The compound described by KV2P2H4O13 crystallizes in the triclinic P-1 space group. K(1) is bonded in a 12-coordinate geometry to two equivalent H(2), two equivalent O(2), two equivalent O(4), two equivalent O(5), two equivalent O(6), and two equivalent O(7) atoms. V(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. P(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one O(5) atom. In the second H site, H(2) is bonded in a single-bond geometry to one K(1) and one O(5) atom. There are seven inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one V(1) and one P(1) atom. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one K(1), one V(1), and one P(1) atom. In the third O site, O(3) is bonded in a distorted bent 150 degrees geometry to one V(1) and one P(1) atom. In the fourth O site, O(4) is bonded in a 2-coordinate geometry to one K(1), one V(1), and one P(1) atom. In the fifth O site, O(5) is bonded in a distorted water-like geometry to one K(1), one V(1), one H(1), and one H(2) atom. In the sixth O site, O(6) is bonded in a single-bond geometry to one K(1) and one V(1) atom. In the seventh O site, O(7) is bonded in a 4-coordinate geometry to two equivalent K(1) atoms. is represented by the CIF card [CIF]
data_KV2P2H4O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.257
_cell_length_b   6.297
_cell_length_c   6.917
_cell_angle_alpha   89.932
_cell_angle_beta   105.928
_cell_angle_gamma   91.071
_symmetry_Int_Tables_number   1
_cell_volume   262.007
_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  0.000  0.000  0.000  1.0
  V  V1  1  0.286  0.755  0.598  1.0
  V  V2  1  0.714  0.245  0.402  1.0
  P  P3  1  0.250  0.250  0.501  1.0
  P  P4  1  0.750  0.750  0.499  1.0
  H  H5  1  0.507  0.725  0.036  1.0
  H  H6  1  0.493  0.275  0.964  1.0
  H  H7  1  0.254  0.636  0.983  1.0
  H  H8  1  0.746  0.364  0.017  1.0
  O  O9  1  0.288  0.061  0.649  1.0
  O  O10  1  0.712  0.939  0.351  1.0
  O  O11  1  0.605  0.769  0.647  1.0
  O  O12  1  0.395  0.231  0.353  1.0
  O  O13  1  0.307  0.450  0.636  1.0
  O  O14  1  0.693  0.550  0.364  1.0
  O  O15  1  0.991  0.747  0.636  1.0
  O  O16  1  0.009  0.253  0.364  1.0
  O  O17  1  0.359  0.740  0.943  1.0
  O  O18  1  0.641  0.260  0.057  1.0
  O  O19  1  0.216  0.760  0.356  1.0
  O  O20  1  0.784  0.240  0.644  1.0
  O  O21  1  0.000  0.500  0.000  1.0
[/CIF]
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The compound described by KV2P2H4O13 crystallizes in the triclinic P-1 space group. K(1) is bonded in a 12-coordinate geometry to two equivalent H(2), two equivalent O(2), two equivalent O(4), two equivalent O(5), two equivalent O(6), and two equivalent O(7) atoms. V(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom. P(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. There are two inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one O(5) atom. In the second H site, H(2) is bonded in a single-bond geometry to one K(1) and one O(5) atom. There are seven inequivalent O sites. In the first O site, O(1) is bonded in a distorted bent 120 degrees geometry to one V(1) and one P(1) atom. In the second O site, O(2) is bonded in a distorted bent 120 degrees geometry to one K(1), one V(1), and one P(1) atom. In the third O site, O(3) is bonded in a distorted bent 150 degrees geometry to one V(1) and one P(1) atom. In the fourth O site, O(4) is bonded in a 2-coordinate geometry to one K(1), one V(1), and one P(1) atom. In the fifth O site, O(5) is bonded in a distorted water-like geometry to one K(1), one V(1), one H(1), and one H(2) atom. In the sixth O site, O(6) is bonded in a single-bond geometry to one K(1) and one V(1) atom. In the seventh O site, O(7) is bonded in a 4-coordinate geometry to two equivalent K(1) atoms. is represented by the CIF card [CIF]
data_KV2P2H4O13
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.257
_cell_length_b   6.297
_cell_length_c   6.917
_cell_angle_alpha   89.932
_cell_angle_beta   105.928
_cell_angle_gamma   91.071
_symmetry_Int_Tables_number   1
_cell_volume   262.007
_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  0.000  0.000  0.000  1.0
  V  V1  1  0.286  0.755  0.598  1.0
  V  V2  1  0.714  0.245  0.402  1.0
  P  P3  1  0.250  0.250  0.501  1.0
  P  P4  1  0.750  0.750  0.499  1.0
  H  H5  1  0.507  0.725  0.036  1.0
  H  H6  1  0.493  0.275  0.964  1.0
  H  H7  1  0.254  0.636  0.983  1.0
  H  H8  1  0.746  0.364  0.017  1.0
  O  O9  1  0.288  0.061  0.649  1.0
  O  O10  1  0.712  0.939  0.351  1.0
  O  O11  1  0.605  0.769  0.647  1.0
  O  O12  1  0.395  0.231  0.353  1.0
  O  O13  1  0.307  0.450  0.636  1.0
  O  O14  1  0.693  0.550  0.364  1.0
  O  O15  1  0.991  0.747  0.636  1.0
  O  O16  1  0.009  0.253  0.364  1.0
  O  O17  1  0.359  0.740  0.943  1.0
  O  O18  1  0.641  0.260  0.057  1.0
  O  O19  1  0.216  0.760  0.356  1.0
  O  O20  1  0.784  0.240  0.644  1.0
  O  O21  1  0.000  0.500  0.000  1.0
[/CIF]
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