data_[Li5V5O10]
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
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.1829]
_cell_length_b [5.1951]
_cell_length_c [7.9293]
_cell_angle_alpha [108.1348]
_cell_angle_beta [102.4094]
_cell_angle_gamma [100.2154]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [LiVO2]
_chemical_formula_sum '[Li5 V5 O10]'
_cell_volume [191.1694]
_cell_formula_units_Z [5]
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  0.1174  0.7131  0.7305  1.0
  Li  Li1  2  0.2840  0.0811  0.0850  1.0
  Li  Li2  1  0.0000  0.5000  0.0000  1.0
  V  V3  2  0.1905  0.8937  0.3920  1.0
  V  V4  2  0.4028  0.2948  0.8113  1.0
  V  V5  1  0.5000  0.5000  0.5000  1.0
  O  O6  2  0.0490  0.1013  0.8350  1.0
  O  O7  2  0.1702  0.2827  0.5532  1.0
  O  O8  2  0.2669  0.5242  0.2681  1.0
  O  O9  2  0.3633  0.6875  0.9571  1.0
  O  O10  2  0.4478  0.8938  0.6375  1.0
]