data_[Ce4Pd16N2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Pd  2.2000  1.4000  0.8462
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.4557]
_cell_length_b [16.4635]
_cell_length_c [5.3807]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Ce2Pd8N]
_chemical_formula_sum '[Ce4 Pd16 N2]'
_cell_volume [394.7125]
_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  4  0.5000  0.1205  0.4871  1
  Pd  Pd1  4  0.0000  0.1008  0.0272  1
  Pd  Pd2  4  0.0000  0.2409  0.7301  1
  Pd  Pd3  4  0.5000  0.1985  0.9931  1
  Pd  Pd4  2  0.0000  0.0000  0.6182  1
  Pd  Pd5  2  0.5000  0.0000  0.9768  1
  N  N6  2  0.0000  0.0000  0.2437  1
]