# generated using pymatgen data_La5P12Ir19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.85023839 _cell_length_b 12.85023839 _cell_length_c 4.04629700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000199 _symmetry_Int_Tables_number 1 _chemical_formula_structural La5P12Ir19 _chemical_formula_sum 'La5 P12 Ir19' _cell_volume 578.64306012 _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 La La0 1 0.00000000 0.81372000 0.50000000 1.0 La La1 1 0.18628000 0.18628000 0.50000000 1.0 La La2 1 0.81372000 0.00000000 0.50000000 1.0 La La3 1 0.33333300 0.66666700 0.00000000 1.0 La La4 1 0.66666700 0.33333300 0.00000000 1.0 P P5 1 0.00000000 0.18188700 0.00000000 1.0 P P6 1 0.81811300 0.81811300 0.00000000 1.0 P P7 1 0.18188700 0.00000000 0.00000000 1.0 P P8 1 0.51885300 0.68946400 0.50000000 1.0 P P9 1 0.31053600 0.82938900 0.50000000 1.0 P P10 1 0.17061100 0.48114700 0.50000000 1.0 P P11 1 0.48114700 0.17061100 0.50000000 1.0 P P12 1 0.68946400 0.51885300 0.50000000 1.0 P P13 1 0.82938900 0.31053600 0.50000000 1.0 P P14 1 0.00000000 0.63708500 0.00000000 1.0 P P15 1 0.36291500 0.36291500 0.00000000 1.0 P P16 1 0.63708500 0.00000000 0.00000000 1.0 Ir Ir17 1 0.00000000 0.28683600 0.50000000 1.0 Ir Ir18 1 0.71316400 0.71316400 0.50000000 1.0 Ir Ir19 1 0.28683600 0.00000000 0.50000000 1.0 Ir Ir20 1 0.62070600 0.80131400 0.00000000 1.0 Ir Ir21 1 0.19868600 0.81939200 0.00000000 1.0 Ir Ir22 1 0.18060800 0.37929400 0.00000000 1.0 Ir Ir23 1 0.37929400 0.18060800 0.00000000 1.0 Ir Ir24 1 0.80131400 0.62070600 0.00000000 1.0 Ir Ir25 1 0.81939200 0.19868600 0.00000000 1.0 Ir Ir26 1 0.50870100 0.87119500 0.50000000 1.0 Ir Ir27 1 0.12880500 0.63750600 0.50000000 1.0 Ir Ir28 1 0.36249400 0.49129900 0.50000000 1.0 Ir Ir29 1 0.49129900 0.36249400 0.50000000 1.0 Ir Ir30 1 0.87119500 0.50870100 0.50000000 1.0 Ir Ir31 1 0.63750600 0.12880500 0.50000000 1.0 Ir Ir32 1 0.00000000 0.00000000 0.00000000 1.0 Ir Ir33 1 0.00000000 0.45988000 0.00000000 1.0 Ir Ir34 1 0.54012000 0.54012000 0.00000000 1.0 Ir Ir35 1 0.45988000 0.00000000 0.00000000 1.0