data_[Ce2In4Pd12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  In  1.7800  1.5500  0.9400
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [3.8876]
_cell_length_b [12.9979]
_cell_length_c [6.7346]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Ce(InPd3)2]
_chemical_formula_sum '[Ce2 In4 Pd12]'
_cell_volume [340.3002]
_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
[
  Ce  Ce0  2  0.5000  0.0000  0.1047  1
  In  In1  4  0.0000  0.1476  0.4669  1
  Pd  Pd2  4  0.0000  0.1556  0.0638  1
  Pd  Pd3  4  0.5000  0.2011  0.7623  1
  Pd  Pd4  2  0.0000  0.0000  0.7933  1
  Pd  Pd5  2  0.5000  0.0000  0.5160  1
]