data_[Na4Li4Be8Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  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 [12.2081]
_cell_length_b [11.9021]
_cell_length_c [6.3053]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.8730]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [NaLi(BeCl3)2]
_chemical_formula_sum '[Na4 Li4 Be8 Cl24]'
_cell_volume [881.2310]
_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
[
  Na  Na0  4  0.0000  0.1065  0.2500  1.0
  Li  Li1  4  0.0000  0.2537  0.7500  1.0
  Be  Be2  8  0.2020  0.4206  0.2454  1.0
  Cl  Cl3  8  0.1248  0.2793  0.1116  1.0
  Cl  Cl4  8  0.1258  0.0919  0.6754  1.0
  Cl  Cl5  8  0.1501  0.4453  0.5340  1.0
]