# generated using pymatgen data_LiP6(Pd10Pb)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.57604311 _cell_length_b 8.57604283 _cell_length_c 8.57604375 _cell_angle_alpha 60.00000397 _cell_angle_beta 60.00000507 _cell_angle_gamma 60.00000011 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiP6(Pd10Pb)2 _chemical_formula_sum 'Li1 P6 Pd20 Pb2' _cell_volume 446.01135659 _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 0.00000000 0.00000000 0.00000000 1.0 P P1 1 0.73850247 0.26149753 0.26149753 1.0 P P2 1 0.26149753 0.73850247 0.73850247 1.0 P P3 1 0.26149753 0.73850247 0.26149753 1.0 P P4 1 0.73850247 0.26149753 0.73850247 1.0 P P5 1 0.26149753 0.26149753 0.73850247 1.0 P P6 1 0.73850247 0.73850247 0.26149753 1.0 Pd Pd7 1 0.38446244 0.38446244 0.38446244 1.0 Pd Pd8 1 0.61553756 0.61553756 0.61553756 1.0 Pd Pd9 1 0.38446244 0.38446244 0.84661267 1.0 Pd Pd10 1 0.38446244 0.84661267 0.38446244 1.0 Pd Pd11 1 0.61553756 0.61553756 0.15338733 1.0 Pd Pd12 1 0.61553756 0.15338733 0.61553756 1.0 Pd Pd13 1 0.84661267 0.38446244 0.38446244 1.0 Pd Pd14 1 0.15338733 0.61553756 0.61553756 1.0 Pd Pd15 1 0.34300079 0.00000000 0.00000000 1.0 Pd Pd16 1 0.65699921 1.00000000 1.00000000 1.0 Pd Pd17 1 1.00000000 0.34300079 0.65699921 1.0 Pd Pd18 1 0.00000000 0.65699921 0.34300079 1.0 Pd Pd19 1 1.00000000 0.34300079 0.00000000 1.0 Pd Pd20 1 0.65699921 0.00000000 0.34300079 1.0 Pd Pd21 1 0.00000000 0.65699921 1.00000000 1.0 Pd Pd22 1 0.34300079 1.00000000 0.65699921 1.0 Pd Pd23 1 0.00000000 0.00000000 0.34300079 1.0 Pd Pd24 1 1.00000000 1.00000000 0.65699921 1.0 Pd Pd25 1 0.65699921 0.34300079 1.00000000 1.0 Pd Pd26 1 0.34300079 0.65699921 0.00000000 1.0 Pb Pb27 1 0.25000000 0.25000000 0.25000000 1.0 Pb Pb28 1 0.75000000 0.75000000 0.75000000 1.0