data_La2CoPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.04
_cell_length_b   8.04
_cell_length_c   8.04
_cell_angle_alpha   29.4
_cell_angle_beta   29.4
_cell_angle_gamma   29.4
_symmetry_Int_Tables_number   1
_chemical_formula_structural   La2CoPd
_chemical_formula_sum   'La2 Co1 Pd1'
_cell_volume   110.92
_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
  La  La1  1  0.0  0.0  0.91  1.0
  La  La2  1  0.0  0.0  0.96  1.0
  Co  Co0  1  0.0  0.0  0.74  1.0
  Pd  Pd3  1  0.0  0.0  0.99  1.0

data_La2CoPd
_symmetry_space_group_name_H-M   Cm
_cell_length_a   7.07
_cell_length_b   4.08
_cell_length_c   8.04
_cell_angle_alpha   90.0
_cell_angle_beta   107.04
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   La2CoPd
_chemical_formula_sum   'La4 Co2 Pd2'
_cell_volume   221.85
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  La  La0  2  0.0  0.0  0.04  1.0
  La  La1  2  0.0  0.0  0.09  1.0
  Co  Co2  2  0.0  0.0  0.26  1.0
  Pd  Pd3  2  0.0  0.0  0.01  1.0

La La Co Pd
La La Co Pd 0 1 o o o 0 2 o o o 1 3 o o o 