data_[Ti20Ga8Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ti  1.5400  1.4000  0.8517
  Ga  1.8100  1.3000  0.7600
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [I4/mcm]
_cell_length_a [6.7966]
_cell_length_b [6.7966]
_cell_length_c [11.4429]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [140]
_chemical_formula_structural [Ti5Ga2Pt]
_chemical_formula_sum '[Ti20 Ga8 Pt4]'
_cell_volume [528.5949]
_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
[
  Ti  Ti0  16  0.1581  0.3419  0.6565  1
  Ti  Ti1  4  0.0000  0.0000  0.0000  1
  Ga  Ga2  8  0.1378  0.3622  0.0000  1
  Pt  Pt3  4  0.0000  0.0000  0.2500  1
]