# generated using pymatgen data_ErLu4HgBi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.00586253 _cell_length_b 9.20035629 _cell_length_c 11.81176451 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErLu4HgBi2 _chemical_formula_sum 'Er4 Lu16 Hg4 Bi8' _cell_volume 870.01663074 _cell_formula_units_Z 4 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 Er Er0 1 0.31894057 0.25000000 0.21313133 1.0 Er Er1 1 0.81894057 0.25000000 0.28686867 1.0 Er Er2 1 0.68105943 0.75000000 0.78686867 1.0 Er Er3 1 0.18105943 0.75000000 0.71313133 1.0 Lu Lu4 1 0.34734831 0.75000000 0.20765077 1.0 Lu Lu5 1 0.84734831 0.75000000 0.29234923 1.0 Lu Lu6 1 0.65265169 0.25000000 0.79234923 1.0 Lu Lu7 1 0.15265169 0.25000000 0.70765077 1.0 Lu Lu8 1 0.68755926 0.56064531 0.05932731 1.0 Lu Lu9 1 0.18755926 0.93935469 0.44067269 1.0 Lu Lu10 1 0.31244074 0.06064531 0.94067269 1.0 Lu Lu11 1 0.81244074 0.43935469 0.55932731 1.0 Lu Lu12 1 0.31244074 0.43935469 0.94067269 1.0 Lu Lu13 1 0.81244074 0.06064531 0.55932731 1.0 Lu Lu14 1 0.68755926 0.93935469 0.05932731 1.0 Lu Lu15 1 0.18755926 0.56064531 0.44067269 1.0 Lu Lu16 1 0.46278155 0.25000000 0.49279719 1.0 Lu Lu17 1 0.96278155 0.25000000 0.00720281 1.0 Lu Lu18 1 0.53721845 0.75000000 0.50720281 1.0 Lu Lu19 1 0.03721845 0.75000000 0.99279719 1.0 Hg Hg20 1 0.40884437 0.75000000 0.96409739 1.0 Hg Hg21 1 0.90884437 0.75000000 0.53590261 1.0 Hg Hg22 1 0.59115563 0.25000000 0.03590261 1.0 Hg Hg23 1 0.09115563 0.25000000 0.46409739 1.0 Bi Bi24 1 0.55543580 0.99901719 0.32369260 1.0 Bi Bi25 1 0.05543580 0.50098281 0.17630740 1.0 Bi Bi26 1 0.44456420 0.49901719 0.67630740 1.0 Bi Bi27 1 0.94456420 0.00098281 0.82369260 1.0 Bi Bi28 1 0.44456420 0.00098281 0.67630740 1.0 Bi Bi29 1 0.94456420 0.49901719 0.82369260 1.0 Bi Bi30 1 0.55543580 0.50098281 0.32369260 1.0 Bi Bi31 1 0.05543580 0.99901719 0.17630740 1.0