The material structure described by Ti10Bi(Pb3O10)3 is Pb(Zr_(1-x)Ti_x)O3-derived structured and crystallizes in the triclinic P1 space group. There are ten inequivalent Ti sites. In the first Ti site, Ti(1) is bonded in a 6-coordinate geometry to one O(19), one O(2), one O(28), one O(30), one O(4), and one O(5) atom. In the second Ti site, Ti(2) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(11), one O(5), one O(7), and one O(9) atom. In the third Ti site, Ti(3) is bonded in a 6-coordinate geometry to one O(10), one O(12), one O(26), one O(4), one O(6), and one O(8) atom. In the fourth Ti site, Ti(4) is bonded in a 6-coordinate geometry to one O(12), one O(15), one O(16), one O(18), one O(3), and one O(9) atom. In the fifth Ti site, Ti(5) is bonded in a 6-coordinate geometry to one O(11), one O(13), one O(14), one O(15), one O(17), and one O(2) atom. In the sixth Ti site, Ti(6) is bonded in a 6-coordinate geometry to one O(17), one O(19), one O(21), one O(22), one O(23), and one O(7) atom. In the seventh Ti site, Ti(7) is bonded in a 6-coordinate geometry to one O(13), one O(18), one O(20), one O(22), one O(24), and one O(8) atom. In the eighth Ti site, Ti(8) is bonded in a 6-coordinate geometry to one O(1), one O(14), one O(23), one O(25), one O(27), and one O(28) atom. In the ninth Ti site, Ti(9) is bonded in a 6-coordinate geometry to one O(16), one O(21), one O(24), one O(25), one O(26), and one O(29) atom. In the tenth Ti site, Ti(10) is bonded in a 6-coordinate geometry to one O(20), one O(27), one O(29), one O(3), one O(30), and one O(6) atom. There are nine inequivalent Pb sites. In the first Pb site, Pb(1) is bonded in a 8-coordinate geometry to one O(12), one O(21), one O(26), one O(27), one O(29), one O(3), one O(4), and one O(9) atom. In the second Pb site, Pb(2) is bonded in a 8-coordinate geometry to one O(13), one O(18), one O(27), one O(3), one O(4), one O(6), one O(8), and one O(9) atom. In the third Pb site, Pb(3) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(11), one O(15), one O(2), one O(25), one O(28), and one O(30) atom. In the fourth Pb site, Pb(4) is bonded in a 8-coordinate geometry to one O(12), one O(13), one O(16), one O(21), one O(24), one O(4), one O(8), and one O(9) atom. In the fifth Pb site, Pb(5) is bonded in a 8-coordinate geometry to one O(10), one O(15), one O(17), one O(2), one O(22), one O(30), one O(5), and one O(7) atom. In the sixth Pb site, Pb(6) is bonded in a 8-coordinate geometry to one O(13), one O(16), one O(18), one O(20), one O(21), one O(27), one O(29), and one O(9) atom. In the seventh Pb site, Pb(7) is bonded in a 8-coordinate geometry to one O(10), one O(11), one O(14), one O(15), one O(22), one O(23), one O(25), and one O(7) atom. In the eighth Pb site, Pb(8) is bonded in a 8-coordinate geometry to one O(13), one O(20), one O(21), one O(24), one O(26), one O(27), one O(4), and one O(6) atom. In the ninth Pb site, Pb(9) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(19), one O(22), one O(23), one O(25), one O(30), and one O(5) atom. Bi(1) is bonded in a 4-coordinate geometry to one O(14), one O(17), one O(19), and one O(28) atom. There are thirty inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one Ti(2), one Ti(8), one Pb(3), and one Pb(9) atom. In the second O site, O(2) is bonded in a distorted bent 150 degrees geometry to one Ti(1), one Ti(5), one Pb(3), and one Pb(5) atom. In the third O site, O(3) is bonded in a 4-coordinate geometry to one Ti(10), one Ti(4), one Pb(1), and one Pb(2) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one Ti(1), one Ti(3), one Pb(1), one Pb(2), one Pb(4), and one Pb(8) atom. In the fifth O site, O(5) is bonded in a 4-coordinate geometry to one Ti(1), one Ti(2), one Pb(5), and one Pb(9) atom. In the sixth O site, O(6) is bonded in a 4-coordinate geometry to one Ti(10), one Ti(3), one Pb(2), and one Pb(8) atom. In the seventh O site, O(7) is bonded in a 4-coordinate geometry to one Ti(2), one Ti(6), one Pb(5), and one Pb(7) atom. In the eighth O site, O(8) is bonded in a 4-coordinate geometry to one Ti(3), one Ti(7), one Pb(2), and one Pb(4) atom. In the ninth O site, O(9) is bonded in a distorted single-bond geometry to one Ti(2), one Ti(4), one Pb(1), one Pb(2), one Pb(4), and one Pb(6) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one Ti(2), one Ti(3), one Pb(3), one Pb(5), one Pb(7), and one Pb(9) atom. In the eleventh O site, O(11) is bonded in a 4-coordinate geometry to one Ti(2), one Ti(5), one Pb(3), and one Pb(7) atom. In the twelfth O site, O(12) is bonded in a 4-coordinate geometry to one Ti(3), one Ti(4), one Pb(1), and one Pb(4) atom. In the thirteenth O site, O(13) is bonded in a distorted single-bond geometry to one Ti(5), one Ti(7), one Pb(2), one Pb(4), one Pb(6), and one Pb(8) atom. In the fourteenth O site, O(14) is bonded in a 4-coordinate geometry to one Ti(5), one Ti(8), one Pb(7), and one Bi(1) atom. In the fifteenth O site, O(15) is bonded in a distorted single-bond geometry to one Ti(4), one Ti(5), one Pb(3), one Pb(5), and one Pb(7) atom. In the sixteenth O site, O(16) is bonded in a 4-coordinate geometry to one Ti(4), one Ti(9), one Pb(4), and one Pb(6) atom. In the seventeenth O site, O(17) is bonded in a 4-coordinate geometry to one Ti(5), one Ti(6), one Pb(5), and one Bi(1) atom. In the eighteenth O site, O(18) is bonded in a 4-coordinate geometry to one Ti(4), one Ti(7), one Pb(2), and one Pb(6) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one Ti(1), one Ti(6), one Pb(9), and one Bi(1) atom. In the twentieth O site, O(20) is bonded in a 4-coordinate geometry to one Ti(10), one Ti(7), one Pb(6), and one Pb(8) atom. In the twenty-first O site, O(21) is bonded in a distorted single-bond geometry to one Ti(6), one Ti(9), one Pb(1), one Pb(4), one Pb(6), and one Pb(8) atom. In the twenty-second O site, O(22) is bonded in a distorted single-bond geometry to one Ti(6), one Ti(7), one Pb(5), one Pb(7), and one Pb(9) atom. In the twenty-third O site, O(23) is bonded in a distorted bent 150 degrees geometry to one Ti(6), one Ti(8), one Pb(7), and one Pb(9) atom. In the twenty-fourth O site, O(24) is bonded in a 4-coordinate geometry to one Ti(7), one Ti(9), one Pb(4), and one Pb(8) atom. In the twenty-fifth O site, O(25) is bonded in a distorted single-bond geometry to one Ti(8), one Ti(9), one Pb(3), one Pb(7), and one Pb(9) atom. In the twenty-sixth O site, O(26) is bonded in a 4-coordinate geometry to one Ti(3), one Ti(9), one Pb(1), and one Pb(8) atom. In the twenty-seventh O site, O(27) is bonded in a distorted single-bond geometry to one Ti(10), one Ti(8), one Pb(1), one Pb(2), one Pb(6), and one Pb(8) atom. In the twenty-eighth O site, O(28) is bonded in a 4-coordinate geometry to one Ti(1), one Ti(8), one Pb(3), and one Bi(1) atom. In the twenty-ninth O site, O(29) is bonded in a 4-coordinate geometry to one Ti(10), one Ti(9), one Pb(1), and one Pb(6) atom. In the thirtieth O site, O(30) is bonded in a distorted single-bond geometry to one Ti(1), one Ti(10), one Pb(3), one Pb(5), and one Pb(9) atom. is represented by the CIF file [CIF]
data_Ti10Bi(Pb3O10)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.772
_cell_length_b   8.773
_cell_length_c   9.424
_cell_angle_alpha   100.738
_cell_angle_beta   111.862
_cell_angle_gamma   89.969
_symmetry_Int_Tables_number   1
_cell_volume   659.370
_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
  Ti  Ti0  1  0.595  0.052  0.731  1.0
  Ti  Ti1  1  0.992  0.246  0.731  1.0
  Ti  Ti2  1  0.793  0.146  0.232  1.0
  Ti  Ti3  1  0.193  0.348  0.232  1.0
  Ti  Ti4  1  0.389  0.441  0.731  1.0
  Ti  Ti5  1  0.798  0.643  0.731  1.0
  Ti  Ti6  1  0.592  0.547  0.232  1.0
  Ti  Ti7  1  0.187  0.849  0.731  1.0
  Ti  Ti8  1  0.994  0.746  0.232  1.0
  Ti  Ti9  1  0.392  0.945  0.232  1.0
  Bi  Bi10  1  0.412  0.706  0.531  1.0
  Pb  Pb11  1  0.002  0.003  0.006  1.0
  Pb  Pb12  1  0.401  0.201  0.006  1.0
  Pb  Pb13  1  0.198  0.097  0.497  1.0
  Pb  Pb14  1  0.803  0.401  0.006  1.0
  Pb  Pb15  1  0.600  0.302  0.497  1.0
  Pb  Pb16  1  0.202  0.600  0.005  1.0
  Pb  Pb17  1  0.001  0.498  0.497  1.0
  Pb  Pb18  1  0.603  0.801  0.005  1.0
  Pb  Pb19  1  0.796  0.900  0.497  1.0
  O  O20  1  0.080  0.039  0.689  1.0
  O  O21  1  0.476  0.238  0.689  1.0
  O  O22  1  0.276  0.138  0.191  1.0
  O  O23  1  0.676  0.087  0.939  1.0
  O  O24  1  0.777  0.133  0.689  1.0
  O  O25  1  0.576  0.038  0.191  1.0
  O  O26  1  0.871  0.436  0.689  1.0
  O  O27  1  0.676  0.338  0.191  1.0
  O  O28  1  0.076  0.288  0.939  1.0
  O  O29  1  0.876  0.188  0.440  1.0
  O  O30  1  0.174  0.342  0.688  1.0
  O  O31  1  0.976  0.239  0.191  1.0
  O  O32  1  0.475  0.489  0.938  1.0
  O  O33  1  0.278  0.640  0.681  1.0
  O  O34  1  0.276  0.392  0.440  1.0
  O  O35  1  0.075  0.538  0.188  1.0
  O  O36  1  0.569  0.542  0.681  1.0
  O  O37  1  0.375  0.437  0.188  1.0
  O  O38  1  0.667  0.832  0.681  1.0
  O  O39  1  0.476  0.738  0.189  1.0
  O  O40  1  0.874  0.688  0.938  1.0
  O  O41  1  0.672  0.588  0.440  1.0
  O  O42  1  0.976  0.738  0.689  1.0
  O  O43  1  0.777  0.638  0.192  1.0
  O  O44  1  0.080  0.787  0.440  1.0
  O  O45  1  0.877  0.938  0.191  1.0
  O  O46  1  0.276  0.888  0.938  1.0
  O  O47  1  0.376  0.930  0.681  1.0
  O  O48  1  0.175  0.838  0.188  1.0
  O  O49  1  0.475  0.984  0.440  1.0
[/CIF]
.
The material structure described by Ti10Bi(Pb3O10)3 is Pb(Zr_(1-x)Ti_x)O3-derived structured and crystallizes in the triclinic P1 space group. There are ten inequivalent Ti sites. In the first Ti site, Ti(1) is bonded in a 6-coordinate geometry to one O(19), one O(2), one O(28), one O(30), one O(4), and one O(5) atom. In the second Ti site, Ti(2) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(11), one O(5), one O(7), and one O(9) atom. In the third Ti site, Ti(3) is bonded in a 6-coordinate geometry to one O(10), one O(12), one O(26), one O(4), one O(6), and one O(8) atom. In the fourth Ti site, Ti(4) is bonded in a 6-coordinate geometry to one O(12), one O(15), one O(16), one O(18), one O(3), and one O(9) atom. In the fifth Ti site, Ti(5) is bonded in a 6-coordinate geometry to one O(11), one O(13), one O(14), one O(15), one O(17), and one O(2) atom. In the sixth Ti site, Ti(6) is bonded in a 6-coordinate geometry to one O(17), one O(19), one O(21), one O(22), one O(23), and one O(7) atom. In the seventh Ti site, Ti(7) is bonded in a 6-coordinate geometry to one O(13), one O(18), one O(20), one O(22), one O(24), and one O(8) atom. In the eighth Ti site, Ti(8) is bonded in a 6-coordinate geometry to one O(1), one O(14), one O(23), one O(25), one O(27), and one O(28) atom. In the ninth Ti site, Ti(9) is bonded in a 6-coordinate geometry to one O(16), one O(21), one O(24), one O(25), one O(26), and one O(29) atom. In the tenth Ti site, Ti(10) is bonded in a 6-coordinate geometry to one O(20), one O(27), one O(29), one O(3), one O(30), and one O(6) atom. There are nine inequivalent Pb sites. In the first Pb site, Pb(1) is bonded in a 8-coordinate geometry to one O(12), one O(21), one O(26), one O(27), one O(29), one O(3), one O(4), and one O(9) atom. In the second Pb site, Pb(2) is bonded in a 8-coordinate geometry to one O(13), one O(18), one O(27), one O(3), one O(4), one O(6), one O(8), and one O(9) atom. In the third Pb site, Pb(3) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(11), one O(15), one O(2), one O(25), one O(28), and one O(30) atom. In the fourth Pb site, Pb(4) is bonded in a 8-coordinate geometry to one O(12), one O(13), one O(16), one O(21), one O(24), one O(4), one O(8), and one O(9) atom. In the fifth Pb site, Pb(5) is bonded in a 8-coordinate geometry to one O(10), one O(15), one O(17), one O(2), one O(22), one O(30), one O(5), and one O(7) atom. In the sixth Pb site, Pb(6) is bonded in a 8-coordinate geometry to one O(13), one O(16), one O(18), one O(20), one O(21), one O(27), one O(29), and one O(9) atom. In the seventh Pb site, Pb(7) is bonded in a 8-coordinate geometry to one O(10), one O(11), one O(14), one O(15), one O(22), one O(23), one O(25), and one O(7) atom. In the eighth Pb site, Pb(8) is bonded in a 8-coordinate geometry to one O(13), one O(20), one O(21), one O(24), one O(26), one O(27), one O(4), and one O(6) atom. In the ninth Pb site, Pb(9) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(19), one O(22), one O(23), one O(25), one O(30), and one O(5) atom. Bi(1) is bonded in a 4-coordinate geometry to one O(14), one O(17), one O(19), and one O(28) atom. There are thirty inequivalent O sites. In the first O site, O(1) is bonded in a 4-coordinate geometry to one Ti(2), one Ti(8), one Pb(3), and one Pb(9) atom. In the second O site, O(2) is bonded in a distorted bent 150 degrees geometry to one Ti(1), one Ti(5), one Pb(3), and one Pb(5) atom. In the third O site, O(3) is bonded in a 4-coordinate geometry to one Ti(10), one Ti(4), one Pb(1), and one Pb(2) atom. In the fourth O site, O(4) is bonded in a distorted single-bond geometry to one Ti(1), one Ti(3), one Pb(1), one Pb(2), one Pb(4), and one Pb(8) atom. In the fifth O site, O(5) is bonded in a 4-coordinate geometry to one Ti(1), one Ti(2), one Pb(5), and one Pb(9) atom. In the sixth O site, O(6) is bonded in a 4-coordinate geometry to one Ti(10), one Ti(3), one Pb(2), and one Pb(8) atom. In the seventh O site, O(7) is bonded in a 4-coordinate geometry to one Ti(2), one Ti(6), one Pb(5), and one Pb(7) atom. In the eighth O site, O(8) is bonded in a 4-coordinate geometry to one Ti(3), one Ti(7), one Pb(2), and one Pb(4) atom. In the ninth O site, O(9) is bonded in a distorted single-bond geometry to one Ti(2), one Ti(4), one Pb(1), one Pb(2), one Pb(4), and one Pb(6) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one Ti(2), one Ti(3), one Pb(3), one Pb(5), one Pb(7), and one Pb(9) atom. In the eleventh O site, O(11) is bonded in a 4-coordinate geometry to one Ti(2), one Ti(5), one Pb(3), and one Pb(7) atom. In the twelfth O site, O(12) is bonded in a 4-coordinate geometry to one Ti(3), one Ti(4), one Pb(1), and one Pb(4) atom. In the thirteenth O site, O(13) is bonded in a distorted single-bond geometry to one Ti(5), one Ti(7), one Pb(2), one Pb(4), one Pb(6), and one Pb(8) atom. In the fourteenth O site, O(14) is bonded in a 4-coordinate geometry to one Ti(5), one Ti(8), one Pb(7), and one Bi(1) atom. In the fifteenth O site, O(15) is bonded in a distorted single-bond geometry to one Ti(4), one Ti(5), one Pb(3), one Pb(5), and one Pb(7) atom. In the sixteenth O site, O(16) is bonded in a 4-coordinate geometry to one Ti(4), one Ti(9), one Pb(4), and one Pb(6) atom. In the seventeenth O site, O(17) is bonded in a 4-coordinate geometry to one Ti(5), one Ti(6), one Pb(5), and one Bi(1) atom. In the eighteenth O site, O(18) is bonded in a 4-coordinate geometry to one Ti(4), one Ti(7), one Pb(2), and one Pb(6) atom. In the nineteenth O site, O(19) is bonded in a 4-coordinate geometry to one Ti(1), one Ti(6), one Pb(9), and one Bi(1) atom. In the twentieth O site, O(20) is bonded in a 4-coordinate geometry to one Ti(10), one Ti(7), one Pb(6), and one Pb(8) atom. In the twenty-first O site, O(21) is bonded in a distorted single-bond geometry to one Ti(6), one Ti(9), one Pb(1), one Pb(4), one Pb(6), and one Pb(8) atom. In the twenty-second O site, O(22) is bonded in a distorted single-bond geometry to one Ti(6), one Ti(7), one Pb(5), one Pb(7), and one Pb(9) atom. In the twenty-third O site, O(23) is bonded in a distorted bent 150 degrees geometry to one Ti(6), one Ti(8), one Pb(7), and one Pb(9) atom. In the twenty-fourth O site, O(24) is bonded in a 4-coordinate geometry to one Ti(7), one Ti(9), one Pb(4), and one Pb(8) atom. In the twenty-fifth O site, O(25) is bonded in a distorted single-bond geometry to one Ti(8), one Ti(9), one Pb(3), one Pb(7), and one Pb(9) atom. In the twenty-sixth O site, O(26) is bonded in a 4-coordinate geometry to one Ti(3), one Ti(9), one Pb(1), and one Pb(8) atom. In the twenty-seventh O site, O(27) is bonded in a distorted single-bond geometry to one Ti(10), one Ti(8), one Pb(1), one Pb(2), one Pb(6), and one Pb(8) atom. In the twenty-eighth O site, O(28) is bonded in a 4-coordinate geometry to one Ti(1), one Ti(8), one Pb(3), and one Bi(1) atom. In the twenty-ninth O site, O(29) is bonded in a 4-coordinate geometry to one Ti(10), one Ti(9), one Pb(1), and one Pb(6) atom. In the thirtieth O site, O(30) is bonded in a distorted single-bond geometry to one Ti(1), one Ti(10), one Pb(3), one Pb(5), and one Pb(9) atom. is represented by the CIF file [CIF]
data_Ti10Bi(Pb3O10)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.772
_cell_length_b   8.773
_cell_length_c   9.424
_cell_angle_alpha   100.738
_cell_angle_beta   111.862
_cell_angle_gamma   89.969
_symmetry_Int_Tables_number   1
_cell_volume   659.370
_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
  Ti  Ti0  1  0.595  0.052  0.731  1.0
  Ti  Ti1  1  0.992  0.246  0.731  1.0
  Ti  Ti2  1  0.793  0.146  0.232  1.0
  Ti  Ti3  1  0.193  0.348  0.232  1.0
  Ti  Ti4  1  0.389  0.441  0.731  1.0
  Ti  Ti5  1  0.798  0.643  0.731  1.0
  Ti  Ti6  1  0.592  0.547  0.232  1.0
  Ti  Ti7  1  0.187  0.849  0.731  1.0
  Ti  Ti8  1  0.994  0.746  0.232  1.0
  Ti  Ti9  1  0.392  0.945  0.232  1.0
  Bi  Bi10  1  0.412  0.706  0.531  1.0
  Pb  Pb11  1  0.002  0.003  0.006  1.0
  Pb  Pb12  1  0.401  0.201  0.006  1.0
  Pb  Pb13  1  0.198  0.097  0.497  1.0
  Pb  Pb14  1  0.803  0.401  0.006  1.0
  Pb  Pb15  1  0.600  0.302  0.497  1.0
  Pb  Pb16  1  0.202  0.600  0.005  1.0
  Pb  Pb17  1  0.001  0.498  0.497  1.0
  Pb  Pb18  1  0.603  0.801  0.005  1.0
  Pb  Pb19  1  0.796  0.900  0.497  1.0
  O  O20  1  0.080  0.039  0.689  1.0
  O  O21  1  0.476  0.238  0.689  1.0
  O  O22  1  0.276  0.138  0.191  1.0
  O  O23  1  0.676  0.087  0.939  1.0
  O  O24  1  0.777  0.133  0.689  1.0
  O  O25  1  0.576  0.038  0.191  1.0
  O  O26  1  0.871  0.436  0.689  1.0
  O  O27  1  0.676  0.338  0.191  1.0
  O  O28  1  0.076  0.288  0.939  1.0
  O  O29  1  0.876  0.188  0.440  1.0
  O  O30  1  0.174  0.342  0.688  1.0
  O  O31  1  0.976  0.239  0.191  1.0
  O  O32  1  0.475  0.489  0.938  1.0
  O  O33  1  0.278  0.640  0.681  1.0
  O  O34  1  0.276  0.392  0.440  1.0
  O  O35  1  0.075  0.538  0.188  1.0
  O  O36  1  0.569  0.542  0.681  1.0
  O  O37  1  0.375  0.437  0.188  1.0
  O  O38  1  0.667  0.832  0.681  1.0
  O  O39  1  0.476  0.738  0.189  1.0
  O  O40  1  0.874  0.688  0.938  1.0
  O  O41  1  0.672  0.588  0.440  1.0
  O  O42  1  0.976  0.738  0.689  1.0
  O  O43  1  0.777  0.638  0.192  1.0
  O  O44  1  0.080  0.787  0.440  1.0
  O  O45  1  0.877  0.938  0.191  1.0
  O  O46  1  0.276  0.888  0.938  1.0
  O  O47  1  0.376  0.930  0.681  1.0
  O  O48  1  0.175  0.838  0.188  1.0
  O  O49  1  0.475  0.984  0.440  1.0
[/CIF]
.