[CIF]
data_SrHf2Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.22689427
_cell_length_b   4.22689427
_cell_length_c   5.93852614
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrHf2Se
_chemical_formula_sum   'Sr1 Hf2 Se1'
_cell_volume   106.10147999
_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  2.11344713  0.00000000  2.96926307  1
  Hf  Hf1  1  0.00000000  2.11344713  2.96926307  1
  Se  Se2  1  0.00000000  0.00000000  0.00000000  1
  Sr  Sr3  1  2.11344713  2.11344713  0.00000000  1
[/CIF]
