The compound described by LiIn(MoTe)6 crystallizes in the hexagonal P-6 space group. Li(1) is bonded in a trigonal planar geometry to three equivalent Te(1) atoms. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 10-coordinate geometry to two equivalent Mo(1), four equivalent Mo(2), two equivalent Te(1), and two equivalent Te(2) atoms. In the second Mo site, Mo(2) is bonded in a 10-coordinate geometry to two equivalent Mo(2), four equivalent Mo(1), two equivalent Te(1), and two equivalent Te(2) atoms. In(1) is bonded in a trigonal planar geometry to three equivalent Te(2) atoms. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a distorted single-bond geometry to one Li(1), two equivalent Mo(1), and two equivalent Mo(2) atoms. In the second Te site, Te(2) is bonded in a 5-coordinate geometry to two equivalent Mo(1), two equivalent Mo(2), and one In(1) atom. is represented by the CIF file [CIF]
data_LiIn(TeMo)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.052
_cell_length_b   10.052
_cell_length_c   4.606
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   403.015
_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  0.000  0.000  0.500  1.0
  In  In1  1  0.667  0.333  0.000  1.0
  Te  Te2  1  0.033  0.315  0.500  1.0
  Te  Te3  1  0.685  0.717  0.500  1.0
  Te  Te4  1  0.283  0.967  0.500  1.0
  Te  Te5  1  0.638  0.008  0.000  1.0
  Te  Te6  1  0.992  0.630  0.000  1.0
  Te  Te7  1  0.370  0.362  0.000  1.0
  Mo  Mo8  1  0.355  0.525  0.500  1.0
  Mo  Mo9  1  0.475  0.830  0.500  1.0
  Mo  Mo10  1  0.170  0.645  0.500  1.0
  Mo  Mo11  1  0.314  0.810  0.000  1.0
  Mo  Mo12  1  0.190  0.504  0.000  1.0
  Mo  Mo13  1  0.496  0.686  0.000  1.0
[/CIF]
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The compound described by LiIn(MoTe)6 crystallizes in the hexagonal P-6 space group. Li(1) is bonded in a trigonal planar geometry to three equivalent Te(1) atoms. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 10-coordinate geometry to two equivalent Mo(1), four equivalent Mo(2), two equivalent Te(1), and two equivalent Te(2) atoms. In the second Mo site, Mo(2) is bonded in a 10-coordinate geometry to two equivalent Mo(2), four equivalent Mo(1), two equivalent Te(1), and two equivalent Te(2) atoms. In(1) is bonded in a trigonal planar geometry to three equivalent Te(2) atoms. There are two inequivalent Te sites. In the first Te site, Te(1) is bonded in a distorted single-bond geometry to one Li(1), two equivalent Mo(1), and two equivalent Mo(2) atoms. In the second Te site, Te(2) is bonded in a 5-coordinate geometry to two equivalent Mo(1), two equivalent Mo(2), and one In(1) atom. is represented by the CIF file [CIF]
data_LiIn(TeMo)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.052
_cell_length_b   10.052
_cell_length_c   4.606
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   403.015
_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  0.000  0.000  0.500  1.0
  In  In1  1  0.667  0.333  0.000  1.0
  Te  Te2  1  0.033  0.315  0.500  1.0
  Te  Te3  1  0.685  0.717  0.500  1.0
  Te  Te4  1  0.283  0.967  0.500  1.0
  Te  Te5  1  0.638  0.008  0.000  1.0
  Te  Te6  1  0.992  0.630  0.000  1.0
  Te  Te7  1  0.370  0.362  0.000  1.0
  Mo  Mo8  1  0.355  0.525  0.500  1.0
  Mo  Mo9  1  0.475  0.830  0.500  1.0
  Mo  Mo10  1  0.170  0.645  0.500  1.0
  Mo  Mo11  1  0.314  0.810  0.000  1.0
  Mo  Mo12  1  0.190  0.504  0.000  1.0
  Mo  Mo13  1  0.496  0.686  0.000  1.0
[/CIF]
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