data_HfZrOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.95
_cell_length_b   4.32
_cell_length_c   5.56
_cell_angle_alpha   90.0
_cell_angle_beta   98.42
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfZrOs2
_chemical_formula_sum   'Hf1 Zr1 Os2'
_cell_volume   70.14
_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  0.07  0.0  0.75  1.0
  Zr  Zr3  1  0.0  0.0  0.0  1.0
  Os  Os1  1  0.13  0.16  0.09  1.0
  Os  Os2  1  0.01  0.16  0.41  1.0

data_HfZrOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.95
_cell_length_b   4.32
_cell_length_c   5.56
_cell_angle_alpha   90.0
_cell_angle_beta   98.42
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfZrOs2
_chemical_formula_sum   'Hf1 Zr1 Os2'
_cell_volume   70.14
_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  0.07  0.0  0.75  1.0
  Zr  Zr1  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.01  0.16  0.41  1.0
  Os  Os3  1  0.13  0.16  0.09  1.0

Hf Zr Os Os