data_[Tb12Zn4Ru4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Zn  1.6500  1.3500  0.8800
  Ru  2.2000  1.3000  0.6610
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [7.9791]
_cell_length_b [5.8108]
_cell_length_c [11.0153]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9063]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Tb3ZnRu]
_chemical_formula_sum '[Tb12 Zn4 Ru4]'
_cell_volume [510.4379]
_cell_formula_units_Z [4]
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  4  0.0277  0.1229  0.3524  1.0
  Tb  Tb1  4  0.2603  0.5848  0.4252  1.0
  Tb  Tb2  4  0.3802  0.1026  0.6244  1.0
  Zn  Zn3  4  0.3215  0.6031  0.7008  1.0
  Ru  Ru4  4  0.0858  0.1548  0.0966  1.0
]