data_[Hg4Te2Os2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Hg  2.0000  1.5000  1.2450
  Te  2.1000  1.4000  1.2933
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.9311]
_cell_length_b [3.2319]
_cell_length_c [6.6830]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.2406]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Hg2TeOs]
_chemical_formula_sum '[Hg4 Te2 Os2]'
_cell_volume [205.9394]
_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  0.0074  0.0000  0.0440  1
  Hg  Hg1  2  0.2995  0.5000  0.3340  1
  Te  Te2  2  0.1495  0.0000  0.7145  1
  Os  Os3  2  0.0435  0.5000  0.4076  1
]