data_[Sr12Li8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
]
_symmetry_space_group_name_H-M [P4_2/mnm]
_cell_length_a [9.7166]
_cell_length_b [9.7166]
_cell_length_c [8.7338]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [136]
_chemical_formula_structural [Sr3Li2]
_chemical_formula_sum '[Sr12 Li8]'
_cell_volume [824.5750]
_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
[
  Sr  Sr0  4  0.0000  0.5000  0.2500  1.0
  Sr  Sr1  4  0.1497  0.8503  0.0000  1.0
  Sr  Sr2  4  0.2115  0.7885  0.5000  1.0
  Li  Li3  8  0.1128  0.1128  0.3181  1.0
]