data_[Sm6Dy2Sc8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Dy  1.2200  1.7500  1.1310
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [10.9380]
_cell_length_b [7.0684]
_cell_length_c [6.0133]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Sm3DySc4]
_chemical_formula_sum '[Sm6 Dy2 Sc8]'
_cell_volume [464.9148]
_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
[
  Sm  Sm0  4  0.2497  0.3635  0.4897  1.0
  Sm  Sm1  2  0.0000  0.6369  0.6395  1.0
  Dy  Dy2  2  0.0000  0.3618  0.1386  1.0
  Sc  Sc3  4  0.2487  0.1119  0.9785  1.0
  Sc  Sc4  2  0.0000  0.1121  0.6506  1.0
  Sc  Sc5  2  0.0000  0.8879  0.1501  1.0
]