# generated using pymatgen data_Lu5(Si5Ir2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.48991695 _cell_length_b 12.48988786 _cell_length_c 4.18194040 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.99913757 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu5(Si5Ir2)2 _chemical_formula_sum 'Lu10 Si20 Ir8' _cell_volume 652.37292535 _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 0.49999033 0.49994230 -0.00000000 1.0 Lu Lu1 1 0.00000913 0.00005807 -0.00000000 1.0 Lu Lu2 1 0.67410617 0.82592529 0.50000000 1.0 Lu Lu3 1 0.32588630 0.17412864 0.50000000 1.0 Lu Lu4 1 0.17410771 0.67408212 0.50000000 1.0 Lu Lu5 1 0.82590211 0.32586361 0.50000000 1.0 Lu Lu6 1 0.38443587 0.88448972 0.50000000 1.0 Lu Lu7 1 0.61554899 0.11559442 0.50000000 1.0 Lu Lu8 1 0.88446475 0.61550491 0.50000000 1.0 Lu Lu9 1 0.11554704 0.38441205 0.50000000 1.0 Si Si10 1 0.56608410 0.93393435 -0.00000000 1.0 Si Si11 1 0.43390816 0.06610571 -0.00000000 1.0 Si Si12 1 0.06608636 0.56606580 -0.00000000 1.0 Si Si13 1 0.93391858 0.43389207 0.00000000 1.0 Si Si14 1 0.70116958 0.66513748 0.00000000 1.0 Si Si15 1 0.29882988 0.33483941 0.00000000 1.0 Si Si16 1 0.20116979 0.83485748 0.00000000 1.0 Si Si17 1 0.79883162 0.16516607 -0.00000000 1.0 Si Si18 1 0.33484418 0.70116691 -0.00000000 1.0 Si Si19 1 0.66515668 0.29882272 0.00000000 1.0 Si Si20 1 0.16514853 0.20117266 -0.00000000 1.0 Si Si21 1 0.83485434 0.79883923 -0.00000000 1.0 Si Si22 1 0.50360488 0.65482600 0.50000000 1.0 Si Si23 1 0.49639712 0.34514534 0.50000000 1.0 Si Si24 1 0.00361127 0.84517530 0.50000000 1.0 Si Si25 1 0.99639276 0.15485154 0.50000000 1.0 Si Si26 1 0.34515930 0.50357889 0.50000000 1.0 Si Si27 1 0.65483510 0.49636213 0.50000000 1.0 Si Si28 1 0.15484113 0.00362914 0.50000000 1.0 Si Si29 1 0.84516419 0.99642533 0.50000000 1.0 Ir Ir30 1 0.51942156 0.74518286 0.00000000 1.0 Ir Ir31 1 0.48057238 0.25481638 0.00000000 1.0 Ir Ir32 1 0.01943647 0.75482466 0.00000000 1.0 Ir Ir33 1 0.98057012 0.24517455 0.00000000 1.0 Ir Ir34 1 0.25481903 0.51940960 -0.00000000 1.0 Ir Ir35 1 0.74517754 0.48054281 -0.00000000 1.0 Ir Ir36 1 0.24517745 0.01945086 0.00000000 1.0 Ir Ir37 1 0.75482146 0.98060056 -0.00000000 1.0