data_[Sc3Zn24Ag18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Zn  1.6500  1.3500  0.8800
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [7.6043]
_cell_length_b [7.6043]
_cell_length_c [15.5548]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Sc(Zn4Ag3)2]
_chemical_formula_sum '[Sc3 Zn24 Ag18]'
_cell_volume [778.9471]
_cell_formula_units_Z [3]
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  0.0000  0.0000  0.0000  1.0
  Zn  Zn1  18  0.0036  0.6840  0.1381  1.0
  Zn  Zn2  6  0.0000  0.0000  0.2172  1.0
  Ag  Ag3  18  0.0292  0.7900  0.6373  1.0
]