The material structure described by Cs2PdBi2 crystallizes in the orthorhombic Cmcm space group. There are two inequivalent Cs sites. In the first Cs site, Cs(1) is bonded in a 6-coordinate geometry to six equivalent Bi(1) atoms. In the second Cs site, Cs(2) is bonded in a 4-coordinate geometry to two equivalent Pd(1) and six equivalent Bi(1) atoms. Pd(1) is bonded to two equivalent Cs(2) and four equivalent Bi(1) atoms to form distorted face-sharing PdCs2Bi4 octahedra. Bi(1) is bonded in a 9-coordinate geometry to three equivalent Cs(1), three equivalent Cs(2), two equivalent Pd(1), and one Bi(1) atom. is represented by the CIF file [CIF]
data_Cs2Bi2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.624
_cell_length_b   8.624
_cell_length_c   7.004
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   126.470
_symmetry_Int_Tables_number   1
_cell_volume   418.889
_cell_formula_units_Z   2
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
  Cs  Cs0  1  0.605  0.395  0.750  1.0
  Cs  Cs1  1  0.395  0.605  0.250  1.0
  Cs  Cs2  1  0.194  0.806  0.750  1.0
  Cs  Cs3  1  0.806  0.194  0.250  1.0
  Bi  Bi4  1  0.710  0.909  0.750  1.0
  Bi  Bi5  1  0.909  0.710  0.250  1.0
  Bi  Bi6  1  0.290  0.091  0.250  1.0
  Bi  Bi7  1  0.091  0.290  0.750  1.0
  Pd  Pd8  1  0.000  0.000  0.000  1.0
  Pd  Pd9  1  0.000  0.000  0.500  1.0
[/CIF]
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The material structure described by Cs2PdBi2 crystallizes in the orthorhombic Cmcm space group. There are two inequivalent Cs sites. In the first Cs site, Cs(1) is bonded in a 6-coordinate geometry to six equivalent Bi(1) atoms. In the second Cs site, Cs(2) is bonded in a 4-coordinate geometry to two equivalent Pd(1) and six equivalent Bi(1) atoms. Pd(1) is bonded to two equivalent Cs(2) and four equivalent Bi(1) atoms to form distorted face-sharing PdCs2Bi4 octahedra. Bi(1) is bonded in a 9-coordinate geometry to three equivalent Cs(1), three equivalent Cs(2), two equivalent Pd(1), and one Bi(1) atom. is represented by the CIF file [CIF]
data_Cs2Bi2Pd
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.624
_cell_length_b   8.624
_cell_length_c   7.004
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   126.470
_symmetry_Int_Tables_number   1
_cell_volume   418.889
_cell_formula_units_Z   2
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
  Cs  Cs0  1  0.605  0.395  0.750  1.0
  Cs  Cs1  1  0.395  0.605  0.250  1.0
  Cs  Cs2  1  0.194  0.806  0.750  1.0
  Cs  Cs3  1  0.806  0.194  0.250  1.0
  Bi  Bi4  1  0.710  0.909  0.750  1.0
  Bi  Bi5  1  0.909  0.710  0.250  1.0
  Bi  Bi6  1  0.290  0.091  0.250  1.0
  Bi  Bi7  1  0.091  0.290  0.750  1.0
  Pd  Pd8  1  0.000  0.000  0.000  1.0
  Pd  Pd9  1  0.000  0.000  0.500  1.0
[/CIF]
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