data_[Li2Y4Re2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Y  1.2200  1.8000  1.0400
  Re  1.9000  1.3500  0.7125
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.7966]
_cell_length_b [5.4793]
_cell_length_c [5.4573]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.7711]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LiY2ReO6]
_chemical_formula_sum '[Li2 Y4 Re2 O12]'
_cell_volume [243.5136]
_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  0.0000  0.5000  0.5000  1
  Y  Y1  4  0.2499  0.5000  0.2868  1
  Re  Re2  2  0.0000  0.0000  0.0000  1
  O  O3  8  0.0738  0.2473  0.3200  1
  O  O4  4  0.2248  0.0000  0.0945  1
]