data_[Tb6Al16Pd6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Al  1.6100  1.2500  0.6750
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.7302]
_cell_length_b [4.4294]
_cell_length_c [9.2080]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.3005]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tb3Al8Pd3]
_chemical_formula_sum '[Tb6 Al16 Pd6]'
_cell_volume [523.6000]
_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  4  0.2133  0.5000  0.7047  1
  Tb  Tb1  2  0.0000  0.0000  0.0000  1
  Al  Al2  4  0.0047  0.5000  0.6725  1
  Al  Al3  4  0.1351  0.0000  0.4248  1
  Al  Al4  4  0.1490  0.0000  0.8643  1
  Al  Al5  4  0.1519  0.5000  0.2826  1
  Pd  Pd6  4  0.1495  0.5000  0.0039  1
  Pd  Pd7  2  0.0000  0.0000  0.5000  1
]