data_SrHf2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.25
_cell_length_b   6.66
_cell_length_c   6.66
_cell_angle_alpha   33.67
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrHf2P
_chemical_formula_sum   'Sr1 Hf2 P1'
_cell_volume   104.72
_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  Sr3  1  0.13  0.0  0.55  1.0
  Hf  Hf0  1  0.0  0.0  0.15  1.0
  Hf  Hf1  1  0.13  0.0  0.02  1.0
  P  P2  1  0.0  0.0  0.52  1.0

data_SrHf2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.86
_cell_length_b   4.25
_cell_length_c   6.66
_cell_angle_alpha   90.0
_cell_angle_beta   106.83
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrHf2P
_chemical_formula_sum   'Sr1 Hf2 P1'
_cell_volume   104.72
_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  0.45  0.13  0.45  1.0
  Hf  Hf1  1  0.85  0.0  0.85  1.0
  Hf  Hf2  1  0.98  0.13  0.98  1.0
  P  P3  1  0.48  0.0  0.48  1.0

Sr Hf Hf P