data_[Ba8Li4Si8]
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
  Si  1.9000  1.1000  0.5400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.1792]
_cell_length_b [5.0644]
_cell_length_c [11.5184]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.3711]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2LiSi2]
_chemical_formula_sum '[Ba8 Li4 Si8]'
_cell_volume [584.2583]
_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  0.0942  0.0000  0.8919  1
  Ba  Ba1  4  0.1974  0.5000  0.6665  1
  Li  Li2  4  0.1284  0.5000  0.3578  1
  Si  Si3  4  0.0671  0.0000  0.4444  1
  Si  Si4  4  0.0995  0.5000  0.1011  1
]