The compound described by PdSb2 is Pyrite-like structured and crystallizes in the cubic Pa-3 space group. Pd(1) is bonded to six equivalent Sb(1) atoms to form PdSb6 octahedra that share corners with twelve equivalent Pd(1)Sb6 octahedra and corners with six equivalent Sb(1)SbPd3 trigonal pyramids. The corner-sharing octahedral tilt angles are 63°. Sb(1) is bonded to three equivalent Pd(1) and one Sb(1) atom to form distorted SbSbPd3 trigonal pyramids that share corners with three equivalent Pd(1)Sb6 octahedra and corners with fifteen equivalent Sb(1)SbPd3 trigonal pyramids. The corner-sharing octahedral tilt angles are 80°. is represented by the CIF card [CIF]
data_Sb2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.521
_cell_length_b   6.521
_cell_length_c   6.521
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   277.333
_cell_formula_units_Z   4
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
  Sb  Sb0  1  0.374  0.374  0.374  1.0
  Sb  Sb1  1  0.126  0.626  0.874  1.0
  Sb  Sb2  1  0.874  0.126  0.626  1.0
  Sb  Sb3  1  0.626  0.874  0.126  1.0
  Sb  Sb4  1  0.626  0.626  0.626  1.0
  Sb  Sb5  1  0.874  0.374  0.126  1.0
  Sb  Sb6  1  0.126  0.874  0.374  1.0
  Sb  Sb7  1  0.374  0.126  0.874  1.0
  Pd  Pd8  1  0.000  0.000  0.000  1.0
  Pd  Pd9  1  0.500  0.000  0.500  1.0
  Pd  Pd10  1  0.500  0.500  0.000  1.0
  Pd  Pd11  1  0.000  0.500  0.500  1.0
[/CIF]
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The compound described by PdSb2 is Pyrite-like structured and crystallizes in the cubic Pa-3 space group. Pd(1) is bonded to six equivalent Sb(1) atoms to form PdSb6 octahedra that share corners with twelve equivalent Pd(1)Sb6 octahedra and corners with six equivalent Sb(1)SbPd3 trigonal pyramids. The corner-sharing octahedral tilt angles are 63°. Sb(1) is bonded to three equivalent Pd(1) and one Sb(1) atom to form distorted SbSbPd3 trigonal pyramids that share corners with three equivalent Pd(1)Sb6 octahedra and corners with fifteen equivalent Sb(1)SbPd3 trigonal pyramids. The corner-sharing octahedral tilt angles are 80°. is represented by the CIF card [CIF]
data_Sb2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.521
_cell_length_b   6.521
_cell_length_c   6.521
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   277.333
_cell_formula_units_Z   4
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
  Sb  Sb0  1  0.374  0.374  0.374  1.0
  Sb  Sb1  1  0.126  0.626  0.874  1.0
  Sb  Sb2  1  0.874  0.126  0.626  1.0
  Sb  Sb3  1  0.626  0.874  0.126  1.0
  Sb  Sb4  1  0.626  0.626  0.626  1.0
  Sb  Sb5  1  0.874  0.374  0.126  1.0
  Sb  Sb6  1  0.126  0.874  0.374  1.0
  Sb  Sb7  1  0.374  0.126  0.874  1.0
  Pd  Pd8  1  0.000  0.000  0.000  1.0
  Pd  Pd9  1  0.500  0.000  0.500  1.0
  Pd  Pd10  1  0.500  0.500  0.000  1.0
  Pd  Pd11  1  0.000  0.500  0.500  1.0
[/CIF]
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