# generated using pymatgen data_Lu4Ga17SiIr6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.47925030 _cell_length_b 7.47924968 _cell_length_c 9.29794138 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.12424049 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu4Ga17SiIr6 _chemical_formula_sum 'Lu4 Ga17 Si1 Ir6' _cell_volume 449.87148450 _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 0.99609420 0.67189404 0.25000000 1.0 Lu Lu1 1 0.00187378 0.33537843 0.75000000 1.0 Lu Lu2 1 0.67189404 0.99609420 0.25000000 1.0 Lu Lu3 1 0.33537843 0.00187378 0.75000000 1.0 Ga Ga4 1 0.87941978 0.87941978 0.75000000 1.0 Ga Ga5 1 0.99799797 0.33617754 0.08297661 1.0 Ga Ga6 1 0.00050557 0.66824706 0.91961886 1.0 Ga Ga7 1 0.00050557 0.66824706 0.58038114 1.0 Ga Ga8 1 0.33617754 0.99799797 0.41702339 1.0 Ga Ga9 1 0.99799797 0.33617754 0.41702339 1.0 Ga Ga10 1 0.66824706 0.00050557 0.58038114 1.0 Ga Ga11 1 0.66824706 0.00050557 0.91961886 1.0 Ga Ga12 1 0.33617754 0.99799797 0.08297661 1.0 Ga Ga13 1 0.32984894 0.32984894 0.57171310 1.0 Ga Ga14 1 0.66268353 0.66268353 0.42911805 1.0 Ga Ga15 1 0.66268353 0.66268353 0.07088195 1.0 Ga Ga16 1 0.32984894 0.32984894 0.92828690 1.0 Ga Ga17 1 0.33417526 0.54654578 0.25000000 1.0 Ga Ga18 1 0.66363063 0.45752152 0.75000000 1.0 Ga Ga19 1 0.54654578 0.33417526 0.25000000 1.0 Ga Ga20 1 0.45752152 0.66363063 0.75000000 1.0 Si Si21 1 0.12849636 0.12849636 0.25000000 1.0 Ir Ir22 1 0.67034197 0.32680457 0.99943654 1.0 Ir Ir23 1 0.32680457 0.67034197 0.99943654 1.0 Ir Ir24 1 0.32680457 0.67034197 0.50056346 1.0 Ir Ir25 1 0.67034197 0.32680457 0.50056346 1.0 Ir Ir26 1 0.99987947 0.99987947 0.01244334 1.0 Ir Ir27 1 0.99987947 0.99987947 0.48755666 1.0