data_[La8Pm4Er16Sc4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Pm  1.1300  1.8500  1.1100
  Er  1.2400  1.7500  1.0300
  Sc  1.3600  1.6000  0.8850
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [6.7510]
_cell_length_b [11.7861]
_cell_length_c [13.1081]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [La2PmEr4Sc]
_chemical_formula_sum '[La8 Pm4 Er16 Sc4]'
_cell_volume [1042.9823]
_cell_formula_units_Z [4]
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  0.0000  0.5000  1
  La  La1  4  0.2500  0.2500  0.7500  1
  Pm  Pm2  4  0.0000  0.0000  0.0000  1
  Er  Er3  8  0.0000  0.0186  0.2499  1
  Er  Er4  8  0.2485  0.2500  0.0151  1
  Sc  Sc5  4  0.2500  0.2500  0.2500  1
]