# generated using pymatgen data_Zr6Zn22SnHg _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.81032577 _cell_length_b 8.81030863 _cell_length_c 8.81030841 _cell_angle_alpha 60.00010295 _cell_angle_beta 60.00011625 _cell_angle_gamma 60.00011869 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Zn22SnHg _chemical_formula_sum 'Zr6 Zn22 Sn1 Hg1' _cell_volume 483.57107159 _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 Zr Zr0 1 0.73523605 0.26476395 0.26476395 1.0 Zr Zr1 1 0.26476395 0.73523605 0.73523605 1.0 Zr Zr2 1 0.26476495 0.73523605 0.26476195 1.0 Zr Zr3 1 0.73523505 0.26476395 0.73523805 1.0 Zr Zr4 1 0.26476495 0.26476195 0.73523605 1.0 Zr Zr5 1 0.73523505 0.73523805 0.26476395 1.0 Zn Zn6 1 0.13596210 0.13596210 0.13596210 1.0 Zn Zn7 1 0.86403790 0.86403790 0.86403790 1.0 Zn Zn8 1 0.13596110 0.13596110 0.59211771 1.0 Zn Zn9 1 0.13596110 0.59211771 0.13596110 1.0 Zn Zn10 1 0.86403890 0.86403890 0.40788229 1.0 Zn Zn11 1 0.86403890 0.40788229 0.86403890 1.0 Zn Zn12 1 0.59211671 0.13596110 0.13596110 1.0 Zn Zn13 1 0.40788329 0.86403890 0.86403890 1.0 Zn Zn14 1 0.50000000 0.00000000 0.00000000 1.0 Zn Zn15 1 0.00000000 0.50000000 0.50000000 1.0 Zn Zn16 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn17 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn18 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn19 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn20 1 0.34784661 0.34784661 0.34784661 1.0 Zn Zn21 1 0.65215339 0.65215339 0.65215339 1.0 Zn Zn22 1 0.34784461 0.34784461 0.95646416 1.0 Zn Zn23 1 0.34784461 0.95646416 0.34784461 1.0 Zn Zn24 1 0.65215539 0.65215539 0.04353584 1.0 Zn Zn25 1 0.65215539 0.04353584 0.65215539 1.0 Zn Zn26 1 0.95646416 0.34784461 0.34784461 1.0 Zn Zn27 1 0.04353584 0.65215539 0.65215539 1.0 Sn Sn28 1 0.50000000 0.50000000 0.50000000 1.0 Hg Hg29 1 0.00000000 0.00000000 0.00000000 1.0