The material described by CsP(HO)2 crystallizes in the orthorhombic Pnma space group. Cs(1) is bonded in a 8-coordinate geometry to one H(1), one H(2), and six equivalent O(1) atoms. P(1) is bonded in a distorted tetrahedral geometry to one H(1), one H(2), and two equivalent O(1) atoms. There are two inequivalent H sites. In the first H site, H(1) is bonded in a distorted single-bond geometry to one Cs(1) and one P(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one Cs(1) and one P(1) atom. O(1) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one P(1) atom. is represented by the CIF file [CIF]
data_CsP(HO)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.665
_cell_length_b   7.958
_cell_length_c   8.385
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   444.684
_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  0.250  0.364  0.134  1.0
  Cs  Cs1  1  0.250  0.136  0.634  1.0
  Cs  Cs2  1  0.750  0.636  0.866  1.0
  Cs  Cs3  1  0.750  0.864  0.366  1.0
  P  P4  1  0.750  0.171  0.889  1.0
  P  P5  1  0.750  0.329  0.389  1.0
  P  P6  1  0.250  0.829  0.111  1.0
  P  P7  1  0.250  0.671  0.611  1.0
  H  H8  1  0.750  0.067  0.026  1.0
  H  H9  1  0.750  0.433  0.526  1.0
  H  H10  1  0.250  0.933  0.974  1.0
  H  H11  1  0.250  0.567  0.474  1.0
  H  H12  1  0.750  0.049  0.764  1.0
  H  H13  1  0.750  0.451  0.264  1.0
  H  H14  1  0.250  0.951  0.236  1.0
  H  H15  1  0.250  0.549  0.736  1.0
  O  O16  1  0.556  0.267  0.882  1.0
  O  O17  1  0.944  0.233  0.382  1.0
  O  O18  1  0.056  0.733  0.118  1.0
  O  O19  1  0.444  0.767  0.618  1.0
  O  O20  1  0.444  0.733  0.118  1.0
  O  O21  1  0.056  0.767  0.618  1.0
  O  O22  1  0.944  0.267  0.882  1.0
  O  O23  1  0.556  0.233  0.382  1.0
[/CIF]
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The material described by CsP(HO)2 crystallizes in the orthorhombic Pnma space group. Cs(1) is bonded in a 8-coordinate geometry to one H(1), one H(2), and six equivalent O(1) atoms. P(1) is bonded in a distorted tetrahedral geometry to one H(1), one H(2), and two equivalent O(1) atoms. There are two inequivalent H sites. In the first H site, H(1) is bonded in a distorted single-bond geometry to one Cs(1) and one P(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one Cs(1) and one P(1) atom. O(1) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one P(1) atom. is represented by the CIF file [CIF]
data_CsP(HO)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.665
_cell_length_b   7.958
_cell_length_c   8.385
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   444.684
_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  0.250  0.364  0.134  1.0
  Cs  Cs1  1  0.250  0.136  0.634  1.0
  Cs  Cs2  1  0.750  0.636  0.866  1.0
  Cs  Cs3  1  0.750  0.864  0.366  1.0
  P  P4  1  0.750  0.171  0.889  1.0
  P  P5  1  0.750  0.329  0.389  1.0
  P  P6  1  0.250  0.829  0.111  1.0
  P  P7  1  0.250  0.671  0.611  1.0
  H  H8  1  0.750  0.067  0.026  1.0
  H  H9  1  0.750  0.433  0.526  1.0
  H  H10  1  0.250  0.933  0.974  1.0
  H  H11  1  0.250  0.567  0.474  1.0
  H  H12  1  0.750  0.049  0.764  1.0
  H  H13  1  0.750  0.451  0.264  1.0
  H  H14  1  0.250  0.951  0.236  1.0
  H  H15  1  0.250  0.549  0.736  1.0
  O  O16  1  0.556  0.267  0.882  1.0
  O  O17  1  0.944  0.233  0.382  1.0
  O  O18  1  0.056  0.733  0.118  1.0
  O  O19  1  0.444  0.767  0.618  1.0
  O  O20  1  0.444  0.733  0.118  1.0
  O  O21  1  0.056  0.767  0.618  1.0
  O  O22  1  0.944  0.267  0.882  1.0
  O  O23  1  0.556  0.233  0.382  1.0
[/CIF]
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