data_LaCo2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.08
_cell_length_b   3.08
_cell_length_c   7.12
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.53
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaCo2Pd
_chemical_formula_sum   'La1 Co2 Pd1'
_cell_volume   67.55
_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  La2  1  0.15  0.0  0.64  1.0
  Co  Co0  1  0.15  0.0  0.89  1.0
  Co  Co1  1  0.0  0.0  0.87  1.0
  Pd  Pd3  1  0.0  0.0  0.39  1.0

data_LaCo2Pd
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.08
_cell_length_b   3.08
_cell_length_c   7.12
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   LaCo2Pd
_chemical_formula_sum   'La1 Co2 Pd1'
_cell_volume   67.58
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  La0  1  0.15  0.0  0.64  1.0
  Co  Co1  1  0.0  0.0  0.87  1.0
  Co  Co2  1  0.15  0.0  0.89  1.0
  Pd  Pd3  1  0.0  0.0  0.39  1.0

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