data_[Tm20Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.1609]
_cell_length_b [6.5128]
_cell_length_c [6.9767]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.8431]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Tm5Pd2]
_chemical_formula_sum '[Tm20 Pd8]'
_cell_volume [729.0819]
_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
[
  Tm  Tm0  8  0.0953  0.1156  0.4299  1.0
  Tm  Tm1  8  0.2206  0.4341  0.8070  1.0
  Tm  Tm2  4  0.0000  0.4331  0.7500  1.0
  Pd  Pd3  8  0.1105  0.2943  0.0671  1.0
]