data_[Hf24Ga8Sn8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hf  1.3000  1.5500  0.8500
  Ga  1.8100  1.3000  0.7600
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.8901]
_cell_length_b [11.8187]
_cell_length_c [5.6626]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.2121]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Hf3GaSn]
_chemical_formula_sum '[Hf24 Ga8 Sn8]'
_cell_volume [839.8397]
_cell_formula_units_Z [8]
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  8  0.0964  0.3051  0.5411  1
  Hf  Hf1  8  0.1767  0.1963  0.1147  1
  Hf  Hf2  8  0.1927  0.0626  0.5952  1
  Ga  Ga3  4  0.0000  0.1084  0.2500  1
  Ga  Ga4  4  0.0000  0.1173  0.7500  1
  Sn  Sn5  8  0.1111  0.4309  0.0184  1
]