data_YbAlPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.05
_cell_length_b   4.23
_cell_length_c   7.98
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbAlPd
_chemical_formula_sum   'Yb4 Al4 Pd4'
_cell_volume   237.71
_cell_formula_units_Z   4
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
  Yb  Yb8  1  0.29  0.17  0.39  1.0
  Yb  Yb9  1  0.81  0.17  0.61  1.0
  Yb  Yb10  1  0.24  0.06  0.38  1.0
  Yb  Yb11  1  0.76  0.06  0.6  1.0
  Al  Al0  1  0.95  0.06  0.47  1.0
  Al  Al1  1  0.47  0.06  0.52  1.0
  Al  Al2  1  0.58  0.17  0.46  1.0
  Al  Al3  1  0.1  0.17  0.52  1.0
  Pd  Pd4  1  0.46  0.06  0.03  1.0
  Pd  Pd5  1  0.94  0.06  0.97  1.0
  Pd  Pd6  1  0.11  0.17  0.02  1.0
  Pd  Pd7  1  0.58  0.17  0.96  1.0

data_YbAlPd
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.23
_cell_length_b   7.05
_cell_length_c   7.98
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   YbAlPd
_chemical_formula_sum   'Yb4 Al4 Pd4'
_cell_volume   237.71
_cell_formula_units_Z   4
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
  Yb  Yb0  2  0.44  0.24  0.61  1.0
  Yb  Yb1  2  0.44  0.71  0.39  1.0
  Al  Al2  2  0.44  0.42  0.48  1.0
  Al  Al3  2  0.44  0.95  0.53  1.0
  Pd  Pd4  2  0.44  0.42  0.97  1.0
  Pd  Pd5  2  0.44  0.94  0.03  1.0

Yb Yb Yb Yb Al Al Al Al Pd Pd Pd Pd