data_[In2Pd6Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0941]
_cell_length_b [5.5631]
_cell_length_c [7.2240]
_cell_angle_alpha [83.3779]
_cell_angle_beta [73.2457]
_cell_angle_gamma [74.1697]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [InPd3Pb]
_chemical_formula_sum '[In2 Pd6 Pb2]'
_cell_volume [188.4447]
_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
[
  In  In0  2  0.1569  0.6365  0.8018  1
  Pd  Pd1  2  0.0457  0.1675  0.8299  1
  Pd  Pd2  2  0.2855  0.4112  0.4380  1
  Pd  Pd3  2  0.4346  0.2652  0.0413  1
  Pb  Pb4  2  0.3449  0.9074  0.3490  1
]