data_[Li8V2O8F2]
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
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2_1]
_cell_length_a [5.2414]
_cell_length_b [9.4705]
_cell_length_c [5.5533]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.7718]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [4]
_chemical_formula_structural [Li4VO4F]
_chemical_formula_sum '[Li8 V2 O8 F2]'
_cell_volume [243.9057]
_cell_formula_units_Z [2]
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  2  0.0567  0.7413  0.4938  1.0
  Li  Li1  2  0.1024  0.5056  0.2946  1.0
  Li  Li2  2  0.2645  0.5222  0.8440  1.0
  Li  Li3  2  0.3504  0.0356  0.5940  1.0
  V  V4  2  0.2893  0.2193  0.1499  1.0
  O  O5  2  0.0036  0.6806  0.8024  1.0
  O  O6  2  0.2316  0.1445  0.8404  1.0
  O  O7  2  0.3385  0.4038  0.1633  1.0
  O  O8  2  0.4159  0.6309  0.5881  1.0
  F  F9  2  0.0103  0.9279  0.4618  1.0
]