data_[Hg2Os4W2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Os  2.2000  1.3000  0.6730
  W  2.3600  1.3500  0.7667
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.5619]
_cell_length_b [2.8412]
_cell_length_c [4.8742]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.9944]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [HgOs2W]
_chemical_formula_sum '[Hg2 Os4 W2]'
_cell_volume [129.9903]
_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
[
  Hg  Hg0  2  0.2446  0.5000  0.2389  1
  Os  Os1  2  0.2606  0.0000  0.7399  1
  Os  Os2  2  0.4836  0.5000  0.9870  1
  W  W3  2  0.0112  0.5000  0.5342  1
]