data_[Sr24In8Hg4]
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
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [11.2266]
_cell_length_b [11.4131]
_cell_length_c [11.5056]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Sr6In2Hg]
_chemical_formula_sum '[Sr24 In8 Hg4]'
_cell_volume [1474.2203]
_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  8  0.0000  0.2890  0.3321  1
  Sr  Sr1  8  0.1729  0.2574  0.0000  1
  Sr  Sr2  8  0.1967  0.0000  0.2574  1
  In  In3  4  0.0000  0.5000  0.1254  1
  In  In4  4  0.1442  0.5000  0.5000  1
  Hg  Hg5  2  0.0000  0.0000  0.0000  1
  Hg  Hg6  2  0.0000  0.0000  0.5000  1
]