data_[Li2La2Sm2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  La  1.1000  1.9500  1.1720
  Sm  1.1700  1.8500  1.2290
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.3020]
_cell_length_b [3.9481]
_cell_length_c [8.5785]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.3211]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiLaSmS3]
_chemical_formula_sum '[Li2 La2 Sm2 S6]'
_cell_volume [274.7038]
_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  2  0.0872  0.2500  0.5850  1.0
  La  La1  2  0.1815  0.2500  0.2200  1.0
  Sm  Sm2  2  0.3384  0.7500  0.8334  1.0
  S  S3  2  0.0988  0.2500  0.8646  1.0
  S  S4  2  0.2061  0.7500  0.4979  1.0
  S  S5  2  0.4243  0.7500  0.1720  1.0
]