data_[Tm16Ag2Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.4599]
_cell_length_b [5.0282]
_cell_length_c [6.7752]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.8348]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm8AgPd2]
_chemical_formula_sum '[Tm16 Ag2 Pd4]'
_cell_volume [572.2372]
_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
[
  Tm  Tm0  4  0.0331  0.0000  0.7737  1.0
  Tm  Tm1  4  0.0928  0.5000  0.4663  1.0
  Tm  Tm2  4  0.1708  0.5000  0.9774  1.0
  Tm  Tm3  4  0.2014  0.0000  0.3259  1.0
  Ag  Ag4  2  0.0000  0.5000  0.0000  1.0
  Pd  Pd5  4  0.1863  0.0000  0.7243  1.0
]