data_[Sm24Tm4Sc2]
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
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P4/nbm]
_cell_length_a [6.4828]
_cell_length_b [6.4828]
_cell_length_c [24.9374]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [125]
_chemical_formula_structural [Sm12Tm2Sc]
_chemical_formula_sum '[Sm24 Tm4 Sc2]'
_cell_volume [1048.0351]
_cell_formula_units_Z [2]
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  8  0.1682  0.3318  0.4369  1
  Sm  Sm1  8  0.1854  0.3146  0.1089  1
  Sm  Sm2  4  0.0000  0.0000  0.2113  1
  Sm  Sm3  4  0.0000  0.0000  0.3350  1
  Tm  Tm4  4  0.0000  0.5000  0.2700  1
  Sc  Sc5  2  0.0000  0.5000  0.0000  1
]