# generated using pymatgen data_SrHg11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.14268400 _cell_length_b 10.14268400 _cell_length_c 10.14268400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrHg11 _chemical_formula_sum 'Sr3 Hg33' _cell_volume 1043.41886658 _cell_formula_units_Z 3 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 0.00000000 0.00000000 0.50000000 1.0 Sr Sr1 1 0.00000000 0.50000000 0.00000000 1.0 Sr Sr2 1 0.50000000 0.00000000 0.00000000 1.0 Hg Hg3 1 0.50000000 0.50000000 0.50000000 1.0 Hg Hg4 1 0.15271200 0.15271200 0.84728800 1.0 Hg Hg5 1 0.15271200 0.84728800 0.15271200 1.0 Hg Hg6 1 0.84728800 0.15271200 0.15271200 1.0 Hg Hg7 1 0.84728800 0.84728800 0.84728800 1.0 Hg Hg8 1 0.84728800 0.84728800 0.15271200 1.0 Hg Hg9 1 0.84728800 0.15271200 0.84728800 1.0 Hg Hg10 1 0.15271200 0.84728800 0.84728800 1.0 Hg Hg11 1 0.15271200 0.15271200 0.15271200 1.0 Hg Hg12 1 0.34164500 0.34164500 0.00000000 1.0 Hg Hg13 1 0.34164500 0.00000000 0.65835500 1.0 Hg Hg14 1 0.00000000 0.34164500 0.65835500 1.0 Hg Hg15 1 0.34164500 0.65835500 0.00000000 1.0 Hg Hg16 1 0.34164500 0.00000000 0.34164500 1.0 Hg Hg17 1 0.00000000 0.65835500 0.34164500 1.0 Hg Hg18 1 0.65835500 0.34164500 0.00000000 1.0 Hg Hg19 1 0.65835500 0.00000000 0.34164500 1.0 Hg Hg20 1 0.00000000 0.34164500 0.34164500 1.0 Hg Hg21 1 0.65835500 0.65835500 0.00000000 1.0 Hg Hg22 1 0.65835500 0.00000000 0.65835500 1.0 Hg Hg23 1 0.00000000 0.65835500 0.65835500 1.0 Hg Hg24 1 0.26227200 0.26227200 0.50000000 1.0 Hg Hg25 1 0.26227200 0.50000000 0.73772800 1.0 Hg Hg26 1 0.50000000 0.26227200 0.73772800 1.0 Hg Hg27 1 0.26227200 0.73772800 0.50000000 1.0 Hg Hg28 1 0.26227200 0.50000000 0.26227200 1.0 Hg Hg29 1 0.50000000 0.73772800 0.26227200 1.0 Hg Hg30 1 0.73772800 0.26227200 0.50000000 1.0 Hg Hg31 1 0.73772800 0.50000000 0.26227200 1.0 Hg Hg32 1 0.50000000 0.26227200 0.26227200 1.0 Hg Hg33 1 0.73772800 0.73772800 0.50000000 1.0 Hg Hg34 1 0.73772800 0.50000000 0.73772800 1.0 Hg Hg35 1 0.50000000 0.73772800 0.73772800 1.0