data_[Tb6Rh2Br6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Rh  2.2800  1.3500  0.7450
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.6004]
_cell_length_b [4.0858]
_cell_length_c [11.9182]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.5470]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Tb3RhBr3]
_chemical_formula_sum '[Tb6 Rh2 Br6]'
_cell_volume [418.6468]
_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  0.1015  0.2500  0.8303  1
  Tb  Tb1  2  0.1445  0.2500  0.3632  1
  Tb  Tb2  2  0.2734  0.7500  0.6034  1
  Rh  Rh3  2  0.0583  0.2500  0.5977  1
  Br  Br4  2  0.1335  0.2500  0.0997  1
  Br  Br5  2  0.3437  0.7500  0.8571  1
  Br  Br6  2  0.4296  0.7500  0.3699  1
]