data_[Ho12Tm16Sc8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Tm  1.2500  1.7500  1.0950
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [16.6735]
_cell_length_b [9.7239]
_cell_length_c [6.5933]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.2351]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Ho3(Tm2Sc)2]
_chemical_formula_sum '[Ho12 Tm16 Sc8]'
_cell_volume [1067.2709]
_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
[
  Ho  Ho0  8  0.1527  0.0456  0.7394  1.0
  Ho  Ho1  4  0.0000  0.4884  0.7500  1.0
  Tm  Tm2  8  0.0167  0.1807  0.0140  1.0
  Tm  Tm3  8  0.1883  0.3762  0.9092  1.0
  Sc  Sc4  8  0.1647  0.2874  0.3920  1.0
]