data_[Ac2La4Th6As12]
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
  Th  1.3000  1.8000  1.0800
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.5053]
_cell_length_b [12.9823]
_cell_length_c [7.5338]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.3876]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AcLa2(ThAs2)3]
_chemical_formula_sum '[Ac2 La4 Th6 As12]'
_cell_volume [692.4402]
_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  0.0000  0.3331  0.0000  1
  Ac  Ac1  2  0.0000  0.0000  0.0000  1
  Th  Th2  4  0.0000  0.1656  0.5000  1
  Th  Th3  2  0.0000  0.5000  0.5000  1
  As  As4  8  0.2432  0.3308  0.7372  1
  As  As5  4  0.2487  0.5000  0.2615  1
]