data_[Hg6Pb5]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.3453]
_cell_length_b [6.5237]
_cell_length_c [8.3475]
_cell_angle_alpha [67.2668]
_cell_angle_beta [77.3288]
_cell_angle_gamma [83.1349]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Hg6Pb5]
_chemical_formula_sum '[Hg6 Pb5]'
_cell_volume [310.7041]
_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
[
  Hg  Hg0  2  0.1322  0.9496  0.1497  1
  Hg  Hg1  2  0.1747  0.4412  0.3569  1
  Hg  Hg2  2  0.4848  0.7537  0.8967  1
  Pb  Pb3  2  0.2398  0.8824  0.5696  1
  Pb  Pb4  2  0.3682  0.3064  0.7099  1
  Pb  Pb5  1  0.0000  0.5000  0.0000  1
]