data_[Sc5Si7Pt9]
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 [P-6]
_cell_length_a [10.0120]
_cell_length_b [10.0120]
_cell_length_c [3.9120]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [174]
_chemical_formula_structural [Sc5Si7Pt9]
_chemical_formula_sum '[Sc5 Si7 Pt9]'
_cell_volume [339.6049]
_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
[
  Sc  Sc0  3  0.2291  0.1251  0.5000  1
  Sc  Sc1  1  0.3333  0.6667  0.0000  1
  Sc  Sc2  1  0.6667  0.3333  0.5000  1
  Si  Si3  3  0.1434  0.7165  0.5000  1
  Si  Si4  3  0.4276  0.1138  0.0000  1
  Si  Si5  1  0.0000  0.0000  0.0000  1
  Pt  Pt6  3  0.0513  0.4485  0.5000  1
  Pt  Pt7  3  0.1226  0.2841  0.0000  1
  Pt  Pt8  3  0.4339  0.3522  0.0000  1
]