The material described by CaAuGa crystallizes in the orthorhombic Pnma space group. Ca(1) is bonded in a 12-coordinate geometry to six equivalent Au(1) and six equivalent Ga(1) atoms. Au(1) is bonded in a 10-coordinate geometry to six equivalent Ca(1) and four equivalent Ga(1) atoms. Ga(1) is bonded in a 10-coordinate geometry to six equivalent Ca(1) and four equivalent Au(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_CaGaAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.557
_cell_length_b   7.306
_cell_length_c   7.660
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   254.981
_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
  Ca  Ca0  1  0.750  0.494  0.199  1.0
  Ca  Ca1  1  0.250  0.006  0.699  1.0
  Ca  Ca2  1  0.750  0.994  0.301  1.0
  Ca  Ca3  1  0.250  0.506  0.801  1.0
  Ga  Ga4  1  0.250  0.181  0.081  1.0
  Ga  Ga5  1  0.750  0.319  0.581  1.0
  Ga  Ga6  1  0.250  0.681  0.419  1.0
  Ga  Ga7  1  0.750  0.819  0.919  1.0
  Au  Au8  1  0.250  0.796  0.092  1.0
  Au  Au9  1  0.750  0.204  0.908  1.0
  Au  Au10  1  0.250  0.296  0.408  1.0
  Au  Au11  1  0.750  0.704  0.592  1.0
[/CIF]
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The material described by CaAuGa crystallizes in the orthorhombic Pnma space group. Ca(1) is bonded in a 12-coordinate geometry to six equivalent Au(1) and six equivalent Ga(1) atoms. Au(1) is bonded in a 10-coordinate geometry to six equivalent Ca(1) and four equivalent Ga(1) atoms. Ga(1) is bonded in a 10-coordinate geometry to six equivalent Ca(1) and four equivalent Au(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_CaGaAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.557
_cell_length_b   7.306
_cell_length_c   7.660
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   254.981
_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
  Ca  Ca0  1  0.750  0.494  0.199  1.0
  Ca  Ca1  1  0.250  0.006  0.699  1.0
  Ca  Ca2  1  0.750  0.994  0.301  1.0
  Ca  Ca3  1  0.250  0.506  0.801  1.0
  Ga  Ga4  1  0.250  0.181  0.081  1.0
  Ga  Ga5  1  0.750  0.319  0.581  1.0
  Ga  Ga6  1  0.250  0.681  0.419  1.0
  Ga  Ga7  1  0.750  0.819  0.919  1.0
  Au  Au8  1  0.250  0.796  0.092  1.0
  Au  Au9  1  0.750  0.204  0.908  1.0
  Au  Au10  1  0.250  0.296  0.408  1.0
  Au  Au11  1  0.750  0.704  0.592  1.0
[/CIF]
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