data_[Ce8Pa2N14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ce  1.1200  1.8500  1.0800
  Pa  1.5000  1.8000  1.0400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.5576]
_cell_length_b [3.4935]
_cell_length_c [9.7580]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.7243]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Ce4PaN7]
_chemical_formula_sum '[Ce8 Pa2 N14]'
_cell_volume [375.2918]
_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  0.1140  0.0000  0.4155  1
  Ce  Ce1  2  0.1865  0.5000  0.8170  1
  Ce  Ce2  2  0.3110  0.0000  0.1844  1
  Ce  Ce3  2  0.4977  0.5000  0.9992  1
  Pa  Pa4  2  0.3912  0.5000  0.5790  1
  N  N5  2  0.0528  0.0000  0.7863  1
  N  N6  2  0.1483  0.5000  0.0377  1
  N  N7  2  0.2334  0.5000  0.3748  1
  N  N8  2  0.2808  0.0000  0.6251  1
  N  N9  2  0.3446  0.0000  0.9609  1
  N  N10  2  0.4439  0.5000  0.2112  1
  N  N11  2  0.4958  0.0000  0.5090  1
]