data_[Sc4Si8Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Si  1.9000  1.1000  0.5400
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [6.4071]
_cell_length_b [4.1138]
_cell_length_c [10.4613]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [ScSi2Pt]
_chemical_formula_sum '[Sc4 Si8 Pt4]'
_cell_volume [275.7323]
_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
[
  Sc  Sc0  4  0.1648  0.2500  0.3042  1.0
  Si  Si1  4  0.0360  0.2500  0.8383  1.0
  Si  Si2  4  0.1871  0.7500  0.4972  1.0
  Pt  Pt3  4  0.1603  0.2500  0.6169  1.0
]