data_[La12In4Pt2]
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
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [Pnnm]
_cell_length_a [9.7272]
_cell_length_b [10.6350]
_cell_length_c [5.6595]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [58]
_chemical_formula_structural [La6In2Pt]
_chemical_formula_sum '[La12 In4 Pt2]'
_cell_volume [585.4648]
_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  0.0002  0.2121  0.0000  1.0
  La  La1  4  0.1364  0.5750  0.5000  1.0
  La  La2  4  0.2161  0.9384  0.5000  1.0
  In  In3  4  0.1707  0.2516  0.5000  1.0
  Pt  Pt4  2  0.0000  0.5000  0.0000  1.0
]