data_[Sc14Ag6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sc  1.3600  1.6000  0.8850
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P6_3mc]
_cell_length_a [8.9306]
_cell_length_b [8.9306]
_cell_length_c [6.6234]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [186]
_chemical_formula_structural [Sc7Ag3]
_chemical_formula_sum '[Sc14 Ag6]'
_cell_volume [457.4804]
_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  6  0.0685  0.5342  0.8310  1.0
  Sc  Sc1  6  0.1218  0.2436  0.5666  1.0
  Sc  Sc2  2  0.3333  0.6667  0.4776  1.0
  Ag  Ag3  6  0.2135  0.4270  0.1406  1.0
]