Li7Ho3(MoO4)8 is Zircon-derived structured and crystallizes in the triclinic P1 space group. There are seven inequivalent Li sites. In the first Li site, Li(1) is bonded in a square co-planar geometry to one O(21), one O(24), one O(5), and one O(8) atom. In the second Li site, Li(2) is bonded in a square co-planar geometry to one O(22), one O(23), one O(6), and one O(7) atom. In the third Li site, Li(3) is bonded in a 6-coordinate geometry to one O(11), one O(17), one O(22), one O(29), one O(5), and one O(9) atom. In the fourth Li site, Li(4) is bonded in a 6-coordinate geometry to one O(10), one O(12), one O(18), one O(21), one O(30), and one O(6) atom. In the fifth Li site, Li(5) is bonded in a 6-coordinate geometry to one O(11), one O(19), one O(24), one O(31), one O(7), and one O(9) atom. In the sixth Li site, Li(6) is bonded in a 6-coordinate geometry to one O(10), one O(12), one O(20), one O(23), one O(32), and one O(8) atom. In the seventh Li site, Li(7) is bonded in a 8-coordinate geometry to one O(1), one O(13), one O(16), one O(18), one O(26), one O(27), one O(3), and one O(30) atom. There are three inequivalent Ho sites. In the first Ho site, Ho(1) is bonded in a 8-coordinate geometry to one O(14), one O(15), one O(17), one O(2), one O(25), one O(28), one O(29), and one O(4) atom. In the second Ho site, Ho(2) is bonded in a 8-coordinate geometry to one O(1), one O(14), one O(15), one O(20), one O(25), one O(28), one O(3), and one O(32) atom. In the third Ho site, Ho(3) is bonded in a 8-coordinate geometry to one O(13), one O(16), one O(19), one O(2), one O(26), one O(27), one O(31), and one O(4) atom. There are eight inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to one O(10), one O(13), one O(29), and one O(6) atom. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to one O(14), one O(30), one O(5), and one O(9) atom. In the third Mo site, Mo(3) is bonded in a tetrahedral geometry to one O(12), one O(15), one O(31), and one O(8) atom. In the fourth Mo site, Mo(4) is bonded in a tetrahedral geometry to one O(11), one O(16), one O(32), and one O(7) atom. In the fifth Mo site, Mo(5) is bonded in a tetrahedral geometry to one O(1), one O(17), one O(21), and one O(26) atom. In the sixth Mo site, Mo(6) is bonded in a tetrahedral geometry to one O(18), one O(2), one O(22), and one O(25) atom. In the seventh Mo site, Mo(7) is bonded in a tetrahedral geometry to one O(19), one O(23), one O(28), and one O(3) atom. In the eighth Mo site, Mo(8) is bonded in a tetrahedral geometry to one O(20), one O(24), one O(27), and one O(4) atom. There are thirty-two inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one Li(7), one Ho(2), and one Mo(5) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(3), and one Mo(6) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Li(7), one Ho(2), and one Mo(7) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(3), and one Mo(8) atom. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Li(1), one Li(3), and one Mo(2) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Li(2), one Li(4), and one Mo(1) atom. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one Li(2), one Li(5), and one Mo(4) atom. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one Li(1), one Li(6), and one Mo(3) atom. In the ninth O site, O(9) is bonded in a distorted bent 150 degrees geometry to one Li(3), one Li(5), and one Mo(2) atom. In the tenth O site, O(10) is bonded in a 2-coordinate geometry to one Li(4), one Li(6), and one Mo(1) atom. In the eleventh O site, O(11) is bonded in a distorted bent 150 degrees geometry to one Li(3), one Li(5), and one Mo(4) atom. In the twelfth O site, O(12) is bonded in a distorted bent 150 degrees geometry to one Li(4), one Li(6), and one Mo(3) atom. In the thirteenth O site, O(13) is bonded in a distorted trigonal planar geometry to one Li(7), one Ho(3), and one Mo(1) atom. In the fourteenth O site, O(14) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(2), and one Mo(2) atom. In the fifteenth O site, O(15) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(2), and one Mo(3) atom. In the sixteenth O site, O(16) is bonded in a 3-coordinate geometry to one Li(7), one Ho(3), and one Mo(4) atom. In the seventeenth O site, O(17) is bonded in a 3-coordinate geometry to one Li(3), one Ho(1), and one Mo(5) atom. In the eighteenth O site, O(18) is bonded in a 3-coordinate geometry to one Li(4), one Li(7), and one Mo(6) atom. In the nineteenth O site, O(19) is bonded in a distorted trigonal planar geometry to one Li(5), one Ho(3), and one Mo(7) atom. In the twentieth O site, O(20) is bonded in a 3-coordinate geometry to one Li(6), one Ho(2), and one Mo(8) atom. In the twenty-first O site, O(21) is bonded in a distorted bent 120 degrees geometry to one Li(1), one Li(4), and one Mo(5) atom. In the twenty-second O site, O(22) is bonded in a distorted bent 120 degrees geometry to one Li(2), one Li(3), and one Mo(6) atom. In the twenty-third O site, O(23) is bonded in a distorted bent 120 degrees geometry to one Li(2), one Li(6), and one Mo(7) atom. In the twenty-fourth O site, O(24) is bonded in a 3-coordinate geometry to one Li(1), one Li(5), and one Mo(8) atom. In the twenty-fifth O site, O(25) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(2), and one Mo(6) atom. In the twenty-sixth O site, O(26) is bonded in a 3-coordinate geometry to one Li(7), one Ho(3), and one Mo(5) atom. In the twenty-seventh O site, O(27) is bonded in a 3-coordinate geometry to one Li(7), one Ho(3), and one Mo(8) atom. In the twenty-eighth O site, O(28) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(2), and one Mo(7) atom. In the twenty-ninth O site, O(29) is bonded in a distorted trigonal planar geometry to one Li(3), one Ho(1), and one Mo(1) atom. In the thirtieth O site, O(30) is bonded in a distorted trigonal planar geometry to one Li(4), one Li(7), and one Mo(2) atom. In the thirty-first O site, O(31) is bonded in a distorted trigonal planar geometry to one Li(5), one Ho(3), and one Mo(3) atom. In the thirty-second O site, O(32) is bonded in a distorted trigonal planar geometry to one Li(6), one Ho(2), and one Mo(4) atom.
Li7Ho3(MoO4)8 is Zircon-derived structured and crystallizes in the triclinic P1 space group. There are seven inequivalent Li sites. In the first Li site, Li(1) is bonded in a square co-planar geometry to one O(21), one O(24), one O(5), and one O(8) atom. The Li(1)-O(21) bond length is 2.03 Å. The Li(1)-O(24) bond length is 2.07 Å. The Li(1)-O(5) bond length is 1.99 Å. The Li(1)-O(8) bond length is 2.02 Å. In the second Li site, Li(2) is bonded in a square co-planar geometry to one O(22), one O(23), one O(6), and one O(7) atom. The Li(2)-O(22) bond length is 2.05 Å. The Li(2)-O(23) bond length is 2.06 Å. The Li(2)-O(6) bond length is 2.00 Å. The Li(2)-O(7) bond length is 2.01 Å. In the third Li site, Li(3) is bonded in a 6-coordinate geometry to one O(11), one O(17), one O(22), one O(29), one O(5), and one O(9) atom. The Li(3)-O(11) bond length is 1.96 Å. The Li(3)-O(17) bond length is 2.08 Å. The Li(3)-O(22) bond length is 2.58 Å. The Li(3)-O(29) bond length is 2.10 Å. The Li(3)-O(5) bond length is 2.30 Å. The Li(3)-O(9) bond length is 2.62 Å. In the fourth Li site, Li(4) is bonded in a 6-coordinate geometry to one O(10), one O(12), one O(18), one O(21), one O(30), and one O(6) atom. The Li(4)-O(10) bond length is 2.59 Å. The Li(4)-O(12) bond length is 2.03 Å. The Li(4)-O(18) bond length is 2.09 Å. The Li(4)-O(21) bond length is 2.59 Å. The Li(4)-O(30) bond length is 2.02 Å. The Li(4)-O(6) bond length is 2.34 Å. In the fifth Li site, Li(5) is bonded in a 6-coordinate geometry to one O(11), one O(19), one O(24), one O(31), one O(7), and one O(9) atom. The Li(5)-O(11) bond length is 2.63 Å. The Li(5)-O(19) bond length is 2.08 Å. The Li(5)-O(24) bond length is 2.56 Å. The Li(5)-O(31) bond length is 2.10 Å. The Li(5)-O(7) bond length is 2.28 Å. The Li(5)-O(9) bond length is 1.97 Å. In the sixth Li site, Li(6) is bonded in a 6-coordinate geometry to one O(10), one O(12), one O(20), one O(23), one O(32), and one O(8) atom. The Li(6)-O(10) bond length is 1.97 Å. The Li(6)-O(12) bond length is 2.62 Å. The Li(6)-O(20) bond length is 2.09 Å. The Li(6)-O(23) bond length is 2.60 Å. The Li(6)-O(32) bond length is 2.10 Å. The Li(6)-O(8) bond length is 2.30 Å. In the seventh Li site, Li(7) is bonded in a 8-coordinate geometry to one O(1), one O(13), one O(16), one O(18), one O(26), one O(27), one O(3), and one O(30) atom. The Li(7)-O(1) bond length is 2.41 Å. The Li(7)-O(13) bond length is 2.35 Å. The Li(7)-O(16) bond length is 2.52 Å. The Li(7)-O(18) bond length is 2.38 Å. The Li(7)-O(26) bond length is 2.60 Å. The Li(7)-O(27) bond length is 2.57 Å. The Li(7)-O(3) bond length is 2.45 Å. The Li(7)-O(30) bond length is 2.37 Å. There are three inequivalent Ho sites. In the first Ho site, Ho(1) is bonded in a 8-coordinate geometry to one O(14), one O(15), one O(17), one O(2), one O(25), one O(28), one O(29), and one O(4) atom. The Ho(1)-O(14) bond length is 2.32 Å. The Ho(1)-O(15) bond length is 2.42 Å. The Ho(1)-O(17) bond length is 2.33 Å. The Ho(1)-O(2) bond length is 2.39 Å. The Ho(1)-O(25) bond length is 2.46 Å. The Ho(1)-O(28) bond length is 2.40 Å. The Ho(1)-O(29) bond length is 2.32 Å. The Ho(1)-O(4) bond length is 2.35 Å. In the second Ho site, Ho(2) is bonded in a 8-coordinate geometry to one O(1), one O(14), one O(15), one O(20), one O(25), one O(28), one O(3), and one O(32) atom. The Ho(2)-O(1) bond length is 2.30 Å. The Ho(2)-O(14) bond length is 2.39 Å. The Ho(2)-O(15) bond length is 2.36 Å. The Ho(2)-O(20) bond length is 2.38 Å. The Ho(2)-O(25) bond length is 2.41 Å. The Ho(2)-O(28) bond length is 2.48 Å. The Ho(2)-O(3) bond length is 2.37 Å. The Ho(2)-O(32) bond length is 2.33 Å. In the third Ho site, Ho(3) is bonded in a 8-coordinate geometry to one O(13), one O(16), one O(19), one O(2), one O(26), one O(27), one O(31), and one O(4) atom. The Ho(3)-O(13) bond length is 2.36 Å. The Ho(3)-O(16) bond length is 2.31 Å. The Ho(3)-O(19) bond length is 2.35 Å. The Ho(3)-O(2) bond length is 2.35 Å. The Ho(3)-O(26) bond length is 2.35 Å. The Ho(3)-O(27) bond length is 2.46 Å. The Ho(3)-O(31) bond length is 2.40 Å. The Ho(3)-O(4) bond length is 2.42 Å. There are eight inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to one O(10), one O(13), one O(29), and one O(6) atom. The Mo(1)-O(10) bond length is 1.77 Å. The Mo(1)-O(13) bond length is 1.84 Å. The Mo(1)-O(29) bond length is 1.84 Å. The Mo(1)-O(6) bond length is 1.79 Å. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to one O(14), one O(30), one O(5), and one O(9) atom. The Mo(2)-O(14) bond length is 1.90 Å. The Mo(2)-O(30) bond length is 1.79 Å. The Mo(2)-O(5) bond length is 1.79 Å. The Mo(2)-O(9) bond length is 1.77 Å. In the third Mo site, Mo(3) is bonded in a tetrahedral geometry to one O(12), one O(15), one O(31), and one O(8) atom. The Mo(3)-O(12) bond length is 1.76 Å. The Mo(3)-O(15) bond length is 1.87 Å. The Mo(3)-O(31) bond length is 1.82 Å. The Mo(3)-O(8) bond length is 1.78 Å. In the fourth Mo site, Mo(4) is bonded in a tetrahedral geometry to one O(11), one O(16), one O(32), and one O(7) atom. The Mo(4)-O(11) bond length is 1.76 Å. The Mo(4)-O(16) bond length is 1.84 Å. The Mo(4)-O(32) bond length is 1.84 Å. The Mo(4)-O(7) bond length is 1.79 Å. In the fifth Mo site, Mo(5) is bonded in a tetrahedral geometry to one O(1), one O(17), one O(21), and one O(26) atom. The Mo(5)-O(1) bond length is 1.83 Å. The Mo(5)-O(17) bond length is 1.82 Å. The Mo(5)-O(21) bond length is 1.77 Å. The Mo(5)-O(26) bond length is 1.81 Å. In the sixth Mo site, Mo(6) is bonded in a tetrahedral geometry to one O(18), one O(2), one O(22), and one O(25) atom. The Mo(6)-O(18) bond length is 1.77 Å. The Mo(6)-O(2) bond length is 1.87 Å. The Mo(6)-O(22) bond length is 1.77 Å. The Mo(6)-O(25) bond length is 1.85 Å. In the seventh Mo site, Mo(7) is bonded in a tetrahedral geometry to one O(19), one O(23), one O(28), and one O(3) atom. The Mo(7)-O(19) bond length is 1.81 Å. The Mo(7)-O(23) bond length is 1.77 Å. The Mo(7)-O(28) bond length is 1.85 Å. The Mo(7)-O(3) bond length is 1.81 Å. In the eighth Mo site, Mo(8) is bonded in a tetrahedral geometry to one O(20), one O(24), one O(27), and one O(4) atom. The Mo(8)-O(20) bond length is 1.82 Å. The Mo(8)-O(24) bond length is 1.77 Å. The Mo(8)-O(27) bond length is 1.80 Å. The Mo(8)-O(4) bond length is 1.87 Å. There are thirty-two inequivalent O sites. In the first O site, O(1) is bonded in a distorted trigonal planar geometry to one Li(7), one Ho(2), and one Mo(5) atom. In the second O site, O(2) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(3), and one Mo(6) atom. In the third O site, O(3) is bonded in a distorted trigonal planar geometry to one Li(7), one Ho(2), and one Mo(7) atom. In the fourth O site, O(4) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(3), and one Mo(8) atom. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Li(1), one Li(3), and one Mo(2) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Li(2), one Li(4), and one Mo(1) atom. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one Li(2), one Li(5), and one Mo(4) atom. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one Li(1), one Li(6), and one Mo(3) atom. In the ninth O site, O(9) is bonded in a distorted bent 150 degrees geometry to one Li(3), one Li(5), and one Mo(2) atom. In the tenth O site, O(10) is bonded in a 2-coordinate geometry to one Li(4), one Li(6), and one Mo(1) atom. In the eleventh O site, O(11) is bonded in a distorted bent 150 degrees geometry to one Li(3), one Li(5), and one Mo(4) atom. In the twelfth O site, O(12) is bonded in a distorted bent 150 degrees geometry to one Li(4), one Li(6), and one Mo(3) atom. In the thirteenth O site, O(13) is bonded in a distorted trigonal planar geometry to one Li(7), one Ho(3), and one Mo(1) atom. In the fourteenth O site, O(14) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(2), and one Mo(2) atom. In the fifteenth O site, O(15) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(2), and one Mo(3) atom. In the sixteenth O site, O(16) is bonded in a 3-coordinate geometry to one Li(7), one Ho(3), and one Mo(4) atom. In the seventeenth O site, O(17) is bonded in a 3-coordinate geometry to one Li(3), one Ho(1), and one Mo(5) atom. In the eighteenth O site, O(18) is bonded in a 3-coordinate geometry to one Li(4), one Li(7), and one Mo(6) atom. In the nineteenth O site, O(19) is bonded in a distorted trigonal planar geometry to one Li(5), one Ho(3), and one Mo(7) atom. In the twentieth O site, O(20) is bonded in a 3-coordinate geometry to one Li(6), one Ho(2), and one Mo(8) atom. In the twenty-first O site, O(21) is bonded in a distorted bent 120 degrees geometry to one Li(1), one Li(4), and one Mo(5) atom. In the twenty-second O site, O(22) is bonded in a distorted bent 120 degrees geometry to one Li(2), one Li(3), and one Mo(6) atom. In the twenty-third O site, O(23) is bonded in a distorted bent 120 degrees geometry to one Li(2), one Li(6), and one Mo(7) atom. In the twenty-fourth O site, O(24) is bonded in a 3-coordinate geometry to one Li(1), one Li(5), and one Mo(8) atom. In the twenty-fifth O site, O(25) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(2), and one Mo(6) atom. In the twenty-sixth O site, O(26) is bonded in a 3-coordinate geometry to one Li(7), one Ho(3), and one Mo(5) atom. In the twenty-seventh O site, O(27) is bonded in a 3-coordinate geometry to one Li(7), one Ho(3), and one Mo(8) atom. In the twenty-eighth O site, O(28) is bonded in a distorted trigonal planar geometry to one Ho(1), one Ho(2), and one Mo(7) atom. In the twenty-ninth O site, O(29) is bonded in a distorted trigonal planar geometry to one Li(3), one Ho(1), and one Mo(1) atom. In the thirtieth O site, O(30) is bonded in a distorted trigonal planar geometry to one Li(4), one Li(7), and one Mo(2) atom. In the thirty-first O site, O(31) is bonded in a distorted trigonal planar geometry to one Li(5), one Ho(3), and one Mo(3) atom. In the thirty-second O site, O(32) is bonded in a distorted trigonal planar geometry to one Li(6), one Ho(2), and one Mo(4) atom.