data_[Tb12Hg4Rh2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Hg  2.0000  1.5000  1.2450
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [6.9835]
_cell_length_b [7.3478]
_cell_length_c [12.3803]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.8449]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Tb6Hg2Rh]
_chemical_formula_sum '[Tb12 Hg4 Rh2]'
_cell_volume [527.6235]
_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  4  0.1299  0.1959  0.4493  1.0
  Tb  Tb1  4  0.2536  0.6889  0.4457  1.0
  Tb  Tb2  4  0.3622  0.0129  0.2457  1.0
  Hg  Hg3  4  0.2069  0.0910  0.7468  1.0
  Rh  Rh4  2  0.5000  0.0000  0.5000  1.0
]