data_[Li8H20Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  H  2.2000  0.2500  0.0000
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [4.7559]
_cell_length_b [13.8675]
_cell_length_c [4.7029]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [Li2H5Pd2]
_chemical_formula_sum '[Li8 H20 Pd8]'
_cell_volume [310.1646]
_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
[
  Li  Li0  8  0.0000  0.1327  0.0237  1
  H  H1  8  0.0000  0.1256  0.5750  1
  H  H2  8  0.2500  0.0287  0.2500  1
  Pd  Pd3  4  0.0000  0.0000  0.5000  1
  Pd  Pd4  4  0.0000  0.2500  0.5362  1
  H  H5  4  0.2500  0.2500  0.2500  1
]