data_[Li8Pm6In8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Pm  1.1300  1.8500  1.1100
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [3.4687]
_cell_length_b [5.0042]
_cell_length_c [31.1002]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Li4Pm3In4]
_chemical_formula_sum '[Li8 Pm6 In8]'
_cell_volume [539.8442]
_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
[
  Li  Li0  4  0.0000  0.0000  0.2390  1
  Li  Li1  4  0.0000  0.5000  0.0934  1
  Pm  Pm2  4  0.0000  0.5000  0.3571  1
  Pm  Pm3  2  0.0000  0.0000  0.5000  1
  In  In4  4  0.0000  0.0000  0.0502  1
  In  In5  4  0.0000  0.5000  0.1838  1
]