data_[Pr4Nd2Dy6S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  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 [17.5651]
_cell_length_b [3.9553]
_cell_length_c [8.0849]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.7136]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pr2Nd(DyS2)3]
_chemical_formula_sum '[Pr4 Nd2 Dy6 S12]'
_cell_volume [543.2842]
_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
[
  Pr  Pr0  4  0.1667  0.0000  0.3334  1.0
  Nd  Nd1  2  0.0000  0.5000  0.0000  1.0
  Dy  Dy2  4  0.1669  0.0000  0.8333  1.0
  Dy  Dy3  2  0.0000  0.5000  0.5000  1.0
  S  S4  4  0.0043  0.0000  0.7412  1.0
  S  S5  4  0.1624  0.5000  0.5941  1.0
  S  S6  4  0.1701  0.5000  0.0720  1.0
]