data_[Ba2Li2Pd2Cl12]
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
  Pd  2.2000  1.4000  0.8462
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [6.7807]
_cell_length_b [11.0220]
_cell_length_c [6.6833]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.3690]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [BaLiPdCl6]
_chemical_formula_sum '[Ba2 Li2 Pd2 Cl12]'
_cell_volume [499.0639]
_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  2  0.0000  0.0008  0.5000  1.0
  Li  Li1  2  0.0000  0.3207  0.0000  1.0
  Pd  Pd2  2  0.0000  0.6661  0.0000  1.0
  Cl  Cl3  4  0.1282  0.5081  0.2061  1.0
  Cl  Cl4  4  0.1727  0.8116  0.2005  1.0
  Cl  Cl5  4  0.1957  0.1871  0.2305  1.0
]