data_TlAgBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.52
_cell_length_b   4.79
_cell_length_c   7.12
_cell_angle_alpha   90.0
_cell_angle_beta   100.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlAgBi2
_chemical_formula_sum   'Tl1 Ag1 Bi2'
_cell_volume   117.73
_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  Tl3  1  0.33  0.0  0.5  1.0
  Ag  Ag0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.19  0.39  0.51  1.0
  Bi  Bi2  1  0.98  0.39  0.48  1.0

data_TlAgBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.52
_cell_length_b   4.79
_cell_length_c   7.12
_cell_angle_alpha   90.0
_cell_angle_beta   100.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlAgBi2
_chemical_formula_sum   'Tl1 Ag1 Bi2'
_cell_volume   117.73
_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  0.33  0.0  0.5  1.0
  Ag  Ag1  1  0.0  0.0  0.0  1.0
  Bi  Bi2  1  0.19  0.39  0.51  1.0
  Bi  Bi3  1  0.98  0.39  0.48  1.0

Tl Ag Bi Bi