data_Cu5Pd4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34
_cell_length_b   6.34
_cell_length_c   6.34
_cell_angle_alpha   93.6
_cell_angle_beta   93.6
_cell_angle_gamma   150.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu5Pd4
_chemical_formula_sum   'Cu5 Pd4'
_cell_volume   120.02
_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
  Cu  Cu0  1  0.0  0.0  0.0  1.0
  Cu  Cu1  1  0.89  0.89  0.0  1.0
  Cu  Cu2  1  0.55  0.45  0.59  1.0
  Cu  Cu3  1  0.45  0.55  0.59  1.0
  Cu  Cu4  1  0.45  0.45  0.59  1.0
  Pd  Pd5  1  0.0  0.79  0.0  1.0
  Pd  Pd6  1  0.0  0.9  0.0  1.0
  Pd  Pd7  1  0.79  0.0  0.0  1.0
  Pd  Pd8  1  0.9  0.0  0.0  1.0

data_Cu5Pd4
_symmetry_space_group_name_H-M   Cm
_cell_length_a   3.18
_cell_length_b   12.28
_cell_length_c   6.34
_cell_angle_alpha   90.0
_cell_angle_beta   104.52
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Cu5Pd4
_chemical_formula_sum   'Cu10 Pd8'
_cell_volume   240.04
_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
  Cu  Cu0  4  0.0  0.45  0.41  1.0
  Cu  Cu1  2  0.0  0.0  0.0  1.0
  Cu  Cu2  2  0.05  0.5  0.41  1.0
  Cu  Cu3  2  0.11  0.0  0.0  1.0
  Pd  Pd4  4  0.05  0.05  0.0  1.0
  Pd  Pd5  4  0.11  0.11  0.0  1.0

Cu Cu Cu Cu Cu Pd Pd Pd Pd