The compound described by K6Pd3(BrCl2)4 crystallizes in the orthorhombic Amm2 space group. There are three inequivalent K sites. In the first K site, K(1) is bonded in a body-centered cubic geometry to two equivalent Br(1), two equivalent Cl(1), two equivalent Cl(2), and two equivalent Cl(3) atoms. In the second K site, K(2) is bonded in a body-centered cubic geometry to two equivalent Br(2), two equivalent Br(3), two equivalent Cl(2), and two equivalent Cl(3) atoms. In the third K site, K(3) is bonded in a body-centered cubic geometry to two equivalent Br(2), two equivalent Cl(1), and four equivalent Cl(4) atoms. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a square co-planar geometry to one Br(1), one Br(3), and two equivalent Cl(3) atoms. In the second Pd site, Pd(2) is bonded in a rectangular see-saw-like geometry to one Br(2), one Cl(1), one Cl(2), and one Cl(4) atom. There are three inequivalent Br sites. In the first Br site, Br(1) is bonded to four equivalent K(1) and one Pd(1) atom to form BrK4Pd square pyramids that share  a cornercorner with one Br(3)K4Pd square pyramid, corners with four equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(2)K4Pd square pyramids, corners with four equivalent Cl(3)K4Pd square pyramids, edges with two equivalent Br(1)K4Pd square pyramids, edges with two equivalent Cl(1)K4Pd square pyramids, edges with two equivalent Cl(2)K4Pd square pyramids, and faces with two equivalent Cl(3)K4Pd square pyramids. In the second Br site, Br(2) is bonded to two equivalent K(2), two equivalent K(3), and one Pd(2) atom to form BrK4Pd square pyramids that share corners with two equivalent Br(3)K4Pd square pyramids, corners with two equivalent Cl(2)K4Pd square pyramids, corners with two equivalent Cl(3)K4Pd square pyramids, corners with three equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(4)K4Pd square pyramids,  an edgeedge with one Br(3)K4Pd square pyramid,  an edgeedge with one Cl(1)K4Pd square pyramid,  an edgeedge with one Cl(3)K4Pd square pyramid,  an edgeedge with one Cl(4)K4Pd square pyramid, edges with two equivalent Br(2)K4Pd square pyramids,  a faceface with one Cl(2)K4Pd square pyramid, and  a faceface with one Cl(4)K4Pd square pyramid. In the third Br site, Br(3) is bonded to four equivalent K(2) and one Pd(1) atom to form BrK4Pd square pyramids that share  a cornercorner with one Br(1)K4Pd square pyramid, corners with four equivalent Br(2)K4Pd square pyramids, corners with four equivalent Cl(2)K4Pd square pyramids, corners with four equivalent Cl(3)K4Pd square pyramids, edges with two equivalent Br(2)K4Pd square pyramids, edges with two equivalent Br(3)K4Pd square pyramids, edges with two equivalent Cl(2)K4Pd square pyramids, and faces with two equivalent Cl(3)K4Pd square pyramids. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded to two equivalent K(1), two equivalent K(3), and one Pd(2) atom to form ClK4Pd square pyramids that share corners with two equivalent Br(1)K4Pd square pyramids, corners with two equivalent Cl(2)K4Pd square pyramids, corners with two equivalent Cl(3)K4Pd square pyramids, corners with three equivalent Br(2)K4Pd square pyramids, corners with four equivalent Cl(4)K4Pd square pyramids,  an edgeedge with one Br(1)K4Pd square pyramid,  an edgeedge with one Br(2)K4Pd square pyramid,  an edgeedge with one Cl(3)K4Pd square pyramid,  an edgeedge with one Cl(4)K4Pd square pyramid, edges with two equivalent Cl(1)K4Pd square pyramids,  a faceface with one Cl(2)K4Pd square pyramid, and  a faceface with one Cl(4)K4Pd square pyramid. In the second Cl site, Cl(2) is bonded to two equivalent K(1), two equivalent K(2), and one Pd(2) atom to form ClK4Pd square pyramids that share  a cornercorner with one Cl(4)K4Pd square pyramid, corners with two equivalent Br(1)K4Pd square pyramids, corners with two equivalent Br(2)K4Pd square pyramids, corners with two equivalent Br(3)K4Pd square pyramids, corners with two equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(3)K4Pd square pyramids,  an edgeedge with one Br(1)K4Pd square pyramid,  an edgeedge with one Br(3)K4Pd square pyramid, edges with two equivalent Cl(2)K4Pd square pyramids, edges with two equivalent Cl(3)K4Pd square pyramids,  a faceface with one Br(2)K4Pd square pyramid, and  a faceface with one Cl(1)K4Pd square pyramid. In the third Cl site, Cl(3) is bonded to two equivalent K(1), two equivalent K(2), and one Pd(1) atom to form distorted ClK4Pd square pyramids that share  a cornercorner with one Cl(3)K4Pd square pyramid, corners with two equivalent Br(1)K4Pd square pyramids, corners with two equivalent Br(2)K4Pd square pyramids, corners with two equivalent Br(3)K4Pd square pyramids, corners with two equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(2)K4Pd square pyramids,  an edgeedge with one Br(2)K4Pd square pyramid,  an edgeedge with one Cl(1)K4Pd square pyramid, edges with two equivalent Cl(2)K4Pd square pyramids, edges with two equivalent Cl(3)K4Pd square pyramids,  a faceface with one Br(1)K4Pd square pyramid, and  a faceface with one Br(3)K4Pd square pyramid. In the fourth Cl site, Cl(4) is bonded to four equivalent K(3) and one Pd(2) atom to form ClK4Pd square pyramids that share  a cornercorner with one Cl(2)K4Pd square pyramid, corners with four equivalent Br(2)K4Pd square pyramids, corners with four equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(4)K4Pd square pyramids,  an edgeedge with one Br(2)K4Pd square pyramid,  an edgeedge with one Cl(1)K4Pd square pyramid, edges with four equivalent Cl(4)K4Pd square pyramids,  a faceface with one Br(2)K4Pd square pyramid, and  a faceface with one Cl(1)K4Pd square pyramid. is represented by the CIF file [CIF]
data_K6Pd3(BrCl2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.486
_cell_length_b   16.486
_cell_length_c   4.273
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   143.953
_symmetry_Int_Tables_number   1
_cell_volume   683.460
_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
  K  K0  1  0.336  0.164  0.500  1.0
  K  K1  1  0.666  0.833  0.500  1.0
  K  K2  1  0.003  0.496  0.500  1.0
  K  K3  1  0.164  0.336  0.500  1.0
  K  K4  1  0.496  0.003  0.500  1.0
  K  K5  1  0.833  0.666  0.500  1.0
  Pd  Pd6  1  0.001  0.001  0.000  1.0
  Pd  Pd7  1  0.331  0.665  0.000  1.0
  Pd  Pd8  1  0.665  0.331  0.000  1.0
  Br  Br9  1  0.243  0.243  0.000  1.0
  Br  Br10  1  0.573  0.907  0.000  1.0
  Br  Br11  1  0.907  0.573  0.000  1.0
  Br  Br12  1  0.757  0.757  0.000  1.0
  Cl  Cl13  1  0.100  0.434  0.000  1.0
  Cl  Cl14  1  0.434  0.100  0.000  1.0
  Cl  Cl15  1  0.590  0.405  0.000  1.0
  Cl  Cl16  1  0.926  0.075  0.000  1.0
  Cl  Cl17  1  0.257  0.740  0.000  1.0
  Cl  Cl18  1  0.405  0.590  0.000  1.0
  Cl  Cl19  1  0.740  0.257  0.000  1.0
  Cl  Cl20  1  0.075  0.926  0.000  1.0
[/CIF]
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The compound described by K6Pd3(BrCl2)4 crystallizes in the orthorhombic Amm2 space group. There are three inequivalent K sites. In the first K site, K(1) is bonded in a body-centered cubic geometry to two equivalent Br(1), two equivalent Cl(1), two equivalent Cl(2), and two equivalent Cl(3) atoms. In the second K site, K(2) is bonded in a body-centered cubic geometry to two equivalent Br(2), two equivalent Br(3), two equivalent Cl(2), and two equivalent Cl(3) atoms. In the third K site, K(3) is bonded in a body-centered cubic geometry to two equivalent Br(2), two equivalent Cl(1), and four equivalent Cl(4) atoms. There are two inequivalent Pd sites. In the first Pd site, Pd(1) is bonded in a square co-planar geometry to one Br(1), one Br(3), and two equivalent Cl(3) atoms. In the second Pd site, Pd(2) is bonded in a rectangular see-saw-like geometry to one Br(2), one Cl(1), one Cl(2), and one Cl(4) atom. There are three inequivalent Br sites. In the first Br site, Br(1) is bonded to four equivalent K(1) and one Pd(1) atom to form BrK4Pd square pyramids that share  a cornercorner with one Br(3)K4Pd square pyramid, corners with four equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(2)K4Pd square pyramids, corners with four equivalent Cl(3)K4Pd square pyramids, edges with two equivalent Br(1)K4Pd square pyramids, edges with two equivalent Cl(1)K4Pd square pyramids, edges with two equivalent Cl(2)K4Pd square pyramids, and faces with two equivalent Cl(3)K4Pd square pyramids. In the second Br site, Br(2) is bonded to two equivalent K(2), two equivalent K(3), and one Pd(2) atom to form BrK4Pd square pyramids that share corners with two equivalent Br(3)K4Pd square pyramids, corners with two equivalent Cl(2)K4Pd square pyramids, corners with two equivalent Cl(3)K4Pd square pyramids, corners with three equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(4)K4Pd square pyramids,  an edgeedge with one Br(3)K4Pd square pyramid,  an edgeedge with one Cl(1)K4Pd square pyramid,  an edgeedge with one Cl(3)K4Pd square pyramid,  an edgeedge with one Cl(4)K4Pd square pyramid, edges with two equivalent Br(2)K4Pd square pyramids,  a faceface with one Cl(2)K4Pd square pyramid, and  a faceface with one Cl(4)K4Pd square pyramid. In the third Br site, Br(3) is bonded to four equivalent K(2) and one Pd(1) atom to form BrK4Pd square pyramids that share  a cornercorner with one Br(1)K4Pd square pyramid, corners with four equivalent Br(2)K4Pd square pyramids, corners with four equivalent Cl(2)K4Pd square pyramids, corners with four equivalent Cl(3)K4Pd square pyramids, edges with two equivalent Br(2)K4Pd square pyramids, edges with two equivalent Br(3)K4Pd square pyramids, edges with two equivalent Cl(2)K4Pd square pyramids, and faces with two equivalent Cl(3)K4Pd square pyramids. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded to two equivalent K(1), two equivalent K(3), and one Pd(2) atom to form ClK4Pd square pyramids that share corners with two equivalent Br(1)K4Pd square pyramids, corners with two equivalent Cl(2)K4Pd square pyramids, corners with two equivalent Cl(3)K4Pd square pyramids, corners with three equivalent Br(2)K4Pd square pyramids, corners with four equivalent Cl(4)K4Pd square pyramids,  an edgeedge with one Br(1)K4Pd square pyramid,  an edgeedge with one Br(2)K4Pd square pyramid,  an edgeedge with one Cl(3)K4Pd square pyramid,  an edgeedge with one Cl(4)K4Pd square pyramid, edges with two equivalent Cl(1)K4Pd square pyramids,  a faceface with one Cl(2)K4Pd square pyramid, and  a faceface with one Cl(4)K4Pd square pyramid. In the second Cl site, Cl(2) is bonded to two equivalent K(1), two equivalent K(2), and one Pd(2) atom to form ClK4Pd square pyramids that share  a cornercorner with one Cl(4)K4Pd square pyramid, corners with two equivalent Br(1)K4Pd square pyramids, corners with two equivalent Br(2)K4Pd square pyramids, corners with two equivalent Br(3)K4Pd square pyramids, corners with two equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(3)K4Pd square pyramids,  an edgeedge with one Br(1)K4Pd square pyramid,  an edgeedge with one Br(3)K4Pd square pyramid, edges with two equivalent Cl(2)K4Pd square pyramids, edges with two equivalent Cl(3)K4Pd square pyramids,  a faceface with one Br(2)K4Pd square pyramid, and  a faceface with one Cl(1)K4Pd square pyramid. In the third Cl site, Cl(3) is bonded to two equivalent K(1), two equivalent K(2), and one Pd(1) atom to form distorted ClK4Pd square pyramids that share  a cornercorner with one Cl(3)K4Pd square pyramid, corners with two equivalent Br(1)K4Pd square pyramids, corners with two equivalent Br(2)K4Pd square pyramids, corners with two equivalent Br(3)K4Pd square pyramids, corners with two equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(2)K4Pd square pyramids,  an edgeedge with one Br(2)K4Pd square pyramid,  an edgeedge with one Cl(1)K4Pd square pyramid, edges with two equivalent Cl(2)K4Pd square pyramids, edges with two equivalent Cl(3)K4Pd square pyramids,  a faceface with one Br(1)K4Pd square pyramid, and  a faceface with one Br(3)K4Pd square pyramid. In the fourth Cl site, Cl(4) is bonded to four equivalent K(3) and one Pd(2) atom to form ClK4Pd square pyramids that share  a cornercorner with one Cl(2)K4Pd square pyramid, corners with four equivalent Br(2)K4Pd square pyramids, corners with four equivalent Cl(1)K4Pd square pyramids, corners with four equivalent Cl(4)K4Pd square pyramids,  an edgeedge with one Br(2)K4Pd square pyramid,  an edgeedge with one Cl(1)K4Pd square pyramid, edges with four equivalent Cl(4)K4Pd square pyramids,  a faceface with one Br(2)K4Pd square pyramid, and  a faceface with one Cl(1)K4Pd square pyramid. is represented by the CIF file [CIF]
data_K6Pd3(BrCl2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   16.486
_cell_length_b   16.486
_cell_length_c   4.273
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   143.953
_symmetry_Int_Tables_number   1
_cell_volume   683.460
_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
  K  K0  1  0.336  0.164  0.500  1.0
  K  K1  1  0.666  0.833  0.500  1.0
  K  K2  1  0.003  0.496  0.500  1.0
  K  K3  1  0.164  0.336  0.500  1.0
  K  K4  1  0.496  0.003  0.500  1.0
  K  K5  1  0.833  0.666  0.500  1.0
  Pd  Pd6  1  0.001  0.001  0.000  1.0
  Pd  Pd7  1  0.331  0.665  0.000  1.0
  Pd  Pd8  1  0.665  0.331  0.000  1.0
  Br  Br9  1  0.243  0.243  0.000  1.0
  Br  Br10  1  0.573  0.907  0.000  1.0
  Br  Br11  1  0.907  0.573  0.000  1.0
  Br  Br12  1  0.757  0.757  0.000  1.0
  Cl  Cl13  1  0.100  0.434  0.000  1.0
  Cl  Cl14  1  0.434  0.100  0.000  1.0
  Cl  Cl15  1  0.590  0.405  0.000  1.0
  Cl  Cl16  1  0.926  0.075  0.000  1.0
  Cl  Cl17  1  0.257  0.740  0.000  1.0
  Cl  Cl18  1  0.405  0.590  0.000  1.0
  Cl  Cl19  1  0.740  0.257  0.000  1.0
  Cl  Cl20  1  0.075  0.926  0.000  1.0
[/CIF]
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