data_[Ac5Tm1Cd4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Tm  1.2500  1.7500  1.0950
  Cd  1.6900  1.5500  1.0900
]
_symmetry_space_group_name_H-M [P4/mmm]
_cell_length_a [4.0513]
_cell_length_b [4.0513]
_cell_length_c [21.1732]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [123]
_chemical_formula_structural [Ac5TmCd4]
_chemical_formula_sum '[Ac5 Tm1 Cd4]'
_cell_volume [347.5138]
_cell_formula_units_Z [1]
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
[
  Ac  Ac0  2  0.5000  0.5000  0.1118  1
  Ac  Ac1  2  0.5000  0.5000  0.3058  1
  Ac  Ac2  1  0.5000  0.5000  0.5000  1
  Tm  Tm3  1  0.0000  0.0000  0.0000  1
  Cd  Cd4  2  0.0000  0.0000  0.2066  1
  Cd  Cd5  2  0.0000  0.0000  0.4035  1
]