data_[Na2In3Pb1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  In  1.7800  1.5500  0.9400
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pmm2]
_cell_length_a [3.5317]
_cell_length_b [5.3690]
_cell_length_c [8.9064]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [25]
_chemical_formula_structural [Na2In3Pb]
_chemical_formula_sum '[Na2 In3 Pb1]'
_cell_volume [168.8814]
_cell_formula_units_Z [1]
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
[
  Na  Na0  1  0.0000  0.0000  0.5014  1.0
  Na  Na1  1  0.0000  0.5000  0.9990  1.0
  In  In2  1  0.5000  0.0000  0.1620  1.0
  In  In3  1  0.5000  0.0000  0.8287  1.0
  In  In4  1  0.5000  0.5000  0.6765  1.0
  Pb  Pb5  1  0.5000  0.5000  0.3323  1.0
]