data_[Zr4Zn2Rh6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Zn  1.6500  1.3500  0.8800
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [P-3m1]
_cell_length_a [4.5508]
_cell_length_b [4.5508]
_cell_length_c [11.1340]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [164]
_chemical_formula_structural [Zr2ZnRh3]
_chemical_formula_sum '[Zr4 Zn2 Rh6]'
_cell_volume [199.6934]
_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  2  0.3333  0.6667  0.1843  1
  Zr  Zr1  1  0.0000  0.0000  0.0000  1
  Zr  Zr2  1  0.0000  0.0000  0.5000  1
  Zn  Zn3  2  0.3333  0.6667  0.6654  1
  Rh  Rh4  2  0.0000  0.0000  0.2499  1
  Rh  Rh5  2  0.3333  0.6667  0.4224  1
  Rh  Rh6  2  0.3333  0.6667  0.9204  1
]