data_[Pr4Hg5Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Hg  2.0000  1.5000  1.2450
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.8938]
_cell_length_b [3.8362]
_cell_length_c [9.9749]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.5822]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Pr4Hg5Au2]
_chemical_formula_sum '[Pr4 Hg5 Au2]'
_cell_volume [301.0950]
_cell_formula_units_Z [1]
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  2  0.1823  0.5000  0.8676  1.0
  Pr  Pr1  2  0.2434  0.5000  0.4317  1.0
  Hg  Hg2  2  0.1687  0.0000  0.1447  1.0
  Hg  Hg3  2  0.4527  0.0000  0.6819  1.0
  Hg  Hg4  1  0.5000  0.0000  0.0000  1.0
  Au  Au5  2  0.0715  0.0000  0.6351  1.0
]