data_[Hg2Mo2Pb2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Mo  2.1600  1.4500  0.7750
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [3.2785]
_cell_length_b [5.6416]
_cell_length_c [8.0334]
_cell_angle_alpha [93.6347]
_cell_angle_beta [91.5751]
_cell_angle_gamma [105.3541]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [HgMoPb]
_chemical_formula_sum '[Hg2 Mo2 Pb2]'
_cell_volume [142.8458]
_cell_formula_units_Z [2]
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  1  0.2048  0.9947  0.2116  1
  Hg  Hg1  1  0.8841  0.3287  0.9880  1
  Mo  Mo2  1  0.0147  0.6598  0.7098  1
  Mo  Mo3  1  0.5834  0.7734  0.9247  1
  Pb  Pb4  1  0.4674  0.5510  0.3578  1
  Pb  Pb5  1  0.7006  0.0985  0.6292  1
]