data_[La8In12Ag16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  In  1.7800  1.5500  0.9400
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [Cmce]
_cell_length_a [6.3476]
_cell_length_b [16.9797]
_cell_length_c [8.2014]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [La2In3Ag4]
_chemical_formula_sum '[La8 In12 Ag16]'
_cell_volume [883.9451]
_cell_formula_units_Z [4]
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  8  0.0000  0.1060  0.5969  1.0
  In  In1  8  0.2500  0.2342  0.2500  1.0
  In  In2  4  0.0000  0.0000  0.0000  1.0
  Ag  Ag3  8  0.0000  0.1713  0.9835  1.0
  Ag  Ag4  8  0.2500  0.0642  0.2500  1.0
]