data_[Sm3Dy4Er5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Dy  1.2200  1.7500  1.1310
  Er  1.2400  1.7500  1.0300
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.1399]
_cell_length_b [7.0949]
_cell_length_c [8.6827]
_cell_angle_alpha [89.9945]
_cell_angle_beta [89.8608]
_cell_angle_gamma [89.8584]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Sm3Dy4Er5]
_chemical_formula_sum '[Sm3 Dy4 Er5]'
_cell_volume [378.2322]
_cell_formula_units_Z [1]
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  0.3335  0.2500  0.1667  1
  Sm  Sm1  1  0.5000  0.5000  0.5000  1
  Dy  Dy2  2  0.1669  1.0000  0.8323  1
  Dy  Dy3  2  0.3322  0.7507  0.1670  1
  Er  Er4  2  0.0008  0.7504  0.5000  1
  Er  Er5  2  0.1653  0.4998  0.8324  1
  Er  Er6  1  0.5000  0.0000  0.5000  1
]