data_[Tb8Si12Pd36]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tb  1.1000  1.7500  0.9815
  Si  1.9000  1.1000  0.5400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.3110]
_cell_length_b [7.6356]
_cell_length_c [10.0174]
_cell_angle_alpha [90.0000]
_cell_angle_beta [116.0949]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tb2(SiPd3)3]
_chemical_formula_sum '[Tb8 Si12 Pd36]'
_cell_volume [914.3601]
_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  8  0.1714  0.4146  0.7491  1
  Si  Si1  8  0.0862  0.2602  0.0004  1
  Si  Si2  4  0.2500  0.2500  0.5000  1
  Pd  Pd3  8  0.0579  0.4297  0.4221  1
  Pd  Pd4  8  0.1015  0.0907  0.5459  1
  Pd  Pd5  8  0.1081  0.1868  0.2472  1
  Pd  Pd6  8  0.2291  0.0887  0.9274  1
  Pd  Pd7  4  0.0000  0.1389  0.7500  1
]