data_ZrBi2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97
_cell_length_b   5.97
_cell_length_c   5.91
_cell_angle_alpha   100.66
_cell_angle_beta   100.66
_cell_angle_gamma   32.95
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrBi2Pb
_chemical_formula_sum   'Zr1 Bi2 Pb1'
_cell_volume   112.59
_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
  Zr  Zr3  1  0.0  0.0  0.0  1.0
  Bi  Bi0  1  0.2  0.0  0.49  1.0
  Bi  Bi1  1  0.12  0.0  0.31  1.0
  Pb  Pb2  1  0.16  0.0  0.9  1.0

data_ZrBi2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.39
_cell_length_b   5.91
_cell_length_c   5.97
_cell_angle_alpha   100.66
_cell_angle_beta   106.48
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrBi2Pb
_chemical_formula_sum   'Zr1 Bi2 Pb1'
_cell_volume   112.59
_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
  Zr  Zr0  1  0.0  0.0  0.0  1.0
  Bi  Bi1  1  0.0  0.31  0.12  1.0
  Bi  Bi2  1  0.0  0.49  0.2  1.0
  Pb  Pb3  1  0.0  0.9  0.16  1.0

Zr Bi Bi Pb