The compound described by K4PH5S3O16 crystallizes in the triclinic P1 space group. There are four inequivalent K sites. In the first K site, K(1) is bonded in a 9-coordinate geometry to one H(2), one O(1), one O(12), one O(2), one O(3), one O(4), one O(5), one O(7), and one O(9) atom. In the second K site, K(2) is bonded in a 6-coordinate geometry to one O(10), one O(13), one O(2), one O(6), one O(7), and one O(9) atom. In the third K site, K(3) is bonded in a 6-coordinate geometry to one O(10), one O(11), one O(15), one O(4), one O(7), and one O(8) atom. In the fourth K site, K(4) is bonded in a 9-coordinate geometry to one H(5), one O(10), one O(12), one O(13), one O(14), one O(15), one O(16), one O(5), and one O(8) atom. P(1) is bonded in a tetrahedral geometry to one O(1), one O(13), one O(14), and one O(2) atom. There are five inequivalent H sites. In the first H site, H(1) is bonded in a linear geometry to one O(1) and one O(16) atom. In the second H site, H(2) is bonded in a distorted linear geometry to one K(1), one O(2), and one O(4) atom. In the third H site, H(3) is bonded in a distorted single-bond geometry to one O(3) and one O(6) atom. In the fourth H site, H(4) is bonded in a linear geometry to one O(11) and one O(14) atom. In the fifth H site, H(5) is bonded in a distorted linear geometry to one K(4), one O(13), and one O(15) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a tetrahedral geometry to one O(15), one O(16), one O(3), and one O(4) atom. In the second S site, S(2) is bonded in a tetrahedral geometry to one O(10), one O(5), one O(6), and one O(8) atom. In the third S site, S(3) is bonded in a tetrahedral geometry to one O(11), one O(12), one O(7), and one O(9) atom. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one K(1), one P(1), and one H(1) atom. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one K(1), one K(2), one P(1), and one H(2) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one K(1), one H(3), and one S(1) atom. In the fourth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one K(1), one K(3), one H(2), and one S(1) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one K(1), one K(4), and one S(2) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one K(2), one H(3), and one S(2) atom. In the seventh O site, O(7) is bonded in a distorted single-bond geometry to one K(1), one K(2), one K(3), and one S(3) atom. In the eighth O site, O(8) is bonded in a 1-coordinate geometry to one K(3), one K(4), and one S(2) atom. In the ninth O site, O(9) is bonded in a 1-coordinate geometry to one K(1), one K(2), and one S(3) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one K(2), one K(3), one K(4), and one S(2) atom. In the eleventh O site, O(11) is bonded in a 2-coordinate geometry to one K(3), one H(4), and one S(3) atom. In the twelfth O site, O(12) is bonded in a distorted single-bond geometry to one K(1), one K(4), and one S(3) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 120 degrees geometry to one K(2), one K(4), one P(1), and one H(5) atom. In the fourteenth O site, O(14) is bonded in a distorted bent 120 degrees geometry to one K(4), one P(1), and one H(4) atom. In the fifteenth O site, O(15) is bonded in a distorted bent 120 degrees geometry to one K(3), one K(4), one H(5), and one S(1) atom. In the sixteenth O site, O(16) is bonded in a distorted bent 120 degrees geometry to one K(4), one H(1), and one S(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_K4PH5S3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.387
_cell_length_b   7.618
_cell_length_c   7.645
_cell_angle_alpha   70.786
_cell_angle_beta   87.855
_cell_angle_gamma   85.528
_symmetry_Int_Tables_number   1
_cell_volume   404.990
_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
  K  K0  1  0.162  0.187  0.336  1.0
  K  K1  1  0.465  0.257  0.777  1.0
  K  K2  1  0.537  0.743  0.224  1.0
  K  K3  1  0.838  0.809  0.664  1.0
  P  P4  1  0.960  0.277  0.809  1.0
  H  H5  1  0.010  0.473  0.525  1.0
  H  H6  1  0.121  0.055  0.045  1.0
  H  H7  1  0.251  0.581  0.966  1.0
  H  H8  1  0.750  0.421  0.031  1.0
  H  H9  1  0.869  0.989  0.916  1.0
  S  S10  1  0.036  0.724  0.198  1.0
  S  S11  1  0.373  0.780  0.723  1.0
  S  S12  1  0.627  0.221  0.276  1.0
  O  O13  1  0.059  0.347  0.616  1.0
  O  O14  1  0.116  0.194  0.952  1.0
  O  O15  1  0.155  0.569  0.169  1.0
  O  O16  1  0.149  0.882  0.190  1.0
  O  O17  1  0.206  0.897  0.660  1.0
  O  O18  1  0.314  0.577  0.847  1.0
  O  O19  1  0.519  0.150  0.158  1.0
  O  O20  1  0.482  0.738  0.576  1.0
  O  O21  1  0.517  0.263  0.423  1.0
  O  O22  1  0.481  0.849  0.842  1.0
  O  O23  1  0.685  0.422  0.152  1.0
  O  O24  1  0.794  0.104  0.340  1.0
  O  O25  1  0.844  0.112  0.807  1.0
  O  O26  1  0.841  0.432  0.844  1.0
  O  O27  1  0.894  0.792  0.052  1.0
  O  O28  1  0.944  0.657  0.383  1.0
[/CIF]
.
The compound described by K4PH5S3O16 crystallizes in the triclinic P1 space group. There are four inequivalent K sites. In the first K site, K(1) is bonded in a 9-coordinate geometry to one H(2), one O(1), one O(12), one O(2), one O(3), one O(4), one O(5), one O(7), and one O(9) atom. In the second K site, K(2) is bonded in a 6-coordinate geometry to one O(10), one O(13), one O(2), one O(6), one O(7), and one O(9) atom. In the third K site, K(3) is bonded in a 6-coordinate geometry to one O(10), one O(11), one O(15), one O(4), one O(7), and one O(8) atom. In the fourth K site, K(4) is bonded in a 9-coordinate geometry to one H(5), one O(10), one O(12), one O(13), one O(14), one O(15), one O(16), one O(5), and one O(8) atom. P(1) is bonded in a tetrahedral geometry to one O(1), one O(13), one O(14), and one O(2) atom. There are five inequivalent H sites. In the first H site, H(1) is bonded in a linear geometry to one O(1) and one O(16) atom. In the second H site, H(2) is bonded in a distorted linear geometry to one K(1), one O(2), and one O(4) atom. In the third H site, H(3) is bonded in a distorted single-bond geometry to one O(3) and one O(6) atom. In the fourth H site, H(4) is bonded in a linear geometry to one O(11) and one O(14) atom. In the fifth H site, H(5) is bonded in a distorted linear geometry to one K(4), one O(13), and one O(15) atom. There are three inequivalent S sites. In the first S site, S(1) is bonded in a tetrahedral geometry to one O(15), one O(16), one O(3), and one O(4) atom. In the second S site, S(2) is bonded in a tetrahedral geometry to one O(10), one O(5), one O(6), and one O(8) atom. In the third S site, S(3) is bonded in a tetrahedral geometry to one O(11), one O(12), one O(7), and one O(9) atom. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one K(1), one P(1), and one H(1) atom. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one K(1), one K(2), one P(1), and one H(2) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one K(1), one H(3), and one S(1) atom. In the fourth O site, O(4) is bonded in a distorted bent 120 degrees geometry to one K(1), one K(3), one H(2), and one S(1) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one K(1), one K(4), and one S(2) atom. In the sixth O site, O(6) is bonded in a 2-coordinate geometry to one K(2), one H(3), and one S(2) atom. In the seventh O site, O(7) is bonded in a distorted single-bond geometry to one K(1), one K(2), one K(3), and one S(3) atom. In the eighth O site, O(8) is bonded in a 1-coordinate geometry to one K(3), one K(4), and one S(2) atom. In the ninth O site, O(9) is bonded in a 1-coordinate geometry to one K(1), one K(2), and one S(3) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one K(2), one K(3), one K(4), and one S(2) atom. In the eleventh O site, O(11) is bonded in a 2-coordinate geometry to one K(3), one H(4), and one S(3) atom. In the twelfth O site, O(12) is bonded in a distorted single-bond geometry to one K(1), one K(4), and one S(3) atom. In the thirteenth O site, O(13) is bonded in a distorted bent 120 degrees geometry to one K(2), one K(4), one P(1), and one H(5) atom. In the fourteenth O site, O(14) is bonded in a distorted bent 120 degrees geometry to one K(4), one P(1), and one H(4) atom. In the fifteenth O site, O(15) is bonded in a distorted bent 120 degrees geometry to one K(3), one K(4), one H(5), and one S(1) atom. In the sixteenth O site, O(16) is bonded in a distorted bent 120 degrees geometry to one K(4), one H(1), and one S(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_K4PH5S3O16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.387
_cell_length_b   7.618
_cell_length_c   7.645
_cell_angle_alpha   70.786
_cell_angle_beta   87.855
_cell_angle_gamma   85.528
_symmetry_Int_Tables_number   1
_cell_volume   404.990
_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
  K  K0  1  0.162  0.187  0.336  1.0
  K  K1  1  0.465  0.257  0.777  1.0
  K  K2  1  0.537  0.743  0.224  1.0
  K  K3  1  0.838  0.809  0.664  1.0
  P  P4  1  0.960  0.277  0.809  1.0
  H  H5  1  0.010  0.473  0.525  1.0
  H  H6  1  0.121  0.055  0.045  1.0
  H  H7  1  0.251  0.581  0.966  1.0
  H  H8  1  0.750  0.421  0.031  1.0
  H  H9  1  0.869  0.989  0.916  1.0
  S  S10  1  0.036  0.724  0.198  1.0
  S  S11  1  0.373  0.780  0.723  1.0
  S  S12  1  0.627  0.221  0.276  1.0
  O  O13  1  0.059  0.347  0.616  1.0
  O  O14  1  0.116  0.194  0.952  1.0
  O  O15  1  0.155  0.569  0.169  1.0
  O  O16  1  0.149  0.882  0.190  1.0
  O  O17  1  0.206  0.897  0.660  1.0
  O  O18  1  0.314  0.577  0.847  1.0
  O  O19  1  0.519  0.150  0.158  1.0
  O  O20  1  0.482  0.738  0.576  1.0
  O  O21  1  0.517  0.263  0.423  1.0
  O  O22  1  0.481  0.849  0.842  1.0
  O  O23  1  0.685  0.422  0.152  1.0
  O  O24  1  0.794  0.104  0.340  1.0
  O  O25  1  0.844  0.112  0.807  1.0
  O  O26  1  0.841  0.432  0.844  1.0
  O  O27  1  0.894  0.792  0.052  1.0
  O  O28  1  0.944  0.657  0.383  1.0
[/CIF]
.