data_CoNiPb2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71
_cell_length_b   4.71
_cell_length_c   4.71
_cell_angle_alpha   125.27
_cell_angle_beta   115.36
_cell_angle_gamma   89.67
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoNiPb2
_chemical_formula_sum   'Co1 Ni1 Pb2'
_cell_volume   72.85
_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  Co0  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.0  0.0  0.34  1.0
  Pb  Pb2  1  0.17  0.0  0.67  1.0
  Pb  Pb3  1  0.0  0.52  0.67  1.0

data_CoNiPb2
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.33
_cell_length_b   4.71
_cell_length_c   4.71
_cell_angle_alpha   64.64
_cell_angle_beta   62.63
_cell_angle_gamma   62.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoNiPb2
_chemical_formula_sum   'Co1 Ni1 Pb2'
_cell_volume   72.85
_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  Co0  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.0  0.0  0.34  1.0
  Pb  Pb2  1  0.0  0.83  0.67  1.0
  Pb  Pb3  1  0.52  0.0  0.15  1.0

Co Ni Pb Pb