data_Hf2CoOs
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.22
_cell_length_b   3.22
_cell_length_c   6.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   91.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2CoOs
_chemical_formula_sum   'Hf2 Co1 Os1'
_cell_volume   67.14
_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  Hf1  1  0.24  0.0  0.23  1.0
  Hf  Hf2  1  0.0  0.0  0.66  1.0
  Co  Co0  1  0.0  0.0  0.72  1.0
  Os  Os3  1  0.24  0.0  0.11  1.0

data_Hf2CoOs
_symmetry_space_group_name_H-M   Pm
_cell_length_a   3.22
_cell_length_b   3.22
_cell_length_c   6.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   6
_chemical_formula_structural   Hf2CoOs
_chemical_formula_sum   'Hf2 Co1 Os1'
_cell_volume   67.17
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '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  0.0  0.66  1.0
  Hf  Hf1  1  0.24  0.0  0.23  1.0
  Co  Co2  1  0.0  0.0  0.72  1.0
  Os  Os3  1  0.24  0.0  0.11  1.0

Hf Hf Co Os