data_HfBeCo2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.88
_cell_length_b   3.35
_cell_length_c   5.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfBeCo2
_chemical_formula_sum   'Hf1 Be1 Co2'
_cell_volume   50.78
_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  Hf3  1  0.44  0.67  0.58  1.0
  Be  Be0  1  0.0  0.0  0.29  1.0
  Co  Co1  1  0.44  0.67  0.04  1.0
  Co  Co2  1  0.0  0.0  0.27  1.0

data_HfBeCo2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.88
_cell_length_b   3.35
_cell_length_c   5.27
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfBeCo2
_chemical_formula_sum   'Hf1 Be1 Co2'
_cell_volume   50.78
_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  0.44  0.67  0.58  1.0
  Be  Be1  1  0.0  0.0  0.29  1.0
  Co  Co2  1  0.0  0.0  0.27  1.0
  Co  Co3  1  0.44  0.67  0.04  1.0

Hf Be Co Co