The material structure described by Cu3(WO3)4 crystallizes in the cubic Im-3 space group. W(1) is bonded to six equivalent O(1) atoms to form corner-sharing WO6 octahedra. The corner-sharing octahedral tilt angles are 39°. Cu(1) is bonded in a square co-planar geometry to four equivalent O(1) atoms. O(1) is bonded in a distorted trigonal planar geometry to two equivalent W(1) and one Cu(1) atom. is represented by the CIF file [CIF]
data_Cu3(WO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.593
_cell_length_b   6.593
_cell_length_c   6.593
_cell_angle_alpha   109.471
_cell_angle_beta   109.471
_cell_angle_gamma   109.471
_symmetry_Int_Tables_number   1
_cell_volume   220.634
_cell_formula_units_Z   1
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
  Cu  Cu0  1  0.500  0.500  0.000  1.0
  Cu  Cu1  1  0.500  0.000  0.500  1.0
  Cu  Cu2  1  0.000  0.500  0.500  1.0
  W  W3  1  0.500  0.500  0.500  1.0
  W  W4  1  0.000  0.500  0.000  1.0
  W  W5  1  0.000  0.000  0.500  1.0
  W  W6  1  0.500  0.000  0.000  1.0
  O  O7  1  0.309  0.818  0.127  1.0
  O  O8  1  0.691  0.182  0.873  1.0
  O  O9  1  0.691  0.818  0.509  1.0
  O  O10  1  0.873  0.691  0.182  1.0
  O  O11  1  0.818  0.127  0.309  1.0
  O  O12  1  0.182  0.491  0.309  1.0
  O  O13  1  0.491  0.309  0.182  1.0
  O  O14  1  0.182  0.873  0.691  1.0
  O  O15  1  0.309  0.182  0.491  1.0
  O  O16  1  0.127  0.309  0.818  1.0
  O  O17  1  0.818  0.509  0.691  1.0
  O  O18  1  0.509  0.691  0.818  1.0
[/CIF]
.
The material structure described by Cu3(WO3)4 crystallizes in the cubic Im-3 space group. W(1) is bonded to six equivalent O(1) atoms to form corner-sharing WO6 octahedra. The corner-sharing octahedral tilt angles are 39°. Cu(1) is bonded in a square co-planar geometry to four equivalent O(1) atoms. O(1) is bonded in a distorted trigonal planar geometry to two equivalent W(1) and one Cu(1) atom. is represented by the CIF file [CIF]
data_Cu3(WO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.593
_cell_length_b   6.593
_cell_length_c   6.593
_cell_angle_alpha   109.471
_cell_angle_beta   109.471
_cell_angle_gamma   109.471
_symmetry_Int_Tables_number   1
_cell_volume   220.634
_cell_formula_units_Z   1
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
  Cu  Cu0  1  0.500  0.500  0.000  1.0
  Cu  Cu1  1  0.500  0.000  0.500  1.0
  Cu  Cu2  1  0.000  0.500  0.500  1.0
  W  W3  1  0.500  0.500  0.500  1.0
  W  W4  1  0.000  0.500  0.000  1.0
  W  W5  1  0.000  0.000  0.500  1.0
  W  W6  1  0.500  0.000  0.000  1.0
  O  O7  1  0.309  0.818  0.127  1.0
  O  O8  1  0.691  0.182  0.873  1.0
  O  O9  1  0.691  0.818  0.509  1.0
  O  O10  1  0.873  0.691  0.182  1.0
  O  O11  1  0.818  0.127  0.309  1.0
  O  O12  1  0.182  0.491  0.309  1.0
  O  O13  1  0.491  0.309  0.182  1.0
  O  O14  1  0.182  0.873  0.691  1.0
  O  O15  1  0.309  0.182  0.491  1.0
  O  O16  1  0.127  0.309  0.818  1.0
  O  O17  1  0.818  0.509  0.691  1.0
  O  O18  1  0.509  0.691  0.818  1.0
[/CIF]
.