data_[V12Ir4Rh8]
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
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [Imma]
_cell_length_a [3.8716]
_cell_length_b [7.3233]
_cell_length_c [11.7072]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [74]
_chemical_formula_structural [V3IrRh2]
_chemical_formula_sum '[V12 Ir4 Rh8]'
_cell_volume [331.9371]
_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  8  0.0000  0.0006  0.8329  1.0
  V  V1  4  0.0000  0.0000  0.5000  1.0
  Ir  Ir2  4  0.0000  0.2500  0.6655  1.0
  Rh  Rh3  4  0.0000  0.2500  0.0015  1.0
  Rh  Rh4  4  0.0000  0.2500  0.3329  1.0
]