The material described by WMoZn2O6 crystallizes in the monoclinic P2_1/c space group. W(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form WO6 octahedra that share corners with six equivalent Mo(1)O6 octahedra and corners with eight equivalent Zn(1)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 46-48°. Mo(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form MoO6 octahedra that share corners with six equivalent W(1)O6 octahedra and corners with eight equivalent Zn(1)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 46-48°. Zn(1) is bonded to one O(1), one O(2), and two equivalent O(3) atoms to form ZnO4 tetrahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent Mo(1)O6 octahedra, and corners with two equivalent Zn(1)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 62-83°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one W(1), one Mo(1), and one Zn(1) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one W(1), one Mo(1), and one Zn(1) atom. In the third O site, O(3) is bonded to one W(1), one Mo(1), and two equivalent Zn(1) atoms to form distorted corner-sharing OZn2MoW tetrahedra. is represented by the CIF file [CIF]
data_Zn2MoWO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.381
_cell_length_b   5.376
_cell_length_c   7.903
_cell_angle_alpha   90.000
_cell_angle_beta   89.246
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   228.622
_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
  Zn  Zn0  1  0.016  0.023  0.250  1.0
  Zn  Zn1  1  0.484  0.523  0.250  1.0
  Zn  Zn2  1  0.984  0.977  0.750  1.0
  Zn  Zn3  1  0.516  0.477  0.750  1.0
  Mo  Mo4  1  0.500  0.000  0.000  1.0
  Mo  Mo5  1  0.000  0.500  0.500  1.0
  W  W6  1  0.500  0.000  0.500  1.0
  W  W7  1  0.000  0.500  0.000  1.0
  O  O8  1  0.656  0.321  0.428  1.0
  O  O9  1  0.844  0.821  0.072  1.0
  O  O10  1  0.344  0.679  0.572  1.0
  O  O11  1  0.156  0.179  0.928  1.0
  O  O12  1  0.180  0.157  0.564  1.0
  O  O13  1  0.320  0.657  0.936  1.0
  O  O14  1  0.820  0.843  0.436  1.0
  O  O15  1  0.680  0.343  0.064  1.0
  O  O16  1  0.119  0.399  0.241  1.0
  O  O17  1  0.381  0.899  0.259  1.0
  O  O18  1  0.619  0.101  0.741  1.0
  O  O19  1  0.881  0.601  0.759  1.0
[/CIF]
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The material described by WMoZn2O6 crystallizes in the monoclinic P2_1/c space group. W(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form WO6 octahedra that share corners with six equivalent Mo(1)O6 octahedra and corners with eight equivalent Zn(1)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 46-48°. Mo(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form MoO6 octahedra that share corners with six equivalent W(1)O6 octahedra and corners with eight equivalent Zn(1)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 46-48°. Zn(1) is bonded to one O(1), one O(2), and two equivalent O(3) atoms to form ZnO4 tetrahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent Mo(1)O6 octahedra, and corners with two equivalent Zn(1)O4 tetrahedra. The corner-sharing octahedral tilt angles range from 62-83°. There are three inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one W(1), one Mo(1), and one Zn(1) atom. In the second O site, O(2) is bonded in a trigonal planar geometry to one W(1), one Mo(1), and one Zn(1) atom. In the third O site, O(3) is bonded to one W(1), one Mo(1), and two equivalent Zn(1) atoms to form distorted corner-sharing OZn2MoW tetrahedra. is represented by the CIF file [CIF]
data_Zn2MoWO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.381
_cell_length_b   5.376
_cell_length_c   7.903
_cell_angle_alpha   90.000
_cell_angle_beta   89.246
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   228.622
_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
  Zn  Zn0  1  0.016  0.023  0.250  1.0
  Zn  Zn1  1  0.484  0.523  0.250  1.0
  Zn  Zn2  1  0.984  0.977  0.750  1.0
  Zn  Zn3  1  0.516  0.477  0.750  1.0
  Mo  Mo4  1  0.500  0.000  0.000  1.0
  Mo  Mo5  1  0.000  0.500  0.500  1.0
  W  W6  1  0.500  0.000  0.500  1.0
  W  W7  1  0.000  0.500  0.000  1.0
  O  O8  1  0.656  0.321  0.428  1.0
  O  O9  1  0.844  0.821  0.072  1.0
  O  O10  1  0.344  0.679  0.572  1.0
  O  O11  1  0.156  0.179  0.928  1.0
  O  O12  1  0.180  0.157  0.564  1.0
  O  O13  1  0.320  0.657  0.936  1.0
  O  O14  1  0.820  0.843  0.436  1.0
  O  O15  1  0.680  0.343  0.064  1.0
  O  O16  1  0.119  0.399  0.241  1.0
  O  O17  1  0.381  0.899  0.259  1.0
  O  O18  1  0.619  0.101  0.741  1.0
  O  O19  1  0.881  0.601  0.759  1.0
[/CIF]
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