's from ICSD ; _chemical_formula_sum 'Na Mn Si2 O6' _cell_length_a 9.513 _cell_length_b 8.621 _cell_length_c 5.354 _cell_angle_alpha 90 _cell_angle_beta 105.14 _cell_angle_gamma 90 _cell_volume 423.849 _symmetry_space_group_name_H-M 'C 1 2/c 1' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '1/2+x,1/2+y,z' 'x,-y,1/2+z' '1/2+x,1/2-y,1/2+z' '-x,y,1/2-z' '1/2-x,1/2+y,1/2-z' '-x,-y,-z' '1/2-x,1/2-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_Uiso_or_equiv NaM2 0.00000 0.29820 0.25000 0.00950 MnM1 0.00000 0.90578 0.25000 0.00317 Si 0.29402 0.08865 0.24630 0.00393 O1 0.11720 0.07610 0.16120 0.00595 O2 0.36090 0.25970 0.30380 0.00823 O3 0.35630 0.00800 0.01910 0.00671