# generated using pymatgen data_SrHg3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.22319400 _cell_length_b 6.95448125 _cell_length_c 6.95448125 _cell_angle_alpha 120.01562324 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrHg3 _chemical_formula_sum 'Sr2 Hg6' _cell_volume 218.73983350 _cell_formula_units_Z 2 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 Sr Sr0 1 0.75000000 0.66666929 0.33333071 1.0 Sr Sr1 1 0.25000000 0.33333071 0.66666929 1.0 Hg Hg2 1 0.75000000 0.15620337 0.31230635 1.0 Hg Hg3 1 0.75000000 0.15625336 0.84374664 1.0 Hg Hg4 1 0.75000000 0.68769365 0.84379663 1.0 Hg Hg5 1 0.25000000 0.84379663 0.68769365 1.0 Hg Hg6 1 0.25000000 0.84374664 0.15625336 1.0 Hg Hg7 1 0.25000000 0.31230635 0.15620337 1.0