data_[Na8Li4B4O12]
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
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [8.1675]
_cell_length_b [5.8414]
_cell_length_c [6.4051]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.4722]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [Na2LiBO3]
_chemical_formula_sum '[Na8 Li4 B4 O12]'
_cell_volume [298.3763]
_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  0.1713  0.6803  0.1665  1
  Na  Na1  2  0.0000  0.1627  0.0000  1
  Na  Na2  2  0.0000  0.9926  0.5000  1
  Li  Li3  4  0.1340  0.3924  0.4579  1
  B  B4  4  0.1520  0.6404  0.7305  1
  O  O5  4  0.0649  0.4378  0.7504  1
  O  O6  4  0.1248  0.8414  0.8307  1
  O  O7  4  0.2371  0.1306  0.4074  1
]