data_[Rb4Sr2Al4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Sr  0.9500  2.0000  1.3200
  Al  1.6100  1.2500  0.6750
]
_symmetry_space_group_name_H-M [P4/mbm]
_cell_length_a [10.2087]
_cell_length_b [10.2087]
_cell_length_c [3.8417]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [127]
_chemical_formula_structural [Rb2SrAl2]
_chemical_formula_sum '[Rb4 Sr2 Al4]'
_cell_volume [400.3706]
_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
[
  Rb  Rb0  4  0.1226  0.3774  0.0000  1
  Sr  Sr1  2  0.0000  0.0000  0.0000  1
  Al  Al2  4  0.1806  0.6806  0.5000  1
]