# generated using pymatgen data_Ho16Sc4(Ir3Rh)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.65165695 _cell_length_b 10.65165695 _cell_length_c 6.24760613 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ho16Sc4(Ir3Rh)3 _chemical_formula_sum 'Ho16 Sc4 Ir9 Rh3' _cell_volume 708.83962100 _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 Ho Ho0 1 0.28709431 0.08576347 0.38212718 1.0 Ho Ho1 1 0.28704078 0.91346375 0.88198711 1.0 Ho Ho2 1 0.71295922 0.08653625 0.88198711 1.0 Ho Ho3 1 0.71290569 0.91423653 0.38212718 1.0 Ho Ho4 1 0.58653625 0.78704078 0.88198711 1.0 Ho Ho5 1 0.58576347 0.21290569 0.38212718 1.0 Ho Ho6 1 0.41423653 0.78709431 0.38212718 1.0 Ho Ho7 1 0.41346375 0.21295922 0.88198711 1.0 Ho Ho8 1 0.21233881 0.41404871 0.61666432 1.0 Ho Ho9 1 0.21298058 0.58630785 0.11887772 1.0 Ho Ho10 1 0.78701942 0.41369215 0.11887772 1.0 Ho Ho11 1 0.78766119 0.58595129 0.61666432 1.0 Ho Ho12 1 0.91369215 0.71298058 0.11887772 1.0 Ho Ho13 1 0.91404871 0.28766119 0.61666432 1.0 Ho Ho14 1 0.08595129 0.71233881 0.61666432 1.0 Ho Ho15 1 0.08630785 0.28701942 0.11887772 1.0 Sc Sc16 1 0.00000000 0.00000000 0.50035596 1.0 Sc Sc17 1 0.00000000 0.00000000 0.00002225 1.0 Sc Sc18 1 0.50000000 0.50000000 0.00002225 1.0 Sc Sc19 1 0.50000000 0.50000000 0.50035596 1.0 Ir Ir20 1 0.85040413 0.14833725 0.24989125 1.0 Ir Ir21 1 0.85075459 0.85122864 0.74987276 1.0 Ir Ir22 1 0.14924541 0.14877136 0.74987276 1.0 Ir Ir23 1 0.14959587 0.85166275 0.24989125 1.0 Ir Ir24 1 0.64877136 0.35075459 0.74987276 1.0 Ir Ir25 1 0.64833725 0.64959587 0.24989125 1.0 Ir Ir26 1 0.35166275 0.35040413 0.24989125 1.0 Ir Ir27 1 0.35122864 0.64924541 0.74987276 1.0 Ir Ir28 1 0.00000000 0.50000000 0.36987910 1.0 Rh Rh29 1 0.50000000 0.00000000 0.12943972 1.0 Rh Rh30 1 0.50000000 0.00000000 0.63033436 1.0 Rh Rh31 1 0.00000000 0.50000000 0.87190904 1.0