data_[La4Be12Pt4]
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
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [I-4m2]
_cell_length_a [3.9863]
_cell_length_b [3.9863]
_cell_length_c [21.6894]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [119]
_chemical_formula_structural [LaBe3Pt]
_chemical_formula_sum '[La4 Be12 Pt4]'
_cell_volume [344.6642]
_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  2  0.0000  0.0000  0.5000  1
  La  La1  2  0.0000  0.5000  0.7500  1
  Be  Be2  8  0.0000  0.2508  0.6233  1
  Be  Be3  4  0.0000  0.0000  0.0971  1
  Pt  Pt4  4  0.0000  0.5000  0.1461  1
]