data_[Na1In7Pb4]
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 [P-1]
_cell_length_a [5.6449]
_cell_length_b [7.1220]
_cell_length_c [8.8958]
_cell_angle_alpha [77.8314]
_cell_angle_beta [80.8629]
_cell_angle_gamma [89.9067]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [NaIn7Pb4]
_chemical_formula_sum '[Na1 In7 Pb4]'
_cell_volume [344.9785]
_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  0.0000  1
  In  In1  2  0.0014  0.1753  0.3324  1
  In  In2  2  0.4986  0.5915  0.6598  1
  In  In3  2  0.4988  0.2718  0.9956  1
  In  In4  1  0.0000  0.5000  0.0000  1
  Pb  Pb5  2  0.0042  0.6598  0.3305  1
  Pb  Pb6  2  0.4961  0.0688  0.6809  1
]