The material structure described by LiAu4Se4(O3Cl)4 crystallizes in the triclinic P1 space group. Li(1) is bonded in a 4-coordinate geometry to one O(9), one Cl(2), and two equivalent Cl(3) atoms. There are four inequivalent Au sites. In the first Au site, Au(1) is bonded in a rectangular see-saw-like geometry to one O(3), one O(5), one O(7), and one Cl(2) atom. In the second Au site, Au(2) is bonded in a rectangular see-saw-like geometry to one O(1), one O(11), one O(4), and one O(6) atom. In the third Au site, Au(3) is bonded in a rectangular see-saw-like geometry to one O(10), one O(2), one O(8), and one Cl(1) atom. In the fourth Au site, Au(4) is bonded in a distorted rectangular see-saw-like geometry to one O(12), one O(9), one Cl(3), and one Cl(4) atom. There are four inequivalent Se sites. In the first Se site, Se(1) is bonded in a distorted trigonal non-coplanar geometry to one O(1), one O(3), and one O(9) atom. In the second Se site, Se(2) is bonded in a trigonal non-coplanar geometry to one O(10), one O(6), and one O(7) atom. In the third Se site, Se(3) is bonded in a distorted trigonal non-coplanar geometry to one O(2), one O(4), and one O(5) atom. In the fourth Se site, Se(4) is bonded in a distorted trigonal non-coplanar geometry to one O(11), one O(12), and one O(8) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Au(2) and one Se(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Au(3) and one Se(3) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Au(1) and one Se(1) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Au(2) and one Se(3) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to one Au(1) and one Se(3) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Au(2) and one Se(2) atom. In the seventh O site, O(7) is bonded in a bent 120 degrees geometry to one Au(1) and one Se(2) atom. In the eighth O site, O(8) is bonded in a bent 120 degrees geometry to one Au(3) and one Se(4) atom. In the ninth O site, O(9) is bonded in a distorted trigonal planar geometry to one Li(1), one Au(4), and one Se(1) atom. In the tenth O site, O(10) is bonded in a bent 120 degrees geometry to one Au(3) and one Se(2) atom. In the eleventh O site, O(11) is bonded in a bent 120 degrees geometry to one Au(2) and one Se(4) atom. In the twelfth O site, O(12) is bonded in a bent 120 degrees geometry to one Au(4) and one Se(4) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one Au(3) atom. In the second Cl site, Cl(2) is bonded in a water-like geometry to one Li(1) and one Au(1) atom. In the third Cl site, Cl(3) is bonded in a 3-coordinate geometry to two equivalent Li(1) and one Au(4) atom. In the fourth Cl site, Cl(4) is bonded in a single-bond geometry to one Au(4) atom. is represented by the CIF card [CIF]
data_LiAu4Se4(ClO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.475
_cell_length_b   9.934
_cell_length_c   11.346
_cell_angle_alpha   84.482
_cell_angle_beta   89.766
_cell_angle_gamma   90.030
_symmetry_Int_Tables_number   1
_cell_volume   502.030
_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
  Li  Li0  1  0.796  0.244  0.359  1.0
  Au  Au1  1  0.988  0.588  0.184  1.0
  Au  Au2  1  0.996  0.998  0.999  1.0
  Au  Au3  1  0.009  0.410  0.812  1.0
  Au  Au4  1  0.014  0.999  0.500  1.0
  Se  Se5  1  0.707  0.883  0.261  1.0
  Se  Se6  1  0.203  0.710  0.912  1.0
  Se  Se7  1  0.785  0.290  0.079  1.0
  Se  Se8  1  0.297  0.118  0.741  1.0
  Cl  Cl9  1  0.352  0.485  0.671  1.0
  Cl  Cl10  1  0.669  0.488  0.333  1.0
  Cl  Cl11  1  0.283  0.209  0.452  1.0
  Cl  Cl12  1  0.714  0.807  0.534  1.0
  O  O13  1  0.654  0.962  0.119  1.0
  O  O14  1  0.684  0.346  0.936  1.0
  O  O15  1  0.016  0.780  0.245  1.0
  O  O16  1  0.081  0.178  0.063  1.0
  O  O17  1  0.055  0.401  0.127  1.0
  O  O18  1  0.906  0.820  0.932  1.0
  O  O19  1  0.304  0.655  0.056  1.0
  O  O20  1  0.984  0.222  0.754  1.0
  O  O21  1  0.893  0.020  0.321  1.0
  O  O22  1  0.938  0.594  0.871  1.0
  O  O23  1  0.345  0.038  0.883  1.0
  O  O24  1  0.105  0.988  0.680  1.0
[/CIF]
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The material structure described by LiAu4Se4(O3Cl)4 crystallizes in the triclinic P1 space group. Li(1) is bonded in a 4-coordinate geometry to one O(9), one Cl(2), and two equivalent Cl(3) atoms. There are four inequivalent Au sites. In the first Au site, Au(1) is bonded in a rectangular see-saw-like geometry to one O(3), one O(5), one O(7), and one Cl(2) atom. In the second Au site, Au(2) is bonded in a rectangular see-saw-like geometry to one O(1), one O(11), one O(4), and one O(6) atom. In the third Au site, Au(3) is bonded in a rectangular see-saw-like geometry to one O(10), one O(2), one O(8), and one Cl(1) atom. In the fourth Au site, Au(4) is bonded in a distorted rectangular see-saw-like geometry to one O(12), one O(9), one Cl(3), and one Cl(4) atom. There are four inequivalent Se sites. In the first Se site, Se(1) is bonded in a distorted trigonal non-coplanar geometry to one O(1), one O(3), and one O(9) atom. In the second Se site, Se(2) is bonded in a trigonal non-coplanar geometry to one O(10), one O(6), and one O(7) atom. In the third Se site, Se(3) is bonded in a distorted trigonal non-coplanar geometry to one O(2), one O(4), and one O(5) atom. In the fourth Se site, Se(4) is bonded in a distorted trigonal non-coplanar geometry to one O(11), one O(12), and one O(8) atom. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a bent 120 degrees geometry to one Au(2) and one Se(1) atom. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Au(3) and one Se(3) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one Au(1) and one Se(1) atom. In the fourth O site, O(4) is bonded in a bent 120 degrees geometry to one Au(2) and one Se(3) atom. In the fifth O site, O(5) is bonded in a bent 120 degrees geometry to one Au(1) and one Se(3) atom. In the sixth O site, O(6) is bonded in a bent 120 degrees geometry to one Au(2) and one Se(2) atom. In the seventh O site, O(7) is bonded in a bent 120 degrees geometry to one Au(1) and one Se(2) atom. In the eighth O site, O(8) is bonded in a bent 120 degrees geometry to one Au(3) and one Se(4) atom. In the ninth O site, O(9) is bonded in a distorted trigonal planar geometry to one Li(1), one Au(4), and one Se(1) atom. In the tenth O site, O(10) is bonded in a bent 120 degrees geometry to one Au(3) and one Se(2) atom. In the eleventh O site, O(11) is bonded in a bent 120 degrees geometry to one Au(2) and one Se(4) atom. In the twelfth O site, O(12) is bonded in a bent 120 degrees geometry to one Au(4) and one Se(4) atom. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one Au(3) atom. In the second Cl site, Cl(2) is bonded in a water-like geometry to one Li(1) and one Au(1) atom. In the third Cl site, Cl(3) is bonded in a 3-coordinate geometry to two equivalent Li(1) and one Au(4) atom. In the fourth Cl site, Cl(4) is bonded in a single-bond geometry to one Au(4) atom. is represented by the CIF card [CIF]
data_LiAu4Se4(ClO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.475
_cell_length_b   9.934
_cell_length_c   11.346
_cell_angle_alpha   84.482
_cell_angle_beta   89.766
_cell_angle_gamma   90.030
_symmetry_Int_Tables_number   1
_cell_volume   502.030
_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
  Li  Li0  1  0.796  0.244  0.359  1.0
  Au  Au1  1  0.988  0.588  0.184  1.0
  Au  Au2  1  0.996  0.998  0.999  1.0
  Au  Au3  1  0.009  0.410  0.812  1.0
  Au  Au4  1  0.014  0.999  0.500  1.0
  Se  Se5  1  0.707  0.883  0.261  1.0
  Se  Se6  1  0.203  0.710  0.912  1.0
  Se  Se7  1  0.785  0.290  0.079  1.0
  Se  Se8  1  0.297  0.118  0.741  1.0
  Cl  Cl9  1  0.352  0.485  0.671  1.0
  Cl  Cl10  1  0.669  0.488  0.333  1.0
  Cl  Cl11  1  0.283  0.209  0.452  1.0
  Cl  Cl12  1  0.714  0.807  0.534  1.0
  O  O13  1  0.654  0.962  0.119  1.0
  O  O14  1  0.684  0.346  0.936  1.0
  O  O15  1  0.016  0.780  0.245  1.0
  O  O16  1  0.081  0.178  0.063  1.0
  O  O17  1  0.055  0.401  0.127  1.0
  O  O18  1  0.906  0.820  0.932  1.0
  O  O19  1  0.304  0.655  0.056  1.0
  O  O20  1  0.984  0.222  0.754  1.0
  O  O21  1  0.893  0.020  0.321  1.0
  O  O22  1  0.938  0.594  0.871  1.0
  O  O23  1  0.345  0.038  0.883  1.0
  O  O24  1  0.105  0.988  0.680  1.0
[/CIF]
.