data_[Os6N10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Os  2.2000  1.3000  0.6730
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P31m]
_cell_length_a [6.3371]
_cell_length_b [6.3371]
_cell_length_c [19.5036]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [157]
_chemical_formula_structural [Os3N5]
_chemical_formula_sum '[Os6 N10]'
_cell_volume [678.3112]
_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
[
  Os  Os0  3  0.0000  0.2307  0.6126  1
  Os  Os1  2  0.3333  0.6667  0.5805  1
  Os  Os2  1  0.0000  0.0000  0.4139  1
  N  N3  6  0.1055  0.7321  0.3817  1
  N  N4  3  0.0000  0.6371  0.5985  1
  N  N5  1  0.0000  0.0000  0.5016  1
]