data_[Li8Nb1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Nb  1.6000  1.4500  0.8200
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.4194]
_cell_length_b [5.4926]
_cell_length_c [6.0172]
_cell_angle_alpha [90.7094]
_cell_angle_beta [116.1728]
_cell_angle_gamma [119.3787]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li8NbO6]
_chemical_formula_sum '[Li8 Nb1 O6]'
_cell_volume [133.9493]
_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  0.1297  0.2354  0.6390  1.0
  Li  Li1  2  0.2599  0.4938  0.3639  1.0
  Li  Li2  2  0.3056  0.6419  0.9747  1.0
  Li  Li3  2  0.4099  0.8969  0.6448  1.0
  Nb  Nb4  1  0.0000  0.0000  0.0000  1.0
  O  O5  2  0.1351  0.9067  0.7550  1.0
  O  O6  2  0.1549  0.7635  0.2438  1.0
  O  O7  2  0.4799  0.3902  0.2417  1.0
]