data_[K4Li2Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Li  0.9800  1.4500  0.9000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [P6_3/mmc]
_cell_length_a [5.6721]
_cell_length_b [5.6721]
_cell_length_c [9.2304]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [194]
_chemical_formula_structural [K2LiPd3]
_chemical_formula_sum '[K4 Li2 Pd6]'
_cell_volume [257.1774]
_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
[
  K  K0  4  0.3333  0.6667  0.0671  1.0
  Li  Li1  2  0.0000  0.0000  0.0000  1.0
  Pd  Pd2  6  0.1653  0.3306  0.7500  1.0
]