data_ScBi2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.39
_cell_length_b   11.39
_cell_length_c   11.39
_cell_angle_alpha   17.63
_cell_angle_beta   17.63
_cell_angle_gamma   17.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScBi2Pb
_chemical_formula_sum   'Sc1 Bi2 Pb1'
_cell_volume   118.26
_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  Sc3  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.0  0.0  0.76  1.0
  Bi  Bi1  1  0.0  0.0  0.86  1.0
  Pb  Pb2  1  0.0  0.0  0.81  1.0

data_ScBi2Pb
_symmetry_space_group_name_H-M   Cm
_cell_length_a   6.05
_cell_length_b   3.49
_cell_length_c   11.39
_cell_angle_alpha   90.0
_cell_angle_beta   100.19
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ScBi2Pb
_chemical_formula_sum   'Sc2 Bi4 Pb2'
_cell_volume   236.52
_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
  Sc  Sc0  2  0.0  0.0  0.0  1.0
  Bi  Bi1  2  0.0  0.0  0.14  1.0
  Bi  Bi2  2  0.0  0.0  0.24  1.0
  Pb  Pb3  2  0.0  0.0  0.19  1.0

Sc Bi Bi Pb