# generated using pymatgen data_MgHg2(P3Pd10)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.54968043 _cell_length_b 8.54968015 _cell_length_c 8.54968075 _cell_angle_alpha 59.99999768 _cell_angle_beta 59.99999876 _cell_angle_gamma 59.99999153 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgHg2(P3Pd10)2 _chemical_formula_sum 'Mg1 Hg2 P6 Pd20' _cell_volume 441.91079451 _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 0.00000000 0.00000000 0.00000000 1.0 Hg Hg1 1 0.25000000 0.25000000 0.25000000 1.0 Hg Hg2 1 0.75000000 0.75000000 0.75000000 1.0 P P3 1 0.73476897 0.73476897 0.26523103 1.0 P P4 1 0.26523103 0.26523103 0.73476897 1.0 P P5 1 0.26523103 0.73476897 0.73476897 1.0 P P6 1 0.73476897 0.26523103 0.73476897 1.0 P P7 1 0.26523103 0.73476897 0.26523103 1.0 P P8 1 0.73476897 0.26523103 0.26523103 1.0 Pd Pd9 1 0.61609197 0.61609197 0.61609197 1.0 Pd Pd10 1 0.38390803 0.84827592 0.38390803 1.0 Pd Pd11 1 0.65824297 0.34175703 0.00000000 1.0 Pd Pd12 1 0.00000000 0.34175703 0.65824297 1.0 Pd Pd13 1 0.65824297 1.00000000 0.00000000 1.0 Pd Pd14 1 0.61609197 0.61609197 0.15172408 1.0 Pd Pd15 1 0.00000000 0.00000000 0.65824297 1.0 Pd Pd16 1 0.00000000 0.34175703 0.00000000 1.0 Pd Pd17 1 0.65824297 1.00000000 0.34175703 1.0 Pd Pd18 1 0.34175703 0.00000000 0.00000000 1.0 Pd Pd19 1 1.00000000 0.65824297 1.00000000 1.0 Pd Pd20 1 0.34175703 0.00000000 0.65824297 1.0 Pd Pd21 1 1.00000000 0.65824297 0.34175703 1.0 Pd Pd22 1 0.34175703 0.65824297 1.00000000 1.0 Pd Pd23 1 0.15172408 0.61609197 0.61609197 1.0 Pd Pd24 1 0.38390803 0.38390803 0.38390803 1.0 Pd Pd25 1 0.84827592 0.38390803 0.38390803 1.0 Pd Pd26 1 0.38390803 0.38390803 0.84827592 1.0 Pd Pd27 1 0.61609197 0.15172408 0.61609197 1.0 Pd Pd28 1 0.00000000 0.00000000 0.34175703 1.0