data_ScSnBi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.04
_cell_length_b   6.04
_cell_length_c   5.68
_cell_angle_alpha   101.72
_cell_angle_beta   101.72
_cell_angle_gamma   33.05
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScSnBi2
_chemical_formula_sum   'Sc1 Sn1 Bi2'
_cell_volume   110.3
_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
  Sc  Sc2  1  0.0  0.0  0.0  1.0
  Sn  Sn3  1  0.19  0.0  0.77  1.0
  Bi  Bi0  1  0.22  0.0  0.3  1.0
  Bi  Bi1  1  0.15  0.0  0.25  1.0

data_ScSnBi2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.43
_cell_length_b   5.68
_cell_length_c   6.04
_cell_angle_alpha   101.72
_cell_angle_beta   106.52
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScSnBi2
_chemical_formula_sum   'Sc1 Sn1 Bi2'
_cell_volume   110.3
_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
  Sc  Sc0  1  0.0  0.0  0.0  1.0
  Sn  Sn1  1  0.0  0.77  0.19  1.0
  Bi  Bi2  1  0.0  0.25  0.15  1.0
  Bi  Bi3  1  0.0  0.3  0.22  1.0

Sc Sn Bi Bi