data_HfBeP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.84
_cell_length_b   4.84
_cell_length_c   3.85
_cell_angle_alpha   110.55
_cell_angle_beta   110.55
_cell_angle_gamma   43.35
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfBeP2
_chemical_formula_sum   'Hf1 Be1 P2'
_cell_volume   57.27
_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  Hf1  1  0.77  0.0  0.78  1.0
  Be  Be0  1  0.0  0.0  0.0  1.0
  P  P2  1  0.17  0.0  0.75  1.0
  P  P3  1  0.37  0.0  0.81  1.0

data_HfBeP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.58
_cell_length_b   3.85
_cell_length_c   4.84
_cell_angle_alpha   110.55
_cell_angle_beta   111.68
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfBeP2
_chemical_formula_sum   'Hf1 Be1 P2'
_cell_volume   57.27
_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  0.0  0.78  0.77  1.0
  Be  Be1  1  0.0  0.0  0.0  1.0
  P  P2  1  0.0  0.75  0.17  1.0
  P  P3  1  0.0  0.81  0.37  1.0

Hf Be P P