data_HfPOs2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.56
_cell_length_b   4.56
_cell_length_c   4.89
_cell_angle_alpha   101.52
_cell_angle_beta   101.52
_cell_angle_gamma   38.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfPOs2
_chemical_formula_sum   'Hf1 P1 Os2'
_cell_volume   62.05
_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  0.79  0.0  0.39  1.0
  P  P3  1  0.0  0.0  0.0  1.0
  Os  Os1  1  0.2  0.0  0.1  1.0
  Os  Os2  1  0.38  0.0  0.68  1.0

data_HfPOs2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.02
_cell_length_b   4.56
_cell_length_c   4.89
_cell_angle_alpha   101.52
_cell_angle_beta   90.0
_cell_angle_gamma   109.32
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfPOs2
_chemical_formula_sum   'Hf1 P1 Os2'
_cell_volume   62.05
_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  0.21  0.61  1.0
  P  P1  1  0.0  0.0  0.0  1.0
  Os  Os2  1  0.0  0.62  0.32  1.0
  Os  Os3  1  0.0  0.8  0.9  1.0

Hf P Os Os
Hf P Os Os 0 2 o o o 0 2 + o o 0 3 o o o 0 3 + o o 0 0 + - o 0 1 + o o 0 1 + o + 1 2 o o o 1 3 o o - 1 3 - o - 2 3 o o o 2 3 o o - 3 3 + - o 