Th4PbP6O24 crystallizes in the triclinic P1 space group. There are four inequivalent Th sites. In the first Th site, Th(1) is bonded in a 9-coordinate geometry to one O(11), one O(15), one O(18), one O(2), one O(21), one O(24), one O(5), one O(8), and one O(9) atom. In the second Th site, Th(2) is bonded in a 9-coordinate geometry to one O(1), one O(10), one O(12), one O(16), one O(17), one O(22), one O(23), one O(6), and one O(7) atom. In the third Th site, Th(3) is bonded in a 9-coordinate geometry to one O(11), one O(13), one O(20), one O(22), one O(23), one O(4), one O(6), one O(7), and one O(9) atom. In the fourth Th site, Th(4) is bonded in a 9-coordinate geometry to one O(10), one O(12), one O(14), one O(19), one O(21), one O(24), one O(3), one O(5), and one O(8) atom. Pb(1) is bonded in a 6-coordinate geometry to one O(1), one O(14), one O(16), one O(19), one O(2), and one O(21) atom. There are six inequivalent P sites. In the first P site, P(1) is bonded in a tetrahedral geometry to one O(13), one O(14), one O(21), and one O(22) atom. In the second P site, P(2) is bonded in a tetrahedral geometry to one O(15), one O(16), one O(23), and one O(24) atom. In the third P site, P(3) is bonded in a tetrahedral geometry to one O(1), one O(17), one O(5), and one O(9) atom. In the fourth P site, P(4) is bonded in a tetrahedral geometry to one O(10), one O(18), one O(2), and one O(6) atom. In the fifth P site, P(5) is bonded in a tetrahedral geometry to one O(11), one O(19), one O(3), and one O(7) atom. In the sixth P site, P(6) is bonded in a tetrahedral geometry to one O(12), one O(20), one O(4), and one O(8) atom. There are twenty-four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Th(2), one Pb(1), and one P(3) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Th(1), one Pb(1), and one P(4) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one Th(4) and one P(5) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Th(3) and one P(6) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one Th(1), one Th(4), and one P(3) atom. In the sixth O site, O(6) is bonded in a distorted single-bond geometry to one Th(2), one Th(3), and one P(4) atom. In the seventh O site, O(7) is bonded in a distorted single-bond geometry to one Th(2), one Th(3), and one P(5) atom. In the eighth O site, O(8) is bonded in a distorted single-bond geometry to one Th(1), one Th(4), and one P(6) atom. In the ninth O site, O(9) is bonded in a distorted single-bond geometry to one Th(1), one Th(3), and one P(3) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one Th(2), one Th(4), and one P(4) atom. In the eleventh O site, O(11) is bonded in a distorted single-bond geometry to one Th(1), one Th(3), and one P(5) atom. In the twelfth O site, O(12) is bonded in a distorted single-bond geometry to one Th(2), one Th(4), and one P(6) atom. In the thirteenth O site, O(13) is bonded in a distorted water-like geometry to one Th(3) and one P(1) atom. In the fourteenth O site, O(14) is bonded in a distorted single-bond geometry to one Th(4), one Pb(1), and one P(1) atom. In the fifteenth O site, O(15) is bonded in a water-like geometry to one Th(1) and one P(2) atom. In the sixteenth O site, O(16) is bonded in a distorted single-bond geometry to one Th(2), one Pb(1), and one P(2) atom. In the seventeenth O site, O(17) is bonded in a bent 150 degrees geometry to one Th(2) and one P(3) atom. In the eighteenth O site, O(18) is bonded in a bent 150 degrees geometry to one Th(1) and one P(4) atom. In the nineteenth O site, O(19) is bonded in a 1-coordinate geometry to one Th(4), one Pb(1), and one P(5) atom. In the twentieth O site, O(20) is bonded in a bent 150 degrees geometry to one Th(3) and one P(6) atom. In the twenty-first O site, O(21) is bonded in a distorted single-bond geometry to one Th(1), one Th(4), one Pb(1), and one P(1) atom. In the twenty-second O site, O(22) is bonded in a distorted single-bond geometry to one Th(2), one Th(3), and one P(1) atom. In the twenty-third O site, O(23) is bonded in a distorted single-bond geometry to one Th(2), one Th(3), and one P(2) atom. In the twenty-fourth O site, O(24) is bonded in a distorted single-bond geometry to one Th(1), one Th(4), and one P(2) atom.
Th4PbP6O24 crystallizes in the triclinic P1 space group. There are four inequivalent Th sites. In the first Th site, Th(1) is bonded in a 9-coordinate geometry to one O(11), one O(15), one O(18), one O(2), one O(21), one O(24), one O(5), one O(8), and one O(9) atom. The Th(1)-O(11) bond length is 2.46 Å. The Th(1)-O(15) bond length is 2.40 Å. The Th(1)-O(18) bond length is 2.33 Å. The Th(1)-O(2) bond length is 2.45 Å. The Th(1)-O(21) bond length is 2.56 Å. The Th(1)-O(24) bond length is 2.66 Å. The Th(1)-O(5) bond length is 2.56 Å. The Th(1)-O(8) bond length is 2.51 Å. The Th(1)-O(9) bond length is 2.56 Å. In the second Th site, Th(2) is bonded in a 9-coordinate geometry to one O(1), one O(10), one O(12), one O(16), one O(17), one O(22), one O(23), one O(6), and one O(7) atom. The Th(2)-O(1) bond length is 2.48 Å. The Th(2)-O(10) bond length is 2.55 Å. The Th(2)-O(12) bond length is 2.46 Å. The Th(2)-O(16) bond length is 2.51 Å. The Th(2)-O(17) bond length is 2.31 Å. The Th(2)-O(22) bond length is 2.49 Å. The Th(2)-O(23) bond length is 2.59 Å. The Th(2)-O(6) bond length is 2.52 Å. The Th(2)-O(7) bond length is 2.49 Å. In the third Th site, Th(3) is bonded in a 9-coordinate geometry to one O(11), one O(13), one O(20), one O(22), one O(23), one O(4), one O(6), one O(7), and one O(9) atom. The Th(3)-O(11) bond length is 2.61 Å. The Th(3)-O(13) bond length is 2.41 Å. The Th(3)-O(20) bond length is 2.36 Å. The Th(3)-O(22) bond length is 2.74 Å. The Th(3)-O(23) bond length is 2.49 Å. The Th(3)-O(4) bond length is 2.34 Å. The Th(3)-O(6) bond length is 2.58 Å. The Th(3)-O(7) bond length is 2.53 Å. The Th(3)-O(9) bond length is 2.48 Å. In the fourth Th site, Th(4) is bonded in a 9-coordinate geometry to one O(10), one O(12), one O(14), one O(19), one O(21), one O(24), one O(3), one O(5), and one O(8) atom. The Th(4)-O(10) bond length is 2.44 Å. The Th(4)-O(12) bond length is 2.50 Å. The Th(4)-O(14) bond length is 2.50 Å. The Th(4)-O(19) bond length is 2.42 Å. The Th(4)-O(21) bond length is 2.69 Å. The Th(4)-O(24) bond length is 2.44 Å. The Th(4)-O(3) bond length is 2.37 Å. The Th(4)-O(5) bond length is 2.53 Å. The Th(4)-O(8) bond length is 2.46 Å. Pb(1) is bonded in a 6-coordinate geometry to one O(1), one O(14), one O(16), one O(19), one O(2), and one O(21) atom. The Pb(1)-O(1) bond length is 2.77 Å. The Pb(1)-O(14) bond length is 2.58 Å. The Pb(1)-O(16) bond length is 2.49 Å. The Pb(1)-O(19) bond length is 2.67 Å. The Pb(1)-O(2) bond length is 2.88 Å. The Pb(1)-O(21) bond length is 2.88 Å. There are six inequivalent P sites. In the first P site, P(1) is bonded in a tetrahedral geometry to one O(13), one O(14), one O(21), and one O(22) atom. The P(1)-O(13) bond length is 1.54 Å. The P(1)-O(14) bond length is 1.56 Å. The P(1)-O(21) bond length is 1.57 Å. The P(1)-O(22) bond length is 1.56 Å. In the second P site, P(2) is bonded in a tetrahedral geometry to one O(15), one O(16), one O(23), and one O(24) atom. The P(2)-O(15) bond length is 1.54 Å. The P(2)-O(16) bond length is 1.57 Å. The P(2)-O(23) bond length is 1.56 Å. The P(2)-O(24) bond length is 1.56 Å. In the third P site, P(3) is bonded in a tetrahedral geometry to one O(1), one O(17), one O(5), and one O(9) atom. The P(3)-O(1) bond length is 1.55 Å. The P(3)-O(17) bond length is 1.53 Å. The P(3)-O(5) bond length is 1.56 Å. The P(3)-O(9) bond length is 1.57 Å. In the fourth P site, P(4) is bonded in a tetrahedral geometry to one O(10), one O(18), one O(2), and one O(6) atom. The P(4)-O(10) bond length is 1.58 Å. The P(4)-O(18) bond length is 1.53 Å. The P(4)-O(2) bond length is 1.54 Å. The P(4)-O(6) bond length is 1.56 Å. In the fifth P site, P(5) is bonded in a tetrahedral geometry to one O(11), one O(19), one O(3), and one O(7) atom. The P(5)-O(11) bond length is 1.56 Å. The P(5)-O(19) bond length is 1.55 Å. The P(5)-O(3) bond length is 1.54 Å. The P(5)-O(7) bond length is 1.56 Å. In the sixth P site, P(6) is bonded in a tetrahedral geometry to one O(12), one O(20), one O(4), and one O(8) atom. The P(6)-O(12) bond length is 1.58 Å. The P(6)-O(20) bond length is 1.53 Å. The P(6)-O(4) bond length is 1.52 Å. The P(6)-O(8) bond length is 1.58 Å. There are twenty-four inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Th(2), one Pb(1), and one P(3) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Th(1), one Pb(1), and one P(4) atom. In the third O site, O(3) is bonded in a 2-coordinate geometry to one Th(4) and one P(5) atom. In the fourth O site, O(4) is bonded in a distorted bent 150 degrees geometry to one Th(3) and one P(6) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one Th(1), one Th(4), and one P(3) atom. In the sixth O site, O(6) is bonded in a distorted single-bond geometry to one Th(2), one Th(3), and one P(4) atom. In the seventh O site, O(7) is bonded in a distorted single-bond geometry to one Th(2), one Th(3), and one P(5) atom. In the eighth O site, O(8) is bonded in a distorted single-bond geometry to one Th(1), one Th(4), and one P(6) atom. In the ninth O site, O(9) is bonded in a distorted single-bond geometry to one Th(1), one Th(3), and one P(3) atom. In the tenth O site, O(10) is bonded in a distorted single-bond geometry to one Th(2), one Th(4), and one P(4) atom. In the eleventh O site, O(11) is bonded in a distorted single-bond geometry to one Th(1), one Th(3), and one P(5) atom. In the twelfth O site, O(12) is bonded in a distorted single-bond geometry to one Th(2), one Th(4), and one P(6) atom. In the thirteenth O site, O(13) is bonded in a distorted water-like geometry to one Th(3) and one P(1) atom. In the fourteenth O site, O(14) is bonded in a distorted single-bond geometry to one Th(4), one Pb(1), and one P(1) atom. In the fifteenth O site, O(15) is bonded in a water-like geometry to one Th(1) and one P(2) atom. In the sixteenth O site, O(16) is bonded in a distorted single-bond geometry to one Th(2), one Pb(1), and one P(2) atom. In the seventeenth O site, O(17) is bonded in a bent 150 degrees geometry to one Th(2) and one P(3) atom. In the eighteenth O site, O(18) is bonded in a bent 150 degrees geometry to one Th(1) and one P(4) atom. In the nineteenth O site, O(19) is bonded in a 1-coordinate geometry to one Th(4), one Pb(1), and one P(5) atom. In the twentieth O site, O(20) is bonded in a bent 150 degrees geometry to one Th(3) and one P(6) atom. In the twenty-first O site, O(21) is bonded in a distorted single-bond geometry to one Th(1), one Th(4), one Pb(1), and one P(1) atom. In the twenty-second O site, O(22) is bonded in a distorted single-bond geometry to one Th(2), one Th(3), and one P(1) atom. In the twenty-third O site, O(23) is bonded in a distorted single-bond geometry to one Th(2), one Th(3), and one P(2) atom. In the twenty-fourth O site, O(24) is bonded in a distorted single-bond geometry to one Th(1), one Th(4), and one P(2) atom.