data_[Tb3B2Pd1Pt9]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  B  2.0400  0.8500  0.4100
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [5.6986]
_cell_length_b [5.6986]
_cell_length_c [9.5168]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Tb3B2PdPt9]
_chemical_formula_sum '[Tb3 B2 Pd1 Pt9]'
_cell_volume [267.6405]
_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  2  0.3333  0.6667  0.6004  1
  Tb  Tb1  1  0.0000  0.0000  0.0000  1
  B  B2  2  0.3333  0.6667  0.1468  1
  Pd  Pd3  1  0.0000  0.0000  0.5000  1
  Pt  Pt4  6  0.1636  0.3271  0.2778  1
  Pt  Pt5  3  0.0000  0.5000  0.0000  1
]