data_[Sr4Al6In2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Al  1.6100  1.2500  0.6750
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.3595]
_cell_length_b [4.8894]
_cell_length_c [7.9348]
_cell_angle_alpha [90.0000]
_cell_angle_beta [133.8889]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Sr2Al3In]
_chemical_formula_sum '[Sr4 Al6 In2]'
_cell_volume [317.6154]
_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  0.0464  0.5000  0.2954  1.0
  Sr  Sr1  2  0.4525  0.0000  0.7016  1.0
  Al  Al2  2  0.1525  0.0000  0.0859  1.0
  Al  Al3  2  0.1703  0.0000  0.7431  1.0
  Al  Al4  2  0.3385  0.5000  0.8955  1.0
  In  In5  2  0.3397  0.5000  0.2786  1.0
]