data_[Na4B8Cl24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  B  2.0400  0.8500  0.4100
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.5250]
_cell_length_b [11.1272]
_cell_length_c [7.8668]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.0129]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Na(BCl3)2]
_chemical_formula_sum '[Na4 B8 Cl24]'
_cell_volume [976.7675]
_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  0.1331  0.7500  1
  B  B1  8  0.2183  0.4136  0.6772  1
  Cl  Cl2  8  0.1215  0.0768  0.1662  1
  Cl  Cl3  8  0.1543  0.4755  0.0011  1
  Cl  Cl4  8  0.1555  0.2657  0.6373  1
]