data_Ba2CoPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.83
_cell_length_b   4.8
_cell_length_c   6.94
_cell_angle_alpha   90.0
_cell_angle_beta   108.46
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2CoPb
_chemical_formula_sum   'Ba2 Co1 Pb1'
_cell_volume   152.78
_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
  Ba  Ba0  1  0.83  0.0  0.8  1.0
  Ba  Ba1  1  0.77  0.4  0.34  1.0
  Co  Co2  1  0.14  0.0  0.89  1.0
  Pb  Pb3  1  0.21  0.4  0.85  1.0

data_Ba2CoPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.8
_cell_length_b   4.83
_cell_length_c   6.94
_cell_angle_alpha   108.46
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2CoPb
_chemical_formula_sum   'Ba2 Co1 Pb1'
_cell_volume   152.78
_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
  Ba  Ba0  1  0.0  0.17  0.2  1.0
  Ba  Ba1  1  0.6  0.23  0.66  1.0
  Co  Co2  1  0.0  0.86  0.11  1.0
  Pb  Pb3  1  0.6  0.79  0.15  1.0

Ba Ba Co Pb
Ba Ba Co Pb 0 2 + o o 0 1 o o + 0 1 o o o 0 1 o - o 1 2 o o - 1 2 o + - 1 2 + o - 1 2 + o o 1 2 + + o 1 3 o o - 1 3 + o - 1 3 + o o 2 3 o o o 