The material structure described by BaPb3(NO3)8 crystallizes in the trigonal R-3 space group. Ba(1) is bonded in a cuboctahedral geometry to six equivalent O(2) and six equivalent O(4) atoms. Pb(1) is bonded in a 12-coordinate geometry to two equivalent O(2), two equivalent O(4), four equivalent O(1), and four equivalent O(3) atoms. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one O(2), one O(3), and one O(4) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to three equivalent O(1) atoms. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to two equivalent Pb(1) and one N(2) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Ba(1), one Pb(1), and one N(1) atom. In the third O site, O(3) is bonded in a single-bond geometry to two equivalent Pb(1) and one N(1) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to one Ba(1), one Pb(1), and one N(1) atom. is represented by the CIF card [CIF]
data_BaPb3(NO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.030
_cell_length_b   8.030
_cell_length_c   8.030
_cell_angle_alpha   90.092
_cell_angle_beta   90.092
_cell_angle_gamma   90.092
_symmetry_Int_Tables_number   1
_cell_volume   517.698
_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
  Ba  Ba0  1  0.500  0.500  0.500  1.0
  Pb  Pb1  1  0.500  0.000  0.000  1.0
  Pb  Pb2  1  0.000  0.000  0.500  1.0
  Pb  Pb3  1  0.000  0.500  0.000  1.0
  N  N4  1  0.653  0.853  0.347  1.0
  N  N5  1  0.347  0.147  0.653  1.0
  N  N6  1  0.151  0.151  0.151  1.0
  N  N7  1  0.853  0.347  0.653  1.0
  N  N8  1  0.347  0.653  0.853  1.0
  N  N9  1  0.849  0.849  0.849  1.0
  N  N10  1  0.147  0.653  0.347  1.0
  N  N11  1  0.653  0.347  0.147  1.0
  O  O12  1  0.022  0.211  0.220  1.0
  O  O13  1  0.786  0.477  0.714  1.0
  O  O14  1  0.287  0.721  0.981  1.0
  O  O15  1  0.978  0.789  0.780  1.0
  O  O16  1  0.214  0.523  0.286  1.0
  O  O17  1  0.713  0.279  0.019  1.0
  O  O18  1  0.220  0.022  0.211  1.0
  O  O19  1  0.791  0.279  0.523  1.0
  O  O20  1  0.477  0.714  0.786  1.0
  O  O21  1  0.780  0.978  0.789  1.0
  O  O22  1  0.209  0.721  0.477  1.0
  O  O23  1  0.523  0.286  0.214  1.0
  O  O24  1  0.211  0.220  0.022  1.0
  O  O25  1  0.981  0.287  0.721  1.0
  O  O26  1  0.279  0.523  0.791  1.0
  O  O27  1  0.789  0.780  0.978  1.0
  O  O28  1  0.019  0.713  0.279  1.0
  O  O29  1  0.721  0.477  0.209  1.0
  O  O30  1  0.721  0.981  0.287  1.0
  O  O31  1  0.714  0.786  0.477  1.0
  O  O32  1  0.523  0.791  0.279  1.0
  O  O33  1  0.279  0.019  0.713  1.0
  O  O34  1  0.286  0.214  0.523  1.0
  O  O35  1  0.477  0.209  0.721  1.0
[/CIF]
.
The material structure described by BaPb3(NO3)8 crystallizes in the trigonal R-3 space group. Ba(1) is bonded in a cuboctahedral geometry to six equivalent O(2) and six equivalent O(4) atoms. Pb(1) is bonded in a 12-coordinate geometry to two equivalent O(2), two equivalent O(4), four equivalent O(1), and four equivalent O(3) atoms. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one O(2), one O(3), and one O(4) atom. In the second N site, N(2) is bonded in a trigonal planar geometry to three equivalent O(1) atoms. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to two equivalent Pb(1) and one N(2) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Ba(1), one Pb(1), and one N(1) atom. In the third O site, O(3) is bonded in a single-bond geometry to two equivalent Pb(1) and one N(1) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to one Ba(1), one Pb(1), and one N(1) atom. is represented by the CIF card [CIF]
data_BaPb3(NO3)8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.030
_cell_length_b   8.030
_cell_length_c   8.030
_cell_angle_alpha   90.092
_cell_angle_beta   90.092
_cell_angle_gamma   90.092
_symmetry_Int_Tables_number   1
_cell_volume   517.698
_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
  Ba  Ba0  1  0.500  0.500  0.500  1.0
  Pb  Pb1  1  0.500  0.000  0.000  1.0
  Pb  Pb2  1  0.000  0.000  0.500  1.0
  Pb  Pb3  1  0.000  0.500  0.000  1.0
  N  N4  1  0.653  0.853  0.347  1.0
  N  N5  1  0.347  0.147  0.653  1.0
  N  N6  1  0.151  0.151  0.151  1.0
  N  N7  1  0.853  0.347  0.653  1.0
  N  N8  1  0.347  0.653  0.853  1.0
  N  N9  1  0.849  0.849  0.849  1.0
  N  N10  1  0.147  0.653  0.347  1.0
  N  N11  1  0.653  0.347  0.147  1.0
  O  O12  1  0.022  0.211  0.220  1.0
  O  O13  1  0.786  0.477  0.714  1.0
  O  O14  1  0.287  0.721  0.981  1.0
  O  O15  1  0.978  0.789  0.780  1.0
  O  O16  1  0.214  0.523  0.286  1.0
  O  O17  1  0.713  0.279  0.019  1.0
  O  O18  1  0.220  0.022  0.211  1.0
  O  O19  1  0.791  0.279  0.523  1.0
  O  O20  1  0.477  0.714  0.786  1.0
  O  O21  1  0.780  0.978  0.789  1.0
  O  O22  1  0.209  0.721  0.477  1.0
  O  O23  1  0.523  0.286  0.214  1.0
  O  O24  1  0.211  0.220  0.022  1.0
  O  O25  1  0.981  0.287  0.721  1.0
  O  O26  1  0.279  0.523  0.791  1.0
  O  O27  1  0.789  0.780  0.978  1.0
  O  O28  1  0.019  0.713  0.279  1.0
  O  O29  1  0.721  0.477  0.209  1.0
  O  O30  1  0.721  0.981  0.287  1.0
  O  O31  1  0.714  0.786  0.477  1.0
  O  O32  1  0.523  0.791  0.279  1.0
  O  O33  1  0.279  0.019  0.713  1.0
  O  O34  1  0.286  0.214  0.523  1.0
  O  O35  1  0.477  0.209  0.721  1.0
[/CIF]
.