data_[Sc16Os4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Os  2.2000  1.3000  0.6730
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Imm2]
_cell_length_a [4.8754]
_cell_length_b [14.7847]
_cell_length_c [6.5999]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [Sc8Os2Pb]
_chemical_formula_sum '[Sc16 Os4 Pb2]'
_cell_volume [475.7240]
_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
[
  Sc  Sc0  4  0.0000  0.1161  0.8077  1
  Sc  Sc1  4  0.0000  0.2911  0.4933  1
  Sc  Sc2  4  0.0000  0.3260  0.9452  1
  Sc  Sc3  2  0.0000  0.0000  0.3672  1
  Sc  Sc4  2  0.0000  0.5000  0.6051  1
  Os  Os5  4  0.0000  0.1689  0.1877  1
  Pb  Pb6  2  0.0000  0.5000  0.1642  1
]