data_[Cu12H8Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cu  1.9000  1.3500  0.8200
  H  2.2000  0.2500  0.0000
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [10.1084]
_cell_length_b [2.8296]
_cell_length_c [8.9746]
_cell_angle_alpha [90.0000]
_cell_angle_beta [118.9433]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cu3H2Rh]
_chemical_formula_sum '[Cu12 H8 Rh4]'
_cell_volume [224.6377]
_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
[
  Cu  Cu0  4  0.1136  0.0000  0.2151  1
  Cu  Cu1  4  0.1151  0.5000  0.9722  1
  Cu  Cu2  4  0.1240  0.5000  0.4628  1
  H  H3  4  0.2207  0.5000  0.8467  1
  H  H4  4  0.2422  0.0000  0.6279  1
  Rh  Rh5  4  0.1239  0.0000  0.7170  1
]