The material described by Se(OF)2 is Silicon tetrafluoride-derived structured and crystallizes in the tetragonal P4_12_12 space group. The structure is zero-dimensional and consists of four Se(OF)2 clusters. Se(1) is bonded in a tetrahedral geometry to two equivalent O(1) and two equivalent F(1) atoms. O(1) is bonded in a single-bond geometry to one Se(1) atom. F(1) is bonded in a single-bond geometry to one Se(1) atom. is represented by the CIF card [CIF]
data_Se(OF)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.464
_cell_length_b   5.464
_cell_length_c   10.936
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   326.498
_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
  Se  Se0  1  0.095  0.095  0.000  1.0
  Se  Se1  1  0.905  0.905  0.500  1.0
  Se  Se2  1  0.405  0.595  0.250  1.0
  Se  Se3  1  0.595  0.405  0.750  1.0
  O  O4  1  0.344  0.029  0.067  1.0
  O  O5  1  0.656  0.971  0.567  1.0
  O  O6  1  0.471  0.844  0.317  1.0
  O  O7  1  0.156  0.529  0.183  1.0
  O  O8  1  0.529  0.156  0.817  1.0
  O  O9  1  0.844  0.471  0.683  1.0
  O  O10  1  0.029  0.344  0.933  1.0
  O  O11  1  0.971  0.656  0.433  1.0
  F  F12  1  0.972  0.139  0.401  1.0
  F  F13  1  0.028  0.861  0.901  1.0
  F  F14  1  0.361  0.472  0.651  1.0
  F  F15  1  0.528  0.639  0.849  1.0
  F  F16  1  0.639  0.528  0.151  1.0
  F  F17  1  0.472  0.361  0.349  1.0
  F  F18  1  0.139  0.972  0.599  1.0
  F  F19  1  0.861  0.028  0.099  1.0
[/CIF]
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The material described by Se(OF)2 is Silicon tetrafluoride-derived structured and crystallizes in the tetragonal P4_12_12 space group. The structure is zero-dimensional and consists of four Se(OF)2 clusters. Se(1) is bonded in a tetrahedral geometry to two equivalent O(1) and two equivalent F(1) atoms. O(1) is bonded in a single-bond geometry to one Se(1) atom. F(1) is bonded in a single-bond geometry to one Se(1) atom. is represented by the CIF card [CIF]
data_Se(OF)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.464
_cell_length_b   5.464
_cell_length_c   10.936
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   326.498
_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
  Se  Se0  1  0.095  0.095  0.000  1.0
  Se  Se1  1  0.905  0.905  0.500  1.0
  Se  Se2  1  0.405  0.595  0.250  1.0
  Se  Se3  1  0.595  0.405  0.750  1.0
  O  O4  1  0.344  0.029  0.067  1.0
  O  O5  1  0.656  0.971  0.567  1.0
  O  O6  1  0.471  0.844  0.317  1.0
  O  O7  1  0.156  0.529  0.183  1.0
  O  O8  1  0.529  0.156  0.817  1.0
  O  O9  1  0.844  0.471  0.683  1.0
  O  O10  1  0.029  0.344  0.933  1.0
  O  O11  1  0.971  0.656  0.433  1.0
  F  F12  1  0.972  0.139  0.401  1.0
  F  F13  1  0.028  0.861  0.901  1.0
  F  F14  1  0.361  0.472  0.651  1.0
  F  F15  1  0.528  0.639  0.849  1.0
  F  F16  1  0.639  0.528  0.151  1.0
  F  F17  1  0.472  0.361  0.349  1.0
  F  F18  1  0.139  0.972  0.599  1.0
  F  F19  1  0.861  0.028  0.099  1.0
[/CIF]
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