data_TlHgPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.99
_cell_length_b   5.99
_cell_length_c   5.99
_cell_angle_alpha   146.01
_cell_angle_beta   132.36
_cell_angle_gamma   59.8
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlHgPb
_chemical_formula_sum   'Tl1 Hg1 Pb1'
_cell_volume   87.93
_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
  Tl  Tl2  1  0.0  0.0  0.48  1.0
  Hg  Hg0  1  0.0  0.0  0.38  1.0
  Pb  Pb1  1  0.0  0.0  0.9  1.0

data_TlHgPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.5
_cell_length_b   4.84
_cell_length_c   5.99
_cell_angle_alpha   113.82
_cell_angle_beta   107.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlHgPb
_chemical_formula_sum   'Tl1 Hg1 Pb1'
_cell_volume   87.93
_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
  Tl  Tl0  1  0.0  0.48  0.48  1.0
  Hg  Hg1  1  0.0  0.38  0.38  1.0
  Pb  Pb2  1  0.0  0.9  0.9  1.0

Tl Hg Pb
Tl Hg Pb 0 1 o o o 0 2 o o o 1 2 o o o 1 2 o o - 