data_[Tm4Ni2Pd2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Ni  1.9100  1.3500  0.7400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [4.3275]
_cell_length_b [6.9032]
_cell_length_c [5.4647]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Tm2NiPd]
_chemical_formula_sum '[Tm4 Ni2 Pd2]'
_cell_volume [163.2524]
_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  2  0.0000  0.4339  0.6360  1
  Tm  Tm1  2  0.0000  0.9264  0.8608  1
  Ni  Ni2  2  0.0000  0.2902  0.1446  1
  Pd  Pd3  2  0.0000  0.7913  0.3586  1
]