data_[Th4Pa4N14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Pa  1.5000  1.8000  1.0400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [Cmmm]
_cell_length_a [7.6723]
_cell_length_b [8.1398]
_cell_length_c [5.5150]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [65]
_chemical_formula_structural [Th2Pa2N7]
_chemical_formula_sum '[Th4 Pa4 N14]'
_cell_volume [344.4214]
_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
[
  Th  Th0  4  0.2385  0.5000  0.5000  1
  Pa  Pa1  4  0.0000  0.2687  0.0000  1
  N  N2  8  0.2500  0.2500  0.2471  1
  N  N3  4  0.0000  0.5000  0.2421  1
  N  N4  2  0.0000  0.0000  0.0000  1
]