data_LaPPd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.62
_cell_length_b   4.62
_cell_length_c   4.62
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LaPPd
_chemical_formula_sum   'La1 P1 Pd1'
_cell_volume   69.94
_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
  La  La0  1  0.64  0.64  0.64  1.0
  P  P1  1  0.0  0.0  0.0  1.0
  Pd  Pd2  1  0.91  0.91  0.91  1.0

data_LaPPd
_symmetry_space_group_name_H-M   R3m
_cell_length_a   4.62
_cell_length_b   4.62
_cell_length_c   11.33
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   LaPPd
_chemical_formula_sum   'La3 P3 Pd3'
_cell_volume   209.81
_cell_formula_units_Z   3
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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
  La  La0  3  0.0  0.0  0.36  1.0
  P  P1  3  0.0  0.0  0.0  1.0
  Pd  Pd2  3  0.0  0.0  0.09  1.0

La P Pd
LaPdP crystallizes in the trigonal R3m space group. La(1) is bonded to four equivalent Pd(1) and three equivalent P(1) atoms to form LaP3Pd4 hexagonal pyramids that share corners with six equivalent La(1)P3Pd4 hexagonal pyramids, corners with four equivalent P(1)La3Pd trigonal pyramids, and edges with six equivalent La(1)P3Pd4 hexagonal pyramids. There are three shorter (2.76 Å) and one longer (3.06 Å) La(1)-Pd(1) bond length. All La(1)-P(1) bond lengths are 2.69 Å. Pd(1) is bonded in a distorted single-bond geometry to four equivalent La(1) and one P(1) atom. The Pd(1)-P(1) bond length is 1.07 Å. P(1) is bonded to three equivalent La(1) and one Pd(1) atom to form distorted PLa3Pd trigonal pyramids that share corners with four equivalent La(1)P3Pd4 hexagonal pyramids and corners with six equivalent P(1)La3Pd trigonal pyramids.