data_[La6Sm8Er6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Sm  1.1700  1.8500  1.2290
  Er  1.2400  1.7500  1.0300
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [3.7956]
_cell_length_b [13.5286]
_cell_length_c [13.4735]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [La3Sm4Er3]
_chemical_formula_sum '[La6 Sm8 Er6]'
_cell_volume [691.8609]
_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
[
  La  La0  4  0.0000  0.2441  0.2485  1
  La  La1  2  0.5000  0.0000  0.8288  1
  Sm  Sm2  4  0.0000  0.1279  0.0042  1
  Sm  Sm3  2  0.0000  0.0000  0.3734  1
  Sm  Sm4  2  0.0000  0.0000  0.6230  1
  Er  Er5  4  0.5000  0.1698  0.4988  1
  Er  Er6  2  0.5000  0.0000  0.1717  1
]