data_YNb2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.52
_cell_length_b   5.52
_cell_length_c   5.52
_cell_angle_alpha   143.88
_cell_angle_beta   124.78
_cell_angle_gamma   67.77
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YNb2Pd
_chemical_formula_sum   'Y1 Nb2 Pd1'
_cell_volume   80.08
_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
  Y  Y3  1  0.0  0.0  0.32  1.0
  Nb  Nb0  1  0.0  0.56  0.39  1.0
  Nb  Nb1  1  0.0  0.0  0.92  1.0
  Pd  Pd2  1  0.0  0.56  0.11  1.0

data_YNb2Pd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.42
_cell_length_b   5.11
_cell_length_c   5.52
_cell_angle_alpha   117.61
_cell_angle_beta   108.06
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YNb2Pd
_chemical_formula_sum   'Y1 Nb2 Pd1'
_cell_volume   80.08
_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
  Y  Y0  1  0.0  0.32  0.32  1.0
  Nb  Nb1  1  0.0  0.92  0.92  1.0
  Nb  Nb2  1  0.44  0.83  0.83  1.0
  Pd  Pd3  1  0.44  0.56  0.56  1.0

Y Nb Nb Pd