data_CoPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.92
_cell_length_b   3.92
_cell_length_c   4.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoPd
_chemical_formula_sum   'Co2 Pd2'
_cell_volume   61.09
_cell_formula_units_Z   2
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  0.3  1.0
  Co  Co1  1  0.0  0.0  0.0  1.0
  Pd  Pd2  1  0.96  0.13  0.44  1.0
  Pd  Pd3  1  0.0  0.26  0.15  1.0

data_CoPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.92
_cell_length_b   3.92
_cell_length_c   4.59
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CoPd
_chemical_formula_sum   'Co2 Pd2'
_cell_volume   61.09
_cell_formula_units_Z   2
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
  Co  Co1  1  0.0  0.0  0.3  1.0
  Pd  Pd2  1  0.0  0.26  0.15  1.0
  Pd  Pd3  1  0.96  0.13  0.44  1.0

Co Co Pd Pd
Co Co Pd Pd 0 2 - o o 0 1 o o o 0 3 o o o 1 3 o o o 2 3 + o o 