data_[Ho2Er2Pa2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Er  1.2400  1.7500  1.0300
  Pa  1.5000  1.8000  1.0400
]
_symmetry_space_group_name_H-M [P6/mmm]
_cell_length_a [5.4104]
_cell_length_b [5.4104]
_cell_length_c [6.7731]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [191]
_chemical_formula_structural [HoErPa]
_chemical_formula_sum '[Ho2 Er2 Pa2]'
_cell_volume [171.7048]
_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
[
  Ho  Ho0  2  0.3333  0.6667  0.0000  1
  Er  Er1  2  0.0000  0.0000  0.2613  1
  Pa  Pa2  2  0.3333  0.6667  0.5000  1
]