data_Ni5Pd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.22
_cell_length_b   5.22
_cell_length_c   3.72
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.58
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni5Pd3
_chemical_formula_sum   'Ni5 Pd3'
_cell_volume   101.48
_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
  Ni  Ni0  1  0.0  0.0  0.0  1.0
  Ni  Ni1  1  0.82  0.13  0.0  1.0
  Ni  Ni2  1  0.82  0.87  0.0  1.0
  Ni  Ni3  1  0.47  0.0  0.86  1.0
  Ni  Ni4  1  0.81  0.0  0.86  1.0
  Pd  Pd5  1  0.64  0.0  0.0  1.0
  Pd  Pd6  1  0.64  0.05  0.86  1.0
  Pd  Pd7  1  0.64  0.95  0.86  1.0

data_Ni5Pd3
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.72
_cell_length_b   5.22
_cell_length_c   5.22
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Ni5Pd3
_chemical_formula_sum   'Ni5 Pd3'
_cell_volume   101.51
_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
  Ni  Ni0  2  -0.0  0.13  0.82  1.0
  Ni  Ni1  1  0.0  0.0  0.0  1.0
  Ni  Ni2  1  0.86  0.0  0.47  1.0
  Ni  Ni3  1  0.86  0.0  0.81  1.0
  Pd  Pd4  2  0.86  0.05  0.64  1.0
  Pd  Pd5  1  -0.0  0.0  0.64  1.0

Ni Ni Ni Ni Ni Pd Pd Pd