The crystal structure described by CaAu3Ga crystallizes in the cubic Pa-3 space group. Ca(1) is bonded in a 15-coordinate geometry to twelve equivalent Au(1) and three equivalent Ga(1) atoms. Au(1) is bonded in a 5-coordinate geometry to four equivalent Ca(1) and two equivalent Ga(1) atoms. Ga(1) is bonded in a 6-coordinate geometry to three equivalent Ca(1) and six equivalent Au(1) atoms. is represented by the CIF card [CIF]
data_CaGaAu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.194
_cell_length_b   9.194
_cell_length_c   9.194
_cell_angle_alpha   90.000
_cell_angle_beta   90.001
_cell_angle_gamma   89.999
_symmetry_Int_Tables_number   1
_cell_volume   777.066
_cell_formula_units_Z   8
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  0.391  0.391  0.391  1.0
  Ca  Ca1  1  0.609  0.891  0.109  1.0
  Ca  Ca2  1  0.109  0.891  0.391  1.0
  Ca  Ca3  1  0.609  0.609  0.609  1.0
  Ca  Ca4  1  0.891  0.391  0.109  1.0
  Ca  Ca5  1  0.391  0.109  0.891  1.0
  Ca  Ca6  1  0.109  0.609  0.891  1.0
  Ca  Ca7  1  0.891  0.109  0.609  1.0
  Ga  Ga8  1  0.887  0.613  0.387  1.0
  Ga  Ga9  1  0.613  0.387  0.887  1.0
  Ga  Ga10  1  0.887  0.887  0.887  1.0
  Ga  Ga11  1  0.387  0.613  0.113  1.0
  Ga  Ga12  1  0.113  0.113  0.113  1.0
  Ga  Ga13  1  0.387  0.887  0.613  1.0
  Ga  Ga14  1  0.613  0.113  0.387  1.0
  Ga  Ga15  1  0.113  0.387  0.613  1.0
  Au  Au16  1  0.575  0.263  0.135  1.0
  Au  Au17  1  0.075  0.237  0.865  1.0
  Au  Au18  1  0.263  0.135  0.575  1.0
  Au  Au19  1  0.635  0.575  0.237  1.0
  Au  Au20  1  0.575  0.237  0.635  1.0
  Au  Au21  1  0.263  0.365  0.075  1.0
  Au  Au22  1  0.365  0.425  0.763  1.0
  Au  Au23  1  0.237  0.865  0.075  1.0
  Au  Au24  1  0.237  0.635  0.575  1.0
  Au  Au25  1  0.763  0.135  0.925  1.0
  Au  Au26  1  0.737  0.635  0.925  1.0
  Au  Au27  1  0.737  0.865  0.425  1.0
  Au  Au28  1  0.365  0.075  0.263  1.0
  Au  Au29  1  0.425  0.737  0.865  1.0
  Au  Au30  1  0.925  0.737  0.635  1.0
  Au  Au31  1  0.635  0.925  0.737  1.0
  Au  Au32  1  0.865  0.425  0.737  1.0
  Au  Au33  1  0.425  0.763  0.365  1.0
  Au  Au34  1  0.925  0.763  0.135  1.0
  Au  Au35  1  0.075  0.263  0.365  1.0
  Au  Au36  1  0.763  0.365  0.425  1.0
  Au  Au37  1  0.135  0.575  0.263  1.0
  Au  Au38  1  0.865  0.075  0.237  1.0
  Au  Au39  1  0.135  0.925  0.763  1.0
[/CIF]
.
The crystal structure described by CaAu3Ga crystallizes in the cubic Pa-3 space group. Ca(1) is bonded in a 15-coordinate geometry to twelve equivalent Au(1) and three equivalent Ga(1) atoms. Au(1) is bonded in a 5-coordinate geometry to four equivalent Ca(1) and two equivalent Ga(1) atoms. Ga(1) is bonded in a 6-coordinate geometry to three equivalent Ca(1) and six equivalent Au(1) atoms. is represented by the CIF card [CIF]
data_CaGaAu3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.194
_cell_length_b   9.194
_cell_length_c   9.194
_cell_angle_alpha   90.000
_cell_angle_beta   90.001
_cell_angle_gamma   89.999
_symmetry_Int_Tables_number   1
_cell_volume   777.066
_cell_formula_units_Z   8
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  0.391  0.391  0.391  1.0
  Ca  Ca1  1  0.609  0.891  0.109  1.0
  Ca  Ca2  1  0.109  0.891  0.391  1.0
  Ca  Ca3  1  0.609  0.609  0.609  1.0
  Ca  Ca4  1  0.891  0.391  0.109  1.0
  Ca  Ca5  1  0.391  0.109  0.891  1.0
  Ca  Ca6  1  0.109  0.609  0.891  1.0
  Ca  Ca7  1  0.891  0.109  0.609  1.0
  Ga  Ga8  1  0.887  0.613  0.387  1.0
  Ga  Ga9  1  0.613  0.387  0.887  1.0
  Ga  Ga10  1  0.887  0.887  0.887  1.0
  Ga  Ga11  1  0.387  0.613  0.113  1.0
  Ga  Ga12  1  0.113  0.113  0.113  1.0
  Ga  Ga13  1  0.387  0.887  0.613  1.0
  Ga  Ga14  1  0.613  0.113  0.387  1.0
  Ga  Ga15  1  0.113  0.387  0.613  1.0
  Au  Au16  1  0.575  0.263  0.135  1.0
  Au  Au17  1  0.075  0.237  0.865  1.0
  Au  Au18  1  0.263  0.135  0.575  1.0
  Au  Au19  1  0.635  0.575  0.237  1.0
  Au  Au20  1  0.575  0.237  0.635  1.0
  Au  Au21  1  0.263  0.365  0.075  1.0
  Au  Au22  1  0.365  0.425  0.763  1.0
  Au  Au23  1  0.237  0.865  0.075  1.0
  Au  Au24  1  0.237  0.635  0.575  1.0
  Au  Au25  1  0.763  0.135  0.925  1.0
  Au  Au26  1  0.737  0.635  0.925  1.0
  Au  Au27  1  0.737  0.865  0.425  1.0
  Au  Au28  1  0.365  0.075  0.263  1.0
  Au  Au29  1  0.425  0.737  0.865  1.0
  Au  Au30  1  0.925  0.737  0.635  1.0
  Au  Au31  1  0.635  0.925  0.737  1.0
  Au  Au32  1  0.865  0.425  0.737  1.0
  Au  Au33  1  0.425  0.763  0.365  1.0
  Au  Au34  1  0.925  0.763  0.135  1.0
  Au  Au35  1  0.075  0.263  0.365  1.0
  Au  Au36  1  0.763  0.365  0.425  1.0
  Au  Au37  1  0.135  0.575  0.263  1.0
  Au  Au38  1  0.865  0.075  0.237  1.0
  Au  Au39  1  0.135  0.925  0.763  1.0
[/CIF]
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