data_[La8Pa4In4N20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pa  1.5000  1.8000  1.0400
  In  1.7800  1.5500  0.9400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [3.5938]
_cell_length_b [14.3739]
_cell_length_c [11.0310]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [La2PaInN5]
_chemical_formula_sum '[La8 Pa4 In4 N20]'
_cell_volume [569.8234]
_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
[
  La  La0  4  0.0000  0.1073  0.6926  1
  La  La1  4  0.0000  0.1304  0.2895  1
  Pa  Pa2  4  0.0000  0.2152  0.0070  1
  In  In3  4  0.0000  0.4791  0.4693  1
  N  N4  4  0.0000  0.0631  0.0615  1
  N  N5  4  0.0000  0.2770  0.6420  1
  N  N6  4  0.0000  0.3041  0.3776  1
  N  N7  4  0.0000  0.3657  0.0084  1
  N  N8  4  0.0000  0.4935  0.7762  1
]