data_[Hf8In8Sn4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  In  1.7800  1.5500  0.9400
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [8.7228]
_cell_length_b [11.5116]
_cell_length_c [5.5137]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.6785]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Hf2In2Sn]
_chemical_formula_sum '[Hf8 In8 Sn4]'
_cell_volume [510.8365]
_cell_formula_units_Z [4]
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  4  0.0000  0.0697  0.2500  1
  Hf  Hf1  4  0.0000  0.4312  0.7500  1
  In  In2  8  0.1821  0.3508  0.3331  1
  Sn  Sn3  4  0.0000  0.1781  0.7500  1
]