# generated using pymatgen data_SrHg3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.93121800 _cell_length_b 6.86700800 _cell_length_c 6.79056800 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrHg3 _chemical_formula_sum 'Sr4 Hg12' _cell_volume 463.10148229 _cell_formula_units_Z 4 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 0.25000000 0.03309500 0.00889100 1.0 Sr Sr1 1 0.25000000 0.46690500 0.50889100 1.0 Sr Sr2 1 0.75000000 0.96690500 0.99110900 1.0 Sr Sr3 1 0.75000000 0.53309500 0.49110900 1.0 Hg Hg4 1 0.99016400 0.23045000 0.73236600 1.0 Hg Hg5 1 0.50983600 0.26955000 0.23236600 1.0 Hg Hg6 1 0.49016400 0.76955000 0.26763400 1.0 Hg Hg7 1 0.00983600 0.73045000 0.76763400 1.0 Hg Hg8 1 0.00983600 0.76955000 0.26763400 1.0 Hg Hg9 1 0.49016400 0.73045000 0.76763400 1.0 Hg Hg10 1 0.50983600 0.23045000 0.73236600 1.0 Hg Hg11 1 0.99016400 0.26955000 0.23236600 1.0 Hg Hg12 1 0.25000000 0.97157600 0.51299000 1.0 Hg Hg13 1 0.25000000 0.52842400 0.01299000 1.0 Hg Hg14 1 0.75000000 0.02842400 0.48701000 1.0 Hg Hg15 1 0.75000000 0.47157600 0.98701000 1.0