data_[Ac2Y4Er14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Y  1.2200  1.8000  1.0400
  Er  1.2400  1.7500  1.0300
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [5.4474]
_cell_length_b [7.0779]
_cell_length_c [16.7672]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [AcY2Er7]
_chemical_formula_sum '[Ac2 Y4 Er14]'
_cell_volume [646.4793]
_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
[
  Ac  Ac0  2  0.0000  0.0000  0.0000  1
  Y  Y1  4  0.0000  0.5000  0.2003  1
  Er  Er2  8  0.0000  0.2454  0.3885  1
  Er  Er3  4  0.0000  0.0000  0.2033  1
  Er  Er4  2  0.0000  0.5000  0.0000  1
]