data_Co2BiPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.0
_cell_length_b   5.34
_cell_length_c   5.34
_cell_angle_alpha   42.39
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Co2BiPb
_chemical_formula_sum   'Co2 Bi1 Pb1'
_cell_volume   76.82
_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
  Co  Co1  1  0.0  0.0  0.84  1.0
  Co  Co2  1  0.0  0.0  0.1  1.0
  Bi  Bi0  1  0.0  0.0  0.03  1.0
  Pb  Pb3  1  0.0  0.0  0.9  1.0

data_Co2BiPb
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.86
_cell_length_b   4.0
_cell_length_c   5.34
_cell_angle_alpha   90.0
_cell_angle_beta   111.19
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Co2BiPb
_chemical_formula_sum   'Co2 Bi1 Pb1'
_cell_volume   76.82
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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
  Co  Co0  1  0.16  0.0  0.16  1.0
  Co  Co1  1  0.9  0.0  0.9  1.0
  Bi  Bi2  1  0.97  0.0  0.97  1.0
  Pb  Pb3  1  0.1  0.0  0.1  1.0

Co Co Bi Pb
Co Co Bi Pb 0 3 o o o 1 2 o o o 