data_[Ni2Os4Rh12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Os  2.2000  1.3000  0.6730
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.7239]
_cell_length_b [4.5863]
_cell_length_c [7.1457]
_cell_angle_alpha [90.0000]
_cell_angle_beta [126.0215]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ni(OsRh3)2]
_chemical_formula_sum '[Ni2 Os4 Rh12]'
_cell_volume [257.7475]
_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  0.0000  0.5000  0.5000  1
  Os  Os1  4  0.0669  0.0000  0.7278  1
  Rh  Rh2  4  0.1028  0.5000  0.9281  1
  Rh  Rh3  4  0.1638  0.0000  0.1671  1
  Rh  Rh4  4  0.2379  0.5000  0.4004  1
]