data_HfCo2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99
_cell_length_b   4.99
_cell_length_c   2.81
_cell_angle_alpha   100.78
_cell_angle_beta   100.78
_cell_angle_gamma   116.74
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfCo2Pd
_chemical_formula_sum   'Hf1 Co2 Pd1'
_cell_volume   58.55
_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
  Hf  Hf2  1  0.62  0.0  0.0  1.0
  Co  Co0  1  0.81  0.13  0.31  1.0
  Co  Co1  1  0.81  0.87  0.31  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0

data_HfCo2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.81
_cell_length_b   4.98
_cell_length_c   4.99
_cell_angle_alpha   116.46
_cell_angle_beta   100.78
_cell_angle_gamma   100.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfCo2Pd
_chemical_formula_sum   'Hf1 Co2 Pd1'
_cell_volume   58.55
_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
  Hf  Hf0  1  0.0  0.0  0.62  1.0
  Co  Co1  1  0.19  0.87  0.68  1.0
  Co  Co2  1  0.44  0.13  0.93  1.0
  Pd  Pd3  1  0.0  0.0  0.0  1.0

Hf Co Co Pd