data_[Na16Li16B64O112]
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 [Fdd2]
_cell_length_a [13.1309]
_cell_length_b [14.0751]
_cell_length_c [10.1643]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [43]
_chemical_formula_structural [NaLiB4O7]
_chemical_formula_sum '[Na16 Li16 B64 O112]'
_cell_volume [1878.5569]
_cell_formula_units_Z [16]
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  16  0.1042  0.2609  0.1258  1
  Li  Li1  16  0.0026  0.1268  0.3677  1
  B  B2  16  0.0335  0.0783  0.6519  1
  B  B3  16  0.0419  0.3772  0.5537  1
  B  B4  16  0.0889  0.0242  0.1714  1
  B  B5  16  0.1207  0.2083  0.7849  1
  O  O6  16  0.0402  0.1688  0.7216  1
  O  O7  16  0.0420  0.4044  0.0463  1
  O  O8  16  0.0588  0.1058  0.0839  1
  O  O9  16  0.0679  0.2955  0.4918  1
  O  O10  16  0.1167  0.4420  0.5858  1
  O  O11  16  0.1182  0.2991  0.8356  1
  O  O12  8  0.0000  0.0000  0.2564  1
  O  O13  8  0.0000  0.0000  0.7371  1
]