The material structure described by KDyTiO4 crystallizes in the orthorhombic Pbcm space group. K(1) is bonded in a 7-coordinate geometry to two equivalent O(3) and five equivalent O(1) atoms. Dy(1) is bonded in a 8-coordinate geometry to two equivalent O(2), two equivalent O(3), and four equivalent O(4) atoms. Ti(1) is bonded in a 6-coordinate geometry to one O(1), one O(4), two equivalent O(2), and two equivalent O(3) atoms. There are four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to five equivalent K(1) and one Ti(1) atom. In the second O site, O(2) is bonded in a 4-coordinate geometry to two equivalent Dy(1) and two equivalent Ti(1) atoms. In the third O site, O(3) is bonded in a 6-coordinate geometry to two equivalent K(1), two equivalent Dy(1), and two equivalent Ti(1) atoms. In the fourth O site, O(4) is bonded in a 5-coordinate geometry to four equivalent Dy(1) and one Ti(1) atom. is represented by the CIF file [CIF]
data_KDyTiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.393
_cell_length_b   5.516
_cell_length_c   12.925
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   384.479
_cell_formula_units_Z   4
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
  K  K0  1  0.250  0.478  0.595  1.0
  K  K1  1  0.750  0.522  0.405  1.0
  K  K2  1  0.250  0.978  0.405  1.0
  K  K3  1  0.750  0.022  0.595  1.0
  Dy  Dy4  1  0.250  0.972  0.102  1.0
  Dy  Dy5  1  0.750  0.028  0.898  1.0
  Dy  Dy6  1  0.250  0.472  0.898  1.0
  Dy  Dy7  1  0.750  0.528  0.102  1.0
  Ti  Ti8  1  0.250  0.492  0.245  1.0
  Ti  Ti9  1  0.750  0.508  0.755  1.0
  Ti  Ti10  1  0.250  0.992  0.755  1.0
  Ti  Ti11  1  0.750  0.008  0.245  1.0
  O  O12  1  0.250  0.960  0.620  1.0
  O  O13  1  0.750  0.040  0.380  1.0
  O  O14  1  0.250  0.460  0.380  1.0
  O  O15  1  0.750  0.540  0.620  1.0
  O  O16  1  0.000  0.750  0.801  1.0
  O  O17  1  0.000  0.250  0.199  1.0
  O  O18  1  0.500  0.250  0.199  1.0
  O  O19  1  0.500  0.750  0.801  1.0
  O  O20  1  0.000  0.750  0.229  1.0
  O  O21  1  0.000  0.250  0.771  1.0
  O  O22  1  0.500  0.250  0.771  1.0
  O  O23  1  0.500  0.750  0.229  1.0
  O  O24  1  0.250  0.572  0.061  1.0
  O  O25  1  0.750  0.428  0.939  1.0
  O  O26  1  0.250  0.072  0.939  1.0
  O  O27  1  0.750  0.928  0.061  1.0
[/CIF]
.
The material structure described by KDyTiO4 crystallizes in the orthorhombic Pbcm space group. K(1) is bonded in a 7-coordinate geometry to two equivalent O(3) and five equivalent O(1) atoms. Dy(1) is bonded in a 8-coordinate geometry to two equivalent O(2), two equivalent O(3), and four equivalent O(4) atoms. Ti(1) is bonded in a 6-coordinate geometry to one O(1), one O(4), two equivalent O(2), and two equivalent O(3) atoms. There are four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to five equivalent K(1) and one Ti(1) atom. In the second O site, O(2) is bonded in a 4-coordinate geometry to two equivalent Dy(1) and two equivalent Ti(1) atoms. In the third O site, O(3) is bonded in a 6-coordinate geometry to two equivalent K(1), two equivalent Dy(1), and two equivalent Ti(1) atoms. In the fourth O site, O(4) is bonded in a 5-coordinate geometry to four equivalent Dy(1) and one Ti(1) atom. is represented by the CIF file [CIF]
data_KDyTiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.393
_cell_length_b   5.516
_cell_length_c   12.925
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   384.479
_cell_formula_units_Z   4
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
  K  K0  1  0.250  0.478  0.595  1.0
  K  K1  1  0.750  0.522  0.405  1.0
  K  K2  1  0.250  0.978  0.405  1.0
  K  K3  1  0.750  0.022  0.595  1.0
  Dy  Dy4  1  0.250  0.972  0.102  1.0
  Dy  Dy5  1  0.750  0.028  0.898  1.0
  Dy  Dy6  1  0.250  0.472  0.898  1.0
  Dy  Dy7  1  0.750  0.528  0.102  1.0
  Ti  Ti8  1  0.250  0.492  0.245  1.0
  Ti  Ti9  1  0.750  0.508  0.755  1.0
  Ti  Ti10  1  0.250  0.992  0.755  1.0
  Ti  Ti11  1  0.750  0.008  0.245  1.0
  O  O12  1  0.250  0.960  0.620  1.0
  O  O13  1  0.750  0.040  0.380  1.0
  O  O14  1  0.250  0.460  0.380  1.0
  O  O15  1  0.750  0.540  0.620  1.0
  O  O16  1  0.000  0.750  0.801  1.0
  O  O17  1  0.000  0.250  0.199  1.0
  O  O18  1  0.500  0.250  0.199  1.0
  O  O19  1  0.500  0.750  0.801  1.0
  O  O20  1  0.000  0.750  0.229  1.0
  O  O21  1  0.000  0.250  0.771  1.0
  O  O22  1  0.500  0.250  0.771  1.0
  O  O23  1  0.500  0.750  0.229  1.0
  O  O24  1  0.250  0.572  0.061  1.0
  O  O25  1  0.750  0.428  0.939  1.0
  O  O26  1  0.250  0.072  0.939  1.0
  O  O27  1  0.750  0.928  0.061  1.0
[/CIF]
.