# generated using pymatgen data_K4Hg3Ge20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.11321110 _cell_length_b 11.11321110 _cell_length_c 11.11321110 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural K4Hg3Ge20 _chemical_formula_sum 'K8 Hg6 Ge40' _cell_volume 1372.52003315 _cell_formula_units_Z 2 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy K K0 1 0.25000000 0.00000000 0.50000000 1.0 K K1 1 0.75000000 0.00000000 0.50000000 1.0 K K2 1 0.50000000 0.25000000 0.00000000 1.0 K K3 1 0.50000000 0.75000000 0.00000000 1.0 K K4 1 -0.00000000 0.50000000 0.25000000 1.0 K K5 1 -0.00000000 0.50000000 0.75000000 1.0 K K6 1 -0.00000000 0.00000000 0.00000000 1.0 K K7 1 0.50000000 0.50000000 0.50000000 1.0 Hg Hg8 1 0.25000000 0.50000000 0.00000000 1.0 Hg Hg9 1 0.75000000 0.50000000 0.00000000 1.0 Hg Hg10 1 -0.00000000 0.25000000 0.50000000 1.0 Hg Hg11 1 -0.00000000 0.75000000 0.50000000 1.0 Hg Hg12 1 0.50000000 0.00000000 0.25000000 1.0 Hg Hg13 1 0.50000000 0.00000000 0.75000000 1.0 Ge Ge14 1 0.18299684 0.18299684 0.18299684 1.0 Ge Ge15 1 0.81700316 0.81700316 0.81700316 1.0 Ge Ge16 1 0.81700316 0.81700316 0.18299684 1.0 Ge Ge17 1 0.81700316 0.18299684 0.81700316 1.0 Ge Ge18 1 0.68299684 0.68299684 0.31700316 1.0 Ge Ge19 1 0.18299684 0.18299684 0.81700316 1.0 Ge Ge20 1 0.18299684 0.81700316 0.18299684 1.0 Ge Ge21 1 0.31700316 0.31700316 0.68299684 1.0 Ge Ge22 1 0.18299684 0.81700316 0.81700316 1.0 Ge Ge23 1 0.31700316 0.31700316 0.31700316 1.0 Ge Ge24 1 0.81700316 0.18299684 0.18299684 1.0 Ge Ge25 1 0.68299684 0.68299684 0.68299684 1.0 Ge Ge26 1 0.68299684 0.31700316 0.68299684 1.0 Ge Ge27 1 0.31700316 0.68299684 0.31700316 1.0 Ge Ge28 1 0.31700316 0.68299684 0.68299684 1.0 Ge Ge29 1 0.68299684 0.31700316 0.31700316 1.0 Ge Ge30 1 -0.00000000 0.11337323 0.30147132 1.0 Ge Ge31 1 -0.00000000 0.88662677 0.69852868 1.0 Ge Ge32 1 -0.00000000 0.88662677 0.30147132 1.0 Ge Ge33 1 -0.00000000 0.11337323 0.69852868 1.0 Ge Ge34 1 0.30147132 0.00000000 0.11337323 1.0 Ge Ge35 1 0.61337323 0.50000000 0.19852868 1.0 Ge Ge36 1 0.69852868 0.00000000 0.88662677 1.0 Ge Ge37 1 0.38662677 0.50000000 0.80147132 1.0 Ge Ge38 1 0.30147132 0.00000000 0.88662677 1.0 Ge Ge39 1 0.38662677 0.50000000 0.19852868 1.0 Ge Ge40 1 0.69852868 0.00000000 0.11337323 1.0 Ge Ge41 1 0.61337323 0.50000000 0.80147132 1.0 Ge Ge42 1 0.11337323 0.30147132 0.00000000 1.0 Ge Ge43 1 0.50000000 0.80147132 0.38662677 1.0 Ge Ge44 1 0.88662677 0.69852868 0.00000000 1.0 Ge Ge45 1 0.50000000 0.19852868 0.61337323 1.0 Ge Ge46 1 0.11337323 0.69852868 0.00000000 1.0 Ge Ge47 1 0.50000000 0.19852868 0.38662677 1.0 Ge Ge48 1 0.88662677 0.30147132 0.00000000 1.0 Ge Ge49 1 0.50000000 0.80147132 0.61337323 1.0 Ge Ge50 1 0.19852868 0.61337323 0.50000000 1.0 Ge Ge51 1 0.80147132 0.38662677 0.50000000 1.0 Ge Ge52 1 0.19852868 0.38662677 0.50000000 1.0 Ge Ge53 1 0.80147132 0.61337323 0.50000000 1.0