# generated using pymatgen data_LiTh3(Pd5Pt)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.85355879 _cell_length_b 5.85355869 _cell_length_c 9.54027306 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.18761569 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiTh3(Pd5Pt)2 _chemical_formula_sum 'Li1 Th3 Pd10 Pt2' _cell_volume 282.55776000 _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 Li Li0 1 0.33355976 0.66644024 0.25000000 1.0 Th Th1 1 0.99957637 0.00042363 0.48984925 1.0 Th Th2 1 0.99957637 0.00042363 0.01015075 1.0 Th Th3 1 0.66741055 0.33258945 0.75000000 1.0 Pd Pd4 1 0.49703579 0.50296421 0.49269080 1.0 Pd Pd5 1 0.49640196 0.99477646 0.49233893 1.0 Pd Pd6 1 0.00522354 0.50359804 0.49233893 1.0 Pd Pd7 1 0.49703579 0.50296421 0.00730920 1.0 Pd Pd8 1 0.49640196 0.99477646 0.00766107 1.0 Pd Pd9 1 0.00522354 0.50359804 0.00766107 1.0 Pd Pd10 1 0.82436869 0.64884248 0.25000000 1.0 Pd Pd11 1 0.35115752 0.17563131 0.25000000 1.0 Pd Pd12 1 0.82515548 0.17484452 0.25000000 1.0 Pd Pd13 1 0.17396338 0.82603662 0.75000000 1.0 Pt Pt14 1 0.17342812 0.34551983 0.75000000 1.0 Pt Pt15 1 0.65448017 0.82657188 0.75000000 1.0