data_HfOs2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   4.68
_cell_angle_alpha   103.14
_cell_angle_beta   103.14
_cell_angle_gamma   35.39
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfOs2Se
_chemical_formula_sum   'Hf1 Os2 Se1'
_cell_volume   66.3
_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  0.22  0.0  0.27  1.0
  Os  Os1  1  0.5  0.0  0.35  1.0
  Os  Os2  1  0.94  0.0  0.2  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

data_HfOs2Se
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.05
_cell_length_b   4.68
_cell_length_c   5.02
_cell_angle_alpha   103.14
_cell_angle_beta   107.7
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfOs2Se
_chemical_formula_sum   'Hf1 Os2 Se1'
_cell_volume   66.3
_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  0.27  0.22  1.0
  Os  Os1  1  0.0  0.2  0.94  1.0
  Os  Os2  1  0.0  0.35  0.5  1.0
  Se  Se3  1  0.0  0.0  0.0  1.0

Hf Os Os Se