data_[Li8Ni4B4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ni  1.9100  1.3500  0.7400
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C222_1]
_cell_length_a [6.8882]
_cell_length_b [7.1333]
_cell_length_c [6.1398]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [20]
_chemical_formula_structural [Li2NiBO4]
_chemical_formula_sum '[Li8 Ni4 B4 O16]'
_cell_volume [301.6884]
_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
[
  Li  Li0  4  0.0000  0.3076  0.7500  1
  Li  Li1  4  0.1798  0.0000  0.5000  1
  Ni  Ni2  4  0.0000  0.3125  0.2500  1
  B  B3  4  0.1845  0.0000  0.0000  1
  O  O4  8  0.0524  0.1683  0.0094  1
  O  O5  8  0.1974  0.4923  0.2985  1
]