data_[Pa2P2N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pa  1.5000  1.8000  1.0400
  P  2.1900  1.0000  0.5500
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [3.8703]
_cell_length_b [5.3149]
_cell_length_c [6.0148]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.3203]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [PaPN3]
_chemical_formula_sum '[Pa2 P2 N6]'
_cell_volume [120.3976]
_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
[
  Pa  Pa0  2  0.1720  0.2500  0.8010  1
  P  P1  2  0.4244  0.2500  0.3285  1
  N  N2  4  0.3078  0.0046  0.1621  1
  N  N3  2  0.1465  0.7500  0.5664  1
]