# generated using pymatgen data_Yb5Th3(Si3Pd)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.22070101 _cell_length_b 8.19990992 _cell_length_c 8.33682900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.08397696 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb5Th3(Si3Pd)4 _chemical_formula_sum 'Yb5 Th3 Si12 Pd4' _cell_volume 486.27431944 _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 Yb Yb0 1 0.49982255 0.50021500 0.75000000 1.0 Yb Yb1 1 0.50013880 0.49990674 0.25000000 1.0 Yb Yb2 1 0.00039045 0.50021400 0.75000000 1.0 Yb Yb3 1 0.99976694 0.49990674 0.25000000 1.0 Yb Yb4 1 0.49975774 0.99951549 0.75000000 1.0 Th Th5 1 0.50030234 0.00060668 0.25000000 1.0 Th Th6 1 0.99997790 0.99995580 0.75000000 1.0 Th Th7 1 0.00002780 0.00005559 0.25000000 1.0 Si Si8 1 0.83626806 0.16666641 0.99864150 1.0 Si Si9 1 0.16377396 0.83335197 0.99895326 1.0 Si Si10 1 0.33039835 0.16666641 0.99864150 1.0 Si Si11 1 0.16377396 0.83335197 0.50104674 1.0 Si Si12 1 0.66957801 0.83335197 0.99895326 1.0 Si Si13 1 0.83626806 0.16666641 0.50135850 1.0 Si Si14 1 0.83314239 0.66628577 0.00208643 1.0 Si Si15 1 0.66957801 0.83335197 0.50104674 1.0 Si Si16 1 0.16682458 0.33364916 0.00222775 1.0 Si Si17 1 0.33039835 0.16666641 0.50135850 1.0 Si Si18 1 0.16682458 0.33364916 0.49777225 1.0 Si Si19 1 0.83314239 0.66628577 0.49791357 1.0 Pd Pd20 1 0.66570155 0.33140310 0.99865472 1.0 Pd Pd21 1 0.33421884 0.66843769 0.99952678 1.0 Pd Pd22 1 0.33421884 0.66843769 0.50047322 1.0 Pd Pd23 1 0.66570155 0.33140310 0.50134528 1.0