data_[Tm9Cd3Cu24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tm  1.2500  1.7500  1.0950
  Cd  1.6900  1.5500  1.0900
  Cu  1.9000  1.3500  0.8200
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [5.1452]
_cell_length_b [5.1452]
_cell_length_c [25.2576]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [Tm3CdCu8]
_chemical_formula_sum '[Tm9 Cd3 Cu24]'
_cell_volume [579.0611]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.0056  1
  Tm  Tm1  3  0.0000  0.0000  0.4948  1
  Tm  Tm2  3  0.0000  0.0000  0.6213  1
  Cd  Cd3  3  0.0000  0.0000  0.1282  1
  Cu  Cu4  9  0.0010  0.5005  0.5629  1
  Cu  Cu5  9  0.1696  0.3392  0.3954  1
  Cu  Cu6  3  0.0000  0.0000  0.3132  1
  Cu  Cu7  3  0.0000  0.0000  0.8120  1
]