data_[Ba6Ga18Pt4]
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 [Immm]
_cell_length_a [4.4365]
_cell_length_b [11.5714]
_cell_length_c [12.8529]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Ba3Ga9Pt2]
_chemical_formula_sum '[Ba6 Ga18 Pt4]'
_cell_volume [659.8128]
_cell_formula_units_Z [2]
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  0.0000  0.3061  1.0
  Ba  Ba1  2  0.0000  0.0000  0.0000  1.0
  Ga  Ga2  8  0.0000  0.2927  0.1116  1.0
  Ga  Ga3  8  0.0000  0.3295  0.3227  1.0
  Ga  Ga4  2  0.0000  0.5000  0.0000  1.0
  Pt  Pt5  4  0.0000  0.2278  0.5000  1.0
]