data_[Ac6Nd4Dy2S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Nd  1.1400  1.8500  1.2765
  Dy  1.2200  1.7500  1.1310
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.1647]
_cell_length_b [12.4343]
_cell_length_c [7.2618]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.3199]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ac3Nd2DyS6]
_chemical_formula_sum '[Ac6 Nd4 Dy2 S12]'
_cell_volume [610.5106]
_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  0.0000  0.1699  0.5000  1
  Ac  Ac1  2  0.0000  0.5000  0.5000  1
  Nd  Nd2  4  0.0000  0.3334  0.0000  1
  Dy  Dy3  2  0.0000  0.0000  0.0000  1
  S  S4  8  0.2378  0.1621  0.2280  1
  S  S5  4  0.2468  0.0000  0.7683  1
]