data_HfPd4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.92
_cell_length_b   4.92
_cell_length_c   4.92
_cell_angle_alpha   99.45
_cell_angle_beta   99.45
_cell_angle_gamma   132.2
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfPd4
_chemical_formula_sum   'Hf1 Pd4'
_cell_volume   80.72
_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  0.0  1.0
  Pd  Pd1  1  0.91  0.62  0.99  1.0
  Pd  Pd2  1  0.8  0.27  0.0  1.0
  Pd  Pd3  1  0.27  0.56  0.0  1.0
  Pd  Pd4  1  0.38  0.91  0.99  1.0

data_HfPd4
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.99
_cell_length_b   9.0
_cell_length_c   4.92
_cell_angle_alpha   90.0
_cell_angle_beta   113.9
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   HfPd4
_chemical_formula_sum   'Hf2 Pd8'
_cell_volume   161.44
_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
  Hf  Hf0  2  0.0  0.0  0.0  1.0
  Pd  Pd1  2  0.06  0.5  0.29  1.0
  Pd  Pd2  2  0.13  0.5  0.71  1.0
  Pd  Pd3  2  0.27  0.0  0.47  1.0
  Pd  Pd4  2  0.41  0.5  0.53  1.0

Hf Pd Pd Pd Pd