data_[Li4Al2Re2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Al  1.6100  1.2500  0.6750
  Re  1.9000  1.3500  0.7125
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [5.0329]
_cell_length_b [5.2166]
_cell_length_c [8.8506]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.7396]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Li2AlReO6]
_chemical_formula_sum '[Li4 Al2 Re2 O12]'
_cell_volume [190.9473]
_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  4  0.2458  0.5343  0.7527  1
  Al  Al1  2  0.5000  0.0000  0.0000  1
  Re  Re2  2  0.0000  0.0000  0.5000  1
  O  O3  4  0.1350  0.6979  0.4437  1
  O  O4  4  0.2544  0.1958  0.4473  1
  O  O5  4  0.3567  0.5297  0.2495  1
]