The material structure described by CsVOF4 crystallizes in the orthorhombic Pnma space group. Cs(1) is bonded in a 12-coordinate geometry to three equivalent O(1), three equivalent F(3), and six equivalent F(1) atoms. V(1) is bonded in a 5-coordinate geometry to one O(1), one F(2), one F(3), and two equivalent F(1) atoms. O(1) is bonded in a single-bond geometry to three equivalent Cs(1) and one V(1) atom. There are three inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to three equivalent Cs(1) and one V(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to one V(1) atom. In the third F site, F(3) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one V(1) atom. is represented by the CIF card [CIF]
data_CsVOF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.654
_cell_length_b   6.475
_cell_length_c   14.914
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   545.949
_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
  Cs  Cs0  1  0.533  0.750  0.372  1.0
  Cs  Cs1  1  0.033  0.750  0.128  1.0
  Cs  Cs2  1  0.467  0.250  0.628  1.0
  Cs  Cs3  1  0.967  0.250  0.872  1.0
  V  V4  1  0.011  0.250  0.359  1.0
  V  V5  1  0.511  0.250  0.141  1.0
  V  V6  1  0.989  0.750  0.641  1.0
  V  V7  1  0.489  0.750  0.859  1.0
  O  O8  1  0.813  0.250  0.437  1.0
  O  O9  1  0.313  0.250  0.063  1.0
  O  O10  1  0.187  0.750  0.563  1.0
  O  O11  1  0.687  0.750  0.937  1.0
  F  F12  1  0.053  0.972  0.338  1.0
  F  F13  1  0.553  0.528  0.162  1.0
  F  F14  1  0.947  0.472  0.662  1.0
  F  F15  1  0.447  0.028  0.838  1.0
  F  F16  1  0.947  0.028  0.662  1.0
  F  F17  1  0.447  0.472  0.838  1.0
  F  F18  1  0.053  0.528  0.338  1.0
  F  F19  1  0.553  0.972  0.162  1.0
  F  F20  1  0.822  0.250  0.258  1.0
  F  F21  1  0.322  0.250  0.242  1.0
  F  F22  1  0.178  0.750  0.742  1.0
  F  F23  1  0.678  0.750  0.758  1.0
  F  F24  1  0.287  0.250  0.424  1.0
  F  F25  1  0.787  0.250  0.076  1.0
  F  F26  1  0.713  0.750  0.576  1.0
  F  F27  1  0.213  0.750  0.924  1.0
[/CIF]
.
The material structure described by CsVOF4 crystallizes in the orthorhombic Pnma space group. Cs(1) is bonded in a 12-coordinate geometry to three equivalent O(1), three equivalent F(3), and six equivalent F(1) atoms. V(1) is bonded in a 5-coordinate geometry to one O(1), one F(2), one F(3), and two equivalent F(1) atoms. O(1) is bonded in a single-bond geometry to three equivalent Cs(1) and one V(1) atom. There are three inequivalent F sites. In the first F site, F(1) is bonded in a single-bond geometry to three equivalent Cs(1) and one V(1) atom. In the second F site, F(2) is bonded in a distorted single-bond geometry to one V(1) atom. In the third F site, F(3) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one V(1) atom. is represented by the CIF card [CIF]
data_CsVOF4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.654
_cell_length_b   6.475
_cell_length_c   14.914
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   545.949
_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
  Cs  Cs0  1  0.533  0.750  0.372  1.0
  Cs  Cs1  1  0.033  0.750  0.128  1.0
  Cs  Cs2  1  0.467  0.250  0.628  1.0
  Cs  Cs3  1  0.967  0.250  0.872  1.0
  V  V4  1  0.011  0.250  0.359  1.0
  V  V5  1  0.511  0.250  0.141  1.0
  V  V6  1  0.989  0.750  0.641  1.0
  V  V7  1  0.489  0.750  0.859  1.0
  O  O8  1  0.813  0.250  0.437  1.0
  O  O9  1  0.313  0.250  0.063  1.0
  O  O10  1  0.187  0.750  0.563  1.0
  O  O11  1  0.687  0.750  0.937  1.0
  F  F12  1  0.053  0.972  0.338  1.0
  F  F13  1  0.553  0.528  0.162  1.0
  F  F14  1  0.947  0.472  0.662  1.0
  F  F15  1  0.447  0.028  0.838  1.0
  F  F16  1  0.947  0.028  0.662  1.0
  F  F17  1  0.447  0.472  0.838  1.0
  F  F18  1  0.053  0.528  0.338  1.0
  F  F19  1  0.553  0.972  0.162  1.0
  F  F20  1  0.822  0.250  0.258  1.0
  F  F21  1  0.322  0.250  0.242  1.0
  F  F22  1  0.178  0.750  0.742  1.0
  F  F23  1  0.678  0.750  0.758  1.0
  F  F24  1  0.287  0.250  0.424  1.0
  F  F25  1  0.787  0.250  0.076  1.0
  F  F26  1  0.713  0.750  0.576  1.0
  F  F27  1  0.213  0.750  0.924  1.0
[/CIF]
.