data_[Pm12Ho12In4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pm  1.1300  1.8500  1.1100
  Ho  1.2300  1.7500  1.0410
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [13.4324]
_cell_length_b [5.2296]
_cell_length_c [12.7319]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Pm3Ho3In]
_chemical_formula_sum '[Pm12 Ho12 In4]'
_cell_volume [894.3601]
_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
[
  Pm  Pm0  4  0.0899  0.2500  0.3104  1
  Pm  Pm1  4  0.1762  0.7500  0.7296  1
  Pm  Pm2  4  0.1886  0.7500  0.1216  1
  Ho  Ho3  4  0.0202  0.2500  0.0676  1
  Ho  Ho4  4  0.0529  0.2500  0.5715  1
  Ho  Ho5  4  0.2258  0.7500  0.4389  1
  In  In6  4  0.0525  0.2500  0.8177  1
]