data_[Li8Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [9.6614]
_cell_length_b [4.5565]
_cell_length_c [5.1978]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [LiPd]
_chemical_formula_sum '[Li8 Pd8]'
_cell_volume [228.8177]
_cell_formula_units_Z [8]
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
[
  Li  Li0  4  0.0796  0.2500  0.0350  1.0
  Li  Li1  4  0.1793  0.7500  0.2756  1.0
  Pd  Pd2  4  0.0736  0.2500  0.5349  1.0
  Pd  Pd3  4  0.1748  0.7500  0.7714  1.0
]