# generated using pymatgen data_Zr3Ta2Al3O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.04000873 _cell_length_b 8.04000901 _cell_length_c 5.43865238 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999072 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr3Ta2Al3O _chemical_formula_sum 'Zr6 Ta4 Al6 O2' _cell_volume 304.46335518 _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 Zr Zr0 1 0.23737005 0.00000000 0.25000000 1.0 Zr Zr1 1 0.76262995 1.00000000 0.75000000 1.0 Zr Zr2 1 0.00000000 0.23737005 0.25000000 1.0 Zr Zr3 1 1.00000000 0.76262995 0.75000000 1.0 Zr Zr4 1 0.76262995 0.76262995 0.25000000 1.0 Zr Zr5 1 0.23737005 0.23737005 0.75000000 1.0 Ta Ta6 1 0.33333300 0.66666700 0.00000000 1.0 Ta Ta7 1 0.66666700 0.33333300 0.00000000 1.0 Ta Ta8 1 0.66666700 0.33333300 0.50000000 1.0 Ta Ta9 1 0.33333300 0.66666700 0.50000000 1.0 Al Al10 1 0.58856013 0.00000000 0.25000000 1.0 Al Al11 1 0.41143987 1.00000000 0.75000000 1.0 Al Al12 1 0.00000000 0.58856013 0.25000000 1.0 Al Al13 1 1.00000000 0.41143987 0.75000000 1.0 Al Al14 1 0.41143987 0.41143987 0.25000000 1.0 Al Al15 1 0.58856013 0.58856013 0.75000000 1.0 O O16 1 0.00000000 0.00000000 0.00000000 1.0 O O17 1 0.00000000 0.00000000 0.50000000 1.0