data_[Sm8Hf4Sc4Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Hf  1.3000  1.5500  0.8500
  Sc  1.3600  1.6000  0.8850
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [6.5208]
_cell_length_b [13.7537]
_cell_length_c [6.5103]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Sm2HfScPt2]
_chemical_formula_sum '[Sm8 Hf4 Sc4 Pt8]'
_cell_volume [583.8710]
_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
[
  Sm  Sm0  8  0.2455  0.1856  0.0000  1.0
  Hf  Hf1  4  0.0000  0.5000  0.2500  1.0
  Sc  Sc2  4  0.0000  0.0000  0.2500  1.0
  Pt  Pt3  8  0.2428  0.3941  0.0000  1.0
]