The material structure described by Te(WO4)3 crystallizes in the triclinic P1 space group. There are three inequivalent W sites. In the first W site, W(1) is bonded to one O(1), one O(11), one O(12), one O(2), one O(4), and one O(9) atom to form WO6 octahedra that share corners with two equivalent W(3)O6 octahedra and corners with four equivalent Te(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 25-32°. In the second W site, W(2) is bonded to one O(10), one O(3), one O(5), one O(6), one O(7), and one O(8) atom to form WO6 octahedra that share corners with two equivalent Te(1)O6 octahedra and corners with four equivalent W(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 27-34°. In the third W site, W(3) is bonded to one O(10), one O(11), one O(2), one O(3), one O(5), and one O(8) atom to form corner-sharing WO6 octahedra. The corner-sharing octahedral tilt angles range from 27-34°. Te(1) is bonded to one O(1), one O(12), one O(4), one O(6), one O(7), and one O(9) atom to form TeO6 octahedra that share corners with two equivalent W(2)O6 octahedra and corners with four equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 25-32°. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one W(1) and one Te(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one W(1) and one W(3) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one W(2) and one W(3) atom. In the fourth O site, O(4) is bonded in a bent 150 degrees geometry to one W(1) and one Te(1) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to one W(2) and one W(3) atom. In the sixth O site, O(6) is bonded in a bent 150 degrees geometry to one W(2) and one Te(1) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one W(2) and one Te(1) atom. In the eighth O site, O(8) is bonded in a bent 150 degrees geometry to one W(2) and one W(3) atom. In the ninth O site, O(9) is bonded in a bent 150 degrees geometry to one W(1) and one Te(1) atom. In the tenth O site, O(10) is bonded in a bent 150 degrees geometry to one W(2) and one W(3) atom. In the eleventh O site, O(11) is bonded in a bent 150 degrees geometry to one W(1) and one W(3) atom. In the twelfth O site, O(12) is bonded in a bent 150 degrees geometry to one W(1) and one Te(1) atom. is represented by the CIF file [CIF]
data_Te(WO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.140
_cell_length_b   5.313
_cell_length_c   7.381
_cell_angle_alpha   87.526
_cell_angle_beta   90.002
_cell_angle_gamma   90.011
_symmetry_Int_Tables_number   1
_cell_volume   201.384
_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
  Te  Te0  1  0.499  0.498  0.499  1.0
  W  W1  1  0.005  0.998  0.519  1.0
  W  W2  1  0.494  0.539  0.999  1.0
  W  W3  1  0.001  0.040  0.019  1.0
  O  O4  1  0.708  0.209  0.550  1.0
  O  O5  1  0.906  0.005  0.254  1.0
  O  O6  1  0.704  0.807  0.955  1.0
  O  O7  1  0.790  0.708  0.550  1.0
  O  O8  1  0.199  0.709  0.046  1.0
  O  O9  1  0.597  0.504  0.250  1.0
  O  O10  1  0.405  0.499  0.750  1.0
  O  O11  1  0.799  0.307  0.956  1.0
  O  O12  1  0.208  0.290  0.452  1.0
  O  O13  1  0.302  0.209  0.048  1.0
  O  O14  1  0.092  0.998  0.755  1.0
  O  O15  1  0.291  0.791  0.453  1.0
[/CIF]
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The material structure described by Te(WO4)3 crystallizes in the triclinic P1 space group. There are three inequivalent W sites. In the first W site, W(1) is bonded to one O(1), one O(11), one O(12), one O(2), one O(4), and one O(9) atom to form WO6 octahedra that share corners with two equivalent W(3)O6 octahedra and corners with four equivalent Te(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 25-32°. In the second W site, W(2) is bonded to one O(10), one O(3), one O(5), one O(6), one O(7), and one O(8) atom to form WO6 octahedra that share corners with two equivalent Te(1)O6 octahedra and corners with four equivalent W(3)O6 octahedra. The corner-sharing octahedral tilt angles range from 27-34°. In the third W site, W(3) is bonded to one O(10), one O(11), one O(2), one O(3), one O(5), and one O(8) atom to form corner-sharing WO6 octahedra. The corner-sharing octahedral tilt angles range from 27-34°. Te(1) is bonded to one O(1), one O(12), one O(4), one O(6), one O(7), and one O(9) atom to form TeO6 octahedra that share corners with two equivalent W(2)O6 octahedra and corners with four equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 25-32°. There are twelve inequivalent O sites. In the first O site, O(1) is bonded in a bent 150 degrees geometry to one W(1) and one Te(1) atom. In the second O site, O(2) is bonded in a bent 150 degrees geometry to one W(1) and one W(3) atom. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one W(2) and one W(3) atom. In the fourth O site, O(4) is bonded in a bent 150 degrees geometry to one W(1) and one Te(1) atom. In the fifth O site, O(5) is bonded in a bent 150 degrees geometry to one W(2) and one W(3) atom. In the sixth O site, O(6) is bonded in a bent 150 degrees geometry to one W(2) and one Te(1) atom. In the seventh O site, O(7) is bonded in a bent 150 degrees geometry to one W(2) and one Te(1) atom. In the eighth O site, O(8) is bonded in a bent 150 degrees geometry to one W(2) and one W(3) atom. In the ninth O site, O(9) is bonded in a bent 150 degrees geometry to one W(1) and one Te(1) atom. In the tenth O site, O(10) is bonded in a bent 150 degrees geometry to one W(2) and one W(3) atom. In the eleventh O site, O(11) is bonded in a bent 150 degrees geometry to one W(1) and one W(3) atom. In the twelfth O site, O(12) is bonded in a bent 150 degrees geometry to one W(1) and one Te(1) atom. is represented by the CIF file [CIF]
data_Te(WO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.140
_cell_length_b   5.313
_cell_length_c   7.381
_cell_angle_alpha   87.526
_cell_angle_beta   90.002
_cell_angle_gamma   90.011
_symmetry_Int_Tables_number   1
_cell_volume   201.384
_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
  Te  Te0  1  0.499  0.498  0.499  1.0
  W  W1  1  0.005  0.998  0.519  1.0
  W  W2  1  0.494  0.539  0.999  1.0
  W  W3  1  0.001  0.040  0.019  1.0
  O  O4  1  0.708  0.209  0.550  1.0
  O  O5  1  0.906  0.005  0.254  1.0
  O  O6  1  0.704  0.807  0.955  1.0
  O  O7  1  0.790  0.708  0.550  1.0
  O  O8  1  0.199  0.709  0.046  1.0
  O  O9  1  0.597  0.504  0.250  1.0
  O  O10  1  0.405  0.499  0.750  1.0
  O  O11  1  0.799  0.307  0.956  1.0
  O  O12  1  0.208  0.290  0.452  1.0
  O  O13  1  0.302  0.209  0.048  1.0
  O  O14  1  0.092  0.998  0.755  1.0
  O  O15  1  0.291  0.791  0.453  1.0
[/CIF]
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