data_SrRePd3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.04
_cell_length_b   5.04
_cell_length_c   5.04
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SrRePd3
_chemical_formula_sum   'Sr1 Re1 Pd3'
_cell_volume   128.15
_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
  Sr  Sr4  1  0.0  0.0  0.0  1.0
  Re  Re0  1  0.52  0.52  0.52  1.0
  Pd  Pd1  1  0.0  0.52  0.0  1.0
  Pd  Pd2  1  0.0  0.0  0.52  1.0
  Pd  Pd3  1  0.52  0.0  0.0  1.0

data_SrRePd3
_symmetry_space_group_name_H-M   R3m
_cell_length_a   7.13
_cell_length_b   7.13
_cell_length_c   8.73
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   SrRePd3
_chemical_formula_sum   'Sr3 Re3 Pd9'
_cell_volume   384.44
_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
  Sr  Sr0  3  0.0  0.0  0.0  1.0
  Re  Re1  3  0.0  0.0  0.52  1.0
  Pd  Pd2  9  0.01  0.51  0.51  1.0

Sr Re Pd Pd Pd
Sr Re Pd Pd Pd 0 4 - o o 0 4 o o o 0 2 o - o 0 2 o o o 0 3 o o - 0 3 o o o 0 1 - - - 1 3 o o o 1 3 o + o 1 3 + o o 1 3 + + o 1 2 o o o 1 2 o o + 1 2 + o o 1 2 + o + 1 4 o o o 1 4 o o + 1 4 o + o 1 4 o + + 
SrRePd3 is (Cubic) Perovskite structured and crystallizes in the trigonal R3m space group. Sr(1) is bonded to six equivalent Pd(1) atoms to form corner-sharing SrPd6 octahedra. The corner-sharing octahedra are not tilted. There are three shorter (2.42 Å) and three longer (2.63 Å) Sr(1)-Pd(1) bond lengths. Re(1) is bonded in a 9-coordinate geometry to nine equivalent Pd(1) atoms. There are three shorter (3.42 Å) and six longer (3.57 Å) Re(1)-Pd(1) bond lengths. Pd(1) is bonded in a linear geometry to two equivalent Sr(1) and three equivalent Re(1) atoms.