The material described by NaP3(PbO3)4 crystallizes in the hexagonal P6_3 space group. Na(1) is bonded in a 6-coordinate geometry to three equivalent O(3) and three equivalent O(4) atoms. There are two inequivalent Pb sites. In the first Pb site, Pb(1) is bonded in a 6-coordinate geometry to one O(3), one O(4), two equivalent O(1), and two equivalent O(2) atoms. In the second Pb site, Pb(2) is bonded in a 6-coordinate geometry to three equivalent O(3) and three equivalent O(4) atoms. 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 four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Pb(1) and one P(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Pb(1) and one P(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to one Na(1), one Pb(1), one Pb(2), and one P(1) atom. In the fourth O site, O(4) is bonded in a 1-coordinate geometry to one Na(1), one Pb(1), one Pb(2), and one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaP3(PbO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.870
_cell_length_b   9.870
_cell_length_c   7.325
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   618.013
_cell_formula_units_Z   2
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
  Na  Na0  1  0.333  0.667  0.506  1.0
  Na  Na1  1  0.667  0.333  0.006  1.0
  P  P2  1  0.021  0.396  0.251  1.0
  P  P3  1  0.375  0.979  0.251  1.0
  P  P4  1  0.396  0.375  0.751  1.0
  P  P5  1  0.604  0.625  0.251  1.0
  P  P6  1  0.625  0.021  0.751  1.0
  P  P7  1  0.979  0.604  0.751  1.0
  Pb  Pb8  1  0.259  0.001  0.750  1.0
  Pb  Pb9  1  0.999  0.257  0.750  1.0
  Pb  Pb10  1  0.333  0.667  0.989  1.0
  Pb  Pb11  1  0.257  0.259  0.250  1.0
  Pb  Pb12  1  0.743  0.741  0.750  1.0
  Pb  Pb13  1  0.667  0.333  0.489  1.0
  Pb  Pb14  1  0.001  0.743  0.250  1.0
  Pb  Pb15  1  0.741  0.999  0.250  1.0
  O  O16  1  0.266  0.918  0.079  1.0
  O  O17  1  0.263  0.924  0.419  1.0
  O  O18  1  0.104  0.579  0.256  1.0
  O  O19  1  0.159  0.677  0.746  1.0
  O  O20  1  0.082  0.349  0.079  1.0
  O  O21  1  0.076  0.339  0.419  1.0
  O  O22  1  0.475  0.896  0.256  1.0
  O  O23  1  0.323  0.482  0.746  1.0
  O  O24  1  0.518  0.841  0.746  1.0
  O  O25  1  0.421  0.525  0.256  1.0
  O  O26  1  0.349  0.266  0.579  1.0
  O  O27  1  0.339  0.263  0.919  1.0
  O  O28  1  0.651  0.734  0.079  1.0
  O  O29  1  0.661  0.737  0.419  1.0
  O  O30  1  0.579  0.475  0.756  1.0
  O  O31  1  0.482  0.159  0.246  1.0
  O  O32  1  0.677  0.518  0.246  1.0
  O  O33  1  0.525  0.104  0.756  1.0
  O  O34  1  0.918  0.651  0.579  1.0
  O  O35  1  0.924  0.661  0.919  1.0
  O  O36  1  0.841  0.323  0.246  1.0
  O  O37  1  0.896  0.421  0.756  1.0
  O  O38  1  0.734  0.082  0.579  1.0
  O  O39  1  0.737  0.076  0.919  1.0
[/CIF]
.
The material described by NaP3(PbO3)4 crystallizes in the hexagonal P6_3 space group. Na(1) is bonded in a 6-coordinate geometry to three equivalent O(3) and three equivalent O(4) atoms. There are two inequivalent Pb sites. In the first Pb site, Pb(1) is bonded in a 6-coordinate geometry to one O(3), one O(4), two equivalent O(1), and two equivalent O(2) atoms. In the second Pb site, Pb(2) is bonded in a 6-coordinate geometry to three equivalent O(3) and three equivalent O(4) atoms. 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 four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to two equivalent Pb(1) and one P(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to two equivalent Pb(1) and one P(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to one Na(1), one Pb(1), one Pb(2), and one P(1) atom. In the fourth O site, O(4) is bonded in a 1-coordinate geometry to one Na(1), one Pb(1), one Pb(2), and one P(1) atom. is represented by the Crystallographic Information File (CIF) [CIF]
data_NaP3(PbO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.870
_cell_length_b   9.870
_cell_length_c   7.325
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   120.000
_symmetry_Int_Tables_number   1
_cell_volume   618.013
_cell_formula_units_Z   2
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
  Na  Na0  1  0.333  0.667  0.506  1.0
  Na  Na1  1  0.667  0.333  0.006  1.0
  P  P2  1  0.021  0.396  0.251  1.0
  P  P3  1  0.375  0.979  0.251  1.0
  P  P4  1  0.396  0.375  0.751  1.0
  P  P5  1  0.604  0.625  0.251  1.0
  P  P6  1  0.625  0.021  0.751  1.0
  P  P7  1  0.979  0.604  0.751  1.0
  Pb  Pb8  1  0.259  0.001  0.750  1.0
  Pb  Pb9  1  0.999  0.257  0.750  1.0
  Pb  Pb10  1  0.333  0.667  0.989  1.0
  Pb  Pb11  1  0.257  0.259  0.250  1.0
  Pb  Pb12  1  0.743  0.741  0.750  1.0
  Pb  Pb13  1  0.667  0.333  0.489  1.0
  Pb  Pb14  1  0.001  0.743  0.250  1.0
  Pb  Pb15  1  0.741  0.999  0.250  1.0
  O  O16  1  0.266  0.918  0.079  1.0
  O  O17  1  0.263  0.924  0.419  1.0
  O  O18  1  0.104  0.579  0.256  1.0
  O  O19  1  0.159  0.677  0.746  1.0
  O  O20  1  0.082  0.349  0.079  1.0
  O  O21  1  0.076  0.339  0.419  1.0
  O  O22  1  0.475  0.896  0.256  1.0
  O  O23  1  0.323  0.482  0.746  1.0
  O  O24  1  0.518  0.841  0.746  1.0
  O  O25  1  0.421  0.525  0.256  1.0
  O  O26  1  0.349  0.266  0.579  1.0
  O  O27  1  0.339  0.263  0.919  1.0
  O  O28  1  0.651  0.734  0.079  1.0
  O  O29  1  0.661  0.737  0.419  1.0
  O  O30  1  0.579  0.475  0.756  1.0
  O  O31  1  0.482  0.159  0.246  1.0
  O  O32  1  0.677  0.518  0.246  1.0
  O  O33  1  0.525  0.104  0.756  1.0
  O  O34  1  0.918  0.651  0.579  1.0
  O  O35  1  0.924  0.661  0.919  1.0
  O  O36  1  0.841  0.323  0.246  1.0
  O  O37  1  0.896  0.421  0.756  1.0
  O  O38  1  0.734  0.082  0.579  1.0
  O  O39  1  0.737  0.076  0.919  1.0
[/CIF]
.