The material described by CsAuCl4 crystallizes in the monoclinic C2/c space group. Cs(1) is bonded in a 10-coordinate geometry to four equivalent Cl(2) and six equivalent Cl(1) atoms. Au(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 to three equivalent Cs(1) and one Au(1) atom to form a mixture of distorted corner and edge-sharing ClCs3Au tetrahedra. In the second Cl site, Cl(2) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one Au(1) atom. is represented by the CIF card [CIF]
data_CsAuCl4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.255
_cell_length_b   7.237
_cell_length_c   9.893
_cell_angle_alpha   103.357
_cell_angle_beta   90.000
_cell_angle_gamma   115.605
_symmetry_Int_Tables_number   1
_cell_volume   390.376
_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  0.296  0.000  0.250  1.0
  Cs  Cs1  1  0.704  0.000  0.750  1.0
  Au  Au2  1  0.000  0.500  0.500  1.0
  Au  Au3  1  0.500  0.500  0.000  1.0
  Cl  Cl4  1  0.135  0.861  0.570  1.0
  Cl  Cl5  1  0.274  0.139  0.930  1.0
  Cl  Cl6  1  0.865  0.139  0.430  1.0
  Cl  Cl7  1  0.726  0.861  0.070  1.0
  Cl  Cl8  1  0.310  0.547  0.364  1.0
  Cl  Cl9  1  0.763  0.453  0.136  1.0
  Cl  Cl10  1  0.690  0.453  0.636  1.0
  Cl  Cl11  1  0.237  0.547  0.864  1.0
[/CIF]
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The material described by CsAuCl4 crystallizes in the monoclinic C2/c space group. Cs(1) is bonded in a 10-coordinate geometry to four equivalent Cl(2) and six equivalent Cl(1) atoms. Au(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 to three equivalent Cs(1) and one Au(1) atom to form a mixture of distorted corner and edge-sharing ClCs3Au tetrahedra. In the second Cl site, Cl(2) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one Au(1) atom. is represented by the CIF card [CIF]
data_CsAuCl4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.255
_cell_length_b   7.237
_cell_length_c   9.893
_cell_angle_alpha   103.357
_cell_angle_beta   90.000
_cell_angle_gamma   115.605
_symmetry_Int_Tables_number   1
_cell_volume   390.376
_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  0.296  0.000  0.250  1.0
  Cs  Cs1  1  0.704  0.000  0.750  1.0
  Au  Au2  1  0.000  0.500  0.500  1.0
  Au  Au3  1  0.500  0.500  0.000  1.0
  Cl  Cl4  1  0.135  0.861  0.570  1.0
  Cl  Cl5  1  0.274  0.139  0.930  1.0
  Cl  Cl6  1  0.865  0.139  0.430  1.0
  Cl  Cl7  1  0.726  0.861  0.070  1.0
  Cl  Cl8  1  0.310  0.547  0.364  1.0
  Cl  Cl9  1  0.763  0.453  0.136  1.0
  Cl  Cl10  1  0.690  0.453  0.636  1.0
  Cl  Cl11  1  0.237  0.547  0.864  1.0
[/CIF]
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