The crystal structure described by (WPO3F)2O2 crystallizes in the triclinic P-1 space group. The structure consists of two water atoms inside a WPO3F framework. In the WPO3F framework, there are two inequivalent W sites. In the first W site, W(1) is bonded in a 4-coordinate geometry to two equivalent O(2) and two equivalent F(1) atoms. In the second W site, W(2) is bonded in a linear geometry to two equivalent O(3) atoms. P(1) is bonded in a distorted single-bond geometry to one O(1), one O(2), and one O(3) atom. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one P(1), one O(2), and one F(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one W(1), one P(1), and one O(1) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one W(2) and one P(1) atom. F(1) is bonded in a distorted L-shaped geometry to one W(1) and one O(1) atom. is represented by the CIF card [CIF]
data_PWO4F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.385
_cell_length_b   5.382
_cell_length_c   7.726
_cell_angle_alpha   109.044
_cell_angle_beta   106.323
_cell_angle_gamma   94.975
_symmetry_Int_Tables_number   1
_cell_volume   199.147
_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
  P  P0  1  0.425  0.591  0.762  1.0
  P  P1  1  0.575  0.409  0.238  1.0
  W  W2  1  0.000  0.000  0.000  1.0
  W  W3  1  0.500  0.500  0.500  1.0
  O  O4  1  0.278  0.582  0.116  1.0
  O  O5  1  0.740  0.643  0.101  1.0
  O  O6  1  0.654  0.410  0.384  1.0
  O  O7  1  0.636  0.996  0.350  1.0
  O  O8  1  0.260  0.357  0.899  1.0
  O  O9  1  0.346  0.590  0.616  1.0
  O  O10  1  0.364  0.004  0.650  1.0
  O  O11  1  0.722  0.418  0.884  1.0
  F  F12  1  0.147  0.799  0.265  1.0
  F  F13  1  0.853  0.201  0.735  1.0
[/CIF]
.
The crystal structure described by (WPO3F)2O2 crystallizes in the triclinic P-1 space group. The structure consists of two water atoms inside a WPO3F framework. In the WPO3F framework, there are two inequivalent W sites. In the first W site, W(1) is bonded in a 4-coordinate geometry to two equivalent O(2) and two equivalent F(1) atoms. In the second W site, W(2) is bonded in a linear geometry to two equivalent O(3) atoms. P(1) is bonded in a distorted single-bond geometry to one O(1), one O(2), and one O(3) atom. There are three inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one P(1), one O(2), and one F(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one W(1), one P(1), and one O(1) atom. In the third O site, O(3) is bonded in a bent 120 degrees geometry to one W(2) and one P(1) atom. F(1) is bonded in a distorted L-shaped geometry to one W(1) and one O(1) atom. is represented by the CIF card [CIF]
data_PWO4F
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.385
_cell_length_b   5.382
_cell_length_c   7.726
_cell_angle_alpha   109.044
_cell_angle_beta   106.323
_cell_angle_gamma   94.975
_symmetry_Int_Tables_number   1
_cell_volume   199.147
_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
  P  P0  1  0.425  0.591  0.762  1.0
  P  P1  1  0.575  0.409  0.238  1.0
  W  W2  1  0.000  0.000  0.000  1.0
  W  W3  1  0.500  0.500  0.500  1.0
  O  O4  1  0.278  0.582  0.116  1.0
  O  O5  1  0.740  0.643  0.101  1.0
  O  O6  1  0.654  0.410  0.384  1.0
  O  O7  1  0.636  0.996  0.350  1.0
  O  O8  1  0.260  0.357  0.899  1.0
  O  O9  1  0.346  0.590  0.616  1.0
  O  O10  1  0.364  0.004  0.650  1.0
  O  O11  1  0.722  0.418  0.884  1.0
  F  F12  1  0.147  0.799  0.265  1.0
  F  F13  1  0.853  0.201  0.735  1.0
[/CIF]
.