data_[Sc10Tl4Cd4Ag2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Tl  1.6200  1.9000  1.3325
  Cd  1.6900  1.5500  1.0900
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [12.0429]
_cell_length_b [12.0429]
_cell_length_c [3.3018]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Sc5Tl2Cd2Ag]
_chemical_formula_sum '[Sc10 Tl4 Cd4 Ag2]'
_cell_volume [478.8662]
_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  8  0.0022  0.1990  0.5000  1
  Sc  Sc1  2  0.0000  0.5000  0.5000  1
  Tl  Tl2  4  0.1628  0.3372  0.0000  1
  Cd  Cd3  4  0.1575  0.6575  0.0000  1
  Ag  Ag4  2  0.0000  0.0000  0.0000  1
]