data_[Hg2Os4Cl2]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.5977]
_cell_length_b [9.8385]
_cell_length_c [2.9001]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.1681]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [HgOs2Cl]
_chemical_formula_sum '[Hg2 Os4 Cl2]'
_cell_volume [136.6613]
_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  0.0000  0.5000  0.0000  1
  Os  Os1  4  0.2500  0.2500  0.0000  1
  Cl  Cl2  2  0.0000  0.0000  0.0000  1
]