data_[Sm8Dy2Sc6]
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 [11.2566]
_cell_length_b [6.0428]
_cell_length_c [7.0034]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [Sm4DySc3]
_chemical_formula_sum '[Sm8 Dy2 Sc6]'
_cell_volume [476.3861]
_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  0.2490  0.9994  0.0600  1.0
  Sm  Sm1  2  0.0000  0.1745  0.8105  1.0
  Sm  Sm2  2  0.0000  0.6627  0.5598  1.0
  Dy  Dy3  2  0.0000  0.6624  0.0633  1.0
  Sc  Sc4  4  0.2466  0.4954  0.3107  1.0
  Sc  Sc5  2  0.0000  0.1679  0.3096  1.0
]