data_TaSnBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.38
_cell_length_b   3.76
_cell_length_c   8.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaSnBi2
_chemical_formula_sum   'Ta1 Sn1 Bi2'
_cell_volume   105.21
_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
  Ta  Ta3  1  0.0  0.0  0.14  1.0
  Sn  Sn2  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.69  0.88  0.86  1.0
  Bi  Bi1  1  0.69  0.88  0.41  1.0

data_TaSnBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.38
_cell_length_b   3.76
_cell_length_c   8.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TaSnBi2
_chemical_formula_sum   'Ta1 Sn1 Bi2'
_cell_volume   105.21
_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
  Ta  Ta0  1  0.0  0.0  0.14  1.0
  Sn  Sn1  1  0.0  0.0  0.0  1.0
  Bi  Bi2  1  0.69  0.88  0.41  1.0
  Bi  Bi3  1  0.69  0.88  0.86  1.0

Ta Sn Bi Bi
Ta Sn Bi Bi 0 1 o o o 0 3 - - o 1 2 - - - 