data_[Li4Tm2Re2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Tm  1.2500  1.7500  1.0950
  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 [5.3029]
_cell_length_b [5.5471]
_cell_length_c [9.3988]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.3706]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Li2TmReO6]
_chemical_formula_sum '[Li4 Tm2 Re2 O12]'
_cell_volume [228.2003]
_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  0.2506  0.5068  0.7564  1.0
  Tm  Tm1  2  0.5000  0.0000  0.0000  1.0
  Re  Re2  2  0.0000  0.0000  0.5000  1.0
  O  O3  4  0.1065  0.5494  0.2289  1.0
  O  O4  4  0.2180  0.2039  0.0678  1.0
  O  O5  4  0.3614  0.6618  0.0591  1.0
]