data_[Tb2Re2Hg2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Re  1.9000  1.3500  0.7125
  Hg  2.0000  1.5000  1.2450
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [5.6671]
_cell_length_b [10.0467]
_cell_length_c [5.3423]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.6817]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [TbReHgO6]
_chemical_formula_sum '[Tb2 Re2 Hg2 O12]'
_cell_volume [291.3623]
_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
[
  Tb  Tb0  2  0.0000  0.3308  0.5000  1.0
  Re  Re1  2  0.0000  0.6809  0.5000  1.0
  Hg  Hg2  2  0.0000  0.0226  0.0000  1.0
  O  O3  4  0.1759  0.5155  0.7088  1.0
  O  O4  4  0.2104  0.7937  0.7229  1.0
  O  O5  4  0.2204  0.6738  0.3006  1.0
]