# generated using pymatgen data_Ta3Re2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.19918703 _cell_length_b 3.19918703 _cell_length_c 16.22910790 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ta3Re2 _chemical_formula_sum 'Ta6 Re4' _cell_volume 166.10163558 _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 0.00000000 0.00000000 0.89207986 1.0 Ta Ta1 1 0.00000000 0.00000000 0.10792014 1.0 Ta Ta2 1 0.00000000 0.00000000 0.30341941 1.0 Ta Ta3 1 0.00000000 0.00000000 0.50000000 1.0 Ta Ta4 1 0.00000000 0.00000000 0.69658059 1.0 Ta Ta5 1 0.50000000 0.50000000 0.00000000 1.0 Re Re6 1 0.50000000 0.50000000 0.20486513 1.0 Re Re7 1 0.50000000 0.50000000 0.40173050 1.0 Re Re8 1 0.50000000 0.50000000 0.59826950 1.0 Re Re9 1 0.50000000 0.50000000 0.79513487 1.0