#------------------------------------------------------------------------------ #$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $ #$Revision: 14 $ #$URL: svn://www.crystallography.net/cod/cif/9/9000267.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_9000267 _chemical_name 'Forsterite' loop_ _publ_author_name 'Baur W H' _journal_name_full "American Mineralogist" _journal_volume 57 _journal_year 1972 _journal_page_first 709 _journal_page_last 731 _publ_section_title ; Computer-simulated crystal structures of observed and hypothetical Mg2SiO4 polymorphs of low and high density ; _chemical_formula_sum 'Si Mg2 O4' _cell_length_a 4.79 _cell_length_b 10.19 _cell_length_c 5.85 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 285.539 _symmetry_space_group_name_H-M 'P b n m' loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' 'x,y,1/2-z' '-x,-y,1/2+z' '1/2+x,1/2-y,1/2+z' '1/2-x,1/2+y,1/2-z' '1/2-x,1/2+y,z' '1/2+x,1/2-y,-z' '-x,-y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Si 0.09450 0.40780 0.25000 Mg1 0.00000 0.00000 0.00000 Mg2 0.00560 0.26320 0.75000 O1 0.24990 0.09070 0.75000 O2 0.28320 0.05780 0.25000 O3 0.23120 0.33700 0.47070