The crystal structure described by TmAuIn crystallizes in the hexagonal P-62m space group. Tm(1) is bonded in a 11-coordinate geometry to one Au(2), four equivalent Au(1), and six equivalent In(1) atoms. There are two inequivalent Au sites. In the first Au site, Au(2) is bonded in a 9-coordinate geometry to three equivalent Tm(1) and six equivalent In(1) atoms. In the second Au site, Au(1) is bonded in a 9-coordinate geometry to six equivalent Tm(1) and three equivalent In(1) atoms. In(1) is bonded in a 4-coordinate geometry to six equivalent Tm(1), two equivalent Au(1), and two equivalent Au(2) atoms. is represented by the CIF file [CIF]
data_TmInAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.603
_cell_length_b   7.603
_cell_length_c   3.972
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   198.829
_cell_formula_units_Z   3
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
  Tm  Tm0  1  0.404  0.404  0.500  1.0
  Tm  Tm1  1  0.596  0.000  0.500  1.0
  Tm  Tm2  1  0.000  0.596  0.500  1.0
  In  In3  1  0.739  0.739  0.000  1.0
  In  In4  1  0.261  0.000  0.000  1.0
  In  In5  1  0.000  0.261  0.000  1.0
  Au  Au6  1  0.667  0.333  0.000  1.0
  Au  Au7  1  0.333  0.667  0.000  1.0
  Au  Au8  1  0.000  0.000  0.500  1.0
[/CIF]
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The crystal structure described by TmAuIn crystallizes in the hexagonal P-62m space group. Tm(1) is bonded in a 11-coordinate geometry to one Au(2), four equivalent Au(1), and six equivalent In(1) atoms. There are two inequivalent Au sites. In the first Au site, Au(2) is bonded in a 9-coordinate geometry to three equivalent Tm(1) and six equivalent In(1) atoms. In the second Au site, Au(1) is bonded in a 9-coordinate geometry to six equivalent Tm(1) and three equivalent In(1) atoms. In(1) is bonded in a 4-coordinate geometry to six equivalent Tm(1), two equivalent Au(1), and two equivalent Au(2) atoms. is represented by the CIF file [CIF]
data_TmInAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.603
_cell_length_b   7.603
_cell_length_c   3.972
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   198.829
_cell_formula_units_Z   3
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
  Tm  Tm0  1  0.404  0.404  0.500  1.0
  Tm  Tm1  1  0.596  0.000  0.500  1.0
  Tm  Tm2  1  0.000  0.596  0.500  1.0
  In  In3  1  0.739  0.739  0.000  1.0
  In  In4  1  0.261  0.000  0.000  1.0
  In  In5  1  0.000  0.261  0.000  1.0
  Au  Au6  1  0.667  0.333  0.000  1.0
  Au  Au7  1  0.333  0.667  0.000  1.0
  Au  Au8  1  0.000  0.000  0.500  1.0
[/CIF]
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