data_[Li2Pa2Re2N8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pa  1.5000  1.8000  1.0400
  Re  1.9000  1.3500  0.7125
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.7265]
_cell_length_b [5.6764]
_cell_length_c [6.4110]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.9007]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiPaReN4]
_chemical_formula_sum '[Li2 Pa2 Re2 N8]'
_cell_volume [195.9507]
_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
[
  Li  Li0  2  0.1288  0.2500  0.4855  1
  Pa  Pa1  2  0.2388  0.2500  0.0411  1
  Re  Re2  2  0.3022  0.7500  0.3305  1
  N  N3  4  0.0623  0.5092  0.2309  1
  N  N4  2  0.4508  0.7500  0.6279  1
  N  N5  2  0.4964  0.2500  0.8407  1
]