# generated using pymatgen data_LiEr6Zn22As _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.92440863 _cell_length_b 8.92440867 _cell_length_c 8.92440865 _cell_angle_alpha 59.99999650 _cell_angle_beta 59.99999634 _cell_angle_gamma 60.00000184 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiEr6Zn22As _chemical_formula_sum 'Li1 Er6 Zn22 As1' _cell_volume 502.60097879 _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 Li Li0 1 0.00000000 0.00000000 0.00000000 1.0 Er Er1 1 0.71549319 0.28450681 0.28450681 1.0 Er Er2 1 0.71549319 0.28450681 0.71549319 1.0 Er Er3 1 0.71549319 0.71549319 0.28450681 1.0 Er Er4 1 0.28450681 0.71549319 0.71549319 1.0 Er Er5 1 0.28450681 0.71549319 0.28450681 1.0 Er Er6 1 0.28450681 0.28450681 0.71549319 1.0 Zn Zn7 1 0.62746208 0.12417931 0.12417931 1.0 Zn Zn8 1 0.12417931 0.62746208 0.12417931 1.0 Zn Zn9 1 0.12417931 0.12417931 0.62746208 1.0 Zn Zn10 1 0.12417931 0.12417931 0.12417931 1.0 Zn Zn11 1 0.37253792 0.87582069 0.87582069 1.0 Zn Zn12 1 0.87582069 0.37253792 0.87582069 1.0 Zn Zn13 1 0.87582069 0.87582069 0.37253792 1.0 Zn Zn14 1 0.87582069 0.87582069 0.87582069 1.0 Zn Zn15 1 0.50000000 0.00000000 0.00000000 1.0 Zn Zn16 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn17 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn18 1 0.00000000 0.50000000 0.50000000 1.0 Zn Zn19 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn20 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn21 1 0.01502774 0.32832375 0.32832375 1.0 Zn Zn22 1 0.32832375 0.01502774 0.32832375 1.0 Zn Zn23 1 0.32832375 0.32832375 0.01502774 1.0 Zn Zn24 1 0.32832375 0.32832375 0.32832375 1.0 Zn Zn25 1 0.98497226 0.67167625 0.67167625 1.0 Zn Zn26 1 0.67167625 0.98497226 0.67167625 1.0 Zn Zn27 1 0.67167625 0.67167625 0.98497226 1.0 Zn Zn28 1 0.67167625 0.67167625 0.67167625 1.0 As As29 1 0.50000000 0.50000000 0.50000000 1.0