data_[Li2U2Pa2N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  U  1.3800  1.7500  0.9913
  Pa  1.5000  1.8000  1.0400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.8855]
_cell_length_b [3.3196]
_cell_length_c [7.1540]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.6271]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiUPaN3]
_chemical_formula_sum '[Li2 U2 Pa2 N6]'
_cell_volume [160.1607]
_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  0.4171  0.2500  0.9235  1
  U  U1  2  0.1940  0.7500  0.6580  1
  Pa  Pa2  2  0.2107  0.7500  0.1773  1
  N  N3  2  0.1330  0.2500  0.8867  1
  N  N4  2  0.1469  0.2500  0.4073  1
  N  N5  2  0.4816  0.2500  0.1988  1
]