data_[Li4Ce4B56]
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
  B  2.0400  0.8500  0.4100
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [5.8595]
_cell_length_b [10.4993]
_cell_length_c [8.2986]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [LiCeB14]
_chemical_formula_sum '[Li4 Ce4 B56]'
_cell_volume [510.5352]
_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  4  0.2500  0.2500  0.2500  1
  Ce  Ce1  4  0.0000  0.2500  0.6336  1
  B  B2  16  0.1598  0.0569  0.8401  1
  B  B3  16  0.2497  0.0796  0.4533  1
  B  B4  8  0.0000  0.0896  0.1707  1
  B  B5  8  0.0000  0.1495  0.3692  1
  B  B6  8  0.0000  0.1659  0.9694  1
]