data_[La16Pt4N8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pt  2.2800  1.3500  0.8050
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [3.8205]
_cell_length_b [12.4480]
_cell_length_c [13.3300]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [La4PtN2]
_chemical_formula_sum '[La16 Pt4 N8]'
_cell_volume [633.9509]
_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  0.2276  0.6062  1.0
  La  La1  4  0.0000  0.0684  0.2500  1.0
  La  La2  4  0.0000  0.5000  0.0000  1.0
  Pt  Pt3  4  0.0000  0.3918  0.2500  1.0
  N  N4  8  0.0000  0.1344  0.0594  1.0
]