The structure described by Ca4Au10In3 crystallizes in the orthorhombic Cmce space group. There are two inequivalent Ca sites. In the first Ca site, Ca(1) is bonded in a 10-coordinate geometry to two equivalent Au(2), four equivalent Au(1), and four equivalent Au(3) atoms. In the second Ca site, Ca(2) is bonded in a 7-coordinate geometry to three equivalent Au(2), four equivalent Au(1), and four equivalent Au(3) atoms. There are three inequivalent Au sites. In the first Au site, Au(1) is bonded in a 11-coordinate geometry to two equivalent Ca(1), two equivalent Ca(2), one Au(1), one Au(2), two equivalent Au(3), one In(2), and two equivalent In(1) atoms. In the second Au site, Au(2) is bonded in a 10-coordinate geometry to two equivalent Ca(1), three equivalent Ca(2), one Au(2), two equivalent Au(1), and two equivalent Au(3) atoms. In the third Au site, Au(3) is bonded in a 11-coordinate geometry to two equivalent Ca(1), two equivalent Ca(2), one Au(2), one Au(3), two equivalent Au(1), one In(2), and two equivalent In(1) atoms. There are two inequivalent In sites. In the first In site, In(1) is bonded in a 8-coordinate geometry to four equivalent Au(1) and four equivalent Au(3) atoms. In the second In site, In(2) is bonded in a distorted body-centered cubic geometry to four equivalent Au(1) and four equivalent Au(3) atoms. is represented by the CIF card [CIF]
data_Ca4In3Au10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.584
_cell_length_b   8.584
_cell_length_c   10.191
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   107.950
_symmetry_Int_Tables_number   1
_cell_volume   714.431
_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
  Ca  Ca0  1  0.696  0.304  0.000  1.0
  Ca  Ca1  1  0.196  0.804  0.500  1.0
  Ca  Ca2  1  0.803  0.803  0.298  1.0
  Ca  Ca3  1  0.303  0.303  0.202  1.0
  Ca  Ca4  1  0.804  0.196  0.500  1.0
  Ca  Ca5  1  0.304  0.696  0.000  1.0
  Ca  Ca6  1  0.697  0.697  0.798  1.0
  Ca  Ca7  1  0.197  0.197  0.702  1.0
  In  In8  1  0.518  0.018  0.250  1.0
  In  In9  1  0.982  0.482  0.750  1.0
  In  In10  1  0.000  0.000  0.000  1.0
  In  In11  1  0.018  0.518  0.250  1.0
  In  In12  1  0.482  0.982  0.750  1.0
  In  In13  1  0.500  0.500  0.500  1.0
  Au  Au14  1  0.152  0.436  0.484  1.0
  Au  Au15  1  0.901  0.901  0.596  1.0
  Au  Au16  1  0.564  0.848  0.516  1.0
  Au  Au17  1  0.883  0.168  0.207  1.0
  Au  Au18  1  0.383  0.668  0.293  1.0
  Au  Au19  1  0.668  0.383  0.293  1.0
  Au  Au20  1  0.401  0.401  0.904  1.0
  Au  Au21  1  0.936  0.652  0.016  1.0
  Au  Au22  1  0.332  0.617  0.707  1.0
  Au  Au23  1  0.348  0.064  0.984  1.0
  Au  Au24  1  0.599  0.599  0.096  1.0
  Au  Au25  1  0.652  0.936  0.016  1.0
  Au  Au26  1  0.099  0.099  0.404  1.0
  Au  Au27  1  0.617  0.332  0.707  1.0
  Au  Au28  1  0.117  0.832  0.793  1.0
  Au  Au29  1  0.064  0.348  0.984  1.0
  Au  Au30  1  0.848  0.564  0.516  1.0
  Au  Au31  1  0.168  0.883  0.207  1.0
  Au  Au32  1  0.436  0.152  0.484  1.0
  Au  Au33  1  0.832  0.117  0.793  1.0
[/CIF]
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The structure described by Ca4Au10In3 crystallizes in the orthorhombic Cmce space group. There are two inequivalent Ca sites. In the first Ca site, Ca(1) is bonded in a 10-coordinate geometry to two equivalent Au(2), four equivalent Au(1), and four equivalent Au(3) atoms. In the second Ca site, Ca(2) is bonded in a 7-coordinate geometry to three equivalent Au(2), four equivalent Au(1), and four equivalent Au(3) atoms. There are three inequivalent Au sites. In the first Au site, Au(1) is bonded in a 11-coordinate geometry to two equivalent Ca(1), two equivalent Ca(2), one Au(1), one Au(2), two equivalent Au(3), one In(2), and two equivalent In(1) atoms. In the second Au site, Au(2) is bonded in a 10-coordinate geometry to two equivalent Ca(1), three equivalent Ca(2), one Au(2), two equivalent Au(1), and two equivalent Au(3) atoms. In the third Au site, Au(3) is bonded in a 11-coordinate geometry to two equivalent Ca(1), two equivalent Ca(2), one Au(2), one Au(3), two equivalent Au(1), one In(2), and two equivalent In(1) atoms. There are two inequivalent In sites. In the first In site, In(1) is bonded in a 8-coordinate geometry to four equivalent Au(1) and four equivalent Au(3) atoms. In the second In site, In(2) is bonded in a distorted body-centered cubic geometry to four equivalent Au(1) and four equivalent Au(3) atoms. is represented by the CIF card [CIF]
data_Ca4In3Au10
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.584
_cell_length_b   8.584
_cell_length_c   10.191
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   107.950
_symmetry_Int_Tables_number   1
_cell_volume   714.431
_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
  Ca  Ca0  1  0.696  0.304  0.000  1.0
  Ca  Ca1  1  0.196  0.804  0.500  1.0
  Ca  Ca2  1  0.803  0.803  0.298  1.0
  Ca  Ca3  1  0.303  0.303  0.202  1.0
  Ca  Ca4  1  0.804  0.196  0.500  1.0
  Ca  Ca5  1  0.304  0.696  0.000  1.0
  Ca  Ca6  1  0.697  0.697  0.798  1.0
  Ca  Ca7  1  0.197  0.197  0.702  1.0
  In  In8  1  0.518  0.018  0.250  1.0
  In  In9  1  0.982  0.482  0.750  1.0
  In  In10  1  0.000  0.000  0.000  1.0
  In  In11  1  0.018  0.518  0.250  1.0
  In  In12  1  0.482  0.982  0.750  1.0
  In  In13  1  0.500  0.500  0.500  1.0
  Au  Au14  1  0.152  0.436  0.484  1.0
  Au  Au15  1  0.901  0.901  0.596  1.0
  Au  Au16  1  0.564  0.848  0.516  1.0
  Au  Au17  1  0.883  0.168  0.207  1.0
  Au  Au18  1  0.383  0.668  0.293  1.0
  Au  Au19  1  0.668  0.383  0.293  1.0
  Au  Au20  1  0.401  0.401  0.904  1.0
  Au  Au21  1  0.936  0.652  0.016  1.0
  Au  Au22  1  0.332  0.617  0.707  1.0
  Au  Au23  1  0.348  0.064  0.984  1.0
  Au  Au24  1  0.599  0.599  0.096  1.0
  Au  Au25  1  0.652  0.936  0.016  1.0
  Au  Au26  1  0.099  0.099  0.404  1.0
  Au  Au27  1  0.617  0.332  0.707  1.0
  Au  Au28  1  0.117  0.832  0.793  1.0
  Au  Au29  1  0.064  0.348  0.984  1.0
  Au  Au30  1  0.848  0.564  0.516  1.0
  Au  Au31  1  0.168  0.883  0.207  1.0
  Au  Au32  1  0.436  0.152  0.484  1.0
  Au  Au33  1  0.832  0.117  0.793  1.0
[/CIF]
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