data_[La4Be2Ag4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Be  1.5700  1.0500  0.5900
  Ag  1.9300  1.6000  1.0867
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [6.8283]
_cell_length_b [6.8283]
_cell_length_c [5.0995]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [La2BeAg2]
_chemical_formula_sum '[La4 Be2 Ag4]'
_cell_volume [237.7682]
_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
[
  La  La0  4  0.1690  0.6690  0.5000  1
  Be  Be1  2  0.0000  0.0000  0.0000  1
  Ag  Ag2  4  0.1487  0.3513  0.0000  1
]