The material structure described by Tl3In crystallizes in the orthorhombic Cmmm space group. There are two inequivalent Tl sites. In the first Tl site, Tl(1) is bonded in a distorted body-centered cubic geometry to two equivalent Tl(2), four equivalent Tl(1), and two equivalent In(1) atoms. In the second Tl site, Tl(2) is bonded in a body-centered cubic geometry to four equivalent Tl(1) and four equivalent Tl(2) atoms. In(1) is bonded in a body-centered cubic geometry to four equivalent Tl(1) and four equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Tl3In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.353
_cell_length_b   3.353
_cell_length_c   10.990
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   108.967
_symmetry_Int_Tables_number   1
_cell_volume   116.841
_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
  Tl  Tl0  1  0.500  0.500  0.759  1.0
  Tl  Tl1  1  0.000  0.000  0.500  1.0
  Tl  Tl2  1  0.500  0.500  0.241  1.0
  In  In3  1  0.000  0.000  0.000  1.0
[/CIF]
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The material structure described by Tl3In crystallizes in the orthorhombic Cmmm space group. There are two inequivalent Tl sites. In the first Tl site, Tl(1) is bonded in a distorted body-centered cubic geometry to two equivalent Tl(2), four equivalent Tl(1), and two equivalent In(1) atoms. In the second Tl site, Tl(2) is bonded in a body-centered cubic geometry to four equivalent Tl(1) and four equivalent Tl(2) atoms. In(1) is bonded in a body-centered cubic geometry to four equivalent Tl(1) and four equivalent In(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Tl3In
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.353
_cell_length_b   3.353
_cell_length_c   10.990
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   108.967
_symmetry_Int_Tables_number   1
_cell_volume   116.841
_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
  Tl  Tl0  1  0.500  0.500  0.759  1.0
  Tl  Tl1  1  0.000  0.000  0.500  1.0
  Tl  Tl2  1  0.500  0.500  0.241  1.0
  In  In3  1  0.000  0.000  0.000  1.0
[/CIF]
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