data_[Ac2La10N10]
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
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.8683]
_cell_length_b [5.3814]
_cell_length_c [7.5311]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.0384]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AcLa5N5]
_chemical_formula_sum '[Ac2 La10 N10]'
_cell_volume [457.3545]
_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  4  0.1716  0.5000  0.8475  1
  La  La1  4  0.1742  0.5000  0.3327  1
  Ac  Ac2  2  0.0000  0.0000  0.0000  1
  La  La3  2  0.0000  0.0000  0.5000  1
  N  N4  4  0.1658  0.0000  0.3487  1
  N  N5  4  0.1781  0.0000  0.8350  1
  N  N6  2  0.0000  0.5000  0.0000  1
]