data_[Sm2Ho4Sc3]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Ho  1.2300  1.7500  1.0410
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [P3m1]
_cell_length_a [3.4948]
_cell_length_b [3.4948]
_cell_length_c [25.3574]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [156]
_chemical_formula_structural [Sm2Ho4Sc3]
_chemical_formula_sum '[Sm2 Ho4 Sc3]'
_cell_volume [268.2064]
_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
[
  Sm  Sm0  1  0.0000  0.0000  0.0861  1
  Sm  Sm1  1  0.0000  0.0000  0.8726  1
  Ho  Ho2  1  0.0000  0.0000  0.2247  1
  Ho  Ho3  1  0.0000  0.0000  0.4325  1
  Ho  Ho4  1  0.3333  0.6667  0.5463  1
  Ho  Ho5  1  0.3333  0.6667  0.7554  1
  Sc  Sc6  1  0.0000  0.0000  0.6511  1
  Sc  Sc7  1  0.3333  0.6667  0.3276  1
  Sc  Sc8  1  0.3333  0.6667  0.9809  1
]