data_[Tm8Ge8Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ge  2.0100  1.2500  0.7700
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.5142]
_cell_length_b [4.2921]
_cell_length_c [10.1616]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.2840]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tm2Ge2Pd]
_chemical_formula_sum '[Tm8 Ge8 Pd4]'
_cell_volume [407.5566]
_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  0.0069  0.0000  0.3280  1.0
  Tm  Tm1  4  0.1840  0.0000  0.1073  1.0
  Ge  Ge2  4  0.0299  0.5000  0.8850  1.0
  Ge  Ge3  4  0.1379  0.5000  0.5706  1.0
  Pd  Pd4  4  0.2205  0.5000  0.3515  1.0
]