data_[Li3U3Pa6N18]
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 [R3]
_cell_length_a [5.8936]
_cell_length_b [5.8936]
_cell_length_c [14.8874]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [146]
_chemical_formula_structural [LiU(PaN3)2]
_chemical_formula_sum '[Li3 U3 Pa6 N18]'
_cell_volume [447.8271]
_cell_formula_units_Z [3]
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  3  0.0000  0.0000  0.1959  1
  U  U1  3  0.0000  0.0000  0.6919  1
  Pa  Pa2  3  0.0000  0.0000  0.4749  1
  Pa  Pa3  3  0.0000  0.0000  0.9790  1
  N  N4  9  0.0282  0.7479  0.5888  1
  N  N5  9  0.0312  0.3574  0.7439  1
]