data_[Li2H6Pd2]
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/m]
_cell_length_a [4.7149]
_cell_length_b [3.4878]
_cell_length_c [5.8384]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.9369]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [LiH3Pd]
_chemical_formula_sum '[Li2 H6 Pd2]'
_cell_volume [89.0606]
_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  0.1655  0.5000  0.3169  1.0
  H  H1  2  0.2622  0.0000  0.0101  1.0
  H  H2  2  0.3532  0.5000  0.7284  1.0
  Pd  Pd3  2  0.3632  0.0000  0.7405  1.0
  H  H4  1  0.0000  0.0000  0.5000  1.0
  H  H5  1  0.5000  0.0000  0.5000  1.0
]