data_[Na3Pr3Er12Se24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Pr  1.1300  1.8500  1.0600
  Er  1.2400  1.7500  1.0300
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [R3m]
_cell_length_a [8.4109]
_cell_length_b [8.4109]
_cell_length_c [21.0815]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [160]
_chemical_formula_structural [NaPr(ErSe2)4]
_chemical_formula_sum '[Na3 Pr3 Er12 Se24]'
_cell_volume [1291.5705]
_cell_formula_units_Z [3]
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
[
  Na  Na0  3  0.0000  0.0000  0.3719  1.0
  Pr  Pr1  3  0.0000  0.0000  0.0045  1.0
  Er  Er2  9  0.1733  0.3466  0.8318  1.0
  Er  Er3  3  0.0000  0.0000  0.6266  1.0
  Se  Se4  9  0.0202  0.5101  0.7574  1.0
  Se  Se5  9  0.1734  0.3469  0.5774  1.0
  Se  Se6  3  0.0000  0.0000  0.2389  1.0
  Se  Se7  3  0.0000  0.0000  0.7585  1.0
]