# generated using pymatgen
data_Hf2TaW3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.43295881
_cell_length_b   5.36564652
_cell_length_c   5.36564656
_cell_angle_alpha   59.99999975
_cell_angle_beta   60.40900570
_cell_angle_gamma   60.40900825
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2TaW3
_chemical_formula_sum   'Hf2 Ta1 W3'
_cell_volume   111.28148669
_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
  Hf  Hf0  1  0.99770059  0.00076614  0.00076614  1.0
  Hf  Hf1  1  0.25229941  0.24923386  0.24923386  1.0
  Ta  Ta2  1  0.12500000  0.62500000  0.62500000  1.0
  W  W3  1  0.62500000  0.62500000  0.62500000  1.0
  W  W4  1  0.62500000  0.12500000  0.62500000  1.0
  W  W5  1  0.62500000  0.62500000  0.12500000  1.0