data_[La4Pm16In2]
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
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.5104]
_cell_length_b [5.0925]
_cell_length_c [8.0989]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.1381]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La2Pm8In]
_chemical_formula_sum '[La4 Pm16 In2]'
_cell_volume [736.9423]
_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
[
  La  La0  4  0.2232  0.0000  0.6333  1
  Pm  Pm1  4  0.0428  0.0000  0.7287  1
  Pm  Pm2  4  0.0884  0.5000  0.4398  1
  Pm  Pm3  4  0.1356  0.0000  0.1748  1
  Pm  Pm4  4  0.1770  0.5000  0.9072  1
  In  In5  2  0.0000  0.5000  0.0000  1
]