# generated using pymatgen data_Ta2Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.20052728 _cell_length_b 10.06775076 _cell_length_c 10.06775076 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta2Au _chemical_formula_sum 'Ta20 Au10' _cell_volume 527.12339279 _cell_formula_units_Z 10 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 0.50000000 0.10448156 0.89551844 1.0 Ta Ta1 1 0.50000000 0.89551844 0.10448156 1.0 Ta Ta2 1 0.00000000 0.39551844 0.39551844 1.0 Ta Ta3 1 0.00000000 0.60448156 0.60448156 1.0 Ta Ta4 1 0.50000000 0.37131792 0.96455394 1.0 Ta Ta5 1 0.50000000 0.62868208 0.03544606 1.0 Ta Ta6 1 0.00000000 0.12868208 0.46455394 1.0 Ta Ta7 1 0.00000000 0.87131792 0.53544606 1.0 Ta Ta8 1 0.50000000 0.96455394 0.37131792 1.0 Ta Ta9 1 0.50000000 0.03544606 0.62868208 1.0 Ta Ta10 1 0.00000000 0.46455394 0.12868208 1.0 Ta Ta11 1 0.00000000 0.53544606 0.87131792 1.0 Ta Ta12 1 0.24979290 0.31695364 0.68304636 1.0 Ta Ta13 1 0.24979290 0.68304636 0.31695364 1.0 Ta Ta14 1 0.74979290 0.18304636 0.18304636 1.0 Ta Ta15 1 0.74979290 0.81695364 0.81695364 1.0 Ta Ta16 1 0.75020710 0.68304636 0.31695364 1.0 Ta Ta17 1 0.75020710 0.31695364 0.68304636 1.0 Ta Ta18 1 0.25020710 0.81695364 0.81695364 1.0 Ta Ta19 1 0.25020710 0.18304636 0.18304636 1.0 Au Au20 1 0.50000000 0.50000000 0.50000000 1.0 Au Au21 1 0.00000000 0.00000000 -0.00000000 1.0 Au Au22 1 0.50000000 0.43638687 0.23282877 1.0 Au Au23 1 0.50000000 0.56361313 0.76717123 1.0 Au Au24 1 0.00000000 0.06361313 0.73282877 1.0 Au Au25 1 0.00000000 0.93638687 0.26717123 1.0 Au Au26 1 0.50000000 0.23282877 0.43638687 1.0 Au Au27 1 0.50000000 0.76717123 0.56361313 1.0 Au Au28 1 0.00000000 0.73282877 0.06361313 1.0 Au Au29 1 0.00000000 0.26717123 0.93638687 1.0