data_ZrPPb
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.63
_cell_length_b   3.63
_cell_length_c   6.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrPPb
_chemical_formula_sum   'Zr1 P1 Pb1'
_cell_volume   72.45
_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
  Zr  Zr2  1  0.0  0.1  0.59  1.0
  P  P0  1  0.0  0.0  0.05  1.0
  Pb  Pb1  1  0.81  0.05  0.07  1.0

data_ZrPPb
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.63
_cell_length_b   3.63
_cell_length_c   6.35
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrPPb
_chemical_formula_sum   'Zr1 P1 Pb1'
_cell_volume   72.45
_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
  Zr  Zr0  1  0.0  0.1  0.59  1.0
  P  P1  1  0.0  0.0  0.05  1.0
  Pb  Pb2  1  0.81  0.05  0.07  1.0

Zr P Pb
Zr P Pb 0 2 - o o 0 2 - o + 0 0 + + o 0 0 o + o 0 0 + o o 0 1 o o o 0 1 o o + 1 2 - o o 
ZrPbP crystallizes in the triclinic P1 space group. Zr(1) is bonded in a 10-coordinate geometry to six equivalent Zr(1), two equivalent Pb(1), and two equivalent P(1) atoms. All Zr(1)-Zr(1) bond lengths are 3.63 Å. There is one shorter (3.05 Å) and one longer (3.41 Å) Zr(1)-Pb(1) bond length. There is one shorter (2.89 Å) and one longer (3.50 Å) Zr(1)-P(1) bond length. Pb(1) is bonded in a single-bond geometry to two equivalent Zr(1) and one P(1) atom. The Pb(1)-P(1) bond length is 0.78 Å. P(1) is bonded in a single-bond geometry to two equivalent Zr(1) and one Pb(1) atom.