data_[Sm24Er4Sc10]
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 [16.7657]
_cell_length_b [6.9178]
_cell_length_c [10.8962]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.4896]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm12Er2Sc5]
_chemical_formula_sum '[Sm24 Er4 Sc10]'
_cell_volume [1217.8526]
_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  8  0.1887  0.2409  0.5954  1
  Sm  Sm1  8  0.2001  0.2566  0.1106  1
  Sm  Sm2  4  0.0839  0.5000  0.3191  1
  Sm  Sm3  4  0.1027  0.0000  0.8154  1
  Er  Er4  4  0.0000  0.2595  0.0000  1
  Sc  Sc5  4  0.1141  0.0000  0.3000  1
  Sc  Sc6  4  0.1203  0.5000  0.8294  1
  Sc  Sc7  2  0.0000  0.0000  0.5000  1
]