data_[Li2V2P2O10]
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 [Pc]
_cell_length_a [6.2169]
_cell_length_b [4.8836]
_cell_length_c [8.6734]
_cell_angle_alpha [90.0000]
_cell_angle_beta [132.6078]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [7]
_chemical_formula_structural [LiVPO5]
_chemical_formula_sum '[Li2 V2 P2 O10]'
_cell_volume [193.8163]
_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  0.9487  0.0825  0.0250  1
  V  V1  2  0.5028  0.2450  0.2492  1
  P  P2  2  0.9978  0.4760  0.7497  1
  O  O3  2  0.1442  0.2950  0.9441  1
  O  O4  2  0.2218  0.3279  0.2828  1
  O  O5  2  0.5155  0.0934  0.7587  1
  O  O6  2  0.7555  0.3420  0.1999  1
  O  O7  2  0.8579  0.2897  0.5575  1
]