data_[Ba8Ga4Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ga  1.8100  1.3000  0.7600
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.5884]
_cell_length_b [16.2847]
_cell_length_c [8.1629]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Ba2GaPt2]
_chemical_formula_sum '[Ba8 Ga4 Pt8]'
_cell_volume [609.9339]
_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
[
  Ba  Ba0  4  0.0000  0.0427  0.2782  1.0
  Ba  Ba1  4  0.0000  0.2125  0.6167  1.0
  Ga  Ga2  4  0.0000  0.4082  0.4134  1.0
  Pt  Pt3  4  0.0000  0.1521  0.9696  1.0
  Pt  Pt4  4  0.0000  0.4480  0.0877  1.0
]