data_[Tb4Ce2Ga6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Ce  1.1200  1.8500  1.0800
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.0930]
_cell_length_b [5.0930]
_cell_length_c [12.5422]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Tb2CeGa3]
_chemical_formula_sum '[Tb4 Ce2 Ga6]'
_cell_volume [281.7467]
_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  0.3333  0.6667  0.1640  1
  Tb  Tb1  1  0.0000  0.0000  0.0000  1
  Tb  Tb2  1  0.0000  0.0000  0.5000  1
  Ce  Ce3  2  0.3333  0.6667  0.6645  1
  Ga  Ga4  2  0.0000  0.0000  0.2475  1
  Ga  Ga5  2  0.3333  0.6667  0.4149  1
  Ga  Ga6  2  0.3333  0.6667  0.9175  1
]