data_[Li8V4B4O16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  V  1.6300  1.3500  0.7775
  B  2.0400  0.8500  0.4100
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [10.9039]
_cell_length_b [5.8892]
_cell_length_c [4.7142]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Li2VBO4]
_chemical_formula_sum '[Li8 V4 B4 O16]'
_cell_volume [302.7252]
_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  8  0.0815  0.5043  0.3053  1
  V  V1  4  0.1799  0.7500  0.8047  1
  B  B2  4  0.1618  0.2500  0.8268  1
  O  O3  8  0.0968  0.0399  0.7260  1
  O  O4  4  0.1613  0.2500  0.1427  1
  O  O5  4  0.2050  0.7500  0.2290  1
]