data_Cr2CoPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66
_cell_length_b   4.66
_cell_length_c   4.66
_cell_angle_alpha   102.34
_cell_angle_beta   102.34
_cell_angle_gamma   37.3
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2CoPb
_chemical_formula_sum   'Cr2 Co1 Pb1'
_cell_volume   59.86
_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
  Cr  Cr1  1  0.33  0.0  0.76  1.0
  Cr  Cr2  1  0.45  0.0  0.79  1.0
  Co  Co0  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.89  0.0  0.27  1.0

data_Cr2CoPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.98
_cell_length_b   4.66
_cell_length_c   4.66
_cell_angle_alpha   102.34
_cell_angle_beta   108.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2CoPb
_chemical_formula_sum   'Cr2 Co1 Pb1'
_cell_volume   59.86
_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
  Cr  Cr0  1  0.0  0.76  0.33  1.0
  Cr  Cr1  1  0.0  0.79  0.45  1.0
  Co  Co2  1  0.0  0.0  0.0  1.0
  Pb  Pb3  1  0.0  0.27  0.89  1.0

Cr Cr Co Pb
Cr Cr Co Pb 0 1 o o o 2 3 - o o 