data_[Ba1Li2Pt1Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Li  0.9800  1.4500  0.9000
  Pt  2.2800  1.3500  0.8050
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.1770]
_cell_length_b [6.9468]
_cell_length_c [8.3102]
_cell_angle_alpha [68.6340]
_cell_angle_beta [84.9162]
_cell_angle_gamma [84.8975]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [BaLi2PtCl8]
_chemical_formula_sum '[Ba1 Li2 Pt1 Cl8]'
_cell_volume [330.1586]
_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  0.5000  0.5000  1.0
  Li  Li1  2  0.4908  0.0292  0.3049  1.0
  Pt  Pt2  1  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  2  0.0939  0.9811  0.2744  1.0
  Cl  Cl4  2  0.1679  0.3162  0.8739  1.0
  Cl  Cl5  2  0.3245  0.8098  0.9696  1.0
  Cl  Cl6  2  0.4449  0.2705  0.4485  1.0
]