# generated using pymatgen data_KHg11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.15438128 _cell_length_b 10.15438128 _cell_length_c 10.15438128 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural KHg11 _chemical_formula_sum 'K3 Hg33' _cell_volume 1047.03307085 _cell_formula_units_Z 3 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 -0.00000000 0.50000000 0.00000000 1.0 K K1 1 -0.00000000 -0.00000000 0.50000000 1.0 K K2 1 0.50000000 -0.00000000 0.00000000 1.0 Hg Hg3 1 0.15260792 0.15260792 0.84739208 1.0 Hg Hg4 1 0.84739208 0.15260792 0.15260792 1.0 Hg Hg5 1 0.84739208 0.84739208 0.15260792 1.0 Hg Hg6 1 0.15260792 0.84739208 0.84739208 1.0 Hg Hg7 1 0.84739208 0.15260792 0.84739208 1.0 Hg Hg8 1 0.84739208 0.84739208 0.84739208 1.0 Hg Hg9 1 0.34448896 0.34448896 0.00000000 1.0 Hg Hg10 1 0.34448896 -0.00000000 0.34448896 1.0 Hg Hg11 1 0.34448896 -0.00000000 0.65551104 1.0 Hg Hg12 1 -0.00000000 0.34448896 0.65551104 1.0 Hg Hg13 1 -0.00000000 0.34448896 0.34448896 1.0 Hg Hg14 1 0.65551104 0.34448896 0.00000000 1.0 Hg Hg15 1 0.34448896 0.65551104 0.00000000 1.0 Hg Hg16 1 0.65551104 -0.00000000 0.34448896 1.0 Hg Hg17 1 -0.00000000 0.65551104 0.65551104 1.0 Hg Hg18 1 0.65551104 -0.00000000 0.65551104 1.0 Hg Hg19 1 -0.00000000 0.65551104 0.34448896 1.0 Hg Hg20 1 0.65551104 0.65551104 0.00000000 1.0 Hg Hg21 1 0.26627899 0.26627899 0.50000000 1.0 Hg Hg22 1 0.26627899 0.50000000 0.26627899 1.0 Hg Hg23 1 0.26627899 0.50000000 0.73372101 1.0 Hg Hg24 1 0.50000000 0.26627899 0.73372101 1.0 Hg Hg25 1 0.50000000 0.26627899 0.26627899 1.0 Hg Hg26 1 0.73372101 0.26627899 0.50000000 1.0 Hg Hg27 1 0.26627899 0.73372101 0.50000000 1.0 Hg Hg28 1 0.73372101 0.50000000 0.26627899 1.0 Hg Hg29 1 0.50000000 0.73372101 0.73372101 1.0 Hg Hg30 1 0.73372101 0.50000000 0.73372101 1.0 Hg Hg31 1 0.50000000 0.73372101 0.26627899 1.0 Hg Hg32 1 0.73372101 0.73372101 0.50000000 1.0 Hg Hg33 1 0.15260792 0.84739208 0.15260792 1.0 Hg Hg34 1 0.15260792 0.15260792 0.15260792 1.0 Hg Hg35 1 0.50000000 0.50000000 0.50000000 1.0