data_[Sr24In18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  In  1.7800  1.5500  0.9400
]
_symmetry_space_group_name_H-M [R-3]
_cell_length_a [15.5554]
_cell_length_b [15.5554]
_cell_length_c [7.1299]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [148]
_chemical_formula_structural [Sr4In3]
_chemical_formula_sum '[Sr24 In18]'
_cell_volume [1494.1001]
_cell_formula_units_Z [6]
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  18  0.0524  0.2549  0.1679  1
  Sr  Sr1  3  0.0000  0.0000  0.0000  1
  Sr  Sr2  3  0.0000  0.0000  0.5000  1
  In  In3  18  0.0470  0.2218  0.6738  1
]