data_[Li3V5O10]
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 [5.1708]
_cell_length_b [5.1894]
_cell_length_c [7.8608]
_cell_angle_alpha [74.4646]
_cell_angle_beta [73.3968]
_cell_angle_gamma [76.5827]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li3V5O10]
_chemical_formula_sum '[Li3 V5 O10]'
_cell_volume [191.9696]
_cell_formula_units_Z [1]
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  0.4760  0.1949  0.6097  1.0
  Li  Li1  1  0.0000  0.5000  0.5000  1.0
  V  V2  2  0.0186  0.8803  0.6880  1.0
  V  V3  2  0.0371  0.6926  0.0982  1.0
  V  V4  1  0.5000  0.0000  0.0000  1.0
  O  O5  2  0.1911  0.5422  0.6697  1.0
  O  O6  2  0.2107  0.1058  0.4813  1.0
  O  O7  2  0.2148  0.3228  0.0591  1.0
  O  O8  2  0.2234  0.9565  0.8593  1.0
  O  O9  2  0.2593  0.8032  0.2273  1.0
]