data_[La8Ga8Ag16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [4.6781]
_cell_length_b [9.4830]
_cell_length_c [16.8880]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [LaGaAg2]
_chemical_formula_sum '[La8 Ga8 Ag16]'
_cell_volume [749.1845]
_cell_formula_units_Z [8]
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
[
  La  La0  4  0.0000  0.2287  0.0000  1.0
  La  La1  4  0.0000  0.5000  0.2091  1.0
  Ga  Ga2  8  0.0000  0.2379  0.3484  1.0
  Ag  Ag3  8  0.0000  0.1481  0.8146  1.0
  Ag  Ag4  4  0.0000  0.0000  0.4224  1.0
  Ag  Ag5  4  0.0000  0.5000  0.4148  1.0
]