The structure described by CsSbS(O2F)2 crystallizes in the orthorhombic Pna2_1 space group. Cs(1) is bonded in a 11-coordinate geometry to one O(1), one O(2), two equivalent O(3), two equivalent O(4), two equivalent F(2), and three equivalent F(1) atoms. Sb(1) is bonded in a distorted rectangular see-saw-like geometry to one O(2), one O(3), one F(1), and one F(2) atom. S(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one Cs(1) and one S(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Cs(1), one Sb(1), and one S(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to two equivalent Cs(1), one Sb(1), and one S(1) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to two equivalent Cs(1) and one S(1) atom. There are two inequivalent F sites. In the first F site, F(2) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one Sb(1) atom. In the second F site, F(1) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one Sb(1) atom. is represented by the CIF card [CIF]
data_CsSbS(O2F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.467
_cell_length_b   10.137
_cell_length_c   11.694
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   648.128
_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  0.614  0.014  0.161  1.0
  Cs  Cs1  1  0.114  0.986  0.839  1.0
  Cs  Cs2  1  0.614  0.514  0.339  1.0
  Cs  Cs3  1  0.114  0.486  0.661  1.0
  Sb  Sb4  1  0.104  0.327  0.081  1.0
  Sb  Sb5  1  0.604  0.673  0.919  1.0
  Sb  Sb6  1  0.104  0.827  0.419  1.0
  Sb  Sb7  1  0.604  0.173  0.581  1.0
  S  S8  1  0.164  0.203  0.366  1.0
  S  S9  1  0.664  0.797  0.634  1.0
  S  S10  1  0.164  0.703  0.134  1.0
  S  S11  1  0.664  0.297  0.866  1.0
  O  O12  1  0.012  0.087  0.338  1.0
  O  O13  1  0.512  0.913  0.662  1.0
  O  O14  1  0.012  0.587  0.162  1.0
  O  O15  1  0.512  0.413  0.838  1.0
  O  O16  1  0.400  0.151  0.422  1.0
  O  O17  1  0.900  0.849  0.578  1.0
  O  O18  1  0.400  0.651  0.078  1.0
  O  O19  1  0.900  0.349  0.922  1.0
  O  O20  1  0.255  0.269  0.257  1.0
  O  O21  1  0.755  0.731  0.743  1.0
  O  O22  1  0.255  0.769  0.243  1.0
  O  O23  1  0.755  0.231  0.757  1.0
  O  O24  1  0.040  0.299  0.439  1.0
  O  O25  1  0.540  0.701  0.561  1.0
  O  O26  1  0.040  0.799  0.061  1.0
  O  O27  1  0.540  0.201  0.939  1.0
  F  F28  1  0.080  0.134  0.062  1.0
  F  F29  1  0.580  0.866  0.938  1.0
  F  F30  1  0.080  0.634  0.438  1.0
  F  F31  1  0.580  0.366  0.562  1.0
  F  F32  1  0.284  0.178  0.655  1.0
  F  F33  1  0.784  0.822  0.345  1.0
  F  F34  1  0.284  0.678  0.845  1.0
  F  F35  1  0.784  0.322  0.155  1.0
[/CIF]
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The structure described by CsSbS(O2F)2 crystallizes in the orthorhombic Pna2_1 space group. Cs(1) is bonded in a 11-coordinate geometry to one O(1), one O(2), two equivalent O(3), two equivalent O(4), two equivalent F(2), and three equivalent F(1) atoms. Sb(1) is bonded in a distorted rectangular see-saw-like geometry to one O(2), one O(3), one F(1), and one F(2) atom. S(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one Cs(1) and one S(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Cs(1), one Sb(1), and one S(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to two equivalent Cs(1), one Sb(1), and one S(1) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to two equivalent Cs(1) and one S(1) atom. There are two inequivalent F sites. In the first F site, F(2) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one Sb(1) atom. In the second F site, F(1) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one Sb(1) atom. is represented by the CIF card [CIF]
data_CsSbS(O2F)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.467
_cell_length_b   10.137
_cell_length_c   11.694
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   648.128
_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  0.614  0.014  0.161  1.0
  Cs  Cs1  1  0.114  0.986  0.839  1.0
  Cs  Cs2  1  0.614  0.514  0.339  1.0
  Cs  Cs3  1  0.114  0.486  0.661  1.0
  Sb  Sb4  1  0.104  0.327  0.081  1.0
  Sb  Sb5  1  0.604  0.673  0.919  1.0
  Sb  Sb6  1  0.104  0.827  0.419  1.0
  Sb  Sb7  1  0.604  0.173  0.581  1.0
  S  S8  1  0.164  0.203  0.366  1.0
  S  S9  1  0.664  0.797  0.634  1.0
  S  S10  1  0.164  0.703  0.134  1.0
  S  S11  1  0.664  0.297  0.866  1.0
  O  O12  1  0.012  0.087  0.338  1.0
  O  O13  1  0.512  0.913  0.662  1.0
  O  O14  1  0.012  0.587  0.162  1.0
  O  O15  1  0.512  0.413  0.838  1.0
  O  O16  1  0.400  0.151  0.422  1.0
  O  O17  1  0.900  0.849  0.578  1.0
  O  O18  1  0.400  0.651  0.078  1.0
  O  O19  1  0.900  0.349  0.922  1.0
  O  O20  1  0.255  0.269  0.257  1.0
  O  O21  1  0.755  0.731  0.743  1.0
  O  O22  1  0.255  0.769  0.243  1.0
  O  O23  1  0.755  0.231  0.757  1.0
  O  O24  1  0.040  0.299  0.439  1.0
  O  O25  1  0.540  0.701  0.561  1.0
  O  O26  1  0.040  0.799  0.061  1.0
  O  O27  1  0.540  0.201  0.939  1.0
  F  F28  1  0.080  0.134  0.062  1.0
  F  F29  1  0.580  0.866  0.938  1.0
  F  F30  1  0.080  0.634  0.438  1.0
  F  F31  1  0.580  0.366  0.562  1.0
  F  F32  1  0.284  0.178  0.655  1.0
  F  F33  1  0.784  0.822  0.345  1.0
  F  F34  1  0.284  0.678  0.845  1.0
  F  F35  1  0.784  0.322  0.155  1.0
[/CIF]
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