data_AlHg2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37
_cell_length_b   9.37
_cell_length_c   9.37
_cell_angle_alpha   18.65
_cell_angle_beta   18.65
_cell_angle_gamma   18.65
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlHg2Os
_chemical_formula_sum   'Al1 Hg2 Os1'
_cell_volume   73.63
_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
  Al  Al0  1  0.0  0.0  0.0  1.0
  Hg  Hg1  1  0.0  0.0  0.73  1.0
  Hg  Hg2  1  0.0  0.0  0.9  1.0
  Os  Os3  1  0.0  0.0  0.81  1.0

data_AlHg2Os
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.26
_cell_length_b   3.04
_cell_length_c   9.37
_cell_angle_alpha   90.0
_cell_angle_beta   100.79
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   AlHg2Os
_chemical_formula_sum   'Al2 Hg4 Os2'
_cell_volume   147.26
_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
  Al  Al0  2  0.0  0.0  0.0  1.0
  Hg  Hg1  2  0.0  0.0  0.1  1.0
  Hg  Hg2  2  0.0  0.0  0.27  1.0
  Os  Os3  2  0.0  0.0  0.19  1.0

Al Hg Hg Os