data_[Sc2Sb4Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Sb  2.0500  1.4500  0.8300
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [14.3700]
_cell_length_b [4.0116]
_cell_length_c [4.2431]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.4605]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [ScSb2Pb]
_chemical_formula_sum '[Sc2 Sb4 Pb2]'
_cell_volume [244.5896]
_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  2  0.4622  0.0000  0.6311  1
  Sb  Sb1  2  0.0092  0.0000  0.1332  1
  Sb  Sb2  2  0.3053  0.5000  0.6185  1
  Pb  Pb3  2  0.2233  0.0000  0.1172  1
]