The material structure described by Cs2Sn(HO2)6 crystallizes in the trigonal P-3 space group. Cs(1) is bonded in a 9-coordinate geometry to three equivalent O(1) and six equivalent O(2) atoms. Sn(1) is bonded in an octahedral geometry to six equivalent O(1) atoms. H(1) is bonded in a distorted linear geometry to one O(1) and one O(2) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a 2-coordinate geometry to one Cs(1), one Sn(1), and one H(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to two equivalent Cs(1) and one H(1) atom. is represented by the CIF file [CIF]
data_Cs2Sn(HO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.863
_cell_length_b   7.863
_cell_length_c   5.100
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   273.023
_cell_formula_units_Z   1
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  0.333  0.667  0.379  1.0
  Cs  Cs1  1  0.667  0.333  0.621  1.0
  Sn  Sn2  1  0.000  0.000  0.500  1.0
  H  H3  1  0.272  0.284  1.000  1.0
  H  H4  1  0.012  0.728  1.000  1.0
  H  H5  1  0.716  0.988  1.000  1.0
  H  H6  1  0.728  0.716  0.000  1.0
  H  H7  1  0.988  0.272  0.000  1.0
  H  H8  1  0.284  0.012  0.000  1.0
  O  O9  1  0.084  0.258  0.729  1.0
  O  O10  1  0.174  0.916  0.729  1.0
  O  O11  1  0.742  0.826  0.729  1.0
  O  O12  1  0.916  0.742  0.271  1.0
  O  O13  1  0.826  0.084  0.271  1.0
  O  O14  1  0.258  0.174  0.271  1.0
  O  O15  1  0.289  0.350  0.822  1.0
  O  O16  1  0.061  0.711  0.822  1.0
  O  O17  1  0.650  0.939  0.822  1.0
  O  O18  1  0.711  0.650  0.178  1.0
  O  O19  1  0.939  0.289  0.178  1.0
  O  O20  1  0.350  0.061  0.178  1.0
[/CIF]
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The material structure described by Cs2Sn(HO2)6 crystallizes in the trigonal P-3 space group. Cs(1) is bonded in a 9-coordinate geometry to three equivalent O(1) and six equivalent O(2) atoms. Sn(1) is bonded in an octahedral geometry to six equivalent O(1) atoms. H(1) is bonded in a distorted linear geometry to one O(1) and one O(2) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a 2-coordinate geometry to one Cs(1), one Sn(1), and one H(1) atom. In the second O site, O(2) is bonded in a single-bond geometry to two equivalent Cs(1) and one H(1) atom. is represented by the CIF file [CIF]
data_Cs2Sn(HO2)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.863
_cell_length_b   7.863
_cell_length_c   5.100
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   273.023
_cell_formula_units_Z   1
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  0.333  0.667  0.379  1.0
  Cs  Cs1  1  0.667  0.333  0.621  1.0
  Sn  Sn2  1  0.000  0.000  0.500  1.0
  H  H3  1  0.272  0.284  1.000  1.0
  H  H4  1  0.012  0.728  1.000  1.0
  H  H5  1  0.716  0.988  1.000  1.0
  H  H6  1  0.728  0.716  0.000  1.0
  H  H7  1  0.988  0.272  0.000  1.0
  H  H8  1  0.284  0.012  0.000  1.0
  O  O9  1  0.084  0.258  0.729  1.0
  O  O10  1  0.174  0.916  0.729  1.0
  O  O11  1  0.742  0.826  0.729  1.0
  O  O12  1  0.916  0.742  0.271  1.0
  O  O13  1  0.826  0.084  0.271  1.0
  O  O14  1  0.258  0.174  0.271  1.0
  O  O15  1  0.289  0.350  0.822  1.0
  O  O16  1  0.061  0.711  0.822  1.0
  O  O17  1  0.650  0.939  0.822  1.0
  O  O18  1  0.711  0.650  0.178  1.0
  O  O19  1  0.939  0.289  0.178  1.0
  O  O20  1  0.350  0.061  0.178  1.0
[/CIF]
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