data_CrFe2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.38
_cell_length_b   4.38
_cell_length_c   2.6
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   107.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrFe2Pd
_chemical_formula_sum   'Cr1 Fe2 Pd1'
_cell_volume   47.5
_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  0.0  0.0  1.0
  Fe  Fe1  1  0.29  0.77  0.3  1.0
  Fe  Fe2  1  0.29  0.23  0.3  1.0
  Pd  Pd3  1  0.58  0.0  0.0  1.0

data_CrFe2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.6
_cell_length_b   4.38
_cell_length_c   4.38
_cell_angle_alpha   107.72
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrFe2Pd
_chemical_formula_sum   'Cr1 Fe2 Pd1'
_cell_volume   47.5
_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  0.0  0.0  1.0
  Fe  Fe1  1  0.3  0.29  0.77  1.0
  Fe  Fe2  1  0.3  0.29  0.23  1.0
  Pd  Pd3  1  -0.0  0.58  0.0  1.0

Cr Fe Fe Pd