data_Ta2NbPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.32
_cell_length_b   5.32
_cell_length_c   5.32
_cell_angle_alpha   142.7
_cell_angle_beta   129.17
_cell_angle_gamma   64.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2NbPd
_chemical_formula_sum   'Ta2 Nb1 Pd1'
_cell_volume   69.9
_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
  Ta  Ta2  1  0.0  0.0  0.02  1.0
  Ta  Ta3  1  0.7  0.0  0.26  1.0
  Nb  Nb0  1  0.0  0.0  0.46  1.0
  Pd  Pd1  1  0.0  0.28  0.25  1.0

data_Ta2NbPd
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.4
_cell_length_b   4.57
_cell_length_c   5.32
_cell_angle_alpha   115.42
_cell_angle_beta   108.65
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ta2NbPd
_chemical_formula_sum   'Ta2 Nb1 Pd1'
_cell_volume   69.9
_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
  Ta  Ta0  1  0.44  0.74  0.44  1.0
  Ta  Ta1  1  0.98  0.98  0.98  1.0
  Nb  Nb2  1  0.54  0.54  0.54  1.0
  Pd  Pd3  1  0.75  0.04  0.04  1.0

Ta Ta Nb Pd