# generated using pymatgen data_Lu2TiBe2Ir5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.64635254 _cell_length_b 9.64635254 _cell_length_c 3.11996378 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu2TiBe2Ir5 _chemical_formula_sum 'Lu4 Ti2 Be4 Ir10' _cell_volume 290.31923562 _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 0.67597338 0.17597338 0.00000000 1.0 Lu Lu1 1 0.32402662 0.82402662 0.00000000 1.0 Lu Lu2 1 0.17597338 0.32402662 0.00000000 1.0 Lu Lu3 1 0.82402662 0.67597338 0.00000000 1.0 Ti Ti4 1 0.00000000 0.00000000 0.00000000 1.0 Ti Ti5 1 0.50000000 0.50000000 0.00000000 1.0 Be Be6 1 0.12224344 0.62224344 0.00000000 1.0 Be Be7 1 0.87775656 0.37775656 0.00000000 1.0 Be Be8 1 0.62224344 0.87775656 0.00000000 1.0 Be Be9 1 0.37775656 0.12224344 0.00000000 1.0 Ir Ir10 1 0.21118233 0.06742298 0.50000000 1.0 Ir Ir11 1 0.78881767 0.93257702 0.50000000 1.0 Ir Ir12 1 0.06742298 0.78881767 0.50000000 1.0 Ir Ir13 1 0.71118233 0.43257702 0.50000000 1.0 Ir Ir14 1 0.93257702 0.21118233 0.50000000 1.0 Ir Ir15 1 0.28881767 0.56742298 0.50000000 1.0 Ir Ir16 1 0.56742298 0.71118233 0.50000000 1.0 Ir Ir17 1 0.43257702 0.28881767 0.50000000 1.0 Ir Ir18 1 0.50000000 0.00000000 0.50000000 1.0 Ir Ir19 1 0.00000000 0.50000000 0.50000000 1.0