data_HfGa2Os
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.01
_cell_length_b   5.01
_cell_length_c   4.43
_cell_angle_alpha   110.65
_cell_angle_beta   110.65
_cell_angle_gamma   39.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfGa2Os
_chemical_formula_sum   'Hf1 Ga2 Os1'
_cell_volume   64.95
_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
  Hf  Hf2  1  0.83  0.0  0.98  1.0
  Ga  Ga0  1  0.43  0.0  0.08  1.0
  Ga  Ga1  1  0.12  0.0  0.19  1.0
  Os  Os3  1  0.65  0.0  0.03  1.0

data_HfGa2Os
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.35
_cell_length_b   4.43
_cell_length_c   5.01
_cell_angle_alpha   110.65
_cell_angle_beta   109.5
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfGa2Os
_chemical_formula_sum   'Hf1 Ga2 Os1'
_cell_volume   64.95
_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
  Hf  Hf0  1  0.0  0.98  0.83  1.0
  Ga  Ga1  1  0.0  0.08  0.43  1.0
  Ga  Ga2  1  0.0  0.19  0.12  1.0
  Os  Os3  1  0.0  0.03  0.65  1.0

Hf Ga Ga Os