# generated using pymatgen data_LiHg2(P3Pd10)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.53280574 _cell_length_b 8.53280573 _cell_length_c 8.53280562 _cell_angle_alpha 60.00000039 _cell_angle_beta 60.00000043 _cell_angle_gamma 59.99999369 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiHg2(P3Pd10)2 _chemical_formula_sum 'Li1 Hg2 P6 Pd20' _cell_volume 439.29934200 _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 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 0.73661627 0.73661627 0.26338373 1.0 P P4 1 0.26338373 0.26338373 0.73661627 1.0 P P5 1 0.26338373 0.73661627 0.73661627 1.0 P P6 1 0.73661627 0.26338373 0.73661627 1.0 P P7 1 0.26338373 0.73661627 0.26338373 1.0 P P8 1 0.73661627 0.26338373 0.26338373 1.0 Pd Pd9 1 0.61601202 0.61601202 0.61601202 1.0 Pd Pd10 1 0.38398798 0.84803305 0.38398798 1.0 Pd Pd11 1 0.65762163 0.34237837 0.00000000 1.0 Pd Pd12 1 0.00000000 0.34237837 0.65762163 1.0 Pd Pd13 1 0.65762163 1.00000000 0.00000000 1.0 Pd Pd14 1 0.61601202 0.61601202 0.15196695 1.0 Pd Pd15 1 0.00000000 0.00000000 0.65762163 1.0 Pd Pd16 1 0.00000000 0.34237837 1.00000000 1.0 Pd Pd17 1 0.65762163 1.00000000 0.34237837 1.0 Pd Pd18 1 0.34237837 0.00000000 1.00000000 1.0 Pd Pd19 1 1.00000000 0.65762163 0.00000000 1.0 Pd Pd20 1 0.34237837 0.00000000 0.65762163 1.0 Pd Pd21 1 1.00000000 0.65762163 0.34237837 1.0 Pd Pd22 1 0.34237837 0.65762163 0.00000000 1.0 Pd Pd23 1 0.15196695 0.61601202 0.61601202 1.0 Pd Pd24 1 0.38398798 0.38398798 0.38398798 1.0 Pd Pd25 1 0.84803305 0.38398798 0.38398798 1.0 Pd Pd26 1 0.38398798 0.38398798 0.84803305 1.0 Pd Pd27 1 0.61601202 0.15196695 0.61601202 1.0 Pd Pd28 1 0.00000000 0.00000000 0.34237837 1.0