data_[Pm16Al24In8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [7.4946]
_cell_length_b [9.3179]
_cell_length_c [16.1565]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Pm2Al3In]
_chemical_formula_sum '[Pm16 Al24 In8]'
_cell_volume [1128.2705]
_cell_formula_units_Z [8]
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
[
  Pm  Pm0  8  0.2499  0.0000  0.0000  1
  Pm  Pm1  8  0.2500  0.2500  0.2500  1
  Al  Al2  16  0.0000  0.2447  0.0818  1
  Al  Al3  8  0.0000  0.0000  0.1632  1
  In  In4  8  0.0000  0.0000  0.3334  1
]