# generated using pymatgen data_Y5Fe3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.49852247 _cell_length_b 12.49852236 _cell_length_c 3.96996101 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999512 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y5Fe3(P3Ir4)4 _chemical_formula_sum 'Y5 Fe3 P12 Ir16' _cell_volume 537.07413931 _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 Y Y0 1 0.00000000 0.18189233 0.50000000 1.0 Y Y1 1 0.81810767 0.81810767 0.50000000 1.0 Y Y2 1 0.18189233 0.00000000 0.50000000 1.0 Y Y3 1 0.66666700 0.33333300 0.00000000 1.0 Y Y4 1 0.33333300 0.66666700 0.00000000 1.0 Fe Fe5 1 0.00000000 0.70561915 0.50000000 1.0 Fe Fe6 1 0.29438085 0.29438085 0.50000000 1.0 Fe Fe7 1 0.70561915 0.00000000 0.50000000 1.0 P P8 1 1.00000000 0.81811888 0.00000000 1.0 P P9 1 0.18188112 0.18188112 0.00000000 1.0 P P10 1 0.81811888 1.00000000 0.00000000 1.0 P P11 1 0.68984348 0.16676536 0.50000000 1.0 P P12 1 0.83323464 0.52307812 0.50000000 1.0 P P13 1 0.47692188 0.31015652 0.50000000 1.0 P P14 1 0.16676536 0.68984348 0.50000000 1.0 P P15 1 0.52307812 0.83323464 0.50000000 1.0 P P16 1 0.31015652 0.47692188 0.50000000 1.0 P P17 1 1.00000000 0.35863161 0.00000000 1.0 P P18 1 0.64136839 0.64136839 0.00000000 1.0 P P19 1 0.35863161 1.00000000 0.00000000 1.0 Ir Ir20 1 1.00000000 0.54195618 0.00000000 1.0 Ir Ir21 1 0.45804382 0.45804382 0.00000000 1.0 Ir Ir22 1 0.54195618 1.00000000 0.00000000 1.0 Ir Ir23 1 0.80561468 0.18046512 0.00000000 1.0 Ir Ir24 1 0.81953488 0.62515056 0.00000000 1.0 Ir Ir25 1 0.37484944 0.19438532 0.00000000 1.0 Ir Ir26 1 0.18046512 0.80561468 0.00000000 1.0 Ir Ir27 1 0.62515056 0.81953488 0.00000000 1.0 Ir Ir28 1 0.19438532 0.37484944 0.00000000 1.0 Ir Ir29 1 0.86828410 0.36191319 0.50000000 1.0 Ir Ir30 1 0.63808681 0.50636991 0.50000000 1.0 Ir Ir31 1 0.49363009 0.13171590 0.50000000 1.0 Ir Ir32 1 0.36191319 0.86828410 0.50000000 1.0 Ir Ir33 1 0.50636991 0.63808681 0.50000000 1.0 Ir Ir34 1 0.13171590 0.49363009 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.00000000 1.0