data_Sr2HfCo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.64
_cell_length_b   6.64
_cell_length_c   6.64
_cell_angle_alpha   148.91
_cell_angle_beta   127.85
_cell_angle_gamma   61.97
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2HfCo
_chemical_formula_sum   'Sr2 Hf1 Co1'
_cell_volume   118.37
_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
  Sr  Sr2  1  0.0  0.0  0.08  1.0
  Sr  Sr3  1  0.0  0.92  0.24  1.0
  Hf  Hf1  1  0.78  0.0  0.74  1.0
  Co  Co0  1  0.0  0.0  0.32  1.0

data_Sr2HfCo
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.56
_cell_length_b   5.84
_cell_length_c   6.64
_cell_angle_alpha   116.08
_cell_angle_beta   105.54
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2HfCo
_chemical_formula_sum   'Sr2 Hf1 Co1'
_cell_volume   118.37
_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
  Sr  Sr0  1  0.0  0.08  0.08  1.0
  Sr  Sr1  1  0.08  0.32  0.32  1.0
  Hf  Hf2  1  0.0  0.74  0.96  1.0
  Co  Co3  1  0.0  0.32  0.32  1.0

Sr Sr Hf Co