data_[In2Ga8Ag2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.1833]
_cell_length_b [6.3373]
_cell_length_c [8.4832]
_cell_angle_alpha [96.8886]
_cell_angle_beta [100.5256]
_cell_angle_gamma [110.7947]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [InGa4Ag]
_chemical_formula_sum '[In2 Ga8 Ag2]'
_cell_volume [250.8898]
_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
[
  In  In0  2  0.1602  0.7782  0.9948  1.0
  Ga  Ga1  2  0.0385  0.5788  0.3441  1.0
  Ga  Ga2  2  0.2639  0.1677  0.8198  1.0
  Ga  Ga3  2  0.4446  0.3815  0.1624  1.0
  Ga  Ga4  2  0.4725  0.0657  0.3511  1.0
  Ag  Ag5  1  0.0000  0.0000  0.5000  1.0
  Ag  Ag6  1  0.5000  0.5000  0.5000  1.0
]