The crystal structure described by CsNd(MoO4)2 crystallizes in the monoclinic P2/c space group. Cs(1) is bonded in a 8-coordinate geometry to two equivalent O(2), two equivalent O(4), and four equivalent O(1) atoms. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(2), two equivalent O(4), and four equivalent O(3) atoms. Mo(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. 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 one Mo(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Cs(1), one Nd(1), and one Mo(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to two equivalent Nd(1) and one Mo(1) atom. In the fourth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one Cs(1), one Nd(1), and one Mo(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_CsNd(MoO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.175
_cell_length_b   8.522
_cell_length_c   9.951
_cell_angle_alpha   88.230
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   438.656
_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  0.468  0.750  0.500  1.0
  Cs  Cs1  1  0.532  0.250  0.500  1.0
  Nd  Nd2  1  0.504  0.750  0.000  1.0
  Nd  Nd3  1  0.496  0.250  0.000  1.0
  Mo  Mo4  1  0.978  0.492  0.193  1.0
  Mo  Mo5  1  0.022  0.508  0.807  1.0
  Mo  Mo6  1  0.978  0.008  0.807  1.0
  Mo  Mo7  1  0.022  0.992  0.193  1.0
  O  O8  1  0.888  0.984  0.355  1.0
  O  O9  1  0.112  0.016  0.645  1.0
  O  O10  1  0.888  0.516  0.645  1.0
  O  O11  1  0.112  0.484  0.355  1.0
  O  O12  1  0.767  0.324  0.182  1.0
  O  O13  1  0.233  0.676  0.818  1.0
  O  O14  1  0.767  0.176  0.818  1.0
  O  O15  1  0.233  0.824  0.182  1.0
  O  O16  1  0.754  0.997  0.069  1.0
  O  O17  1  0.246  0.003  0.931  1.0
  O  O18  1  0.754  0.503  0.931  1.0
  O  O19  1  0.246  0.497  0.069  1.0
  O  O20  1  0.766  0.661  0.185  1.0
  O  O21  1  0.234  0.339  0.815  1.0
  O  O22  1  0.766  0.839  0.815  1.0
  O  O23  1  0.234  0.161  0.185  1.0
[/CIF]
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The crystal structure described by CsNd(MoO4)2 crystallizes in the monoclinic P2/c space group. Cs(1) is bonded in a 8-coordinate geometry to two equivalent O(2), two equivalent O(4), and four equivalent O(1) atoms. Nd(1) is bonded in a 8-coordinate geometry to two equivalent O(2), two equivalent O(4), and four equivalent O(3) atoms. Mo(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. 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 one Mo(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Cs(1), one Nd(1), and one Mo(1) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to two equivalent Nd(1) and one Mo(1) atom. In the fourth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one Cs(1), one Nd(1), and one Mo(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_CsNd(MoO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.175
_cell_length_b   8.522
_cell_length_c   9.951
_cell_angle_alpha   88.230
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   438.656
_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  0.468  0.750  0.500  1.0
  Cs  Cs1  1  0.532  0.250  0.500  1.0
  Nd  Nd2  1  0.504  0.750  0.000  1.0
  Nd  Nd3  1  0.496  0.250  0.000  1.0
  Mo  Mo4  1  0.978  0.492  0.193  1.0
  Mo  Mo5  1  0.022  0.508  0.807  1.0
  Mo  Mo6  1  0.978  0.008  0.807  1.0
  Mo  Mo7  1  0.022  0.992  0.193  1.0
  O  O8  1  0.888  0.984  0.355  1.0
  O  O9  1  0.112  0.016  0.645  1.0
  O  O10  1  0.888  0.516  0.645  1.0
  O  O11  1  0.112  0.484  0.355  1.0
  O  O12  1  0.767  0.324  0.182  1.0
  O  O13  1  0.233  0.676  0.818  1.0
  O  O14  1  0.767  0.176  0.818  1.0
  O  O15  1  0.233  0.824  0.182  1.0
  O  O16  1  0.754  0.997  0.069  1.0
  O  O17  1  0.246  0.003  0.931  1.0
  O  O18  1  0.754  0.503  0.931  1.0
  O  O19  1  0.246  0.497  0.069  1.0
  O  O20  1  0.766  0.661  0.185  1.0
  O  O21  1  0.234  0.339  0.815  1.0
  O  O22  1  0.766  0.839  0.815  1.0
  O  O23  1  0.234  0.161  0.185  1.0
[/CIF]
.