data_[Li2H12Pd8]
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 [P2_1/m]
_cell_length_a [2.8686]
_cell_length_b [13.7519]
_cell_length_c [4.9648]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.4043]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Li(H3Pd2)2]
_chemical_formula_sum '[Li2 H12 Pd8]'
_cell_volume [188.8164]
_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
[
  Li  Li0  2  0.1815  0.2500  0.3326  1
  Pd  Pd1  4  0.0901  0.6395  0.2019  1
  H  H2  4  0.2571  0.0889  0.5246  1
  Pd  Pd3  4  0.3701  0.5528  0.7328  1
  H  H4  4  0.4791  0.6576  0.9586  1
  H  H5  2  0.0000  0.0000  0.0000  1
  H  H6  2  0.1770  0.7500  0.3702  1
]