data_[Ac8La2As10]
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
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.9766]
_cell_length_b [4.5194]
_cell_length_c [11.0650]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.4874]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac4LaAs5]
_chemical_formula_sum '[Ac8 La2 As10]'
_cell_volume [651.9257]
_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  0.1008  0.5000  0.3994  1
  Ac  Ac1  4  0.1995  0.0000  0.8021  1
  La  La2  2  0.0000  0.0000  0.0000  1
  As  As3  4  0.0963  0.5000  0.9031  1
  As  As4  4  0.1980  0.0000  0.2948  1
  As  As5  2  0.0000  0.0000  0.5000  1
]