data_[Ac2La1Pr1S4]
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
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.3077]
_cell_length_b [4.1963]
_cell_length_c [7.3374]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.2901]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ac2LaPrS4]
_chemical_formula_sum '[Ac2 La1 Pr1 S4]'
_cell_volume [212.3704]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1
  Ac  Ac1  1  0.0000  0.5000  0.5000  1
  Ac  Ac2  1  0.5000  0.0000  0.5000  1
  Pr  Pr3  1  0.5000  0.5000  0.0000  1
  S  S4  2  0.2472  0.5000  0.2391  1
  S  S5  2  0.2547  0.0000  0.7612  1
]