data_[Hf1Pd6Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-6m2]
_cell_length_a [8.7507]
_cell_length_b [8.7507]
_cell_length_c [2.7750]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Hf(Pd3Pt2)2]
_chemical_formula_sum '[Hf1 Pd6 Pt4]'
_cell_volume [184.0236]
_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  0.0000  0.0000  0.0000  1
  Pd  Pd1  3  0.0354  0.5177  0.0000  1
  Pd  Pd2  3  0.3593  0.1797  0.5000  1
  Pt  Pt3  3  0.1673  0.3347  0.5000  1
  Pt  Pt4  1  0.6667  0.3333  0.0000  1
]