data_[Nb4Fe10Pd24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Nb  1.6000  1.4500  0.8200
  Fe  1.8300  1.4000  0.8525
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.3790]
_cell_length_b [5.4053]
_cell_length_c [8.3839]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.9290]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Nb2Fe5Pd12]
_chemical_formula_sum '[Nb4 Fe10 Pd24]'
_cell_volume [629.6329]
_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
[
  Nb  Nb0  4  0.0000  0.2615  0.0000  1
  Fe  Fe1  4  0.1368  0.5000  0.8644  1
  Fe  Fe2  4  0.1942  0.5000  0.3699  1
  Fe  Fe3  2  0.0000  0.0000  0.5000  1
  Pd  Pd4  8  0.1517  0.2522  0.6042  1
  Pd  Pd5  8  0.1990  0.2465  0.1152  1
  Pd  Pd6  4  0.0168  0.5000  0.3410  1
  Pd  Pd7  4  0.0907  0.0000  0.2865  1
]