data_[Tm4Cd8Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Cd  1.6900  1.5500  1.0900
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.7887]
_cell_length_b [15.7960]
_cell_length_c [5.3271]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Tm(CdPd)2]
_chemical_formula_sum '[Tm4 Cd8 Pd8]'
_cell_volume [402.9530]
_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  4  0.0000  0.3618  0.9801  1.0
  Cd  Cd1  4  0.0000  0.0159  0.2618  1.0
  Cd  Cd2  4  0.0000  0.1641  0.9505  1.0
  Pd  Pd3  4  0.0000  0.2436  0.4617  1.0
  Pd  Pd4  4  0.0000  0.4456  0.4801  1.0
]