data_[Re1Hg2Pb1]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Re  1.9000  1.3500  0.7125
  Hg  2.0000  1.5000  1.2450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Pm]
_cell_length_a [3.0393]
_cell_length_b [4.9482]
_cell_length_c [5.9047]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.3311]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [6]
_chemical_formula_structural [ReHg2Pb]
_chemical_formula_sum '[Re1 Hg2 Pb1]'
_cell_volume [86.4080]
_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
[
  Re  Re0  1  0.6644  0.5000  0.7311  1
  Hg  Hg1  1  0.4162  0.5000  0.2099  1
  Hg  Hg2  1  0.8174  0.0000  0.0172  1
  Pb  Pb3  1  0.1019  0.0000  0.5418  1
]