data_[La2Pr6Pa4N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  Pa  1.5000  1.8000  1.0400
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.8290]
_cell_length_b [3.6240]
_cell_length_c [7.2797]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.3313]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [LaPr3(PaN3)2]
_chemical_formula_sum '[La2 Pr6 Pa4 N12]'
_cell_volume [406.3478]
_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
[
  La  La0  2  0.0000  0.5000  0.0000  1
  Pr  Pr1  4  0.1675  0.0000  0.8373  1
  Pr  Pr2  2  0.0000  0.5000  0.5000  1
  Pa  Pa3  4  0.1672  0.0000  0.3320  1
  N  N4  4  0.0193  0.0000  0.2626  1
  N  N5  4  0.1674  0.5000  0.1179  1
  N  N6  4  0.1747  0.5000  0.5578  1
]