data_AgHg2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.31
_cell_length_b   10.31
_cell_length_c   10.31
_cell_angle_alpha   16.35
_cell_angle_beta   16.35
_cell_angle_gamma   16.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AgHg2Os
_chemical_formula_sum   'Ag1 Hg2 Os1'
_cell_volume   75.69
_cell_formula_units_Z   1
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
  Ag  Ag0  1  0.0  0.0  0.46  1.0
  Hg  Hg1  1  0.0  0.0  0.38  1.0
  Hg  Hg2  1  0.0  0.0  0.1  1.0
  Os  Os3  1  0.0  0.0  0.34  1.0

data_AgHg2Os
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.08
_cell_length_b   2.93
_cell_length_c   10.31
_cell_angle_alpha   90.0
_cell_angle_beta   99.45
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   AgHg2Os
_chemical_formula_sum   'Ag2 Hg4 Os2'
_cell_volume   151.37
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Ag  Ag0  2  -0.0  0.0  0.54  1.0
  Hg  Hg1  2  -0.0  0.0  0.9  1.0
  Hg  Hg2  2  -0.0  0.0  0.62  1.0
  Os  Os3  2  -0.0  0.0  0.66  1.0

Ag Hg Hg Os