data_[Li2V8O10F14]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2388]
_cell_length_b [5.3710]
_cell_length_c [17.2431]
_cell_angle_alpha [87.1250]
_cell_angle_beta [81.2808]
_cell_angle_gamma [61.0556]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiV4O5F7]
_chemical_formula_sum '[Li2 V8 O10 F14]'
_cell_volume [419.5195]
_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  1  0.0864  0.5406  0.3219  1
  Li  Li1  1  0.4161  0.2140  0.9257  1
  V  V2  1  0.0237  0.9545  0.0043  1
  V  V3  1  0.2258  0.9106  0.6200  1
  V  V4  1  0.2808  0.3440  0.1283  1
  V  V5  1  0.4901  0.2902  0.7458  1
  V  V6  1  0.5119  0.7453  0.2522  1
  V  V7  1  0.6875  0.6404  0.8715  1
  V  V8  1  0.7157  0.1295  0.3700  1
  V  V9  1  0.9932  0.5290  0.4971  1
  O  O10  1  0.0472  0.1863  0.5616  1
  O  O11  1  0.0514  0.6837  0.0637  1
  O  O12  1  0.4307  0.7927  0.9571  1
  O  O13  1  0.4442  0.5679  0.6889  1
  O  O14  1  0.4647  0.0501  0.1832  1
  O  O15  1  0.5082  0.4557  0.3154  1
  O  O16  1  0.5555  0.9250  0.8129  1
  O  O17  1  0.5727  0.4106  0.8408  1
  O  O18  1  0.5906  0.9182  0.3367  1
  O  O19  1  0.9559  0.8078  0.4392  1
  F  F20  1  0.0578  0.6755  0.5897  1
  F  F21  1  0.0656  0.9587  0.2868  1
  F  F22  1  0.0674  0.1724  0.0854  1
  F  F23  1  0.0792  0.4459  0.7940  1
  F  F24  1  0.4234  0.3006  0.4645  1
  F  F25  1  0.4344  0.0758  0.6638  1
  F  F26  1  0.4549  0.5645  0.1612  1
  F  F27  1  0.5707  0.6967  0.5387  1
  F  F28  1  0.5759  0.2052  0.0293  1
  F  F29  1  0.9173  0.8440  0.9140  1
  F  F30  1  0.9214  0.0529  0.7121  1
  F  F31  1  0.9441  0.3359  0.4062  1
  F  F32  1  0.9597  0.5279  0.2207  1
  F  F33  1  0.9903  0.3125  0.9387  1
]