data_[Tm4Ga12Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ga  1.8100  1.3000  0.7600
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [8.2329]
_cell_length_b [4.2158]
_cell_length_c [10.7557]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [TmGa3Pd]
_chemical_formula_sum '[Tm4 Ga12 Pd4]'
_cell_volume [373.3094]
_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  0.1967  0.2500  0.9882  1.0
  Ga  Ga1  4  0.0759  0.2500  0.4025  1.0
  Ga  Ga2  4  0.1036  0.7500  0.1807  1.0
  Ga  Ga3  4  0.1273  0.7500  0.7949  1.0
  Pd  Pd4  4  0.0959  0.2500  0.6430  1.0
]