[CIF]
data_HfSc4Se
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85620489
_cell_length_b   5.85620489
_cell_length_c   5.85620489
_cell_angle_alpha   60.00000000
_cell_angle_beta   60.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfSc4Se
_chemical_formula_sum   'Hf1 Sc4 Se1'
_cell_volume   142.01486031
_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  2.07048109  2.07048109  2.07048109  1
  Sc  Sc1  1  5.15555844  3.12636594  3.12636594  1
  Sc  Sc2  1  3.12636594  3.12636594  5.15555844  1
  Sc  Sc3  1  3.12636594  5.15555844  3.12636594  1
  Sc  Sc4  1  5.15555844  5.15555844  5.15555844  1
  Se  Se5  1  0.00000000  0.00000000  0.00000000  1
[/CIF]
