The material described by LiIn(MoO4)2 crystallizes in the monoclinic C2/c space group. Li(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form edge-sharing LiO6 octahedra. Mo(1) is bonded in a 6-coordinate geometry to one O(1), one O(3), two equivalent O(2), and two equivalent O(4) atoms. In(1) is bonded to two equivalent O(4) and four equivalent O(3) atoms to form distorted edge-sharing InO6 octahedra. There are four inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to two equivalent Li(1) and one Mo(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Li(1) and two equivalent Mo(1) atoms. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Mo(1) and two equivalent In(1) atoms. In the fourth O site, O(4) is bonded in a trigonal planar geometry to two equivalent Mo(1) and one In(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiIn(MoO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.591
_cell_length_b   7.591
_cell_length_c   5.093
_cell_angle_alpha   88.879
_cell_angle_beta   88.879
_cell_angle_gamma   100.884
_symmetry_Int_Tables_number   1
_cell_volume   288.090
_cell_formula_units_Z   2
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  0.585  0.415  0.250  1.0
  Li  Li1  1  0.415  0.585  0.750  1.0
  In  In2  1  0.908  0.092  0.750  1.0
  In  In3  1  0.092  0.908  0.250  1.0
  Mo  Mo4  1  0.573  0.891  0.250  1.0
  Mo  Mo5  1  0.109  0.427  0.250  1.0
  Mo  Mo6  1  0.427  0.109  0.750  1.0
  Mo  Mo7  1  0.891  0.573  0.750  1.0
  O  O8  1  0.435  0.317  0.593  1.0
  O  O9  1  0.683  0.565  0.907  1.0
  O  O10  1  0.445  0.832  0.957  1.0
  O  O11  1  0.168  0.555  0.543  1.0
  O  O12  1  0.565  0.683  0.407  1.0
  O  O13  1  0.317  0.435  0.093  1.0
  O  O14  1  0.942  0.813  0.610  1.0
  O  O15  1  0.187  0.058  0.890  1.0
  O  O16  1  0.058  0.187  0.390  1.0
  O  O17  1  0.813  0.942  0.110  1.0
  O  O18  1  0.948  0.347  0.932  1.0
  O  O19  1  0.653  0.052  0.568  1.0
  O  O20  1  0.052  0.653  0.068  1.0
  O  O21  1  0.347  0.948  0.432  1.0
  O  O22  1  0.832  0.445  0.457  1.0
  O  O23  1  0.555  0.168  0.043  1.0
[/CIF]
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The material described by LiIn(MoO4)2 crystallizes in the monoclinic C2/c space group. Li(1) is bonded to two equivalent O(2) and four equivalent O(1) atoms to form edge-sharing LiO6 octahedra. Mo(1) is bonded in a 6-coordinate geometry to one O(1), one O(3), two equivalent O(2), and two equivalent O(4) atoms. In(1) is bonded to two equivalent O(4) and four equivalent O(3) atoms to form distorted edge-sharing InO6 octahedra. There are four inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to two equivalent Li(1) and one Mo(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Li(1) and two equivalent Mo(1) atoms. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Mo(1) and two equivalent In(1) atoms. In the fourth O site, O(4) is bonded in a trigonal planar geometry to two equivalent Mo(1) and one In(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_LiIn(MoO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.591
_cell_length_b   7.591
_cell_length_c   5.093
_cell_angle_alpha   88.879
_cell_angle_beta   88.879
_cell_angle_gamma   100.884
_symmetry_Int_Tables_number   1
_cell_volume   288.090
_cell_formula_units_Z   2
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  0.585  0.415  0.250  1.0
  Li  Li1  1  0.415  0.585  0.750  1.0
  In  In2  1  0.908  0.092  0.750  1.0
  In  In3  1  0.092  0.908  0.250  1.0
  Mo  Mo4  1  0.573  0.891  0.250  1.0
  Mo  Mo5  1  0.109  0.427  0.250  1.0
  Mo  Mo6  1  0.427  0.109  0.750  1.0
  Mo  Mo7  1  0.891  0.573  0.750  1.0
  O  O8  1  0.435  0.317  0.593  1.0
  O  O9  1  0.683  0.565  0.907  1.0
  O  O10  1  0.445  0.832  0.957  1.0
  O  O11  1  0.168  0.555  0.543  1.0
  O  O12  1  0.565  0.683  0.407  1.0
  O  O13  1  0.317  0.435  0.093  1.0
  O  O14  1  0.942  0.813  0.610  1.0
  O  O15  1  0.187  0.058  0.890  1.0
  O  O16  1  0.058  0.187  0.390  1.0
  O  O17  1  0.813  0.942  0.110  1.0
  O  O18  1  0.948  0.347  0.932  1.0
  O  O19  1  0.653  0.052  0.568  1.0
  O  O20  1  0.052  0.653  0.068  1.0
  O  O21  1  0.347  0.948  0.432  1.0
  O  O22  1  0.832  0.445  0.457  1.0
  O  O23  1  0.555  0.168  0.043  1.0
[/CIF]
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