data_[Sr24Hg12H4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Hg  2.0000  1.5000  1.2450
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [13.0326]
_cell_length_b [15.7524]
_cell_length_c [7.4349]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Sr6Hg3H]
_chemical_formula_sum '[Sr24 Hg12 H4]'
_cell_volume [1526.3437]
_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  0.1592  0.2740  0.8101  1.0
  Sr  Sr1  8  0.1755  0.4656  0.3086  1.0
  Sr  Sr2  4  0.0000  0.0571  0.8857  1.0
  Sr  Sr3  4  0.0000  0.2370  0.2971  1.0
  Hg  Hg4  8  0.1557  0.1042  0.5125  1.0
  Hg  Hg5  4  0.0000  0.4067  0.6057  1.0
  H  H6  4  0.0000  0.2127  0.9636  1.0
]