data_global _chemical_name_mineral 'Ecandrewsite' loop_ _publ_author_name 'Mitchell R H' 'Liferovich R P' _journal_name_full 'The Canadian Mineralogist' _journal_volume 42 _journal_year 2004 _journal_page_first 1871 _journal_page_last 1880 _publ_section_title ; The pyrophanite-ecandrewsite solid-solution: crystal structures of the Mn1-xZnxSiO3 series (0.1 <= x <= 0.8) Sample: x = .8, ilmenite structure ; _database_code_amcsd 0006000 _chemical_formula_sum '(Mn.2 Zn.8) Ti O3' _cell_length_a 5.08849 _cell_length_b 5.08849 _cell_length_c 13.9937 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 313.791 _exptl_crystal_density_diffrn 5.054 _symmetry_space_group_name_H-M 'R -3' loop_ _space_group_symop_operation_xyz 'x,y,z' '2/3+x,1/3+y,1/3+z' '1/3+x,2/3+y,2/3+z' 'y,-x+y,-z' '2/3+y,1/3-x+y,1/3-z' '1/3+y,2/3-x+y,2/3-z' '-x+y,-x,z' '2/3-x+y,1/3-x,1/3+z' '1/3-x+y,2/3-x,2/3+z' '-x,-y,-z' '2/3-x,1/3-y,1/3-z' '1/3-x,2/3-y,2/3-z' '-y,x-y,z' '2/3-y,1/3+x-y,1/3+z' '1/3-y,2/3+x-y,2/3+z' 'x-y,x,-z' '2/3+x-y,1/3+x,1/3-z' '1/3+x-y,2/3+x,2/3-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_U_iso_or_equiv Mn 0.00000 0.00000 0.36134 0.20000 0.00507 Zn 0.00000 0.00000 0.36134 0.80000 0.00507 Ti 0.00000 0.00000 0.14687 1.00000 0.00760 O 0.31952 0.02740 0.24300 1.00000 0.00633