data_[Tb9Pb3C2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Pb  2.3300  1.8000  1.1225
  C  2.5500  0.7000  0.3000
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [6.9815]
_cell_length_b [6.9815]
_cell_length_c [8.5592]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Tb9Pb3C2]
_chemical_formula_sum '[Tb9 Pb3 C2]'
_cell_volume [361.3005]
_cell_formula_units_Z [1]
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  6  0.1699  0.3398  0.6697  1
  Tb  Tb1  3  0.0000  0.5000  0.0000  1
  Pb  Pb2  2  0.3333  0.6667  0.3328  1
  Pb  Pb3  1  0.0000  0.0000  0.0000  1
  C  C4  2  0.3333  0.6667  0.8290  1
]