data_[Tb8Ru4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ru  2.2000  1.3000  0.6610
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.0864]
_cell_length_b [7.9062]
_cell_length_c [8.4905]
_cell_angle_alpha [116.2292]
_cell_angle_beta [100.9741]
_cell_angle_gamma [97.3282]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Tb4Ru2Pb]
_chemical_formula_sum '[Tb8 Ru4 Pb2]'
_cell_volume [349.2474]
_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  1  0.2145  0.0098  0.4105  1.0
  Tb  Tb1  1  0.3026  0.4910  0.3673  1.0
  Tb  Tb2  1  0.4182  0.3010  0.8978  1.0
  Tb  Tb3  1  0.5060  0.7252  0.8411  1.0
  Tb  Tb4  1  0.7162  0.1662  0.2819  1.0
  Tb  Tb5  1  0.7926  0.0831  0.6737  1.0
  Tb  Tb6  1  0.9008  0.6454  0.5651  1.0
  Tb  Tb7  1  0.9984  0.5737  0.9521  1.0
  Ru  Ru8  1  0.1099  0.3659  0.6177  1.0
  Ru  Ru9  1  0.3164  0.9058  0.6751  1.0
  Ru  Ru10  1  0.5954  0.3699  0.6130  1.0
  Ru  Ru11  1  0.8760  0.3664  0.1156  1.0
  Pb  Pb12  1  0.0906  0.0217  0.0017  1.0
  Pb  Pb13  1  0.6624  0.7248  0.2373  1.0
]