data_[Ba2Pa2Os2N8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Pa  1.5000  1.8000  1.0400
  Os  2.2000  1.3000  0.6730
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.1008]
_cell_length_b [5.6093]
_cell_length_c [7.4091]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.8561]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [BaPaOsN4]
_chemical_formula_sum '[Ba2 Pa2 Os2 N8]'
_cell_volume [242.6530]
_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
[
  Ba  Ba0  2  0.2801  0.2500  0.0535  1
  Pa  Pa1  2  0.2051  0.2500  0.5261  1
  Os  Os2  2  0.2513  0.7500  0.3320  1
  N  N3  4  0.0020  0.0189  0.6903  1
  N  N4  2  0.4317  0.7500  0.1748  1
  N  N5  2  0.4544  0.7500  0.5676  1
]