data_[Cs4Be4H16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Be  1.5700  1.0500  0.5900
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.3965]
_cell_length_b [6.5355]
_cell_length_c [5.8059]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.0109]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [CsBeH4]
_chemical_formula_sum '[Cs4 Be4 H16]'
_cell_volume [349.9760]
_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  0.2069  0.0000  0.2688  1.0
  Be  Be1  4  0.0612  0.5000  0.1748  1.0
  H  H2  8  0.0118  0.3724  0.4159  1.0
  H  H3  4  0.0000  0.3370  0.0000  1.0
  H  H4  4  0.2154  0.5000  0.2038  1.0
]