data_HfNbP2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.36
_cell_length_b   4.86
_cell_length_c   4.86
_cell_angle_alpha   39.18
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfNbP2
_chemical_formula_sum   'Hf1 Nb1 P2'
_cell_volume   65.18
_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  0.18  0.0  0.61  1.0
  Nb  Nb1  1  0.0  0.0  0.31  1.0
  P  P2  1  0.18  0.0  0.18  1.0
  P  P3  1  0.0  0.0  0.87  1.0

data_HfNbP2
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.26
_cell_length_b   4.36
_cell_length_c   4.86
_cell_angle_alpha   90.0
_cell_angle_beta   109.59
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfNbP2
_chemical_formula_sum   'Hf1 Nb1 P2'
_cell_volume   65.18
_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  0.39  0.18  0.39  1.0
  Nb  Nb1  1  0.69  0.0  0.69  1.0
  P  P2  1  0.13  0.0  0.13  1.0
  P  P3  1  0.82  0.18  0.82  1.0

Hf Nb P P