data_[Li8Re2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Re  1.9000  1.3500  0.7125
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0958]
_cell_length_b [5.1472]
_cell_length_c [7.7302]
_cell_angle_alpha [71.9947]
_cell_angle_beta [84.1904]
_cell_angle_gamma [68.1805]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li4ReO4]
_chemical_formula_sum '[Li8 Re2 O8]'
_cell_volume [178.9923]
_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  2  0.2154  0.8282  0.7661  1
  Li  Li1  2  0.2409  0.4744  0.5852  1
  Li  Li2  2  0.2429  0.0549  0.4266  1
  Li  Li3  2  0.2430  0.2570  0.9978  1
  Re  Re4  2  0.2494  0.6406  0.2010  1
  O  O5  2  0.0099  0.7987  0.3825  1
  O  O6  2  0.0191  0.4062  0.2016  1
  O  O7  2  0.3416  0.8537  0.9825  1
  O  O8  2  0.4843  0.3061  0.3926  1
]