data_Tl2HgW
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.38
_cell_length_b   11.38
_cell_length_c   11.38
_cell_angle_alpha   15.59
_cell_angle_beta   15.59
_cell_angle_gamma   15.59
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2HgW
_chemical_formula_sum   'Tl2 Hg1 W1'
_cell_volume   92.71
_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  Tl1  1  0.0  0.0  0.58  1.0
  Tl  Tl2  1  0.0  0.0  0.64  1.0
  Hg  Hg0  1  0.0  0.0  0.1  1.0
  W  W3  1  0.0  0.0  0.95  1.0

data_Tl2HgW
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.35
_cell_length_b   3.09
_cell_length_c   11.38
_cell_angle_alpha   90.0
_cell_angle_beta   99.01
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Tl2HgW
_chemical_formula_sum   'Tl4 Hg2 W2'
_cell_volume   185.42
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  0.0  0.0  0.36  1.0
  Tl  Tl1  2  0.0  0.0  0.42  1.0
  Hg  Hg2  2  0.0  0.0  0.9  1.0
  W  W3  2  0.0  0.0  0.05  1.0

Tl Tl Hg W