data_HgOs3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64
_cell_length_b   5.64
_cell_length_c   13.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgOs3
_chemical_formula_sum   'Hg6 Os18'
_cell_volume   378.91
_cell_formula_units_Z   6
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  1  0.0  0.0  0.33  1.0
  Hg  Hg1  1  0.0  0.0  0.44  1.0
  Hg  Hg2  1  0.0  0.25  0.12  1.0
  Hg  Hg3  1  0.0  0.25  0.77  1.0
  Hg  Hg4  1  0.82  0.63  0.65  1.0
  Hg  Hg5  1  0.82  0.63  0.0  1.0
  Os  Os6  1  0.59  0.44  0.33  1.0
  Os  Os7  1  0.22  0.44  0.44  1.0
  Os  Os8  1  0.0  0.64  0.58  1.0
  Os  Os9  1  0.0  0.64  0.07  1.0
  Os  Os10  1  0.61  0.06  0.58  1.0
  Os  Os11  1  0.61  0.06  0.07  1.0
  Os  Os12  1  0.42  0.82  0.19  1.0
  Os  Os13  1  0.42  0.82  0.7  1.0
  Os  Os14  1  0.0  0.88  0.33  1.0
  Os  Os15  1  0.82  0.0  0.44  1.0
  Os  Os16  1  0.41  0.44  0.33  1.0
  Os  Os17  1  0.41  0.44  0.44  1.0
  Os  Os18  1  0.39  0.06  0.58  1.0
  Os  Os19  1  0.39  0.06  0.07  1.0
  Os  Os20  1  0.21  0.82  0.19  1.0
  Os  Os21  1  0.21  0.82  0.7  1.0
  Os  Os22  1  0.82  0.24  0.19  1.0
  Os  Os23  1  0.82  0.24  0.7  1.0

data_HgOs3
_symmetry_space_group_name_H-M   P1
_cell_length_a   5.64
_cell_length_b   5.64
_cell_length_c   13.77
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgOs3
_chemical_formula_sum   'Hg6 Os18'
_cell_volume   378.91
_cell_formula_units_Z   6
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  1  -0.0  0.25  0.12  1.0
  Hg  Hg1  1  -0.0  0.25  0.77  1.0
  Hg  Hg2  1  0.0  0.0  0.33  1.0
  Hg  Hg3  1  0.0  0.0  0.44  1.0
  Hg  Hg4  1  0.82  0.63  0.0  1.0
  Hg  Hg5  1  0.82  0.63  0.65  1.0
  Os  Os6  1  -0.0  0.88  0.33  1.0
  Os  Os7  1  -0.0  0.64  0.07  1.0
  Os  Os8  1  -0.0  0.64  0.58  1.0
  Os  Os9  1  0.21  0.82  0.19  1.0
  Os  Os10  1  0.21  0.82  0.7  1.0
  Os  Os11  1  0.22  0.44  0.44  1.0
  Os  Os12  1  0.39  0.06  0.07  1.0
  Os  Os13  1  0.39  0.06  0.58  1.0
  Os  Os14  1  0.41  0.44  0.33  1.0
  Os  Os15  1  0.41  0.44  0.44  1.0
  Os  Os16  1  0.42  0.82  0.19  1.0
  Os  Os17  1  0.42  0.82  0.7  1.0
  Os  Os18  1  0.59  0.44  0.33  1.0
  Os  Os19  1  0.61  0.06  0.07  1.0
  Os  Os20  1  0.61  0.06  0.58  1.0
  Os  Os21  1  0.82  0.0  0.44  1.0
  Os  Os22  1  0.82  0.24  0.19  1.0
  Os  Os23  1  0.82  0.24  0.7  1.0

Hg Hg Hg Hg Hg Hg Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os Os