data_[Li8Be8Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Be  1.5700  1.0500  0.5900
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [11.9564]
_cell_length_b [11.2755]
_cell_length_c [6.1498]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.6631]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [LiBeCl3]
_chemical_formula_sum '[Li8 Be8 Cl24]'
_cell_volume [798.2907]
_cell_formula_units_Z [8]
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  0.0000  0.1154  0.7500  1.0
  Li  Li1  4  0.0000  0.2575  0.2500  1.0
  Be  Be2  8  0.2039  0.4168  0.7781  1.0
  Cl  Cl3  8  0.1204  0.0896  0.1403  1.0
  Cl  Cl4  8  0.1276  0.2686  0.6284  1.0
  Cl  Cl5  8  0.1472  0.4396  0.0681  1.0
]