data_[Zn6In1Ag6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [5.1656]
_cell_length_b [5.1656]
_cell_length_c [9.7286]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [191]
_chemical_formula_structural [Zn6InAg6]
_chemical_formula_sum '[Zn6 In1 Ag6]'
_cell_volume [224.8167]
_cell_formula_units_Z [1]
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
[
  Zn  Zn0  6  0.0000  0.5000  0.2498  1.0
  In  In1  1  0.0000  0.0000  0.0000  1.0
  Ag  Ag2  2  0.0000  0.0000  0.3583  1.0
  Ag  Ag3  2  0.3333  0.6667  0.0000  1.0
  Ag  Ag4  2  0.3333  0.6667  0.5000  1.0
]