data_[Sm8Er6Sc10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Er  1.2400  1.7500  1.0300
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.4668]
_cell_length_b [5.7026]
_cell_length_c [9.3084]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.6536]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm4Er3Sc5]
_chemical_formula_sum '[Sm8 Er6 Sc10]'
_cell_volume [713.4909]
_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  0.0891  0.0000  0.9498  1
  Sm  Sm1  4  0.2121  0.0000  0.3854  1
  Er  Er2  4  0.2279  0.0000  0.7602  1
  Er  Er3  2  0.0000  0.5000  0.5000  1
  Sc  Sc4  4  0.0606  0.5000  0.2025  1
  Sc  Sc5  4  0.1663  0.5000  0.8612  1
  Sc  Sc6  2  0.0000  0.0000  0.5000  1
]