data_[Ac4La2Pr6N12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  La  1.1000  1.9500  1.1720
  Pr  1.1300  1.8500  1.0600
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [16.5152]
_cell_length_b [3.7703]
_cell_length_c [7.5652]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.3973]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac2LaPr3N6]
_chemical_formula_sum '[Ac4 La2 Pr6 N12]'
_cell_volume [458.2413]
_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
[
  Ac  Ac0  4  0.1661  0.0000  0.3294  1
  La  La1  2  0.0000  0.5000  0.0000  1
  Pr  Pr2  4  0.1626  0.0000  0.8321  1
  Pr  Pr3  2  0.0000  0.5000  0.5000  1
  N  N4  4  0.0025  0.0000  0.7505  1
  N  N5  4  0.1619  0.5000  0.5921  1
  N  N6  4  0.1627  0.5000  0.0763  1
]