data_[Sr2Li12Zn12]
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
  Zn  1.6500  1.3500  0.8800
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [5.2351]
_cell_length_b [9.3142]
_cell_length_c [9.5524]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Sr(LiZn)6]
_chemical_formula_sum '[Sr2 Li12 Zn12]'
_cell_volume [465.7800]
_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
[
  Sr  Sr0  2  0.0000  0.0000  0.0000  1.0
  Li  Li1  4  0.0000  0.0000  0.3460  1.0
  Li  Li2  4  0.0000  0.2862  0.5000  1.0
  Li  Li3  4  0.0000  0.3573  0.0000  1.0
  Zn  Zn4  8  0.2500  0.2500  0.2500  1.0
  Zn  Zn5  4  0.0000  0.5000  0.2705  1.0
]