data_[Os4C32I16N12O4F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Os  2.2000  1.3000  0.6730
  C  2.5500  0.7000  0.3000
  I  2.6600  1.4000  1.2733
  N  3.0400  0.6500  0.6300
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Pca2_1]
_cell_length_a [14.6577]
_cell_length_b [8.9758]
_cell_length_c [14.7140]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [29]
_chemical_formula_structural [OsC8I4N3OF]
_chemical_formula_sum '[Os4 C32 I16 N12 O4 F4]'
_cell_volume [1935.8471]
_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
[
  Os  Os0  4  0.1034  0.2417  0.7615  1
  C  C1  4  0.0344  0.1889  0.0014  1
  C  C2  4  0.0429  0.2275  0.0821  1
  C  C3  4  0.1006  0.2659  0.2336  1
  C  C4  4  0.1321  0.2586  0.3137  1
  C  C5  4  0.1686  0.7549  0.9366  1
  C  C6  4  0.1893  0.7462  0.3710  1
  C  C7  4  0.2185  0.8062  0.8538  1
  C  C8  4  0.2331  0.7583  0.4617  1
  I  I9  4  0.0048  0.0784  0.8901  1
  I  I10  4  0.0567  0.7410  0.1729  1
  I  I11  4  0.1829  0.4351  0.6469  1
  I  I12  4  0.2489  0.2488  0.3819  1
  N  N13  4  0.0502  0.2624  0.1648  1
  N  N14  4  0.1422  0.0900  0.6966  1
  N  N15  4  0.2296  0.6337  0.8884  1
  O  O16  4  0.1697  0.9938  0.6497  1
  F  F17  4  0.0656  0.4084  0.8373  1
]