# generated using pymatgen data_Er4LuIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.68893506 _cell_length_b 10.68893506 _cell_length_c 6.27681780 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Er4LuIr3 _chemical_formula_sum 'Er16 Lu4 Ir12' _cell_volume 717.14735240 _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 0.29051882 0.08710147 0.38078423 1.0 Er Er1 1 0.29051882 0.91289853 0.88078423 1.0 Er Er2 1 0.70948118 0.08710147 0.88078423 1.0 Er Er3 1 0.70948118 0.91289853 0.38078423 1.0 Er Er4 1 0.58710147 0.79051882 0.88078423 1.0 Er Er5 1 0.58710147 0.20948118 0.38078423 1.0 Er Er6 1 0.41289853 0.79051882 0.38078423 1.0 Er Er7 1 0.41289853 0.20948118 0.88078423 1.0 Er Er8 1 0.20948118 0.41289853 0.61921577 1.0 Er Er9 1 0.20948118 0.58710147 0.11921577 1.0 Er Er10 1 0.79051882 0.41289853 0.11921577 1.0 Er Er11 1 0.79051882 0.58710147 0.61921577 1.0 Er Er12 1 0.91289853 0.70948118 0.11921577 1.0 Er Er13 1 0.91289853 0.29051882 0.61921577 1.0 Er Er14 1 0.08710147 0.70948118 0.61921577 1.0 Er Er15 1 0.08710147 0.29051882 0.11921577 1.0 Lu Lu16 1 0.00000000 0.00000000 0.50000000 1.0 Lu Lu17 1 0.00000000 0.00000000 0.00000000 1.0 Lu Lu18 1 0.50000000 0.50000000 0.00000000 1.0 Lu Lu19 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir20 1 0.84771857 0.15228143 0.25000000 1.0 Ir Ir21 1 0.84771857 0.84771857 0.75000000 1.0 Ir Ir22 1 0.15228143 0.15228143 0.75000000 1.0 Ir Ir23 1 0.15228143 0.84771857 0.25000000 1.0 Ir Ir24 1 0.65228143 0.34771857 0.75000000 1.0 Ir Ir25 1 0.65228143 0.65228143 0.25000000 1.0 Ir Ir26 1 0.34771857 0.34771857 0.25000000 1.0 Ir Ir27 1 0.34771857 0.65228143 0.75000000 1.0 Ir Ir28 1 0.50000000 0.00000000 0.12668100 1.0 Ir Ir29 1 0.50000000 0.00000000 0.62668100 1.0 Ir Ir30 1 0.00000000 0.50000000 0.87331900 1.0 Ir Ir31 1 0.00000000 0.50000000 0.37331900 1.0