# generated using pymatgen data_MgHg5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.07821815 _cell_length_b 6.07821815 _cell_length_c 4.55973532 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000230 _symmetry_Int_Tables_number 1 _chemical_formula_structural MgHg5 _chemical_formula_sum 'Mg1 Hg5' _cell_volume 145.88909215 _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 0.00000000 0.68802196 0.50000000 1.0 Hg Hg2 1 0.68802196 0.00000000 0.50000000 1.0 Hg Hg3 1 0.31197804 0.31197804 0.50000000 1.0 Hg Hg4 1 0.66666700 0.33333300 -0.00000000 1.0 Hg Hg5 1 0.33333300 0.66666700 -0.00000000 1.0