# generated using pymatgen data_Lu12Tc3Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.09951333 _cell_length_b 7.28187594 _cell_length_c 8.81825921 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.11453528 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu12Tc3Ir _chemical_formula_sum 'Lu12 Tc3 Ir1' _cell_volume 391.67013074 _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 0.33805239 0.67506055 0.06352943 1.0 Lu Lu1 1 0.15810594 0.17550007 0.43659879 1.0 Lu Lu2 1 0.66103936 0.32404869 0.56122630 1.0 Lu Lu3 1 0.83966070 0.82531085 0.93807833 1.0 Lu Lu4 1 0.66103936 0.32404869 0.93877370 1.0 Lu Lu5 1 0.83966070 0.82531085 0.56192167 1.0 Lu Lu6 1 0.33805239 0.67506055 0.43647057 1.0 Lu Lu7 1 0.15810594 0.17550007 0.06340121 1.0 Lu Lu8 1 0.87574700 0.54374282 0.25000000 1.0 Lu Lu9 1 0.62476323 0.04042461 0.25000000 1.0 Lu Lu10 1 0.13034209 0.45447503 0.75000000 1.0 Lu Lu11 1 0.37283295 0.95942549 0.75000000 1.0 Tc Tc12 1 0.03980250 0.88342069 0.25000000 1.0 Tc Tc13 1 0.46449054 0.38502689 0.25000000 1.0 Tc Tc14 1 0.95976230 0.11623651 0.75000000 1.0 Ir Ir15 1 0.53854261 0.61740763 0.75000000 1.0