The material described by Li5In4 crystallizes in the trigonal P-3m1 space group. There are three inequivalent Li sites. In the first Li site, Li(1) is bonded to four equivalent In(2) atoms to form a mixture of distorted edge and corner-sharing LiIn4 tetrahedra. In the second Li site, Li(2) is bonded in a distorted linear geometry to two equivalent In(1) atoms. In the third Li site, Li(3) is bonded to one In(2) and three equivalent In(1) atoms to form distorted corner-sharing LiIn4 tetrahedra. There are two inequivalent In sites. In the first In site, In(1) is bonded to one Li(2) and three equivalent Li(3) atoms to form distorted corner-sharing InLi4 tetrahedra. In the second In site, In(2) is bonded in a 5-coordinate geometry to one Li(3) and four equivalent Li(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li5In4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.747
_cell_length_b   4.746
_cell_length_c   8.843
_cell_angle_alpha   89.997
_cell_angle_beta   90.008
_cell_angle_gamma   119.999
_symmetry_Int_Tables_number   1
_cell_volume   172.532
_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
  Li  Li0  1  0.334  0.667  0.621  1.0
  Li  Li1  1  0.666  0.333  0.379  1.0
  Li  Li2  1  0.000  0.000  0.500  1.0
  Li  Li3  1  0.333  0.667  0.953  1.0
  Li  Li4  1  0.667  0.333  0.047  1.0
  In  In5  1  1.000  1.000  0.168  1.0
  In  In6  1  0.000  0.000  0.832  1.0
  In  In7  1  0.333  0.667  0.294  1.0
  In  In8  1  0.667  0.333  0.706  1.0
[/CIF]
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The material described by Li5In4 crystallizes in the trigonal P-3m1 space group. There are three inequivalent Li sites. In the first Li site, Li(1) is bonded to four equivalent In(2) atoms to form a mixture of distorted edge and corner-sharing LiIn4 tetrahedra. In the second Li site, Li(2) is bonded in a distorted linear geometry to two equivalent In(1) atoms. In the third Li site, Li(3) is bonded to one In(2) and three equivalent In(1) atoms to form distorted corner-sharing LiIn4 tetrahedra. There are two inequivalent In sites. In the first In site, In(1) is bonded to one Li(2) and three equivalent Li(3) atoms to form distorted corner-sharing InLi4 tetrahedra. In the second In site, In(2) is bonded in a 5-coordinate geometry to one Li(3) and four equivalent Li(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_Li5In4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.747
_cell_length_b   4.746
_cell_length_c   8.843
_cell_angle_alpha   89.997
_cell_angle_beta   90.008
_cell_angle_gamma   119.999
_symmetry_Int_Tables_number   1
_cell_volume   172.532
_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
  Li  Li0  1  0.334  0.667  0.621  1.0
  Li  Li1  1  0.666  0.333  0.379  1.0
  Li  Li2  1  0.000  0.000  0.500  1.0
  Li  Li3  1  0.333  0.667  0.953  1.0
  Li  Li4  1  0.667  0.333  0.047  1.0
  In  In5  1  1.000  1.000  0.168  1.0
  In  In6  1  0.000  0.000  0.832  1.0
  In  In7  1  0.333  0.667  0.294  1.0
  In  In8  1  0.667  0.333  0.706  1.0
[/CIF]
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