data_[Ni4Rh2Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Rh  2.2800  1.3500  0.7450
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [7.9391]
_cell_length_b [2.8295]
_cell_length_c [6.1994]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.9084]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Ni2RhCl]
_chemical_formula_sum '[Ni4 Rh2 Cl2]'
_cell_volume [138.7499]
_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
[
  Ni  Ni0  2  0.0499  0.0000  0.9331  1
  Ni  Ni1  2  0.3163  0.0000  0.7537  1
  Rh  Rh2  2  0.0820  0.5000  0.5977  1
  Cl  Cl3  2  0.0519  0.5000  0.2155  1
]