The material structure described by La4Cu3MoO12 crystallizes in the monoclinic Pm space group. There are four inequivalent La sites. In the first La site, La(1) is bonded in a body-centered cubic geometry to one O(1), one O(11), one O(12), one O(16), one O(5), one O(6), one O(7), and one O(9) atom. In the second La site, La(2) is bonded in a distorted body-centered cubic geometry to one O(10), one O(12), one O(15), one O(2), one O(5), one O(6), one O(8), and one O(9) atom. In the third La site, La(3) is bonded in a distorted body-centered cubic geometry to one O(10), one O(11), one O(12), one O(14), one O(3), one O(5), one O(7), and one O(8) atom. In the fourth La site, La(4) is bonded in a body-centered cubic geometry to one O(10), one O(11), one O(13), one O(4), one O(6), one O(7), one O(8), and one O(9) atom. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a trigonal bipyramidal geometry to one O(2), one O(3), one O(4), and two equivalent O(10) atoms. In the second Mo site, Mo(2) is bonded in a trigonal bipyramidal geometry to one O(14), one O(15), one O(16), and two equivalent O(5) atoms. There are six inequivalent Cu sites. In the first Cu site, Cu(1) is bonded in a distorted T-shaped geometry to one O(1) and two equivalent O(11) atoms. In the second Cu site, Cu(2) is bonded in a 3-coordinate geometry to one O(1) and two equivalent O(12) atoms. In the third Cu site, Cu(3) is bonded in a distorted T-shaped geometry to one O(1) and two equivalent O(9) atoms. In the fourth Cu site, Cu(4) is bonded in a distorted see-saw-like geometry to one O(13), one O(15), and two equivalent O(6) atoms. In the fifth Cu site, Cu(5) is bonded in a 4-coordinate geometry to one O(13), one O(14), and two equivalent O(7) atoms. In the sixth Cu site, Cu(6) is bonded in a distorted T-shaped geometry to one O(13) and two equivalent O(8) atoms. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded to two equivalent La(1), one Cu(1), one Cu(2), and one Cu(3) atom to form distorted OLa2Cu3 trigonal bipyramids that share corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra, edges with two equivalent O(11)La3Cu tetrahedra, edges with two equivalent O(12)La3Cu tetrahedra, and edges with two equivalent O(9)La3Cu tetrahedra. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent La(2) and one Mo(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to two equivalent La(3) and one Mo(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to two equivalent La(4) and one Mo(1) atom. In the fifth O site, O(5) is bonded to one La(1), one La(2), one La(3), and one Mo(2) atom to form OLa3Mo tetrahedra that share  a cornercorner with one O(12)La3Cu tetrahedra,  a cornercorner with one O(5)La3Mo tetrahedra, corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(8)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra,  a cornercorner with one O(1)La2Cu3 trigonal bipyramid,  an edgeedge with one O(11)La3Cu tetrahedra,  an edgeedge with one O(12)La3Cu tetrahedra, and  an edgeedge with one O(10)La3Mo tetrahedra. In the sixth O site, O(6) is bonded to one La(1), one La(2), one La(4), and one Cu(4) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(6)La3Cu tetrahedra,  a cornercorner with one O(9)La3Cu tetrahedra, corners with two equivalent O(12)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(8)La3Cu tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra,  a cornercorner with one O(1)La2Cu3 trigonal bipyramid,  an edgeedge with one O(11)La3Cu tetrahedra,  an edgeedge with one O(9)La3Cu tetrahedra,  an edgeedge with one O(10)La3Mo tetrahedra, and  an edgeedge with one O(13)La2Cu3 trigonal bipyramid. In the seventh O site, O(7) is bonded to one La(1), one La(3), one La(4), and one Cu(5) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(11)La3Cu tetrahedra,  a cornercorner with one O(7)La3Cu tetrahedra, corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(8)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra,  a cornercorner with one O(1)La2Cu3 trigonal bipyramid,  an edgeedge with one O(11)La3Cu tetrahedra,  an edgeedge with one O(12)La3Cu tetrahedra,  an edgeedge with one O(9)La3Cu tetrahedra, and  an edgeedge with one O(13)La2Cu3 trigonal bipyramid. In the eighth O site, O(8) is bonded to one La(2), one La(3), one La(4), and one Cu(6) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(8)La3Cu tetrahedra,  a cornercorner with one O(10)La3Mo tetrahedra, corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra,  an edgeedge with one O(12)La3Cu tetrahedra,  an edgeedge with one O(9)La3Cu tetrahedra,  an edgeedge with one O(10)La3Mo tetrahedra, and  an edgeedge with one O(13)La2Cu3 trigonal bipyramid. In the ninth O site, O(9) is bonded to one La(1), one La(2), one La(4), and one Cu(3) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(6)La3Cu tetrahedra,  a cornercorner with one O(9)La3Cu tetrahedra, corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(12)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra,  a cornercorner with one O(13)La2Cu3 trigonal bipyramid,  an edgeedge with one O(6)La3Cu tetrahedra,  an edgeedge with one O(7)La3Cu tetrahedra,  an edgeedge with one O(8)La3Cu tetrahedra, and  an edgeedge with one O(1)La2Cu3 trigonal bipyramid. In the tenth O site, O(10) is bonded to one La(2), one La(3), one La(4), and one Mo(1) atom to form OLa3Mo tetrahedra that share  a cornercorner with one O(8)La3Cu tetrahedra,  a cornercorner with one O(10)La3Mo tetrahedra, corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(12)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra,  a cornercorner with one O(13)La2Cu3 trigonal bipyramid,  an edgeedge with one O(6)La3Cu tetrahedra,  an edgeedge with one O(8)La3Cu tetrahedra, and  an edgeedge with one O(5)La3Mo tetrahedra. In the eleventh O site, O(11) is bonded to one La(1), one La(3), one La(4), and one Cu(1) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(11)La3Cu tetrahedra,  a cornercorner with one O(7)La3Cu tetrahedra, corners with two equivalent O(12)La3Cu tetrahedra, corners with two equivalent O(8)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra,  a cornercorner with one O(13)La2Cu3 trigonal bipyramid,  an edgeedge with one O(6)La3Cu tetrahedra,  an edgeedge with one O(7)La3Cu tetrahedra,  an edgeedge with one O(5)La3Mo tetrahedra, and  an edgeedge with one O(1)La2Cu3 trigonal bipyramid. In the twelfth O site, O(12) is bonded to one La(1), one La(2), one La(3), and one Cu(2) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(12)La3Cu tetrahedra,  a cornercorner with one O(5)La3Mo tetrahedra, corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra,  an edgeedge with one O(7)La3Cu tetrahedra,  an edgeedge with one O(8)La3Cu tetrahedra,  an edgeedge with one O(5)La3Mo tetrahedra, and  an edgeedge with one O(1)La2Cu3 trigonal bipyramid. In the thirteenth O site, O(13) is bonded to two equivalent La(4), one Cu(4), one Cu(5), and one Cu(6) atom to form distorted OLa2Cu3 trigonal bipyramids that share corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra, edges with two equivalent O(6)La3Cu tetrahedra, edges with two equivalent O(7)La3Cu tetrahedra, and edges with two equivalent O(8)La3Cu tetrahedra. In the fourteenth O site, O(14) is bonded in a 1-coordinate geometry to two equivalent La(3), one Mo(2), and one Cu(5) atom. In the fifteenth O site, O(15) is bonded in a 4-coordinate geometry to two equivalent La(2), one Mo(2), and one Cu(4) atom. In the sixteenth O site, O(16) is bonded in a distorted single-bond geometry to two equivalent La(1) and one Mo(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_La4Cu3MoO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.930
_cell_length_b   10.982
_cell_length_c   7.974
_cell_angle_alpha   90.000
_cell_angle_beta   90.047
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   606.824
_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
  La  La0  1  0.748  0.248  0.882  1.0
  La  La1  1  0.748  0.752  0.882  1.0
  La  La2  1  0.756  0.249  0.372  1.0
  La  La3  1  0.756  0.751  0.372  1.0
  La  La4  1  0.233  0.252  0.634  1.0
  La  La5  1  0.233  0.748  0.634  1.0
  La  La6  1  0.244  0.250  0.124  1.0
  La  La7  1  0.244  0.750  0.124  1.0
  Cu  Cu8  1  0.454  0.500  0.877  1.0
  Cu  Cu9  1  0.883  0.500  0.660  1.0
  Cu  Cu10  1  0.889  0.500  0.097  1.0
  Cu  Cu11  1  0.541  0.000  0.140  1.0
  Cu  Cu12  1  0.107  0.000  0.912  1.0
  Cu  Cu13  1  0.104  0.000  0.349  1.0
  Mo  Mo14  1  0.413  0.500  0.379  1.0
  Mo  Mo15  1  0.572  0.000  0.625  1.0
  O  O16  1  0.736  0.500  0.880  1.0
  O  O17  1  0.681  0.500  0.378  1.0
  O  O18  1  0.278  0.500  0.579  1.0
  O  O19  1  0.277  0.500  0.179  1.0
  O  O20  1  0.577  0.176  0.624  1.0
  O  O21  1  0.577  0.824  0.624  1.0
  O  O22  1  0.579  0.166  0.127  1.0
  O  O23  1  0.579  0.834  0.127  1.0
  O  O24  1  0.080  0.167  0.881  1.0
  O  O25  1  0.080  0.833  0.881  1.0
  O  O26  1  0.078  0.166  0.379  1.0
  O  O27  1  0.078  0.834  0.379  1.0
  O  O28  1  0.912  0.333  0.126  1.0
  O  O29  1  0.912  0.667  0.126  1.0
  O  O30  1  0.414  0.324  0.378  1.0
  O  O31  1  0.414  0.676  0.378  1.0
  O  O32  1  0.412  0.335  0.877  1.0
  O  O33  1  0.412  0.665  0.877  1.0
  O  O34  1  0.912  0.333  0.630  1.0
  O  O35  1  0.912  0.667  0.630  1.0
  O  O36  1  0.257  0.000  0.133  1.0
  O  O37  1  0.307  0.000  0.644  1.0
  O  O38  1  0.687  0.000  0.413  1.0
  O  O39  1  0.713  0.000  0.821  1.0
[/CIF]
.
The material structure described by La4Cu3MoO12 crystallizes in the monoclinic Pm space group. There are four inequivalent La sites. In the first La site, La(1) is bonded in a body-centered cubic geometry to one O(1), one O(11), one O(12), one O(16), one O(5), one O(6), one O(7), and one O(9) atom. In the second La site, La(2) is bonded in a distorted body-centered cubic geometry to one O(10), one O(12), one O(15), one O(2), one O(5), one O(6), one O(8), and one O(9) atom. In the third La site, La(3) is bonded in a distorted body-centered cubic geometry to one O(10), one O(11), one O(12), one O(14), one O(3), one O(5), one O(7), and one O(8) atom. In the fourth La site, La(4) is bonded in a body-centered cubic geometry to one O(10), one O(11), one O(13), one O(4), one O(6), one O(7), one O(8), and one O(9) atom. There are two inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a trigonal bipyramidal geometry to one O(2), one O(3), one O(4), and two equivalent O(10) atoms. In the second Mo site, Mo(2) is bonded in a trigonal bipyramidal geometry to one O(14), one O(15), one O(16), and two equivalent O(5) atoms. There are six inequivalent Cu sites. In the first Cu site, Cu(1) is bonded in a distorted T-shaped geometry to one O(1) and two equivalent O(11) atoms. In the second Cu site, Cu(2) is bonded in a 3-coordinate geometry to one O(1) and two equivalent O(12) atoms. In the third Cu site, Cu(3) is bonded in a distorted T-shaped geometry to one O(1) and two equivalent O(9) atoms. In the fourth Cu site, Cu(4) is bonded in a distorted see-saw-like geometry to one O(13), one O(15), and two equivalent O(6) atoms. In the fifth Cu site, Cu(5) is bonded in a 4-coordinate geometry to one O(13), one O(14), and two equivalent O(7) atoms. In the sixth Cu site, Cu(6) is bonded in a distorted T-shaped geometry to one O(13) and two equivalent O(8) atoms. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded to two equivalent La(1), one Cu(1), one Cu(2), and one Cu(3) atom to form distorted OLa2Cu3 trigonal bipyramids that share corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra, edges with two equivalent O(11)La3Cu tetrahedra, edges with two equivalent O(12)La3Cu tetrahedra, and edges with two equivalent O(9)La3Cu tetrahedra. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent La(2) and one Mo(1) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to two equivalent La(3) and one Mo(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to two equivalent La(4) and one Mo(1) atom. In the fifth O site, O(5) is bonded to one La(1), one La(2), one La(3), and one Mo(2) atom to form OLa3Mo tetrahedra that share  a cornercorner with one O(12)La3Cu tetrahedra,  a cornercorner with one O(5)La3Mo tetrahedra, corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(8)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra,  a cornercorner with one O(1)La2Cu3 trigonal bipyramid,  an edgeedge with one O(11)La3Cu tetrahedra,  an edgeedge with one O(12)La3Cu tetrahedra, and  an edgeedge with one O(10)La3Mo tetrahedra. In the sixth O site, O(6) is bonded to one La(1), one La(2), one La(4), and one Cu(4) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(6)La3Cu tetrahedra,  a cornercorner with one O(9)La3Cu tetrahedra, corners with two equivalent O(12)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(8)La3Cu tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra,  a cornercorner with one O(1)La2Cu3 trigonal bipyramid,  an edgeedge with one O(11)La3Cu tetrahedra,  an edgeedge with one O(9)La3Cu tetrahedra,  an edgeedge with one O(10)La3Mo tetrahedra, and  an edgeedge with one O(13)La2Cu3 trigonal bipyramid. In the seventh O site, O(7) is bonded to one La(1), one La(3), one La(4), and one Cu(5) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(11)La3Cu tetrahedra,  a cornercorner with one O(7)La3Cu tetrahedra, corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(8)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra,  a cornercorner with one O(1)La2Cu3 trigonal bipyramid,  an edgeedge with one O(11)La3Cu tetrahedra,  an edgeedge with one O(12)La3Cu tetrahedra,  an edgeedge with one O(9)La3Cu tetrahedra, and  an edgeedge with one O(13)La2Cu3 trigonal bipyramid. In the eighth O site, O(8) is bonded to one La(2), one La(3), one La(4), and one Cu(6) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(8)La3Cu tetrahedra,  a cornercorner with one O(10)La3Mo tetrahedra, corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra,  an edgeedge with one O(12)La3Cu tetrahedra,  an edgeedge with one O(9)La3Cu tetrahedra,  an edgeedge with one O(10)La3Mo tetrahedra, and  an edgeedge with one O(13)La2Cu3 trigonal bipyramid. In the ninth O site, O(9) is bonded to one La(1), one La(2), one La(4), and one Cu(3) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(6)La3Cu tetrahedra,  a cornercorner with one O(9)La3Cu tetrahedra, corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(12)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra, corners with two equivalent O(5)La3Mo tetrahedra,  a cornercorner with one O(13)La2Cu3 trigonal bipyramid,  an edgeedge with one O(6)La3Cu tetrahedra,  an edgeedge with one O(7)La3Cu tetrahedra,  an edgeedge with one O(8)La3Cu tetrahedra, and  an edgeedge with one O(1)La2Cu3 trigonal bipyramid. In the tenth O site, O(10) is bonded to one La(2), one La(3), one La(4), and one Mo(1) atom to form OLa3Mo tetrahedra that share  a cornercorner with one O(8)La3Cu tetrahedra,  a cornercorner with one O(10)La3Mo tetrahedra, corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(12)La3Cu tetrahedra, corners with two equivalent O(7)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra,  a cornercorner with one O(13)La2Cu3 trigonal bipyramid,  an edgeedge with one O(6)La3Cu tetrahedra,  an edgeedge with one O(8)La3Cu tetrahedra, and  an edgeedge with one O(5)La3Mo tetrahedra. In the eleventh O site, O(11) is bonded to one La(1), one La(3), one La(4), and one Cu(1) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(11)La3Cu tetrahedra,  a cornercorner with one O(7)La3Cu tetrahedra, corners with two equivalent O(12)La3Cu tetrahedra, corners with two equivalent O(8)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra,  a cornercorner with one O(13)La2Cu3 trigonal bipyramid,  an edgeedge with one O(6)La3Cu tetrahedra,  an edgeedge with one O(7)La3Cu tetrahedra,  an edgeedge with one O(5)La3Mo tetrahedra, and  an edgeedge with one O(1)La2Cu3 trigonal bipyramid. In the twelfth O site, O(12) is bonded to one La(1), one La(2), one La(3), and one Cu(2) atom to form OLa3Cu tetrahedra that share  a cornercorner with one O(12)La3Cu tetrahedra,  a cornercorner with one O(5)La3Mo tetrahedra, corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(6)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra,  an edgeedge with one O(7)La3Cu tetrahedra,  an edgeedge with one O(8)La3Cu tetrahedra,  an edgeedge with one O(5)La3Mo tetrahedra, and  an edgeedge with one O(1)La2Cu3 trigonal bipyramid. In the thirteenth O site, O(13) is bonded to two equivalent La(4), one Cu(4), one Cu(5), and one Cu(6) atom to form distorted OLa2Cu3 trigonal bipyramids that share corners with two equivalent O(11)La3Cu tetrahedra, corners with two equivalent O(9)La3Cu tetrahedra, corners with two equivalent O(10)La3Mo tetrahedra, edges with two equivalent O(6)La3Cu tetrahedra, edges with two equivalent O(7)La3Cu tetrahedra, and edges with two equivalent O(8)La3Cu tetrahedra. In the fourteenth O site, O(14) is bonded in a 1-coordinate geometry to two equivalent La(3), one Mo(2), and one Cu(5) atom. In the fifteenth O site, O(15) is bonded in a 4-coordinate geometry to two equivalent La(2), one Mo(2), and one Cu(4) atom. In the sixteenth O site, O(16) is bonded in a distorted single-bond geometry to two equivalent La(1) and one Mo(2) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_La4Cu3MoO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.930
_cell_length_b   10.982
_cell_length_c   7.974
_cell_angle_alpha   90.000
_cell_angle_beta   90.047
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   606.824
_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
  La  La0  1  0.748  0.248  0.882  1.0
  La  La1  1  0.748  0.752  0.882  1.0
  La  La2  1  0.756  0.249  0.372  1.0
  La  La3  1  0.756  0.751  0.372  1.0
  La  La4  1  0.233  0.252  0.634  1.0
  La  La5  1  0.233  0.748  0.634  1.0
  La  La6  1  0.244  0.250  0.124  1.0
  La  La7  1  0.244  0.750  0.124  1.0
  Cu  Cu8  1  0.454  0.500  0.877  1.0
  Cu  Cu9  1  0.883  0.500  0.660  1.0
  Cu  Cu10  1  0.889  0.500  0.097  1.0
  Cu  Cu11  1  0.541  0.000  0.140  1.0
  Cu  Cu12  1  0.107  0.000  0.912  1.0
  Cu  Cu13  1  0.104  0.000  0.349  1.0
  Mo  Mo14  1  0.413  0.500  0.379  1.0
  Mo  Mo15  1  0.572  0.000  0.625  1.0
  O  O16  1  0.736  0.500  0.880  1.0
  O  O17  1  0.681  0.500  0.378  1.0
  O  O18  1  0.278  0.500  0.579  1.0
  O  O19  1  0.277  0.500  0.179  1.0
  O  O20  1  0.577  0.176  0.624  1.0
  O  O21  1  0.577  0.824  0.624  1.0
  O  O22  1  0.579  0.166  0.127  1.0
  O  O23  1  0.579  0.834  0.127  1.0
  O  O24  1  0.080  0.167  0.881  1.0
  O  O25  1  0.080  0.833  0.881  1.0
  O  O26  1  0.078  0.166  0.379  1.0
  O  O27  1  0.078  0.834  0.379  1.0
  O  O28  1  0.912  0.333  0.126  1.0
  O  O29  1  0.912  0.667  0.126  1.0
  O  O30  1  0.414  0.324  0.378  1.0
  O  O31  1  0.414  0.676  0.378  1.0
  O  O32  1  0.412  0.335  0.877  1.0
  O  O33  1  0.412  0.665  0.877  1.0
  O  O34  1  0.912  0.333  0.630  1.0
  O  O35  1  0.912  0.667  0.630  1.0
  O  O36  1  0.257  0.000  0.133  1.0
  O  O37  1  0.307  0.000  0.644  1.0
  O  O38  1  0.687  0.000  0.413  1.0
  O  O39  1  0.713  0.000  0.821  1.0
[/CIF]
.