# generated using pymatgen data_Hf13In3(Pd2N)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.67558193 _cell_length_b 8.67915702 _cell_length_c 8.67558112 _cell_angle_alpha 60.01362452 _cell_angle_beta 59.99999934 _cell_angle_gamma 60.01362690 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf13In3(Pd2N)4 _chemical_formula_sum 'Hf13 In3 Pd8 N4' _cell_volume 462.00763153 _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 Hf Hf0 1 0.62500000 0.12500000 0.62500000 1.0 Hf Hf1 1 0.81622257 0.81636049 0.18370847 1.0 Hf Hf2 1 0.18164596 0.18654964 0.81590170 1.0 Hf Hf3 1 0.81590170 0.18654964 0.81590170 1.0 Hf Hf4 1 0.18370847 0.81636049 0.18370847 1.0 Hf Hf5 1 0.18370847 0.81636049 0.81622257 1.0 Hf Hf6 1 0.81590170 0.18654964 0.18164596 1.0 Hf Hf7 1 0.43377743 0.43363951 0.06629153 1.0 Hf Hf8 1 0.06835404 0.06345036 0.43409830 1.0 Hf Hf9 1 0.43409830 0.06345036 0.43409830 1.0 Hf Hf10 1 0.06629153 0.43363951 0.06629153 1.0 Hf Hf11 1 0.06629153 0.43363951 0.43377743 1.0 Hf Hf12 1 0.43409830 0.06345036 0.06835404 1.0 In In13 1 0.12500000 0.62500000 0.62500000 1.0 In In14 1 0.62500000 0.62500000 0.12500000 1.0 In In15 1 0.62500000 0.62500000 0.62500000 1.0 Pd Pd16 1 0.77524536 0.40075832 0.41199916 1.0 Pd Pd17 1 0.40719979 0.77840164 0.40719979 1.0 Pd Pd18 1 0.41199916 0.40075832 0.77524536 1.0 Pd Pd19 1 0.41199916 0.40075832 0.41199916 1.0 Pd Pd20 1 0.47475464 0.84924168 0.83800084 1.0 Pd Pd21 1 0.84280021 0.47159836 0.84280021 1.0 Pd Pd22 1 0.83800084 0.84924168 0.47475464 1.0 Pd Pd23 1 0.83800084 0.84924168 0.83800084 1.0 N N24 1 0.62500000 0.12500000 0.12500000 1.0 N N25 1 0.12500000 0.62500000 0.12500000 1.0 N N26 1 0.12500000 0.12500000 0.62500000 1.0 N N27 1 0.12500000 0.12500000 0.12500000 1.0