data_HfTa2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.36
_cell_length_b   5.36
_cell_length_c   5.36
_cell_angle_alpha   143.83
_cell_angle_beta   127.82
_cell_angle_gamma   65.14
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTa2P
_chemical_formula_sum   'Hf1 Ta2 P1'
_cell_volume   70.73
_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  0.0  0.51  1.0
  Ta  Ta2  1  0.0  0.36  0.38  1.0
  Ta  Ta3  1  0.66  0.0  0.14  1.0
  P  P1  1  0.0  0.0  0.0  1.0

data_HfTa2P
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.33
_cell_length_b   4.71
_cell_length_c   5.36
_cell_angle_alpha   116.09
_cell_angle_beta   108.08
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   HfTa2P
_chemical_formula_sum   'Hf1 Ta2 P1'
_cell_volume   70.73
_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  0.51  0.51  1.0
  Ta  Ta1  1  0.0  0.14  0.47  1.0
  Ta  Ta2  1  0.64  0.02  0.02  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Hf Ta Ta P