The material described by CsNd(MoO4)2 crystallizes in the monoclinic C2/c space group. Cs(1) is bonded in a 12-coordinate geometry to two equivalent O(2), two equivalent O(3), four equivalent O(1), and four equivalent O(4) atoms. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(3), two equivalent O(4), and four equivalent O(2) 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 distorted single-bond geometry to two equivalent Cs(1) and two equivalent Mo(1) atoms. In the second O site, O(2) is bonded in a 4-coordinate geometry to one Cs(1), two equivalent Nd(1), and one Mo(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Cs(1), one Nd(1), and two equivalent Mo(1) atoms. In the fourth O site, O(4) is bonded in a 2-coordinate geometry to two equivalent Cs(1), one Nd(1), and one Mo(1) atom. is represented by the CIF file [CIF]
data_CsNd(MoO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.756
_cell_length_b   7.756
_cell_length_c   8.053
_cell_angle_alpha   61.594
_cell_angle_beta   61.594
_cell_angle_gamma   88.408
_symmetry_Int_Tables_number   1
_cell_volume   362.262
_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
  Cs  Cs0  1  0.196  0.804  0.750  1.0
  Cs  Cs1  1  0.804  0.196  0.250  1.0
  Nd  Nd2  1  0.770  0.230  0.750  1.0
  Nd  Nd3  1  0.230  0.770  0.250  1.0
  Mo  Mo4  1  0.692  0.690  0.766  1.0
  Mo  Mo5  1  0.308  0.310  0.234  1.0
  Mo  Mo6  1  0.310  0.308  0.734  1.0
  Mo  Mo7  1  0.690  0.692  0.266  1.0
  O  O8  1  0.614  0.757  0.574  1.0
  O  O9  1  0.386  0.243  0.426  1.0
  O  O10  1  0.243  0.386  0.926  1.0
  O  O11  1  0.757  0.614  0.074  1.0
  O  O12  1  0.384  0.075  0.871  1.0
  O  O13  1  0.616  0.925  0.129  1.0
  O  O14  1  0.925  0.616  0.629  1.0
  O  O15  1  0.075  0.384  0.371  1.0
  O  O16  1  0.582  0.371  0.970  1.0
  O  O17  1  0.418  0.629  0.030  1.0
  O  O18  1  0.629  0.418  0.530  1.0
  O  O19  1  0.371  0.582  0.470  1.0
  O  O20  1  0.784  0.938  0.703  1.0
  O  O21  1  0.216  0.062  0.297  1.0
  O  O22  1  0.062  0.216  0.797  1.0
  O  O23  1  0.938  0.784  0.203  1.0
[/CIF]
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The material described by CsNd(MoO4)2 crystallizes in the monoclinic C2/c space group. Cs(1) is bonded in a 12-coordinate geometry to two equivalent O(2), two equivalent O(3), four equivalent O(1), and four equivalent O(4) atoms. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(3), two equivalent O(4), and four equivalent O(2) 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 distorted single-bond geometry to two equivalent Cs(1) and two equivalent Mo(1) atoms. In the second O site, O(2) is bonded in a 4-coordinate geometry to one Cs(1), two equivalent Nd(1), and one Mo(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one Cs(1), one Nd(1), and two equivalent Mo(1) atoms. In the fourth O site, O(4) is bonded in a 2-coordinate geometry to two equivalent Cs(1), one Nd(1), and one Mo(1) atom. is represented by the CIF file [CIF]
data_CsNd(MoO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.756
_cell_length_b   7.756
_cell_length_c   8.053
_cell_angle_alpha   61.594
_cell_angle_beta   61.594
_cell_angle_gamma   88.408
_symmetry_Int_Tables_number   1
_cell_volume   362.262
_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
  Cs  Cs0  1  0.196  0.804  0.750  1.0
  Cs  Cs1  1  0.804  0.196  0.250  1.0
  Nd  Nd2  1  0.770  0.230  0.750  1.0
  Nd  Nd3  1  0.230  0.770  0.250  1.0
  Mo  Mo4  1  0.692  0.690  0.766  1.0
  Mo  Mo5  1  0.308  0.310  0.234  1.0
  Mo  Mo6  1  0.310  0.308  0.734  1.0
  Mo  Mo7  1  0.690  0.692  0.266  1.0
  O  O8  1  0.614  0.757  0.574  1.0
  O  O9  1  0.386  0.243  0.426  1.0
  O  O10  1  0.243  0.386  0.926  1.0
  O  O11  1  0.757  0.614  0.074  1.0
  O  O12  1  0.384  0.075  0.871  1.0
  O  O13  1  0.616  0.925  0.129  1.0
  O  O14  1  0.925  0.616  0.629  1.0
  O  O15  1  0.075  0.384  0.371  1.0
  O  O16  1  0.582  0.371  0.970  1.0
  O  O17  1  0.418  0.629  0.030  1.0
  O  O18  1  0.629  0.418  0.530  1.0
  O  O19  1  0.371  0.582  0.470  1.0
  O  O20  1  0.784  0.938  0.703  1.0
  O  O21  1  0.216  0.062  0.297  1.0
  O  O22  1  0.062  0.216  0.797  1.0
  O  O23  1  0.938  0.784  0.203  1.0
[/CIF]
.