# generated using pymatgen data_ErTh4Ir2Os _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.27158279 _cell_length_b 11.27158279 _cell_length_c 6.36577643 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErTh4Ir2Os _chemical_formula_sum 'Er4 Th16 Ir8 Os4' _cell_volume 808.76284643 _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 0.00000000 0.00000000 0.50000000 1.0 Er Er1 1 0.00000000 0.00000000 0.00000000 1.0 Er Er2 1 0.50000000 0.50000000 0.00000000 1.0 Er Er3 1 0.50000000 0.50000000 0.50000000 1.0 Th Th4 1 0.28952636 0.08882503 0.38998371 1.0 Th Th5 1 0.28952636 0.91117497 0.88998371 1.0 Th Th6 1 0.71047364 0.08882503 0.88998371 1.0 Th Th7 1 0.71047364 0.91117497 0.38998371 1.0 Th Th8 1 0.58882503 0.78952636 0.88998371 1.0 Th Th9 1 0.58882503 0.21047364 0.38998371 1.0 Th Th10 1 0.41117497 0.78952636 0.38998371 1.0 Th Th11 1 0.41117497 0.21047364 0.88998371 1.0 Th Th12 1 0.21047364 0.41117497 0.61001629 1.0 Th Th13 1 0.21047364 0.58882503 0.11001629 1.0 Th Th14 1 0.78952636 0.41117497 0.11001629 1.0 Th Th15 1 0.78952636 0.58882503 0.61001629 1.0 Th Th16 1 0.91117497 0.71047364 0.11001629 1.0 Th Th17 1 0.91117497 0.28952636 0.61001629 1.0 Th Th18 1 0.08882503 0.71047364 0.61001629 1.0 Th Th19 1 0.08882503 0.28952636 0.11001629 1.0 Ir Ir20 1 0.84735564 0.15264436 0.25000000 1.0 Ir Ir21 1 0.84735564 0.84735564 0.75000000 1.0 Ir Ir22 1 0.15264436 0.15264436 0.75000000 1.0 Ir Ir23 1 0.15264436 0.84735564 0.25000000 1.0 Ir Ir24 1 0.65264436 0.34735564 0.75000000 1.0 Ir Ir25 1 0.65264436 0.65264436 0.25000000 1.0 Ir Ir26 1 0.34735564 0.34735564 0.25000000 1.0 Ir Ir27 1 0.34735564 0.65264436 0.75000000 1.0 Os Os28 1 0.50000000 0.00000000 0.12732385 1.0 Os Os29 1 0.50000000 0.00000000 0.62732385 1.0 Os Os30 1 0.00000000 0.50000000 0.87267615 1.0 Os Os31 1 0.00000000 0.50000000 0.37267615 1.0