data_[Tb6Hg2Rh2]
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 [P-1]
_cell_length_a [5.5538]
_cell_length_b [6.2536]
_cell_length_c [8.6925]
_cell_angle_alpha [101.1248]
_cell_angle_beta [99.6765]
_cell_angle_gamma [114.7679]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Tb3HgRh]
_chemical_formula_sum '[Tb6 Hg2 Rh2]'
_cell_volume [258.2659]
_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  0.1981  0.6960  0.8907  1.0
  Tb  Tb1  2  0.2111  0.0557  0.2684  1.0
  Tb  Tb2  2  0.4507  0.3135  0.7147  1.0
  Hg  Hg3  2  0.1565  0.7544  0.5181  1.0
  Rh  Rh4  2  0.2563  0.2583  0.0036  1.0
]