# generated using pymatgen data_Lu2Al6(GaIr)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.43880213 _cell_length_b 7.43880200 _cell_length_c 9.43816634 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.79447411 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu2Al6(GaIr)3 _chemical_formula_sum 'Lu4 Al12 Ga6 Ir6' _cell_volume 453.23138380 _cell_formula_units_Z 2 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 0.99875153 0.66998773 0.25000000 1.0 Lu Lu1 1 0.00124847 0.33001227 0.75000000 1.0 Lu Lu2 1 0.66998773 0.99875153 0.25000000 1.0 Lu Lu3 1 0.33001227 0.00124847 0.75000000 1.0 Al Al4 1 0.00252800 0.33421733 0.07265186 1.0 Al Al5 1 0.99747200 0.66578267 0.92734814 1.0 Al Al6 1 0.99747200 0.66578267 0.57265186 1.0 Al Al7 1 0.33421733 0.00252800 0.42734814 1.0 Al Al8 1 0.00252800 0.33421733 0.42734814 1.0 Al Al9 1 0.66578267 0.99747200 0.57265186 1.0 Al Al10 1 0.66578267 0.99747200 0.92734814 1.0 Al Al11 1 0.33421733 0.00252800 0.07265186 1.0 Al Al12 1 0.33479836 0.33479836 0.56173084 1.0 Al Al13 1 0.66520164 0.66520164 0.43826916 1.0 Al Al14 1 0.66520164 0.66520164 0.06173084 1.0 Al Al15 1 0.33479836 0.33479836 0.93826916 1.0 Ga Ga16 1 0.12776694 0.12776694 0.25000000 1.0 Ga Ga17 1 0.87223306 0.87223306 0.75000000 1.0 Ga Ga18 1 0.33769740 0.54773253 0.25000000 1.0 Ga Ga19 1 0.66230260 0.45226747 0.75000000 1.0 Ga Ga20 1 0.54773253 0.33769740 0.25000000 1.0 Ga Ga21 1 0.45226747 0.66230260 0.75000000 1.0 Ir Ir22 1 0.67217376 0.32782624 0.00000000 1.0 Ir Ir23 1 0.32782624 0.67217376 0.00000000 1.0 Ir Ir24 1 0.32782624 0.67217376 0.50000000 1.0 Ir Ir25 1 0.67217376 0.32782624 0.50000000 1.0 Ir Ir26 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir27 1 0.00000000 0.00000000 0.50000000 1.0