data_[Li2Ce1Fe1H8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ce  1.1200  1.8500  1.0800
  Fe  1.8300  1.4000  0.8525
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.4691]
_cell_length_b [4.3818]
_cell_length_c [5.0709]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.2615]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Li2CeFeH8]
_chemical_formula_sum '[Li2 Ce1 Fe1 H8]'
_cell_volume [95.7995]
_cell_formula_units_Z [1]
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  0.0600  0.5000  0.7741  1.0
  Ce  Ce1  1  0.5000  0.0000  0.5000  1.0
  Fe  Fe2  1  0.0000  0.0000  0.0000  1.0
  H  H3  4  0.2580  0.2513  0.0926  1.0
  H  H4  2  0.0586  0.0000  0.7030  1.0
  H  H5  2  0.3047  0.5000  0.5414  1.0
]