# generated using pymatgen data_Mg3Si(PPd4)5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.51296730 _cell_length_b 8.51083166 _cell_length_c 8.51083278 _cell_angle_alpha 60.01657873 _cell_angle_beta 59.99169983 _cell_angle_gamma 59.99169898 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg3Si(PPd4)5 _chemical_formula_sum 'Mg3 Si1 P5 Pd20' _cell_volume 436.02350032 _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 Mg Mg0 1 0.99668459 0.00331541 0.00331541 1.0 Mg Mg1 1 0.75236779 0.74763221 0.74763221 1.0 Mg Mg2 1 0.25236779 0.24763221 0.24763221 1.0 Si Si3 1 0.73424088 0.26575912 0.26575912 1.0 P P4 1 0.73570518 0.73382134 0.26429482 1.0 P P5 1 0.73570518 0.26429482 0.73382134 1.0 P P6 1 0.26617866 0.73382134 0.26429482 1.0 P P7 1 0.26486078 0.73513922 0.73513922 1.0 P P8 1 0.26617866 0.26429482 0.73382134 1.0 Pd Pd9 1 0.34077946 0.00175413 0.00175413 1.0 Pd Pd10 1 0.99824587 0.65922054 0.34428672 1.0 Pd Pd11 1 0.34268462 0.99996998 0.65731538 1.0 Pd Pd12 1 0.00003002 0.65731538 0.99996998 1.0 Pd Pd13 1 0.65559138 0.34440862 0.99828056 1.0 Pd Pd14 1 0.61741876 0.61909614 0.14606534 1.0 Pd Pd15 1 0.38324902 0.85058131 0.38292066 1.0 Pd Pd16 1 0.14941869 0.61675098 0.61675098 1.0 Pd Pd17 1 0.65559138 0.99828056 0.34440862 1.0 Pd Pd18 1 0.99824587 0.34428672 0.65922054 1.0 Pd Pd19 1 0.65571328 0.00175413 0.00175413 1.0 Pd Pd20 1 0.00171944 0.99828056 0.34440862 1.0 Pd Pd21 1 0.61741876 0.14606534 0.61909614 1.0 Pd Pd22 1 0.34268462 0.65731538 0.99996998 1.0 Pd Pd23 1 0.38090386 0.38258124 0.38258124 1.0 Pd Pd24 1 0.61707934 0.61675098 0.61675098 1.0 Pd Pd25 1 0.38324902 0.38292066 0.85058131 1.0 Pd Pd26 1 0.00003002 0.99996998 0.65731538 1.0 Pd Pd27 1 0.85393466 0.38258124 0.38258124 1.0 Pd Pd28 1 0.00171944 0.34440862 0.99828056 1.0