data_[Li2V2P4O16]
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 [7.9036]
_cell_length_b [5.2418]
_cell_length_c [6.6814]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.5284]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiV(PO4)2]
_chemical_formula_sum '[Li2 V2 P4 O16]'
_cell_volume [276.2789]
_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  0.0000  0.5000  0.0000  1.0
  V  V1  2  0.0000  0.5000  0.5000  1.0
  P  P2  4  0.1557  0.0000  0.7355  1.0
  O  O3  8  0.0391  0.2409  0.7023  1.0
  O  O4  4  0.2258  0.5000  0.4435  1.0
  O  O5  4  0.2487  0.5000  0.0637  1.0
]