The crystal structure described by LiNd(MoO4)2 crystallizes in the monoclinic P2/c space group. Li(1) is bonded in a distorted tetrahedral geometry to two equivalent O(3) and two equivalent O(4) atoms. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(1), two equivalent O(2), two equivalent O(3), and two equivalent O(4) atoms. Mo(1) is bonded in a 6-coordinate geometry to one O(2), one O(4), two equivalent O(1), and two equivalent O(3) atoms. There are four inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Nd(1) and two equivalent Mo(1) atoms. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Nd(1) and one Mo(1) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one Li(1), one Nd(1), and two equivalent Mo(1) atoms. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Li(1), one Nd(1), and one Mo(1) atom. is represented by the CIF file [CIF]
data_LiNd(MoO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.053
_cell_length_b   5.107
_cell_length_c   11.093
_cell_angle_alpha   68.374
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   318.759
_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  0.773  0.000  0.750  1.0
  Li  Li1  1  0.227  0.000  0.250  1.0
  Nd  Nd2  1  0.287  0.500  0.750  1.0
  Nd  Nd3  1  0.713  0.500  0.250  1.0
  Mo  Mo4  1  0.819  0.735  0.528  1.0
  Mo  Mo5  1  0.181  0.265  0.472  1.0
  Mo  Mo6  1  0.819  0.265  0.972  1.0
  Mo  Mo7  1  0.181  0.735  0.028  1.0
  O  O8  1  0.893  0.867  0.092  1.0
  O  O9  1  0.107  0.133  0.908  1.0
  O  O10  1  0.893  0.133  0.408  1.0
  O  O11  1  0.107  0.867  0.592  1.0
  O  O12  1  0.362  0.699  0.907  1.0
  O  O13  1  0.638  0.301  0.093  1.0
  O  O14  1  0.362  0.301  0.593  1.0
  O  O15  1  0.638  0.699  0.407  1.0
  O  O16  1  0.920  0.626  0.880  1.0
  O  O17  1  0.080  0.374  0.120  1.0
  O  O18  1  0.920  0.374  0.620  1.0
  O  O19  1  0.080  0.626  0.380  1.0
  O  O20  1  0.630  0.786  0.642  1.0
  O  O21  1  0.370  0.214  0.358  1.0
  O  O22  1  0.630  0.214  0.858  1.0
  O  O23  1  0.370  0.786  0.142  1.0
[/CIF]
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The crystal structure described by LiNd(MoO4)2 crystallizes in the monoclinic P2/c space group. Li(1) is bonded in a distorted tetrahedral geometry to two equivalent O(3) and two equivalent O(4) atoms. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(1), two equivalent O(2), two equivalent O(3), and two equivalent O(4) atoms. Mo(1) is bonded in a 6-coordinate geometry to one O(2), one O(4), two equivalent O(1), and two equivalent O(3) atoms. There are four inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Nd(1) and two equivalent Mo(1) atoms. In the second O site, O(2) is bonded in a bent 120 degrees geometry to one Nd(1) and one Mo(1) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one Li(1), one Nd(1), and two equivalent Mo(1) atoms. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Li(1), one Nd(1), and one Mo(1) atom. is represented by the CIF file [CIF]
data_LiNd(MoO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.053
_cell_length_b   5.107
_cell_length_c   11.093
_cell_angle_alpha   68.374
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   318.759
_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  0.773  0.000  0.750  1.0
  Li  Li1  1  0.227  0.000  0.250  1.0
  Nd  Nd2  1  0.287  0.500  0.750  1.0
  Nd  Nd3  1  0.713  0.500  0.250  1.0
  Mo  Mo4  1  0.819  0.735  0.528  1.0
  Mo  Mo5  1  0.181  0.265  0.472  1.0
  Mo  Mo6  1  0.819  0.265  0.972  1.0
  Mo  Mo7  1  0.181  0.735  0.028  1.0
  O  O8  1  0.893  0.867  0.092  1.0
  O  O9  1  0.107  0.133  0.908  1.0
  O  O10  1  0.893  0.133  0.408  1.0
  O  O11  1  0.107  0.867  0.592  1.0
  O  O12  1  0.362  0.699  0.907  1.0
  O  O13  1  0.638  0.301  0.093  1.0
  O  O14  1  0.362  0.301  0.593  1.0
  O  O15  1  0.638  0.699  0.407  1.0
  O  O16  1  0.920  0.626  0.880  1.0
  O  O17  1  0.080  0.374  0.120  1.0
  O  O18  1  0.920  0.374  0.620  1.0
  O  O19  1  0.080  0.626  0.380  1.0
  O  O20  1  0.630  0.786  0.642  1.0
  O  O21  1  0.370  0.214  0.358  1.0
  O  O22  1  0.630  0.214  0.858  1.0
  O  O23  1  0.370  0.786  0.142  1.0
[/CIF]
.