data_[Sm4Y12Er10]
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
]
_symmetry_space_group_name_H-M [Pbam]
_cell_length_a [11.6888]
_cell_length_b [20.1747]
_cell_length_c [3.5792]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [55]
_chemical_formula_structural [Sm2Y6Er5]
_chemical_formula_sum '[Sm4 Y12 Er10]'
_cell_volume [844.0505]
_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  0.1648  0.7876  0.0000  1
  Y  Y1  4  0.0570  0.0801  0.0000  1
  Y  Y2  4  0.0845  0.3684  0.0000  1
  Y  Y3  4  0.1750  0.6303  0.5000  1
  Er  Er4  4  0.0934  0.2255  0.5000  1
  Er  Er5  4  0.1991  0.9509  0.5000  1
  Er  Er6  2  0.0000  0.5000  0.5000  1
]