data_[Mo22Os8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mo  2.1600  1.4500  0.7750
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [P4_2/mnm]
_cell_length_a [9.7070]
_cell_length_b [9.7070]
_cell_length_c [4.9756]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [136]
_chemical_formula_structural [Mo11Os4]
_chemical_formula_sum '[Mo22 Os8]'
_cell_volume [468.8364]
_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
[
  Mo  Mo0  8  0.0358  0.3696  0.5000  1
  Mo  Mo1  8  0.1816  0.8184  0.2511  1
  Mo  Mo2  4  0.1040  0.1040  0.5000  1
  Mo  Mo3  2  0.0000  0.0000  0.0000  1
  Os  Os4  8  0.0681  0.2633  0.0000  1
]