data_[Sm4Y2Er2In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Y  1.2200  1.8000  1.0400
  Er  1.2400  1.7500  1.0300
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pmc2_1]
_cell_length_a [5.2346]
_cell_length_b [9.9024]
_cell_length_c [6.8131]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [26]
_chemical_formula_structural [Sm2YErIn2]
_chemical_formula_sum '[Sm4 Y2 Er2 In4]'
_cell_volume [353.1620]
_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  0.1811  0.3205  1.0
  Sm  Sm1  2  0.5000  0.0378  0.0419  1.0
  Y  Y2  2  0.0000  0.4621  0.9725  1.0
  Er  Er3  2  0.5000  0.3202  0.6937  1.0
  In  In4  2  0.0000  0.1494  0.7955  1.0
  In  In5  2  0.5000  0.3636  0.2214  1.0
]