data_[Li4V4P4O20]
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 [C2/m]
_cell_length_a [14.7663]
_cell_length_b [5.9876]
_cell_length_c [5.1472]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.8016]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiVPO5]
_chemical_formula_sum '[Li4 V4 P4 O20]'
_cell_volume [445.4715]
_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  0.1310  0.0000  0.5575  1.0
  V  V1  4  0.0000  0.2268  0.0000  1.0
  P  P2  4  0.1425  0.5000  0.2176  1.0
  O  O3  8  0.0980  0.2833  0.3173  1.0
  O  O4  4  0.0467  0.0000  0.8181  1.0
  O  O5  4  0.0824  0.5000  0.9197  1.0
  O  O6  4  0.2445  0.5000  0.2603  1.0
]