data_[V4Ir4Pd8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  V  1.6300  1.3500  0.7775
  Ir  2.2000  1.3500  0.7650
  Pd  2.2000  1.4000  0.8462
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [4.3911]
_cell_length_b [5.5094]
_cell_length_c [9.4422]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [VIrPd2]
_chemical_formula_sum '[V4 Ir4 Pd8]'
_cell_volume [228.4268]
_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
[
  V  V0  2  0.0000  0.0000  0.6627  1
  V  V1  2  0.5000  0.0000  0.3390  1
  Ir  Ir2  4  0.0000  0.2474  0.4128  1
  Pd  Pd3  4  0.5000  0.2456  0.5860  1
  Pd  Pd4  2  0.0000  0.0000  0.1668  1
  Pd  Pd5  2  0.5000  0.0000  0.8338  1
]