data_[La4B2Sb2Pt12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  B  2.0400  0.8500  0.4100
  Sb  2.0500  1.4500  0.8300
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [12.1062]
_cell_length_b [5.7098]
_cell_length_c [7.2132]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.1504]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [La2BSbPt6]
_chemical_formula_sum '[La4 B2 Sb2 Pt12]'
_cell_volume [402.6101]
_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  2  0.2358  0.0000  0.7713  1.0
  La  La1  2  0.2864  0.5000  0.2549  1.0
  B  B2  2  0.4409  0.5000  0.9767  1.0
  Sb  Sb3  2  0.4839  0.0000  0.5022  1.0
  Pt  Pt4  4  0.0041  0.2555  0.8294  1.0
  Pt  Pt5  4  0.0364  0.2506  0.2484  1.0
  Pt  Pt6  2  0.2220  0.0000  0.1869  1.0
  Pt  Pt7  2  0.2509  0.5000  0.6484  1.0
]