The crystal structure described by KPrPdO3 crystallizes in the monoclinic C2/m space group. K(1) is bonded in a 7-coordinate geometry to two equivalent O(1), two equivalent O(3), and three equivalent O(2) atoms. Pr(1) is bonded in a 7-coordinate geometry to two equivalent O(2), two equivalent O(3), and three equivalent O(1) atoms. Pd(1) is bonded in a rectangular see-saw-like geometry to one O(1), one O(2), and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded to two equivalent K(1), three equivalent Pr(1), and one Pd(1) atom to form distorted OK2Pr3Pd octahedra that share corners with five equivalent O(2)K3Pr2Pd octahedra, edges with four equivalent O(1)K2Pr3Pd octahedra, and edges with four equivalent O(2)K3Pr2Pd octahedra. The corner-sharing octahedral tilt angles range from 7-8°. In the second O site, O(2) is bonded to three equivalent K(1), two equivalent Pr(1), and one Pd(1) atom to form distorted OK3Pr2Pd octahedra that share corners with five equivalent O(1)K2Pr3Pd octahedra, edges with four equivalent O(1)K2Pr3Pd octahedra, and edges with four equivalent O(2)K3Pr2Pd octahedra. The corner-sharing octahedral tilt angles range from 7-8°. In the third O site, O(3) is bonded in a 6-coordinate geometry to two equivalent K(1), two equivalent Pr(1), and two equivalent Pd(1) atoms. is represented by the CIF card [CIF]
data_KPrPdO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.990
_cell_length_b   7.012
_cell_length_c   7.591
_cell_angle_alpha   104.473
_cell_angle_beta   90.000
_cell_angle_gamma   106.530
_symmetry_Int_Tables_number   1
_cell_volume   196.529
_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
  K  K0  1  0.643  0.287  0.565  1.0
  K  K1  1  0.357  0.713  0.435  1.0
  Pr  Pr2  1  0.350  0.701  0.920  1.0
  Pr  Pr3  1  0.650  0.299  0.080  1.0
  Pd  Pd4  1  0.993  0.987  0.228  1.0
  Pd  Pd5  1  0.007  0.013  0.772  1.0
  O  O6  1  0.168  0.336  0.866  1.0
  O  O7  1  0.152  0.304  0.281  1.0
  O  O8  1  0.507  0.013  0.810  1.0
  O  O9  1  0.848  0.696  0.719  1.0
  O  O10  1  0.832  0.664  0.134  1.0
  O  O11  1  0.493  0.987  0.190  1.0
[/CIF]
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The crystal structure described by KPrPdO3 crystallizes in the monoclinic C2/m space group. K(1) is bonded in a 7-coordinate geometry to two equivalent O(1), two equivalent O(3), and three equivalent O(2) atoms. Pr(1) is bonded in a 7-coordinate geometry to two equivalent O(2), two equivalent O(3), and three equivalent O(1) atoms. Pd(1) is bonded in a rectangular see-saw-like geometry to one O(1), one O(2), and two equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded to two equivalent K(1), three equivalent Pr(1), and one Pd(1) atom to form distorted OK2Pr3Pd octahedra that share corners with five equivalent O(2)K3Pr2Pd octahedra, edges with four equivalent O(1)K2Pr3Pd octahedra, and edges with four equivalent O(2)K3Pr2Pd octahedra. The corner-sharing octahedral tilt angles range from 7-8°. In the second O site, O(2) is bonded to three equivalent K(1), two equivalent Pr(1), and one Pd(1) atom to form distorted OK3Pr2Pd octahedra that share corners with five equivalent O(1)K2Pr3Pd octahedra, edges with four equivalent O(1)K2Pr3Pd octahedra, and edges with four equivalent O(2)K3Pr2Pd octahedra. The corner-sharing octahedral tilt angles range from 7-8°. In the third O site, O(3) is bonded in a 6-coordinate geometry to two equivalent K(1), two equivalent Pr(1), and two equivalent Pd(1) atoms. is represented by the CIF card [CIF]
data_KPrPdO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.990
_cell_length_b   7.012
_cell_length_c   7.591
_cell_angle_alpha   104.473
_cell_angle_beta   90.000
_cell_angle_gamma   106.530
_symmetry_Int_Tables_number   1
_cell_volume   196.529
_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
  K  K0  1  0.643  0.287  0.565  1.0
  K  K1  1  0.357  0.713  0.435  1.0
  Pr  Pr2  1  0.350  0.701  0.920  1.0
  Pr  Pr3  1  0.650  0.299  0.080  1.0
  Pd  Pd4  1  0.993  0.987  0.228  1.0
  Pd  Pd5  1  0.007  0.013  0.772  1.0
  O  O6  1  0.168  0.336  0.866  1.0
  O  O7  1  0.152  0.304  0.281  1.0
  O  O8  1  0.507  0.013  0.810  1.0
  O  O9  1  0.848  0.696  0.719  1.0
  O  O10  1  0.832  0.664  0.134  1.0
  O  O11  1  0.493  0.987  0.190  1.0
[/CIF]
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