The crystal structure described by PbBiBO4 crystallizes in the monoclinic P2_1/c space group. B(1) is bonded in a trigonal planar geometry to one O(2), one O(3), and one O(4) atom. Pb(1) is bonded in a 4-coordinate geometry to one O(2), one O(3), and two equivalent O(1) atoms. Bi(1) is bonded to one O(2), one O(3), two equivalent O(1), and two equivalent O(4) atoms to form a mixture of distorted edge and corner-sharing BiO6 pentagonal pyramids. There are four inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to two equivalent Pb(1) and two equivalent Bi(1) atoms. In the second O site, O(2) is bonded in a distorted trigonal non-coplanar geometry to one B(1), one Pb(1), and one Bi(1) atom. In the third O site, O(3) is bonded in a distorted trigonal non-coplanar geometry to one B(1), one Pb(1), and one Bi(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one B(1) and two equivalent Bi(1) atoms. is represented by the CIF card [CIF]
data_BiBPbO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.502
_cell_length_b   7.515
_cell_length_c   10.476
_cell_angle_alpha   46.756
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   430.264
_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
  Bi  Bi0  1  1.000  0.820  0.342  1.0
  Bi  Bi1  1  0.500  0.820  0.842  1.0
  Bi  Bi2  1  0.000  0.180  0.658  1.0
  Bi  Bi3  1  0.500  0.180  0.158  1.0
  B  B4  1  0.244  0.000  0.012  1.0
  B  B5  1  0.756  1.000  0.988  1.0
  B  B6  1  0.256  0.000  0.512  1.0
  B  B7  1  0.744  1.000  0.488  1.0
  Pb  Pb8  1  0.893  0.500  0.818  1.0
  Pb  Pb9  1  0.607  0.500  0.318  1.0
  Pb  Pb10  1  0.393  0.500  0.682  1.0
  Pb  Pb11  1  0.107  0.500  0.182  1.0
  O  O12  1  0.898  0.501  0.396  1.0
  O  O13  1  0.791  0.787  0.529  1.0
  O  O14  1  0.398  0.499  0.104  1.0
  O  O15  1  0.709  0.787  0.029  1.0
  O  O16  1  0.704  0.209  0.316  1.0
  O  O17  1  0.262  0.992  0.385  1.0
  O  O18  1  0.762  0.008  0.115  1.0
  O  O19  1  0.102  0.499  0.604  1.0
  O  O20  1  0.291  0.213  0.971  1.0
  O  O21  1  0.209  0.213  0.471  1.0
  O  O22  1  0.238  0.992  0.885  1.0
  O  O23  1  0.204  0.791  0.184  1.0
  O  O24  1  0.296  0.791  0.684  1.0
  O  O25  1  0.738  0.008  0.615  1.0
  O  O26  1  0.796  0.209  0.816  1.0
  O  O27  1  0.602  0.501  0.896  1.0
[/CIF]
.
The crystal structure described by PbBiBO4 crystallizes in the monoclinic P2_1/c space group. B(1) is bonded in a trigonal planar geometry to one O(2), one O(3), and one O(4) atom. Pb(1) is bonded in a 4-coordinate geometry to one O(2), one O(3), and two equivalent O(1) atoms. Bi(1) is bonded to one O(2), one O(3), two equivalent O(1), and two equivalent O(4) atoms to form a mixture of distorted edge and corner-sharing BiO6 pentagonal pyramids. There are four inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to two equivalent Pb(1) and two equivalent Bi(1) atoms. In the second O site, O(2) is bonded in a distorted trigonal non-coplanar geometry to one B(1), one Pb(1), and one Bi(1) atom. In the third O site, O(3) is bonded in a distorted trigonal non-coplanar geometry to one B(1), one Pb(1), and one Bi(1) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one B(1) and two equivalent Bi(1) atoms. is represented by the CIF card [CIF]
data_BiBPbO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.502
_cell_length_b   7.515
_cell_length_c   10.476
_cell_angle_alpha   46.756
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   430.264
_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
  Bi  Bi0  1  1.000  0.820  0.342  1.0
  Bi  Bi1  1  0.500  0.820  0.842  1.0
  Bi  Bi2  1  0.000  0.180  0.658  1.0
  Bi  Bi3  1  0.500  0.180  0.158  1.0
  B  B4  1  0.244  0.000  0.012  1.0
  B  B5  1  0.756  1.000  0.988  1.0
  B  B6  1  0.256  0.000  0.512  1.0
  B  B7  1  0.744  1.000  0.488  1.0
  Pb  Pb8  1  0.893  0.500  0.818  1.0
  Pb  Pb9  1  0.607  0.500  0.318  1.0
  Pb  Pb10  1  0.393  0.500  0.682  1.0
  Pb  Pb11  1  0.107  0.500  0.182  1.0
  O  O12  1  0.898  0.501  0.396  1.0
  O  O13  1  0.791  0.787  0.529  1.0
  O  O14  1  0.398  0.499  0.104  1.0
  O  O15  1  0.709  0.787  0.029  1.0
  O  O16  1  0.704  0.209  0.316  1.0
  O  O17  1  0.262  0.992  0.385  1.0
  O  O18  1  0.762  0.008  0.115  1.0
  O  O19  1  0.102  0.499  0.604  1.0
  O  O20  1  0.291  0.213  0.971  1.0
  O  O21  1  0.209  0.213  0.471  1.0
  O  O22  1  0.238  0.992  0.885  1.0
  O  O23  1  0.204  0.791  0.184  1.0
  O  O24  1  0.296  0.791  0.684  1.0
  O  O25  1  0.738  0.008  0.615  1.0
  O  O26  1  0.796  0.209  0.816  1.0
  O  O27  1  0.602  0.501  0.896  1.0
[/CIF]
.