data_[Ta4Nb4Pd14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ta  1.5000  1.4500  0.8200
  Nb  1.6000  1.4500  0.8200
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [8.9733]
_cell_length_b [9.5090]
_cell_length_c [4.8454]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.8657]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ta2Nb2Pd7]
_chemical_formula_sum '[Ta4 Nb4 Pd14]'
_cell_volume [375.1169]
_cell_formula_units_Z [2]
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  4  0.0000  0.2645  0.5000  1
  Nb  Nb1  4  0.1854  0.0000  0.5783  1
  Pd  Pd2  8  0.1689  0.2508  0.1764  1
  Pd  Pd3  4  0.1347  0.5000  0.8050  1
  Pd  Pd4  2  0.0000  0.0000  0.0000  1
]