# generated using pymatgen data_Lu5Sb2Ir _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.75597150 _cell_length_b 8.64514906 _cell_length_c 12.04627608 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu5Sb2Ir _chemical_formula_sum 'Lu20 Sb8 Ir4' _cell_volume 807.72123842 _cell_formula_units_Z 4 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 0.16728281 0.75000000 0.21064769 1.0 Lu Lu1 1 0.33271719 0.75000000 0.71064769 1.0 Lu Lu2 1 0.83271719 0.25000000 0.78935231 1.0 Lu Lu3 1 0.66728281 0.25000000 0.28935231 1.0 Lu Lu4 1 0.44363907 0.75000000 0.99921141 1.0 Lu Lu5 1 0.05636093 0.75000000 0.49921141 1.0 Lu Lu6 1 0.55636093 0.25000000 0.00078859 1.0 Lu Lu7 1 0.94363907 0.25000000 0.50078859 1.0 Lu Lu8 1 0.63035434 0.75000000 0.30726604 1.0 Lu Lu9 1 0.86964566 0.75000000 0.80726604 1.0 Lu Lu10 1 0.36964566 0.25000000 0.69273396 1.0 Lu Lu11 1 0.13035434 0.25000000 0.19273396 1.0 Lu Lu12 1 0.82640402 0.54306403 0.06939420 1.0 Lu Lu13 1 0.67359598 0.95693597 0.56939420 1.0 Lu Lu14 1 0.17359598 0.04306403 0.93060580 1.0 Lu Lu15 1 0.32640402 0.45693597 0.43060580 1.0 Lu Lu16 1 0.17359598 0.45693597 0.93060580 1.0 Lu Lu17 1 0.32640402 0.04306403 0.43060580 1.0 Lu Lu18 1 0.82640402 0.95693597 0.06939420 1.0 Lu Lu19 1 0.67359598 0.54306403 0.56939420 1.0 Sb Sb20 1 0.93972369 0.50902754 0.32818682 1.0 Sb Sb21 1 0.56027631 0.99097246 0.82818682 1.0 Sb Sb22 1 0.06027631 0.00902754 0.67181318 1.0 Sb Sb23 1 0.43972369 0.49097246 0.17181318 1.0 Sb Sb24 1 0.06027631 0.49097246 0.67181318 1.0 Sb Sb25 1 0.43972369 0.00902754 0.17181318 1.0 Sb Sb26 1 0.93972369 0.99097246 0.32818682 1.0 Sb Sb27 1 0.56027631 0.50902754 0.82818682 1.0 Ir Ir28 1 0.42617637 0.75000000 0.49050658 1.0 Ir Ir29 1 0.07382363 0.75000000 0.99050658 1.0 Ir Ir30 1 0.57382363 0.25000000 0.50949342 1.0 Ir Ir31 1 0.92617637 0.25000000 0.00949342 1.0