data_[Sm4Tm4Pd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Tm  1.2500  1.7500  1.0950
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.2038]
_cell_length_b [3.7972]
_cell_length_c [8.1439]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.9150]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SmTmPd]
_chemical_formula_sum '[Sm4 Tm4 Pd4]'
_cell_volume [313.1856]
_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
[
  Sm  Sm0  4  0.1582  0.0000  0.0676  1.0
  Tm  Tm1  4  0.0911  0.5000  0.3833  1.0
  Pd  Pd2  4  0.1324  0.0000  0.6765  1.0
]