data_Tl2CrBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.23
_cell_length_b   6.23
_cell_length_c   5.54
_cell_angle_alpha   110.43
_cell_angle_beta   110.43
_cell_angle_gamma   32.49
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2CrBi
_chemical_formula_sum   'Tl2 Cr1 Bi1'
_cell_volume   107.57
_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  0.71  0.0  0.97  1.0
  Tl  Tl3  1  0.24  0.0  0.19  1.0
  Cr  Cr1  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.97  0.0  0.58  1.0

data_Tl2CrBi
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.48
_cell_length_b   5.54
_cell_length_c   6.23
_cell_angle_alpha   110.43
_cell_angle_beta   106.24
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tl2CrBi
_chemical_formula_sum   'Tl2 Cr1 Bi1'
_cell_volume   107.57
_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  0.19  0.24  1.0
  Tl  Tl1  1  0.0  0.97  0.71  1.0
  Cr  Cr2  1  0.0  0.0  0.0  1.0
  Bi  Bi3  1  0.0  0.58  0.97  1.0

Tl Tl Cr Bi