# generated using pymatgen data_Dy5Sc3(P3Ir4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.79341627 _cell_length_b 12.79341676 _cell_length_c 3.94532806 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000127 _symmetry_Int_Tables_number 1 _chemical_formula_structural Dy5Sc3(P3Ir4)4 _chemical_formula_sum 'Dy5 Sc3 P12 Ir16' _cell_volume 559.22532016 _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 Dy Dy0 1 0.33333300 0.66666700 0.50000000 1.0 Dy Dy1 1 0.66666700 0.33333300 0.50000000 1.0 Dy Dy2 1 0.00000000 0.81196263 0.00000000 1.0 Dy Dy3 1 0.18803737 0.18803737 0.00000000 1.0 Dy Dy4 1 0.81196263 0.00000000 0.00000000 1.0 Sc Sc5 1 0.00000000 0.44372108 0.50000000 1.0 Sc Sc6 1 0.55627892 0.55627892 0.50000000 1.0 Sc Sc7 1 0.44372108 1.00000000 0.50000000 1.0 P P8 1 0.00000000 0.64550441 0.50000000 1.0 P P9 1 0.35449559 0.35449559 0.50000000 1.0 P P10 1 0.64550441 0.00000000 0.50000000 1.0 P P11 1 0.51757400 0.68795575 0.00000000 1.0 P P12 1 0.31204425 0.82961825 0.00000000 1.0 P P13 1 0.17038175 0.48242600 0.00000000 1.0 P P14 1 0.48242600 0.17038175 0.00000000 1.0 P P15 1 0.68795575 0.51757400 0.00000000 1.0 P P16 1 0.82961825 0.31204425 0.00000000 1.0 P P17 1 0.00000000 0.17660390 0.50000000 1.0 P P18 1 0.82339610 0.82339610 0.50000000 1.0 P P19 1 0.17660390 0.00000000 0.50000000 1.0 Ir Ir20 1 0.50835059 0.86744770 0.00000000 1.0 Ir Ir21 1 0.13255230 0.64090389 0.00000000 1.0 Ir Ir22 1 0.35909611 0.49164941 0.00000000 1.0 Ir Ir23 1 0.49164941 0.35909611 0.00000000 1.0 Ir Ir24 1 0.86744770 0.50835059 0.00000000 1.0 Ir Ir25 1 0.64090389 0.13255230 0.00000000 1.0 Ir Ir26 1 0.00000000 0.27704383 0.00000000 1.0 Ir Ir27 1 0.72295617 0.72295617 0.00000000 1.0 Ir Ir28 1 0.27704383 0.00000000 0.00000000 1.0 Ir Ir29 1 0.62812492 0.80752151 0.50000000 1.0 Ir Ir30 1 0.19247849 0.82060341 0.50000000 1.0 Ir Ir31 1 0.17939659 0.37187508 0.50000000 1.0 Ir Ir32 1 0.37187508 0.17939659 0.50000000 1.0 Ir Ir33 1 0.80752151 0.62812492 0.50000000 1.0 Ir Ir34 1 0.82060341 0.19247849 0.50000000 1.0 Ir Ir35 1 0.00000000 0.00000000 0.50000000 1.0