data_MgCo2Pb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.16
_cell_length_b   5.16
_cell_length_c   4.44
_cell_angle_alpha   110.95
_cell_angle_beta   110.95
_cell_angle_gamma   36.66
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCo2Pb
_chemical_formula_sum   'Mg1 Co2 Pb1'
_cell_volume   65.36
_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
  Mg  Mg2  1  0.12  0.0  0.18  1.0
  Co  Co0  1  0.59  0.0  0.01  1.0
  Co  Co1  1  0.47  0.0  0.09  1.0
  Pb  Pb3  1  0.81  0.0  0.88  1.0

data_MgCo2Pb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.25
_cell_length_b   4.44
_cell_length_c   5.16
_cell_angle_alpha   110.95
_cell_angle_beta   108.33
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCo2Pb
_chemical_formula_sum   'Mg1 Co2 Pb1'
_cell_volume   65.36
_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
  Mg  Mg0  1  0.0  0.18  0.12  1.0
  Co  Co1  1  0.0  0.01  0.59  1.0
  Co  Co2  1  0.0  0.09  0.47  1.0
  Pb  Pb3  1  0.0  0.88  0.81  1.0

Mg Co Co Pb