# generated using pymatgen
data_Ta2ReIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.28758300
_cell_length_b   10.28758300
_cell_length_c   10.28758300
_cell_angle_alpha   125.91134696
_cell_angle_beta   119.99527313
_cell_angle_gamma   85.03993831
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2ReIr
_chemical_formula_sum   'Ta2 Re1 Ir1'
_cell_volume   729.79144208
_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
  Ta  Ta0  1  0.00000000  0.24731500  0.24731500  1.0
  Ta  Ta1  1  0.00000000  0.75268500  0.75268500  1.0
  Re  Re2  1  0.00000000  0.00000000  0.00000000  1.0
  Ir  Ir3  1  0.00000000  0.50000000  0.50000000  1.0