data_CoPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.14
_cell_length_b   5.14
_cell_length_c   7.0
_cell_angle_alpha   109.93
_cell_angle_beta   109.93
_cell_angle_gamma   35.85
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoPb
_chemical_formula_sum   'Co3 Pb3'
_cell_volume   101.0
_cell_formula_units_Z   3
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  Co0  1  0.69  0.0  0.49  1.0
  Co  Co1  1  0.04  0.0  0.3  1.0
  Co  Co2  1  0.34  0.0  0.67  1.0
  Pb  Pb3  1  0.76  0.0  0.41  1.0
  Pb  Pb4  1  0.73  0.0  0.48  1.0
  Pb  Pb5  1  0.99  0.0  0.34  1.0

data_CoPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.16
_cell_length_b   5.14
_cell_length_c   7.0
_cell_angle_alpha   109.93
_cell_angle_beta   90.0
_cell_angle_gamma   107.92
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoPb
_chemical_formula_sum   'Co3 Pb3'
_cell_volume   101.0
_cell_formula_units_Z   3
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  Co0  1  0.0  0.31  0.51  1.0
  Co  Co1  1  0.0  0.66  0.33  1.0
  Co  Co2  1  0.0  0.96  0.7  1.0
  Pb  Pb3  1  0.0  0.01  0.66  1.0
  Pb  Pb4  1  0.0  0.24  0.59  1.0
  Pb  Pb5  1  0.0  0.27  0.52  1.0

Co Co Co Pb Pb Pb