data_Hf2ReP
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.04
_cell_length_b   3.04
_cell_length_c   8.07
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2ReP
_chemical_formula_sum   'Hf2 Re1 P1'
_cell_volume   70.31
_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  0.75  0.0  0.17  1.0
  Hf  Hf1  1  0.75  0.0  0.91  1.0
  Re  Re3  1  0.0  0.0  0.04  1.0
  P  P2  1  0.0  0.0  0.0  1.0

data_Hf2ReP
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.04
_cell_length_b   3.04
_cell_length_c   8.07
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   109.61
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2ReP
_chemical_formula_sum   'Hf2 Re1 P1'
_cell_volume   70.31
_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  0.75  0.0  0.17  1.0
  Hf  Hf1  1  0.75  0.0  0.91  1.0
  Re  Re2  1  0.0  0.0  0.04  1.0
  P  P3  1  0.0  0.0  0.0  1.0

Hf Hf Re P
Hf2ReP crystallizes in the triclinic P1 space group. The structure is zero-dimensional and consists of one Hf2ReP cluster. There are two inequivalent Hf sites. In the first Hf site, Hf(1) is bonded in a single-bond geometry to one Re(1) atom. The Hf(1)-Re(1) bond length is 1.29 Å. In the second Hf site, Hf(2) is bonded in a single-bond geometry to one P(1) atom. The Hf(2)-P(1) bond length is 1.06 Å. Re(1) is bonded in a distorted bent 150 degrees geometry to one Hf(1) and one P(1) atom. The Re(1)-P(1) bond length is 0.30 Å. P(1) is bonded in a 2-coordinate geometry to one Hf(2) and one Re(1) atom.