data_[Pr16Ga24Hg8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ga  1.8100  1.3000  0.7600
  Hg  2.0000  1.5000  1.2450
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [8.1426]
_cell_length_b [9.0376]
_cell_length_c [15.6609]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Pr2Ga3Hg]
_chemical_formula_sum '[Pr16 Ga24 Hg8]'
_cell_volume [1152.4866]
_cell_formula_units_Z [8]
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
[
  Pr  Pr0  8  0.2466  0.0000  0.5000  1.0
  Pr  Pr1  8  0.2500  0.2500  0.2500  1.0
  Ga  Ga2  16  0.0000  0.2422  0.0808  1.0
  Ga  Ga3  8  0.0000  0.0000  0.1613  1.0
  Hg  Hg4  8  0.0000  0.0000  0.3329  1.0
]