data_[Li2La2Pr2Se6]
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
  Pr  1.1300  1.8500  1.0600
  Se  2.5500  1.1500  1.0133
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.7625]
_cell_length_b [4.1255]
_cell_length_c [9.0284]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.1159]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [LiLaPrSe3]
_chemical_formula_sum '[Li2 La2 Pr2 Se6]'
_cell_volume [319.1051]
_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  0.0862  0.2500  0.5850  1.0
  La  La1  2  0.1792  0.2500  0.2210  1.0
  Pr  Pr2  2  0.3386  0.7500  0.8355  1.0
  Se  Se3  2  0.0937  0.2500  0.8666  1.0
  Se  Se4  2  0.2080  0.7500  0.4940  1.0
  Se  Se5  2  0.4197  0.7500  0.1775  1.0
]