data_[Zr8Pd2Rh14]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Pd  2.2000  1.4000  0.8462
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.8625]
_cell_length_b [4.7955]
_cell_length_c [9.6018]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.4681]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zr4PdRh7]
_chemical_formula_sum '[Zr8 Pd2 Rh14]'
_cell_volume [435.4581]
_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
[
  Zr  Zr0  4  0.0915  0.5000  0.7800  1
  Zr  Zr1  4  0.2488  0.0000  0.6639  1
  Pd  Pd2  2  0.0000  0.0000  0.0000  1
  Rh  Rh3  4  0.0780  0.0000  0.3196  1
  Rh  Rh4  4  0.1312  0.5000  0.5251  1
  Rh  Rh5  4  0.2082  0.0000  0.9073  1
  Rh  Rh6  2  0.0000  0.5000  0.0000  1
]