data_global _chemical_name_mineral 'Galkhaite' loop_ _publ_author_name 'Divjakovic V' 'Nowacki W' _journal_name_full 'Neues Jahrbuch fur Mineralogie, Monatshefte' _journal_volume 1975 _journal_year 1975 _journal_page_first 291 _journal_page_last 293 _publ_section_title ; Die kristallstruktur von galchait [Hg0.76(Cu,Zn)0.24]12Tl0.96(AsS3)8 ; _database_code_amcsd 0014754 _chemical_compound_source 'Getchell mine, Humboldt County, Nevada, USA' _chemical_formula_sum '(Hg4.56 Cu.72 Zn.72) Tl As4 S12' _cell_length_a 10.379 _cell_length_b 10.379 _cell_length_c 10.379 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 1118.064 _exptl_crystal_density_diffrn 5.633 _symmetry_space_group_name_H-M 'I -4 3 m' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,1/2+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' '-x,y,-z' '1/2-x,1/2+y,1/2-z' 'x,-z,-y' '1/2+x,1/2-z,1/2-y' 'z,-y,-x' '1/2+z,1/2-y,1/2-x' 'y,-x,-z' '1/2+y,1/2-x,1/2-z' 'x,z,y' '1/2+x,1/2+z,1/2+y' 'z,y,x' '1/2+z,1/2+y,1/2+x' 'y,x,z' '1/2+y,1/2+x,1/2+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' '-x,-y,z' '1/2-x,1/2-y,1/2+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' 'x,-y,-z' '1/2+x,1/2-y,1/2-z' '-x,z,-y' '1/2-x,1/2+z,1/2-y' '-z,y,-x' '1/2-z,1/2+y,1/2-x' '-y,x,-z' '1/2-y,1/2+x,1/2-z' '-x,-z,y' '1/2-x,1/2-z,1/2+y' '-z,-y,x' '1/2-z,1/2-y,1/2+x' '-y,-x,z' '1/2-y,1/2-x,1/2+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 Hg 0.25000 0.50000 0.00000 0.76000 0.04445 Cu 0.25000 0.50000 0.00000 0.12000 0.04445 Zn 0.25000 0.50000 0.00000 0.12000 0.04445 Tl 0.00000 0.00000 0.00000 1.00000 0.07498 As 0.24560 0.24560 0.24560 1.00000 0.02622 S 0.38840 0.38840 0.16290 1.00000 0.03470 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 Hg 0.06931 0.03220 0.03220 0.00000 0.00000 0.00000 Cu 0.06931 0.03220 0.03220 0.00000 0.00000 0.00000 Zn 0.06931 0.03220 0.03220 0.00000 0.00000 0.00000 Tl 0.07477 0.07477 0.07477 0.00000 0.00000 0.00000 As 0.02620 0.02620 0.02620 -0.00164 -0.00164 -0.00164 S 0.03766 0.03766 0.02838 -0.00764 0.00055 0.00055