data_[Ho4Pa8Be4N20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Pa  1.5000  1.8000  1.0400
  Be  1.5700  1.0500  0.5900
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.3048]
_cell_length_b [15.3020]
_cell_length_c [9.1919]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [HoPa2BeN5]
_chemical_formula_sum '[Ho4 Pa8 Be4 N20]'
_cell_volume [464.8430]
_cell_formula_units_Z [4]
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
[
  Ho  Ho0  4  0.0000  0.2054  0.9980  1
  Pa  Pa1  4  0.0000  0.0977  0.6809  1
  Pa  Pa2  4  0.0000  0.1081  0.3023  1
  Be  Be3  4  0.0000  0.4563  0.4589  1
  N  N4  4  0.0000  0.0313  0.0406  1
  N  N5  4  0.0000  0.3153  0.6896  1
  N  N6  4  0.0000  0.3459  0.3460  1
  N  N7  4  0.0000  0.3571  0.0184  1
  N  N8  4  0.0000  0.4914  0.7893  1
]