The structure described by YTi(WO4)2 is Hydrophilite-derived structured and crystallizes in the triclinic P-1 space group. Y(1) is bonded to one O(1), one O(2), one O(5), one O(6), one O(7), and one O(8) atom to form distorted YO6 octahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent W(2)O6 octahedra, and edges with two equivalent Ti(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 49-61°. Ti(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form distorted TiO6 octahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent W(2)O6 octahedra, and edges with two equivalent Y(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-59°. There are two inequivalent W sites. In the first W site, W(1) is bonded to one O(2), one O(6), two equivalent O(3), and two equivalent O(8) atoms to form WO6 octahedra that share corners with four equivalent Y(1)O6 octahedra, corners with four equivalent Ti(1)O6 octahedra, and edges with two equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-61°. In the second W site, W(2) is bonded to one O(1), one O(5), two equivalent O(4), and two equivalent O(7) atoms to form WO6 octahedra that share corners with four equivalent Y(1)O6 octahedra, corners with four equivalent Ti(1)O6 octahedra, and edges with two equivalent W(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-60°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Y(1), one Ti(1), and one W(2) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Y(1), one Ti(1), and one W(1) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Ti(1) and two equivalent W(1) atoms. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Ti(1) and two equivalent W(2) atoms. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one Y(1), one Ti(1), and one W(2) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Y(1), one Ti(1), and one W(1) atom. In the seventh O site, O(7) is bonded in a trigonal planar geometry to one Y(1) and two equivalent W(2) atoms. In the eighth O site, O(8) is bonded in a trigonal planar geometry to one Y(1) and two equivalent W(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_YTi(WO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.349
_cell_length_b   5.821
_cell_length_c   9.725
_cell_angle_alpha   88.921
_cell_angle_beta   87.317
_cell_angle_gamma   89.454
_symmetry_Int_Tables_number   1
_cell_volume   302.436
_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
  Y  Y0  1  0.256  0.341  0.743  1.0
  Y  Y1  1  0.744  0.659  0.257  1.0
  Ti  Ti2  1  0.770  0.675  0.770  1.0
  Ti  Ti3  1  0.230  0.325  0.230  1.0
  W  W4  1  0.253  0.847  0.502  1.0
  W  W5  1  0.260  0.842  0.997  1.0
  W  W6  1  0.747  0.153  0.498  1.0
  W  W7  1  0.740  0.158  0.003  1.0
  O  O8  1  0.439  0.640  0.854  1.0
  O  O9  1  0.060  0.650  0.644  1.0
  O  O10  1  0.561  0.360  0.146  1.0
  O  O11  1  0.940  0.350  0.356  1.0
  O  O12  1  0.435  0.109  0.385  1.0
  O  O13  1  0.084  0.104  0.119  1.0
  O  O14  1  0.565  0.891  0.615  1.0
  O  O15  1  0.916  0.896  0.881  1.0
  O  O16  1  0.885  0.409  0.867  1.0
  O  O17  1  0.628  0.379  0.619  1.0
  O  O18  1  0.115  0.591  0.133  1.0
  O  O19  1  0.372  0.621  0.381  1.0
  O  O20  1  0.414  0.119  0.898  1.0
  O  O21  1  0.586  0.881  0.102  1.0
  O  O22  1  0.078  0.115  0.598  1.0
  O  O23  1  0.922  0.885  0.402  1.0
[/CIF]
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The structure described by YTi(WO4)2 is Hydrophilite-derived structured and crystallizes in the triclinic P-1 space group. Y(1) is bonded to one O(1), one O(2), one O(5), one O(6), one O(7), and one O(8) atom to form distorted YO6 octahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent W(2)O6 octahedra, and edges with two equivalent Ti(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 49-61°. Ti(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form distorted TiO6 octahedra that share corners with four equivalent W(1)O6 octahedra, corners with four equivalent W(2)O6 octahedra, and edges with two equivalent Y(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-59°. There are two inequivalent W sites. In the first W site, W(1) is bonded to one O(2), one O(6), two equivalent O(3), and two equivalent O(8) atoms to form WO6 octahedra that share corners with four equivalent Y(1)O6 octahedra, corners with four equivalent Ti(1)O6 octahedra, and edges with two equivalent W(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 38-61°. In the second W site, W(2) is bonded to one O(1), one O(5), two equivalent O(4), and two equivalent O(7) atoms to form WO6 octahedra that share corners with four equivalent Y(1)O6 octahedra, corners with four equivalent Ti(1)O6 octahedra, and edges with two equivalent W(2)O6 octahedra. The corner-sharing octahedral tilt angles range from 41-60°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a trigonal planar geometry to one Y(1), one Ti(1), and one W(2) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Y(1), one Ti(1), and one W(1) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Ti(1) and two equivalent W(1) atoms. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Ti(1) and two equivalent W(2) atoms. In the fifth O site, O(5) is bonded in a distorted trigonal planar geometry to one Y(1), one Ti(1), and one W(2) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Y(1), one Ti(1), and one W(1) atom. In the seventh O site, O(7) is bonded in a trigonal planar geometry to one Y(1) and two equivalent W(2) atoms. In the eighth O site, O(8) is bonded in a trigonal planar geometry to one Y(1) and two equivalent W(1) atoms. is represented by the Crystallographic Information File (CIF) [CIF]
data_YTi(WO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.349
_cell_length_b   5.821
_cell_length_c   9.725
_cell_angle_alpha   88.921
_cell_angle_beta   87.317
_cell_angle_gamma   89.454
_symmetry_Int_Tables_number   1
_cell_volume   302.436
_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
  Y  Y0  1  0.256  0.341  0.743  1.0
  Y  Y1  1  0.744  0.659  0.257  1.0
  Ti  Ti2  1  0.770  0.675  0.770  1.0
  Ti  Ti3  1  0.230  0.325  0.230  1.0
  W  W4  1  0.253  0.847  0.502  1.0
  W  W5  1  0.260  0.842  0.997  1.0
  W  W6  1  0.747  0.153  0.498  1.0
  W  W7  1  0.740  0.158  0.003  1.0
  O  O8  1  0.439  0.640  0.854  1.0
  O  O9  1  0.060  0.650  0.644  1.0
  O  O10  1  0.561  0.360  0.146  1.0
  O  O11  1  0.940  0.350  0.356  1.0
  O  O12  1  0.435  0.109  0.385  1.0
  O  O13  1  0.084  0.104  0.119  1.0
  O  O14  1  0.565  0.891  0.615  1.0
  O  O15  1  0.916  0.896  0.881  1.0
  O  O16  1  0.885  0.409  0.867  1.0
  O  O17  1  0.628  0.379  0.619  1.0
  O  O18  1  0.115  0.591  0.133  1.0
  O  O19  1  0.372  0.621  0.381  1.0
  O  O20  1  0.414  0.119  0.898  1.0
  O  O21  1  0.586  0.881  0.102  1.0
  O  O22  1  0.078  0.115  0.598  1.0
  O  O23  1  0.922  0.885  0.402  1.0
[/CIF]
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