data_[Li8V8P8O32]
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
  P  2.1900  1.0000  0.5500
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [Pbca]
_cell_length_a [6.0032]
_cell_length_b [7.6471]
_cell_length_c [14.0089]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [61]
_chemical_formula_structural [LiVPO4]
_chemical_formula_sum '[Li8 V8 P8 O32]'
_cell_volume [643.1007]
_cell_formula_units_Z [8]
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  0.1582  0.1901  0.2248  1
  V  V1  8  0.1071  0.6857  0.5321  1
  P  P2  8  0.1029  0.5517  0.8696  1
  O  O3  8  0.0163  0.6267  0.1357  1
  O  O4  8  0.0604  0.1985  0.5910  1
  O  O5  8  0.1788  0.6031  0.7700  1
  O  O6  8  0.2008  0.0417  0.9450  1
]