# generated using pymatgen data_Lu12TcIr3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.14366661 _cell_length_b 8.85120811 _cell_length_c 6.19536343 _cell_angle_alpha 90.00000000 _cell_angle_beta 89.92962687 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu12TcIr3 _chemical_formula_sum 'Lu12 Tc1 Ir3' _cell_volume 391.73302869 _cell_formula_units_Z 1 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 Lu Lu0 1 0.53668465 0.75000000 0.12435992 1.0 Lu Lu1 1 0.82517798 0.06241426 0.17214328 1.0 Lu Lu2 1 0.82517798 0.43758574 0.17214328 1.0 Lu Lu3 1 0.32495568 0.06220479 0.32569597 1.0 Lu Lu4 1 0.32495568 0.43779521 0.32569597 1.0 Lu Lu5 1 0.03825199 0.75000000 0.37572382 1.0 Lu Lu6 1 0.96375060 0.25000100 0.61811316 1.0 Lu Lu7 1 0.67586680 0.56079027 0.67470222 1.0 Lu Lu8 1 0.67586680 0.93921073 0.67470222 1.0 Lu Lu9 1 0.17404014 0.56010479 0.82951298 1.0 Lu Lu10 1 0.17404014 0.93989621 0.82951298 1.0 Lu Lu11 1 0.46163174 0.25000100 0.87699636 1.0 Tc Tc12 1 0.11378084 0.25000100 0.03224813 1.0 Ir Ir13 1 0.61458221 0.25000100 0.46686271 1.0 Ir Ir14 1 0.38712308 0.75000000 0.53707678 1.0 Ir Ir15 1 0.88411467 0.75000000 0.96450921 1.0