data_[Li1V2Te1O6]
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
  Te  2.1000  1.4000  1.2933
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.4140]
_cell_length_b [5.4173]
_cell_length_c [5.5535]
_cell_angle_alpha [60.9820]
_cell_angle_beta [61.0284]
_cell_angle_gamma [60.1056]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [LiV2TeO6]
_chemical_formula_sum '[Li1 V2 Te1 O6]'
_cell_volume [116.9899]
_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  1  0.2087  0.2092  0.3921  1.0
  V  V1  1  0.4764  0.4721  0.5778  1.0
  V  V2  1  0.9944  0.9928  0.0294  1.0
  Te  Te3  1  0.6878  0.6908  0.9504  1.0
  O  O4  1  0.1388  0.7374  0.7831  1.0
  O  O5  1  0.2925  0.6271  0.2517  1.0
  O  O6  1  0.3283  0.1461  0.7651  1.0
  O  O7  1  0.6265  0.8477  0.2435  1.0
  O  O8  1  0.7430  0.3289  0.7532  1.0
  O  O9  1  0.8420  0.2863  0.2385  1.0
]