data_[Cs4Cd4H8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cd  1.6900  1.5500  1.0900
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [14.9900]
_cell_length_b [3.9395]
_cell_length_c [7.2224]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [CsCdH2]
_chemical_formula_sum '[Cs4 Cd4 H8]'
_cell_volume [426.5012]
_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
[
  Cs  Cs0  4  0.1427  0.7500  0.8846  1.0
  Cd  Cd1  4  0.0703  0.2500  0.4234  1.0
  H  H2  4  0.0840  0.2500  0.1710  1.0
  H  H3  4  0.1752  0.2500  0.5587  1.0
]