data_HgGeOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.2
_cell_length_b   4.2
_cell_length_c   7.54
_cell_angle_alpha   105.54
_cell_angle_beta   105.54
_cell_angle_gamma   39.25
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgGeOs2
_chemical_formula_sum   'Hg1 Ge1 Os2'
_cell_volume   80.75
_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
  Hg  Hg1  1  0.45  0.0  0.66  1.0
  Ge  Ge0  1  0.57  0.0  0.13  1.0
  Os  Os2  1  0.17  0.0  0.67  1.0
  Os  Os3  1  0.32  0.0  0.6  1.0

data_HgGeOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.82
_cell_length_b   4.2
_cell_length_c   7.54
_cell_angle_alpha   105.54
_cell_angle_beta   90.0
_cell_angle_gamma   109.63
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HgGeOs2
_chemical_formula_sum   'Hg1 Ge1 Os2'
_cell_volume   80.75
_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
  Hg  Hg0  1  0.0  0.55  0.34  1.0
  Ge  Ge1  1  0.0  0.43  0.87  1.0
  Os  Os2  1  0.0  0.68  0.4  1.0
  Os  Os3  1  0.0  0.83  0.33  1.0

Hg Ge Os Os