# generated using pymatgen data_Sc8AgIr4Ru3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.46145476 _cell_length_b 4.56648804 _cell_length_c 9.11909721 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00061204 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8AgIr4Ru3 _chemical_formula_sum 'Sc8 Ag1 Ir4 Ru3' _cell_volume 269.06950356 _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 Sc Sc0 1 0.98896562 0.75000000 0.12499881 1.0 Sc Sc1 1 0.51090253 0.75000000 0.12500822 1.0 Sc Sc2 1 0.99535443 0.25000000 0.38146849 1.0 Sc Sc3 1 0.50453258 0.25000000 0.38149160 1.0 Sc Sc4 1 0.49928532 0.75000000 0.62500233 1.0 Sc Sc5 1 0.00084448 0.75000000 0.62499662 1.0 Sc Sc6 1 0.50464005 0.25000000 0.86852329 1.0 Sc Sc7 1 0.99547008 0.25000000 0.86850764 1.0 Ag Ag8 1 0.24996156 0.25000000 0.12500487 1.0 Ir Ir9 1 0.74995692 0.25000000 0.12500278 1.0 Ir Ir10 1 0.24995939 0.75000000 0.37429606 1.0 Ir Ir11 1 0.75004001 0.25000000 0.62499907 1.0 Ir Ir12 1 0.25004551 0.75000000 0.87570507 1.0 Ru Ru13 1 0.74996161 0.75000000 0.37466880 1.0 Ru Ru14 1 0.25004368 0.25000000 0.62499417 1.0 Ru Ru15 1 0.75003823 0.75000000 0.87533019 1.0