The structure described by Ti2ZnO5 crystallizes in the orthorhombic Pmmn space group. Ti(1) is bonded to one O(1), one O(3), and three equivalent O(2) atoms to form a mixture of distorted edge and corner-sharing TiO5 trigonal bipyramids. Zn(1) is bonded in a 6-coordinate geometry to two equivalent O(1) and four equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Ti(1) and two equivalent Zn(1) atoms to form distorted corner-sharing OTi2Zn2 tetrahedra. In the second O site, O(2) is bonded in a distorted trigonal non-coplanar geometry to three equivalent Ti(1) atoms. In the third O site, O(3) is bonded in a distorted trigonal non-coplanar geometry to one Ti(1) and two equivalent Zn(1) atoms. is represented by the CIF card [CIF]
data_Ti2ZnO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.387
_cell_length_b   4.828
_cell_length_c   12.124
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   198.292
_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
  Ti  Ti0  1  0.000  0.591  0.854  1.0
  Ti  Ti1  1  0.500  0.409  0.646  1.0
  Ti  Ti2  1  0.500  0.409  0.354  1.0
  Ti  Ti3  1  0.000  0.591  0.146  1.0
  Zn  Zn4  1  0.500  0.103  0.000  1.0
  Zn  Zn5  1  0.000  0.897  0.500  1.0
  O  O6  1  0.500  0.566  0.500  1.0
  O  O7  1  0.000  0.434  0.000  1.0
  O  O8  1  0.500  0.439  0.821  1.0
  O  O9  1  0.000  0.561  0.679  1.0
  O  O10  1  0.500  0.439  0.179  1.0
  O  O11  1  0.000  0.561  0.321  1.0
  O  O12  1  0.000  0.944  0.109  1.0
  O  O13  1  0.500  0.056  0.391  1.0
  O  O14  1  0.500  0.056  0.609  1.0
  O  O15  1  0.000  0.944  0.891  1.0
[/CIF]
.
The structure described by Ti2ZnO5 crystallizes in the orthorhombic Pmmn space group. Ti(1) is bonded to one O(1), one O(3), and three equivalent O(2) atoms to form a mixture of distorted edge and corner-sharing TiO5 trigonal bipyramids. Zn(1) is bonded in a 6-coordinate geometry to two equivalent O(1) and four equivalent O(3) atoms. There are three inequivalent O sites. In the first O site, O(1) is bonded to two equivalent Ti(1) and two equivalent Zn(1) atoms to form distorted corner-sharing OTi2Zn2 tetrahedra. In the second O site, O(2) is bonded in a distorted trigonal non-coplanar geometry to three equivalent Ti(1) atoms. In the third O site, O(3) is bonded in a distorted trigonal non-coplanar geometry to one Ti(1) and two equivalent Zn(1) atoms. is represented by the CIF card [CIF]
data_Ti2ZnO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.387
_cell_length_b   4.828
_cell_length_c   12.124
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   198.292
_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
  Ti  Ti0  1  0.000  0.591  0.854  1.0
  Ti  Ti1  1  0.500  0.409  0.646  1.0
  Ti  Ti2  1  0.500  0.409  0.354  1.0
  Ti  Ti3  1  0.000  0.591  0.146  1.0
  Zn  Zn4  1  0.500  0.103  0.000  1.0
  Zn  Zn5  1  0.000  0.897  0.500  1.0
  O  O6  1  0.500  0.566  0.500  1.0
  O  O7  1  0.000  0.434  0.000  1.0
  O  O8  1  0.500  0.439  0.821  1.0
  O  O9  1  0.000  0.561  0.679  1.0
  O  O10  1  0.500  0.439  0.179  1.0
  O  O11  1  0.000  0.561  0.321  1.0
  O  O12  1  0.000  0.944  0.109  1.0
  O  O13  1  0.500  0.056  0.391  1.0
  O  O14  1  0.500  0.056  0.609  1.0
  O  O15  1  0.000  0.944  0.891  1.0
[/CIF]
.