The material structure described by BaPdCl4 crystallizes in the orthorhombic Pbcn space group. Ba(1) is bonded in a 8-coordinate geometry to four equivalent Cl(1) and four equivalent Cl(2) atoms. Pd(1) is bonded in a square co-planar geometry to two equivalent Cl(1) and two equivalent Cl(2) atoms. There are two inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a distorted trigonal planar geometry to two equivalent Ba(1) and one Pd(1) atom. In the second Cl site, Cl(2) is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ba(1) and one Pd(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_BaPdCl4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.936
_cell_length_b   7.572
_cell_length_c   12.641
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   663.937
_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
  Ba  Ba0  1  0.500  0.750  0.148  1.0
  Ba  Ba1  1  0.000  0.250  0.352  1.0
  Ba  Ba2  1  0.500  0.250  0.852  1.0
  Ba  Ba3  1  0.000  0.750  0.648  1.0
  Pd  Pd4  1  0.000  0.500  0.000  1.0
  Pd  Pd5  1  0.500  0.500  0.500  1.0
  Pd  Pd6  1  0.500  0.000  0.500  1.0
  Pd  Pd7  1  0.000  0.000  0.000  1.0
  Cl  Cl8  1  0.889  0.471  0.828  1.0
  Cl  Cl9  1  0.389  0.529  0.672  1.0
  Cl  Cl10  1  0.611  0.971  0.672  1.0
  Cl  Cl11  1  0.111  0.029  0.828  1.0
  Cl  Cl12  1  0.111  0.529  0.172  1.0
  Cl  Cl13  1  0.611  0.471  0.328  1.0
  Cl  Cl14  1  0.389  0.029  0.328  1.0
  Cl  Cl15  1  0.889  0.971  0.172  1.0
  Cl  Cl16  1  0.793  0.898  0.437  1.0
  Cl  Cl17  1  0.293  0.102  0.063  1.0
  Cl  Cl18  1  0.707  0.398  0.063  1.0
  Cl  Cl19  1  0.207  0.602  0.437  1.0
  Cl  Cl20  1  0.207  0.102  0.563  1.0
  Cl  Cl21  1  0.707  0.898  0.937  1.0
  Cl  Cl22  1  0.293  0.602  0.937  1.0
  Cl  Cl23  1  0.793  0.398  0.563  1.0
[/CIF]
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The material structure described by BaPdCl4 crystallizes in the orthorhombic Pbcn space group. Ba(1) is bonded in a 8-coordinate geometry to four equivalent Cl(1) and four equivalent Cl(2) atoms. Pd(1) is bonded in a square co-planar geometry to two equivalent Cl(1) and two equivalent Cl(2) atoms. There are two inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a distorted trigonal planar geometry to two equivalent Ba(1) and one Pd(1) atom. In the second Cl site, Cl(2) is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ba(1) and one Pd(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_BaPdCl4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.936
_cell_length_b   7.572
_cell_length_c   12.641
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   663.937
_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
  Ba  Ba0  1  0.500  0.750  0.148  1.0
  Ba  Ba1  1  0.000  0.250  0.352  1.0
  Ba  Ba2  1  0.500  0.250  0.852  1.0
  Ba  Ba3  1  0.000  0.750  0.648  1.0
  Pd  Pd4  1  0.000  0.500  0.000  1.0
  Pd  Pd5  1  0.500  0.500  0.500  1.0
  Pd  Pd6  1  0.500  0.000  0.500  1.0
  Pd  Pd7  1  0.000  0.000  0.000  1.0
  Cl  Cl8  1  0.889  0.471  0.828  1.0
  Cl  Cl9  1  0.389  0.529  0.672  1.0
  Cl  Cl10  1  0.611  0.971  0.672  1.0
  Cl  Cl11  1  0.111  0.029  0.828  1.0
  Cl  Cl12  1  0.111  0.529  0.172  1.0
  Cl  Cl13  1  0.611  0.471  0.328  1.0
  Cl  Cl14  1  0.389  0.029  0.328  1.0
  Cl  Cl15  1  0.889  0.971  0.172  1.0
  Cl  Cl16  1  0.793  0.898  0.437  1.0
  Cl  Cl17  1  0.293  0.102  0.063  1.0
  Cl  Cl18  1  0.707  0.398  0.063  1.0
  Cl  Cl19  1  0.207  0.602  0.437  1.0
  Cl  Cl20  1  0.207  0.102  0.563  1.0
  Cl  Cl21  1  0.707  0.898  0.937  1.0
  Cl  Cl22  1  0.293  0.602  0.937  1.0
  Cl  Cl23  1  0.793  0.398  0.563  1.0
[/CIF]
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