data_[Er24Tm8Sc8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  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 [19.3502]
_cell_length_b [9.5238]
_cell_length_c [6.3998]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.3972]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Er3TmSc]
_chemical_formula_sum '[Er24 Tm8 Sc8]'
_cell_volume [1177.3313]
_cell_formula_units_Z [8]
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
[
  Er  Er0  8  0.0754  0.4427  0.9028  1.0
  Er  Er1  8  0.1455  0.1014  0.0889  1.0
  Er  Er2  8  0.1609  0.2530  0.5751  1.0
  Tm  Tm3  4  0.0000  0.1084  0.7500  1.0
  Tm  Tm4  4  0.0000  0.2451  0.2500  1.0
  Sc  Sc5  8  0.2186  0.4334  0.1787  1.0
]