data_global _chemical_name_mineral 'Yafsoanite' loop_ _publ_author_name 'Rozhdestvenskaya I V' 'Zajakina N V' 'Kim A A' _journal_name_full 'Mineralogiceskij Zhurnal' _journal_volume 6 _journal_year 1984 _journal_page_first 75 _journal_page_last 79 _publ_section_title ; Crystal structure of a zinc calcium tellurate - yafsoanite ; _database_code_amcsd 0014606 _chemical_formula_sum 'Zn2.61 Pb.51 Te2.09 Ca2.64 O12' _cell_length_a 12.621 _cell_length_b 12.621 _cell_length_c 12.621 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 2010.395 _exptl_crystal_density_diffrn 5.556 _symmetry_space_group_name_H-M 'I 41 3 2' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,1/2+z' '-z,1/2+x,1/2-y' '1/2-z,+x,-y' '-y,1/2+z,1/2-x' '1/2-y,+z,-x' '-x,1/2+y,1/2-z' '1/2-x,+y,-z' '3/4-x,1/4+z,3/4+y' '1/4-x,3/4+z,1/4+y' '3/4-z,1/4+y,3/4+x' '1/4-z,3/4+y,1/4+x' '3/4-y,1/4+x,3/4+z' '1/4-y,3/4+x,1/4+z' '1/4-x,1/4-z,1/4-y' '3/4-x,3/4-z,3/4-y' '1/4-z,1/4-y,1/4-x' '3/4-z,3/4-y,3/4-x' '1/4-y,1/4-x,1/4-z' '3/4-y,3/4-x,3/4-z' '1/2-z,-x,1/2+y' '-z,1/2-x,+y' '1/2-y,-z,1/2+x' '-y,1/2-z,+x' '1/2-x,-y,1/2+z' '-x,1/2-y,+z' '1/2+z,1/2-x,-y' '+z,-x,1/2-y' '1/2+y,1/2-z,-x' '+y,-z,1/2-x' '1/2+x,1/2-y,-z' '+x,-y,1/2-z' '3/4+x,3/4-z,1/4+y' '1/4+x,1/4-z,3/4+y' '3/4+z,3/4-y,1/4+x' '1/4+z,1/4-y,3/4+x' '3/4+y,3/4-x,1/4+z' '1/4+y,1/4-x,3/4+z' '1/4+x,3/4+z,3/4-y' '3/4+x,1/4+z,1/4-y' '1/4+z,3/4+y,3/4-x' '3/4+z,1/4+y,1/4-x' '1/4+y,3/4+x,3/4-z' '3/4+y,1/4+x,1/4-z' 'z,x,y' '1/2+z,1/2+x,1/2+y' 'y,z,x' '1/2+y,1/2+z,1/2+x' 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 Zn 0.24057 0.00943 0.12500 0.87000 0.00975 Pb 0.24057 0.00943 0.12500 0.09000 0.00975 Te 0.24057 0.00943 0.12500 0.02000 0.00975 Ca 0.25250 0.50250 0.12500 0.88000 0.00798 Pb 0.25250 0.50250 0.12500 0.08000 0.00798 Te 0.25250 0.50250 0.12500 0.01000 0.00798 Te 0.00443 0.00443 0.00443 1.00000 0.00887 O1 0.13980 -0.03850 -0.02600 1.00000 0.01127 O2 0.85750 0.05880 0.03140 1.00000 0.01469 loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Zn 0.00734 0.00734 0.02001 -0.00140 0.00000 0.00000 Pb 0.00734 0.00734 0.02001 -0.00140 0.00000 0.00000 Te 0.00734 0.00734 0.02001 -0.00140 0.00000 0.00000 Ca 0.00418 0.00418 0.00747 0.01355 0.00000 0.00000 Pb 0.00418 0.00418 0.00747 0.01355 0.00000 0.00000 Te 0.00418 0.00418 0.00747 0.01355 0.00000 0.00000 O1 0.00316 0.02191 0.00709 -0.00608 -0.00507 0.00203 O2 0.01241 0.01697 0.01368 0.00621 0.00013 0.00316