The material described by Pr2Mo3O12 crystallizes in the monoclinic C2/c space group. Pr(1) is bonded in a 8-coordinate geometry to one O(1), one O(3), one O(4), one O(5), two equivalent O(2), and two equivalent O(6) atoms. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to one O(1), one O(3), one O(5), and one O(6) atom. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to two equivalent O(2) and two equivalent O(4) atoms. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Pr(1) and one Mo(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to two equivalent Pr(1) and one Mo(2) atom. In the third O site, O(3) is bonded in a distorted bent 150 degrees geometry to one Pr(1) and one Mo(1) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Pr(1) and one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted bent 120 degrees geometry to one Pr(1) and one Mo(1) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to two equivalent Pr(1) and one Mo(1) atom. is represented by the CIF file [CIF]
data_Pr2(MoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.981
_cell_length_b   6.981
_cell_length_c   11.912
_cell_angle_alpha   80.248
_cell_angle_beta   80.248
_cell_angle_gamma   114.640
_symmetry_Int_Tables_number   1
_cell_volume   501.076
_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
  Pr  Pr0  1  0.207  0.454  0.590  1.0
  Pr  Pr1  1  0.546  0.793  0.910  1.0
  Pr  Pr2  1  0.454  0.207  0.090  1.0
  Pr  Pr3  1  0.793  0.546  0.410  1.0
  Mo  Mo4  1  0.710  0.963  0.575  1.0
  Mo  Mo5  1  0.037  0.290  0.925  1.0
  Mo  Mo6  1  0.374  0.626  0.250  1.0
  Mo  Mo7  1  0.290  0.037  0.425  1.0
  Mo  Mo8  1  0.626  0.374  0.750  1.0
  Mo  Mo9  1  0.963  0.710  0.075  1.0
  O  O10  1  0.066  0.462  0.790  1.0
  O  O11  1  0.417  0.826  0.118  1.0
  O  O12  1  0.716  0.163  0.460  1.0
  O  O13  1  0.538  0.934  0.710  1.0
  O  O14  1  0.837  0.284  0.040  1.0
  O  O15  1  0.174  0.583  0.382  1.0
  O  O16  1  0.702  0.625  0.783  1.0
  O  O17  1  0.071  0.971  0.099  1.0
  O  O18  1  0.390  0.303  0.457  1.0
  O  O19  1  0.375  0.298  0.717  1.0
  O  O20  1  0.697  0.610  0.043  1.0
  O  O21  1  0.029  0.929  0.401  1.0
  O  O22  1  0.583  0.174  0.882  1.0
  O  O23  1  0.934  0.538  0.210  1.0
  O  O24  1  0.284  0.837  0.540  1.0
  O  O25  1  0.163  0.716  0.960  1.0
  O  O26  1  0.462  0.066  0.290  1.0
  O  O27  1  0.826  0.417  0.618  1.0
  O  O28  1  0.929  0.029  0.901  1.0
  O  O29  1  0.298  0.375  0.217  1.0
  O  O30  1  0.610  0.697  0.543  1.0
  O  O31  1  0.303  0.390  0.957  1.0
  O  O32  1  0.625  0.702  0.283  1.0
  O  O33  1  0.971  0.071  0.599  1.0
[/CIF]
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The material described by Pr2Mo3O12 crystallizes in the monoclinic C2/c space group. Pr(1) is bonded in a 8-coordinate geometry to one O(1), one O(3), one O(4), one O(5), two equivalent O(2), and two equivalent O(6) atoms. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to one O(1), one O(3), one O(5), and one O(6) atom. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to two equivalent O(2) and two equivalent O(4) atoms. There are six inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one Pr(1) and one Mo(1) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to two equivalent Pr(1) and one Mo(2) atom. In the third O site, O(3) is bonded in a distorted bent 150 degrees geometry to one Pr(1) and one Mo(1) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Pr(1) and one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted bent 120 degrees geometry to one Pr(1) and one Mo(1) atom. In the sixth O site, O(6) is bonded in a distorted trigonal planar geometry to two equivalent Pr(1) and one Mo(1) atom. is represented by the CIF file [CIF]
data_Pr2(MoO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.981
_cell_length_b   6.981
_cell_length_c   11.912
_cell_angle_alpha   80.248
_cell_angle_beta   80.248
_cell_angle_gamma   114.640
_symmetry_Int_Tables_number   1
_cell_volume   501.076
_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
  Pr  Pr0  1  0.207  0.454  0.590  1.0
  Pr  Pr1  1  0.546  0.793  0.910  1.0
  Pr  Pr2  1  0.454  0.207  0.090  1.0
  Pr  Pr3  1  0.793  0.546  0.410  1.0
  Mo  Mo4  1  0.710  0.963  0.575  1.0
  Mo  Mo5  1  0.037  0.290  0.925  1.0
  Mo  Mo6  1  0.374  0.626  0.250  1.0
  Mo  Mo7  1  0.290  0.037  0.425  1.0
  Mo  Mo8  1  0.626  0.374  0.750  1.0
  Mo  Mo9  1  0.963  0.710  0.075  1.0
  O  O10  1  0.066  0.462  0.790  1.0
  O  O11  1  0.417  0.826  0.118  1.0
  O  O12  1  0.716  0.163  0.460  1.0
  O  O13  1  0.538  0.934  0.710  1.0
  O  O14  1  0.837  0.284  0.040  1.0
  O  O15  1  0.174  0.583  0.382  1.0
  O  O16  1  0.702  0.625  0.783  1.0
  O  O17  1  0.071  0.971  0.099  1.0
  O  O18  1  0.390  0.303  0.457  1.0
  O  O19  1  0.375  0.298  0.717  1.0
  O  O20  1  0.697  0.610  0.043  1.0
  O  O21  1  0.029  0.929  0.401  1.0
  O  O22  1  0.583  0.174  0.882  1.0
  O  O23  1  0.934  0.538  0.210  1.0
  O  O24  1  0.284  0.837  0.540  1.0
  O  O25  1  0.163  0.716  0.960  1.0
  O  O26  1  0.462  0.066  0.290  1.0
  O  O27  1  0.826  0.417  0.618  1.0
  O  O28  1  0.929  0.029  0.901  1.0
  O  O29  1  0.298  0.375  0.217  1.0
  O  O30  1  0.610  0.697  0.543  1.0
  O  O31  1  0.303  0.390  0.957  1.0
  O  O32  1  0.625  0.702  0.283  1.0
  O  O33  1  0.971  0.071  0.599  1.0
[/CIF]
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