data_[Ba1Ga6Pt4]
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 [P-6m2]
_cell_length_a [7.4729]
_cell_length_b [7.4729]
_cell_length_c [4.2022]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [187]
_chemical_formula_structural [Ba(Ga3Pt2)2]
_chemical_formula_sum '[Ba1 Ga6 Pt4]'
_cell_volume [203.2304]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1.0
  Ga  Ga1  3  0.0696  0.5348  0.0000  1.0
  Ga  Ga2  3  0.4006  0.2003  0.5000  1.0
  Pt  Pt3  3  0.2063  0.4126  0.5000  1.0
  Pt  Pt4  1  0.6667  0.3333  0.0000  1.0
]