# generated using pymatgen data_Dy16Sc4(Ir3Ru)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.65460977 _cell_length_b 10.65460977 _cell_length_c 6.29763261 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Dy16Sc4(Ir3Ru)3 _chemical_formula_sum 'Dy16 Sc4 Ir9 Ru3' _cell_volume 714.91172125 _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 0.29005033 0.08481330 0.37900916 1.0 Dy Dy1 1 0.29028116 0.91567424 0.87943528 1.0 Dy Dy2 1 0.70971884 0.08432576 0.87943528 1.0 Dy Dy3 1 0.70994967 0.91518670 0.37900916 1.0 Dy Dy4 1 0.58432576 0.79028116 0.87943528 1.0 Dy Dy5 1 0.58481330 0.20994967 0.37900916 1.0 Dy Dy6 1 0.41518670 0.79005033 0.37900916 1.0 Dy Dy7 1 0.41567424 0.20971884 0.87943528 1.0 Dy Dy8 1 0.21179530 0.41453217 0.62331361 1.0 Dy Dy9 1 0.21137676 0.58558403 0.12009286 1.0 Dy Dy10 1 0.78862324 0.41441597 0.12009286 1.0 Dy Dy11 1 0.78820470 0.58546783 0.62331361 1.0 Dy Dy12 1 0.91441597 0.71137676 0.12009286 1.0 Dy Dy13 1 0.91453217 0.28820470 0.62331361 1.0 Dy Dy14 1 0.08546783 0.71179530 0.62331361 1.0 Dy Dy15 1 0.08558403 0.28862324 0.12009286 1.0 Sc Sc16 1 0.00000000 0.00000000 0.49803966 1.0 Sc Sc17 1 0.00000000 0.00000000 0.99800379 1.0 Sc Sc18 1 0.50000000 0.50000000 0.99800379 1.0 Sc Sc19 1 0.50000000 0.50000000 0.49803966 1.0 Ir Ir20 1 0.85316182 0.14733418 0.24932369 1.0 Ir Ir21 1 0.85276574 0.85275041 0.74904472 1.0 Ir Ir22 1 0.14723426 0.14724959 0.74904472 1.0 Ir Ir23 1 0.14683818 0.85266582 0.24932369 1.0 Ir Ir24 1 0.64724959 0.35276574 0.74904472 1.0 Ir Ir25 1 0.64733418 0.64683818 0.24932369 1.0 Ir Ir26 1 0.35266582 0.35316182 0.24932369 1.0 Ir Ir27 1 0.35275041 0.64723426 0.74904472 1.0 Ir Ir28 1 0.00000000 0.50000000 0.37637746 1.0 Ru Ru29 1 0.50000000 0.00000000 0.12791830 1.0 Ru Ru30 1 0.50000000 0.00000000 0.62741522 1.0 Ru Ru31 1 0.00000000 0.50000000 0.87532783 1.0