The crystal structure described by Nd2(MoO4)3 crystallizes in the monoclinic C2/c space group. Nd(1) is bonded in a 8-coordinate geometry to one O(2), one O(3), one O(4), one O(6), two equivalent O(1), and two equivalent O(5) atoms. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to two equivalent O(1) and two equivalent O(2) atoms. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to one O(3), one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to two equivalent Nd(1) and one Mo(1) atom. In the second O site, O(2) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one Mo(1) atom. In the third O site, O(3) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one Mo(2) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to two equivalent Nd(1) and one Mo(2) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one Mo(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Nd2(MoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.932
_cell_length_b   6.932
_cell_length_c   11.824
_cell_angle_alpha   80.213
_cell_angle_beta   80.213
_cell_angle_gamma   114.368
_symmetry_Int_Tables_number   1
_cell_volume   491.391
_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
  Nd  Nd0  1  0.792  0.545  0.410  1.0
  Nd  Nd1  1  0.455  0.208  0.090  1.0
  Nd  Nd2  1  0.208  0.455  0.590  1.0
  Nd  Nd3  1  0.545  0.792  0.910  1.0
  Mo  Mo4  1  0.373  0.627  0.250  1.0
  Mo  Mo5  1  0.036  0.285  0.927  1.0
  Mo  Mo6  1  0.627  0.373  0.750  1.0
  Mo  Mo7  1  0.715  0.964  0.573  1.0
  Mo  Mo8  1  0.285  0.036  0.427  1.0
  Mo  Mo9  1  0.964  0.715  0.073  1.0
  O  O10  1  0.172  0.582  0.384  1.0
  O  O11  1  0.627  0.703  0.282  1.0
  O  O12  1  0.418  0.828  0.116  1.0
  O  O13  1  0.072  0.978  0.099  1.0
  O  O14  1  0.837  0.281  0.042  1.0
  O  O15  1  0.928  0.022  0.901  1.0
  O  O16  1  0.306  0.392  0.956  1.0
  O  O17  1  0.062  0.457  0.791  1.0
  O  O18  1  0.582  0.172  0.884  1.0
  O  O19  1  0.373  0.297  0.718  1.0
  O  O20  1  0.703  0.627  0.782  1.0
  O  O21  1  0.543  0.938  0.709  1.0
  O  O22  1  0.828  0.418  0.616  1.0
  O  O23  1  0.608  0.694  0.544  1.0
  O  O24  1  0.978  0.072  0.599  1.0
  O  O25  1  0.719  0.163  0.458  1.0
  O  O26  1  0.281  0.837  0.542  1.0
  O  O27  1  0.022  0.928  0.401  1.0
  O  O28  1  0.392  0.306  0.456  1.0
  O  O29  1  0.457  0.062  0.291  1.0
  O  O30  1  0.297  0.373  0.218  1.0
  O  O31  1  0.938  0.543  0.209  1.0
  O  O32  1  0.694  0.608  0.044  1.0
  O  O33  1  0.163  0.719  0.958  1.0
[/CIF]
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The crystal structure described by Nd2(MoO4)3 crystallizes in the monoclinic C2/c space group. Nd(1) is bonded in a 8-coordinate geometry to one O(2), one O(3), one O(4), one O(6), two equivalent O(1), and two equivalent O(5) atoms. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to two equivalent O(1) and two equivalent O(2) atoms. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to one O(3), one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to two equivalent Nd(1) and one Mo(1) atom. In the second O site, O(2) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one Mo(1) atom. In the third O site, O(3) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one Mo(2) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Nd(1) and one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to two equivalent Nd(1) and one Mo(2) atom. In the sixth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Nd(1) and one Mo(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_Nd2(MoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.932
_cell_length_b   6.932
_cell_length_c   11.824
_cell_angle_alpha   80.213
_cell_angle_beta   80.213
_cell_angle_gamma   114.368
_symmetry_Int_Tables_number   1
_cell_volume   491.391
_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
  Nd  Nd0  1  0.792  0.545  0.410  1.0
  Nd  Nd1  1  0.455  0.208  0.090  1.0
  Nd  Nd2  1  0.208  0.455  0.590  1.0
  Nd  Nd3  1  0.545  0.792  0.910  1.0
  Mo  Mo4  1  0.373  0.627  0.250  1.0
  Mo  Mo5  1  0.036  0.285  0.927  1.0
  Mo  Mo6  1  0.627  0.373  0.750  1.0
  Mo  Mo7  1  0.715  0.964  0.573  1.0
  Mo  Mo8  1  0.285  0.036  0.427  1.0
  Mo  Mo9  1  0.964  0.715  0.073  1.0
  O  O10  1  0.172  0.582  0.384  1.0
  O  O11  1  0.627  0.703  0.282  1.0
  O  O12  1  0.418  0.828  0.116  1.0
  O  O13  1  0.072  0.978  0.099  1.0
  O  O14  1  0.837  0.281  0.042  1.0
  O  O15  1  0.928  0.022  0.901  1.0
  O  O16  1  0.306  0.392  0.956  1.0
  O  O17  1  0.062  0.457  0.791  1.0
  O  O18  1  0.582  0.172  0.884  1.0
  O  O19  1  0.373  0.297  0.718  1.0
  O  O20  1  0.703  0.627  0.782  1.0
  O  O21  1  0.543  0.938  0.709  1.0
  O  O22  1  0.828  0.418  0.616  1.0
  O  O23  1  0.608  0.694  0.544  1.0
  O  O24  1  0.978  0.072  0.599  1.0
  O  O25  1  0.719  0.163  0.458  1.0
  O  O26  1  0.281  0.837  0.542  1.0
  O  O27  1  0.022  0.928  0.401  1.0
  O  O28  1  0.392  0.306  0.456  1.0
  O  O29  1  0.457  0.062  0.291  1.0
  O  O30  1  0.297  0.373  0.218  1.0
  O  O31  1  0.938  0.543  0.209  1.0
  O  O32  1  0.694  0.608  0.044  1.0
  O  O33  1  0.163  0.719  0.958  1.0
[/CIF]
.