# generated using pymatgen data_Ta2AlZn3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.99713533 _cell_length_b 4.99713664 _cell_length_c 8.19735714 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000422 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2AlZn3 _chemical_formula_sum 'Ta4 Al2 Zn6' _cell_volume 177.27471907 _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 Ta Ta0 1 0.33333300 0.66666700 0.43512850 1.0 Ta Ta1 1 0.66666700 0.33333300 0.56487150 1.0 Ta Ta2 1 0.66666700 0.33333300 0.93512850 1.0 Ta Ta3 1 0.33333300 0.66666700 0.06487150 1.0 Al Al4 1 0.00000000 0.00000000 0.50000000 1.0 Al Al5 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn6 1 0.82755808 0.17244192 0.25000000 1.0 Zn Zn7 1 0.82755808 0.65511615 0.25000000 1.0 Zn Zn8 1 0.34488385 0.17244192 0.25000000 1.0 Zn Zn9 1 0.17244192 0.82755808 0.75000000 1.0 Zn Zn10 1 0.17244192 0.34488385 0.75000000 1.0 Zn Zn11 1 0.65511615 0.82755808 0.75000000 1.0