data_[Sm2Ho24Er10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Ho  1.2300  1.7500  1.0410
  Er  1.2400  1.7500  1.0300
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.1210]
_cell_length_b [10.5990]
_cell_length_c [17.2555]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.7857]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SmHo12Er5]
_chemical_formula_sum '[Sm2 Ho24 Er10]'
_cell_volume [1111.6282]
_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  2  0.0000  0.0000  0.0000  1
  Ho  Ho1  8  0.1115  0.3333  0.3330  1
  Ho  Ho2  8  0.2233  0.1671  0.1670  1
  Ho  Ho3  4  0.1114  0.0000  0.3329  1
  Ho  Ho4  4  0.2218  0.5000  0.1670  1
  Er  Er5  4  0.0000  0.1665  0.5000  1
  Er  Er6  4  0.0000  0.3333  0.0000  1
  Er  Er7  2  0.0000  0.5000  0.5000  1
]