Identification code | 3162p21c |
Empirical formula | C73H179K5Li8O22Si12 |
Formula weight | 1997.25 |
Temperature/K | 293(2) |
Crystal system | monoclinic |
Space group | P21/c |
a/Å | 16.9979(7) |
b/Å | 16.9979(7) |
c/Å | 43.798(3) |
α/° | 90 |
β/° | 90.10(10) |
γ/° | 90 |
Volume/Å3 | 12654.5(11) |
Z | 4 |
ρcalcg/cm3 | 1.048 |
μ/mm‑1 | 0.337 |
F(000) | 4320.0 |
Crystal size/mm3 | 0.05 × 0.05 × 0.05 |
Radiation | MoKα (λ = 0.71073) |
2Θ range for data collection/° | 4.386 to 50 |
Index ranges | -20 ≤ h ≤ 20, -20 ≤ k ≤ 20, -52 ≤ l ≤ 52 |
Reflections collected | 80446 |
Independent reflections | 22024 [Rint = 0.0904, Rsigma = 0.0768] |
Data/restraints/parameters | 22024/99/1146 |
Goodness-of-fit on F2 | 1.092 |
Final R indexes [I>=2σ (I)] | R1 = 0.1012, wR2 = 0.2743 |
Final R indexes [all data] | R1 = 0.1460, wR2 = 0.3119 |
Largest diff. peak/hole / e Å-3 | 1.57/-0.32 |
Atom | x | y | z | U(eq) |
---|---|---|---|---|
K1 | 2499.7(8) | 2500.7(8) | 6749.2(3) | 53.6(3) |
Si1 | 4083.0(12) | 1114.8(14) | 6908.4(5) | 75.4(6) |
Si2 | 3887.5(13) | 4081.0(12) | 6909.7(5) | 74.9(6) |
Si3 | 917.9(12) | 3885.0(14) | 6909.3(5) | 73.9(6) |
Si4 | 1113.4(13) | 917.8(12) | 6908.7(5) | 74.1(6) |
O1 | 3522(2) | 1627(2) | 7122.2(10) | 58.0(11) |
O2 | 3375(2) | 3523(2) | 7121.4(10) | 57.3(11) |
O3 | 1476(2) | 3372(2) | 7121.6(10) | 57.0(11) |
O4 | 1628(2) | 1478(2) | 7121.7(10) | 56.2(10) |
O5 | 2505(5) | 2500(5) | 6100.2(13) | 114(2) |
O6 | 4494(3) | 2682(3) | 7614.6(15) | 91.7(17) |
O7 | 2683(3) | 509(3) | 7615.1(15) | 92.5(17) |
O8 | 508(3) | 2315(3) | 7615.9(15) | 94.9(19) |
O9 | 2320(3) | 4492(4) | 7615.7(15) | 92.9(18) |
O10 | 2499(2) | 2498(3) | 7543.7(9) | 53.8(10) |
C1 | 4133(5) | 1498(5) | 6514.4(19) | 88(2) |
C2 | 5120(6) | 1095(10) | 7052(3) | 153(6) |
C3 | 3717(8) | 82(5) | 6868(2) | 120(4) |
C4 | 3505(5) | 4131(5) | 6517.7(18) | 88(3) |
C5 | 3914(10) | 5113(6) | 7050(3) | 155(6) |
C6 | 4918(5) | 3711(8) | 6870(2) | 119(4) |
C7 | 870(5) | 3494(6) | 6513.7(19) | 90(3) |
C8 | 1299(8) | 4916(5) | 6865(2) | 120(4) |
C9 | -115(6) | 3922(10) | 7043(3) | 162(6) |
C10 | 89(5) | 1283(8) | 6862(2) | 123(4) |
C11 | 1082(9) | -120(6) | 7052(3) | 153(6) |
C12 | 1508(5) | 862(5) | 6514.6(19) | 90(3) |
C17 | 4852(8) | 2067(7) | 7773(3) | 134(5) |
C18 | 5044(16) | 2363(10) | 8053(4) | 250(12) |
C19 | 4946(13) | 3242(10) | 8034(4) | 201(8) |
C20 | 4825(7) | 3385(6) | 7721(3) | 107(3) |
C21 | 2067(6) | 152(8) | 7780(3) | 143(5) |
C22 | 2341(9) | -98(15) | 8043(4) | 245(12) |
C23 | 3211(10) | -7(15) | 8020(4) | 265(14) |
C24 | 3372(6) | 181(7) | 7735(3) | 115(4) |
C25 | 148(8) | 2929(6) | 7778(3) | 132(5) |
C26 | -109(15) | 2650(9) | 8041(4) | 241(10) |
C27 | -20(15) | 1780(9) | 8012(4) | 251(11) |
C28 | 178(6) | 1627(5) | 7733(3) | 108(3) |
C29 | 2932(7) | 4857(8) | 7776(3) | 139(5) |
C30 | 2645(10) | 5069(15) | 8049(3) | 225(11) |
C31 | 1762(10) | 4935(12) | 8032(3) | 182(7) |
C32 | 1624(6) | 4823(7) | 7726(2) | 108(3) |
C33 | 2528(8) | 2483(8) | 7869(3) | 139(4) |
Li1 | 3582(7) | 2583(7) | 7338(3) | 63(3) |
Li2 | 2588(6) | 1421(6) | 7338(3) | 60(3) |
Li3 | 1432(6) | 2421(6) | 7338(2) | 59(3) |
Li4 | 2417(6) | 3578(6) | 7336(3) | 59(3) |
C13A | 1824(13) | 2370(30) | 5893(5) | 183(17) |
C14A | 2080(15) | 2300(30) | 5611(5) | 120(7) |
C15A | 2929(16) | 2750(20) | 5635(6) | 123(9) |
C16A | 3188(14) | 2630(30) | 5904(5) | 192(19) |
C13B | 2650(20) | 1834(13) | 5897(5) | 146(9) |
C14B | 2710(30) | 2085(16) | 5626(6) | 146(9) |
C15B | 2270(30) | 2933(16) | 5622(6) | 146(14) |
C16B | 2350(30) | 3163(15) | 5899(5) | 200(20) |
K2 | 6957.4(7) | 1468.6(8) | 5553.0(3) | 48.6(3) |
K3 | 6467.3(8) | 3041.3(7) | 4447.1(3) | 48.9(3) |
K4 | 8530.3(8) | 1956.8(7) | 4447.1(3) | 48.6(3) |
K5 | 8043.7(7) | 3531.0(8) | 5552.8(3) | 48.9(3) |
Si5 | 5302.6(10) | 1891.9(11) | 5028.6(4) | 52.6(4) |
Si6 | 6176.6(10) | 3188.0(11) | 5940.9(4) | 53.5(4) |
Si7 | 8823.9(10) | 1812.2(11) | 5940.3(4) | 53.5(4) |
Si8 | 9695.7(9) | 3107.2(11) | 5028.5(4) | 52.2(4) |
Si9 | 6890.3(11) | 4698.9(10) | 4971.6(4) | 52.1(4) |
Si10 | 8187.3(11) | 3823.6(10) | 4059.8(4) | 54.2(4) |
Si11 | 6810.9(11) | 1176.6(10) | 4060.1(4) | 53.8(4) |
Si12 | 8108.6(11) | 303.2(10) | 4971.9(4) | 52.4(4) |
O11 | 6215(2) | 2085(2) | 5009.7(9) | 45.3(9) |
O12 | 6596(2) | 2987(2) | 5625.4(8) | 47.3(9) |
O13 | 8409(2) | 2008(2) | 5624.6(8) | 48.2(9) |
O14 | 8785(2) | 2913(2) | 5010.4(8) | 45.1(9) |
O15 | 7085(2) | 3782(2) | 4990.5(8) | 45.0(9) |
O16 | 7990(2) | 3403(2) | 4374.0(8) | 46.6(9) |
O17 | 7009(2) | 1592(2) | 4372.9(8) | 48.2(9) |
O18 | 7915(2) | 1217(2) | 4989.8(9) | 45.1(9) |
O19 | 6451(4) | 121(4) | 5840.4(14) | 99.8(19) |
O20 | 5118(4) | 3546(4) | 4159.4(15) | 98.1(19) |
O21 | 9877(4) | 1460(4) | 4157.6(14) | 96.8(19) |
O22 | 8543(4) | 4882(4) | 5841.8(15) | 97.9(19) |
C34 | 4988(4) | 1258(5) | 4707.3(18) | 77(2) |
C35 | 5037(4) | 1359(5) | 5383.2(17) | 71(2) |
C36 | 4733(5) | 2821(5) | 5014.7(19) | 82(2) |
C37 | 5128(4) | 3491(6) | 5896.8(18) | 80(2) |
C38 | 6181(5) | 2325(5) | 6201.7(16) | 82(2) |
C39 | 6690(5) | 3996(5) | 6152.6(16) | 73(2) |
C40 | 8809(5) | 2680(5) | 6204.6(17) | 79(2) |
C41 | 8312(5) | 1008(5) | 6150.2(16) | 72(2) |
C42 | 9867(4) | 1506(6) | 5896.0(19) | 81(2) |
C43 | 9964(4) | 3644(5) | 5381.4(17) | 74(2) |
C44 | 10269(5) | 2175(5) | 5020.5(18) | 78(2) |
C45 | 10014(4) | 3739(5) | 4706.6(18) | 78(2) |
C46 | 7820(5) | 5279(5) | 4980.6(18) | 80(2) |
C47 | 6258(5) | 5011(4) | 5297.7(17) | 80(2) |
C48 | 6359(5) | 4955(4) | 4616.7(17) | 72(2) |
C49 | 8488(6) | 4866(4) | 4102.4(17) | 80(2) |
C50 | 9002(5) | 3315(5) | 3848.4(15) | 74(2) |
C51 | 7332(5) | 3823(5) | 3795.7(17) | 80(2) |
C52 | 6002(5) | 1684(5) | 3848.9(16) | 74(2) |
C53 | 7677(5) | 1183(5) | 3795.4(17) | 79(2) |
C54 | 6506(6) | 121(4) | 4104.8(17) | 80(2) |
C55 | 8747(5) | -18(5) | 5290.4(17) | 79(2) |
C56 | 7180(5) | -276(5) | 4982(2) | 84(2) |
C57 | 8641(5) | 36(4) | 4620.4(17) | 70.2(19) |
C58 | 6842(6) | -605(6) | 5872(2) | 99(3) |
C59 | 6641(11) | -875(9) | 6174(3) | 177(6) |
C60 | 5950(8) | -429(9) | 6279(3) | 146(5) |
C61 | 5781(8) | 77(7) | 6028(3) | 150(5) |
C62 | 5073(8) | 4224(8) | 3976(3) | 148(5) |
C63 | 4590(10) | 4046(8) | 3722(3) | 144(5) |
C64 | 4124(9) | 3345(13) | 3823(4) | 201(9) |
C65 | 4396(5) | 3162(6) | 4126(2) | 101(3) |
C66 | 9918(8) | 777(8) | 3972(3) | 148(5) |
C67 | 10436(10) | 948(8) | 3730(3) | 150(5) |
C68 | 10877(9) | 1652(11) | 3830(3) | 172(6) |
C69 | 10598(5) | 1832(7) | 4125(2) | 105(3) |
C70 | 9205(8) | 4926(8) | 6031(3) | 146(5) |
C71 | 9044(8) | 5427(9) | 6276(3) | 142(4) |
C72 | 8349(11) | 5881(9) | 6171(3) | 174(6) |
C73 | 8174(7) | 5601(6) | 5872(2) | 104(3) |
Li5 | 6962(6) | 1510(6) | 4790(2) | 48(2) |
Li6 | 8045(5) | 3483(6) | 4789(2) | 45(2) |
Li7 | 6515(5) | 3027(5) | 5209(2) | 43(2) |
Li8 | 8481(6) | 1962(6) | 5209(2) | 48(2) |
Atom | U11 | U22 | U33 | U23 | U13 | U12 |
---|---|---|---|---|---|---|
K1 | 51.2(7) | 51.9(7) | 57.7(8) | 0.5(6) | 0.7(6) | -0.3(6) |
Si1 | 58.2(12) | 76.9(14) | 91.0(15) | -25.0(11) | -8.5(10) | 22.9(11) |
Si2 | 75.8(13) | 56.5(12) | 92.5(15) | -10.3(10) | 26.6(11) | -23.0(10) |
Si3 | 57.5(11) | 75.5(14) | 88.7(15) | 25.6(11) | 9.0(10) | 22.4(10) |
Si4 | 74.5(13) | 56.2(12) | 91.6(15) | 9.2(10) | -24.1(11) | -21.9(10) |
O1 | 47(2) | 48(2) | 79(3) | -11(2) | -3(2) | 5.3(19) |
O2 | 46(2) | 48(2) | 78(3) | -3(2) | 11(2) | -6.1(19) |
O3 | 42(2) | 48(2) | 81(3) | 10(2) | 4(2) | 6.1(19) |
O4 | 48(2) | 43(2) | 78(3) | 5(2) | -8(2) | -6.3(19) |
O5 | 140(6) | 127(6) | 76(4) | 3(4) | 4(4) | 1(5) |
O6 | 79(4) | 69(4) | 127(5) | -15(3) | -38(3) | -4(3) |
O7 | 67(3) | 80(4) | 130(5) | 40(3) | -14(3) | 5(3) |
O8 | 82(4) | 69(4) | 133(5) | 15(3) | 48(3) | -2(3) |
O9 | 67(3) | 86(4) | 126(5) | -45(3) | 16(3) | 4(3) |
O10 | 51(2) | 58(3) | 53(2) | 0.7(19) | 1.7(18) | -0.9(19) |
C1 | 74(5) | 98(6) | 92(6) | -27(5) | 14(4) | 7(5) |
C2 | 79(7) | 234(16) | 145(10) | -49(10) | -18(6) | 71(9) |
C3 | 188(12) | 58(5) | 114(8) | -22(5) | -13(7) | 32(6) |
C4 | 107(7) | 65(5) | 91(6) | 17(4) | 35(5) | -4(5) |
C5 | 245(17) | 79(7) | 142(10) | -26(6) | 55(10) | -65(9) |
C6 | 63(5) | 178(11) | 115(7) | -11(7) | 26(5) | -38(6) |
C7 | 71(5) | 108(7) | 91(6) | 33(5) | -13(4) | -3(5) |
C8 | 179(11) | 67(6) | 113(8) | 23(5) | 7(7) | 25(7) |
C9 | 82(7) | 264(18) | 141(10) | 60(10) | 22(7) | 79(9) |
C10 | 64(5) | 190(12) | 116(8) | 10(7) | -27(5) | -37(7) |
C11 | 233(16) | 68(6) | 157(11) | 21(6) | -56(10) | -67(8) |
C12 | 96(6) | 76(6) | 98(6) | -20(5) | -26(5) | 1(5) |
C17 | 143(10) | 92(8) | 167(11) | -16(7) | -90(9) | 0(7) |
C18 | 440(40) | 136(14) | 170(15) | 46(12) | -135(19) | -86(18) |
C19 | 310(20) | 141(13) | 152(14) | -26(10) | -90(14) | -47(15) |
C20 | 116(8) | 84(7) | 121(8) | -14(6) | -35(6) | -15(6) |
C21 | 85(7) | 179(12) | 165(11) | 113(10) | -23(7) | -18(7) |
C22 | 98(10) | 420(30) | 212(17) | 180(20) | 31(10) | 27(15) |
C23 | 146(14) | 450(40) | 199(17) | 200(20) | -11(12) | 80(18) |
C24 | 78(6) | 118(8) | 149(10) | 46(7) | -22(6) | 2(6) |
C25 | 144(10) | 91(7) | 163(10) | 15(7) | 90(8) | 5(7) |
C26 | 420(30) | 128(12) | 173(13) | -35(10) | 170(16) | -60(15) |
C27 | 430(30) | 126(11) | 198(14) | 3(11) | 186(17) | -77(15) |
C28 | 107(7) | 76(6) | 142(9) | 17(6) | 51(6) | -5(5) |
C29 | 104(8) | 148(11) | 165(11) | -95(9) | 19(7) | 0(7) |
C30 | 144(14) | 420(30) | 109(10) | -100(15) | -29(9) | 23(17) |
C31 | 162(14) | 260(20) | 121(11) | -68(11) | 22(9) | 55(14) |
C32 | 86(6) | 112(8) | 125(8) | -36(6) | 18(6) | 21(6) |
C33 | 137(11) | 151(11) | 131(10) | 0(8) | 15(8) | 5(9) |
Li1 | 61(7) | 58(7) | 69(7) | -12(5) | -8(5) | 2(5) |
Li2 | 53(6) | 52(6) | 75(7) | 4(5) | -2(5) | -3(5) |
Li3 | 48(6) | 52(6) | 75(7) | 9(5) | 8(5) | -1(5) |
Li4 | 50(6) | 53(6) | 75(7) | -6(5) | 11(5) | 0(5) |
C13A | 92(15) | 370(50) | 88(15) | 60(20) | -43(12) | -140(20) |
C14A | 110(14) | 170(20) | 77(13) | -25(16) | -17(11) | 24(16) |
C15A | 105(14) | 170(30) | 94(16) | 36(17) | 19(12) | 22(15) |
C16A | 99(17) | 390(60) | 86(16) | -30(20) | 28(13) | -130(30) |
C13B | 250(30) | 86(11) | 99(11) | -20(10) | -27(16) | 84(15) |
C14B | 250(30) | 86(11) | 99(11) | -20(10) | -27(16) | 84(15) |
C15B | 270(50) | 82(17) | 90(19) | 5(13) | -50(20) | 30(20) |
C16B | 430(60) | 103(18) | 77(16) | 30(13) | 30(20) | 150(30) |
K2 | 42.4(7) | 48.9(7) | 54.6(7) | 6.7(6) | 1.5(5) | -2.8(6) |
K3 | 49.2(7) | 43.0(7) | 54.6(7) | 1.8(5) | -5.7(6) | 1.6(6) |
K4 | 48.9(7) | 42.4(7) | 54.5(7) | -1.2(5) | 6.3(6) | 2.7(6) |
K5 | 42.9(7) | 48.9(7) | 54.9(8) | -6.4(6) | -0.9(5) | -1.7(6) |
Si5 | 39.8(8) | 56.1(10) | 62.0(10) | -3.6(8) | -0.2(7) | -2.5(8) |
Si6 | 45.2(9) | 66.1(11) | 49.1(9) | -5.8(8) | 7.8(7) | 1.6(8) |
Si7 | 46.3(9) | 64.7(11) | 49.4(9) | 5.7(8) | -5.7(7) | 1.7(8) |
Si8 | 38.1(8) | 56.1(10) | 62.4(10) | 3.5(8) | 1.5(7) | -2.7(8) |
Si9 | 56.4(10) | 38.8(9) | 61.1(10) | -1.1(7) | 4.1(8) | 2.4(8) |
Si10 | 65.6(11) | 46.3(9) | 50.6(10) | 7.1(7) | 6.4(8) | -2.4(8) |
Si11 | 64.6(11) | 47.5(10) | 49.2(10) | -7.8(7) | -4.9(8) | -3.3(8) |
Si12 | 56.2(10) | 39.0(9) | 62.1(10) | 0.6(7) | -1.7(8) | 2.3(8) |
O11 | 38(2) | 42(2) | 56(2) | -4.6(17) | 2.6(17) | -1.6(17) |
O12 | 44(2) | 50(2) | 47(2) | -3.5(17) | 5.3(17) | -1.6(18) |
O13 | 44(2) | 52(2) | 48(2) | 2.7(18) | -5.0(17) | -2.9(18) |
O14 | 38(2) | 44(2) | 53(2) | 5.1(17) | 0.0(16) | -2.0(17) |
O15 | 47(2) | 34(2) | 53(2) | 1.0(16) | 4.2(17) | 3.2(17) |
O16 | 49(2) | 43(2) | 48(2) | 7.5(17) | 3.3(17) | 2.2(18) |
O17 | 54(2) | 46(2) | 45(2) | -6.3(17) | -4.1(17) | 2.7(19) |
O18 | 43(2) | 37(2) | 54(2) | 0.1(17) | -2.5(17) | 0.2(17) |
O19 | 94(4) | 88(4) | 117(5) | 40(3) | 23(3) | -11(3) |
O20 | 83(4) | 90(4) | 121(5) | 24(4) | -39(3) | 8(3) |
O21 | 91(4) | 84(4) | 116(5) | -22(3) | 37(3) | 8(3) |
O22 | 91(4) | 85(4) | 118(5) | -40(3) | -20(3) | -10(3) |
C34 | 58(4) | 89(6) | 83(5) | -19(4) | -5(4) | -19(4) |
C35 | 48(4) | 77(5) | 90(5) | 5(4) | 6(3) | -20(4) |
C36 | 60(4) | 91(6) | 94(6) | 1(4) | 2(4) | 21(4) |
C37 | 55(4) | 108(6) | 76(5) | -29(4) | 8(3) | 14(4) |
C38 | 92(6) | 90(6) | 65(4) | 4(4) | 22(4) | -11(5) |
C39 | 75(5) | 84(5) | 58(4) | -19(4) | 7(3) | -8(4) |
C40 | 79(5) | 90(6) | 67(4) | -15(4) | -12(4) | -10(4) |
C41 | 78(5) | 81(5) | 59(4) | 18(4) | -6(3) | -5(4) |
C42 | 54(4) | 107(7) | 81(5) | 21(4) | -6(4) | 10(4) |
C43 | 52(4) | 86(5) | 84(5) | -5(4) | -4(3) | -16(4) |
C44 | 66(5) | 88(6) | 81(5) | 1(4) | -1(4) | 21(4) |
C45 | 57(4) | 93(6) | 85(5) | 24(4) | 4(4) | -18(4) |
C46 | 87(6) | 71(5) | 81(5) | -3(4) | 0(4) | -22(4) |
C47 | 102(6) | 56(4) | 81(5) | -7(4) | 29(4) | 17(4) |
C48 | 79(5) | 61(4) | 76(5) | 11(4) | -3(4) | 19(4) |
C49 | 113(6) | 52(4) | 75(5) | 8(3) | 21(4) | -19(4) |
C50 | 89(5) | 79(5) | 56(4) | 9(3) | 21(4) | 10(4) |
C51 | 85(5) | 90(6) | 65(5) | 19(4) | -10(4) | 12(5) |
C52 | 87(5) | 75(5) | 61(4) | -9(4) | -18(4) | 5(4) |
C53 | 83(5) | 91(6) | 64(4) | -26(4) | 9(4) | 7(4) |
C54 | 109(6) | 61(5) | 70(5) | -9(4) | -24(4) | -22(4) |
C55 | 96(6) | 62(5) | 81(5) | 0(4) | -23(4) | 21(4) |
C56 | 92(6) | 63(5) | 98(6) | -4(4) | 4(5) | -17(4) |
C57 | 77(5) | 50(4) | 84(5) | -8(3) | 4(4) | 16(4) |
C58 | 100(6) | 77(5) | 120(7) | 13(5) | 8(5) | -18(4) |
C59 | 265(17) | 133(11) | 132(9) | 57(8) | 58(10) | 44(10) |
C60 | 148(11) | 190(13) | 101(7) | 26(7) | 29(7) | -23(8) |
C61 | 140(10) | 115(9) | 196(12) | 52(8) | 85(9) | 4(7) |
C62 | 123(10) | 139(11) | 182(13) | 84(10) | -47(9) | 0(8) |
C63 | 227(16) | 119(10) | 87(7) | 22(7) | -31(9) | 29(10) |
C64 | 124(11) | 320(20) | 160(13) | 96(15) | -73(10) | -44(14) |
C65 | 69(6) | 110(8) | 125(8) | 1(6) | -7(5) | 11(5) |
C66 | 123(9) | 142(10) | 179(11) | -73(9) | 46(8) | 4(7) |
C67 | 193(13) | 133(10) | 124(9) | -29(7) | 45(8) | 21(8) |
C68 | 137(10) | 234(14) | 144(10) | -53(10) | 61(8) | -28(9) |
C69 | 72(6) | 130(8) | 113(7) | -8(6) | 17(5) | 15(6) |
C70 | 139(10) | 129(10) | 171(11) | -45(8) | -77(9) | -8(7) |
C71 | 132(9) | 182(12) | 112(8) | -27(7) | -22(6) | -32(8) |
C72 | 246(15) | 133(11) | 142(10) | -54(8) | -63(10) | 21(9) |
C73 | 119(8) | 77(6) | 114(7) | -16(5) | -7(5) | -15(6) |
Li5 | 46(5) | 48(5) | 50(5) | 3(4) | -2(4) | 1(4) |
Li6 | 43(5) | 48(5) | 45(5) | 2(4) | -1(4) | -5(4) |
Li7 | 45(5) | 36(5) | 48(5) | -3(4) | 2(4) | -1(4) |
Li8 | 49(5) | 44(5) | 51(5) | -2(4) | 2(4) | -3(4) |
Atom | Atom | Length/Å | Atom | Atom | Length/Å | |
---|---|---|---|---|---|---|
K1 | O1 | 2.808(5) | K3 | Li7 | 3.337(9) | |
K1 | O2 | 2.807(5) | K4 | Si8 | 3.770(3) | |
K1 | O3 | 2.809(5) | K4 | Si10 | 3.644(2) | |
K1 | O4 | 2.809(5) | K4 | Si11 | 3.627(3) | |
K1 | O5 | 2.842(6) | K4 | Si12 | 3.702(2) | |
K1 | C4 | 3.411(8) | K4 | O14 | 2.986(4) | |
K1 | C7 | 3.402(9) | K4 | O16 | 2.644(4) | |
K1 | C12 | 3.412(9) | K4 | O17 | 2.679(4) | |
K1 | Li1 | 3.169(12) | K4 | O18 | 2.887(4) | |
K1 | Li2 | 3.169(11) | K4 | O21 | 2.751(6) | |
K1 | Li3 | 3.157(10) | K4 | Li5 | 3.154(10) | |
K1 | Li4 | 3.159(11) | K4 | Li6 | 3.108(10) | |
Si1 | O1 | 1.596(5) | K4 | Li8 | 3.339(9) | |
Si1 | C1 | 1.847(9) | K5 | Si6 | 3.650(3) | |
Si1 | C2 | 1.872(11) | K5 | Si7 | 3.629(3) | |
Si1 | C3 | 1.870(10) | K5 | Si8 | 3.701(4) | |
Si2 | O2 | 1.588(4) | K5 | O12 | 2.649(4) | |
Si2 | C4 | 1.837(9) | K5 | O13 | 2.680(4) | |
Si2 | C5 | 1.859(10) | K5 | O14 | 2.889(4) | |
Si2 | C6 | 1.869(10) | K5 | O15 | 2.982(5) | |
Si3 | O3 | 1.588(5) | K5 | O22 | 2.756(6) | |
Si3 | C7 | 1.857(9) | K5 | C40 | 3.453(8) | |
Si3 | C8 | 1.879(10) | K5 | Li6 | 3.347(9) | |
Si3 | C9 | 1.852(10) | K5 | Li7 | 3.121(10) | |
Si4 | O4 | 1.594(5) | K5 | Li8 | 3.152(9) | |
Si4 | C10 | 1.859(10) | Si5 | O11 | 1.588(4) | |
Si4 | C11 | 1.873(10) | Si5 | C34 | 1.850(7) | |
Si4 | C12 | 1.855(9) | Si5 | C35 | 1.854(7) | |
O1 | Li1 | 1.883(12) | Si5 | C36 | 1.854(8) | |
O1 | Li2 | 1.881(11) | Si5 | Li5 | 3.080(10) | |
O2 | Li1 | 1.891(13) | Si5 | Li7 | 2.931(9) | |
O2 | Li4 | 1.883(11) | Si6 | O12 | 1.593(4) | |
O3 | Li3 | 1.875(11) | Si6 | C37 | 1.865(7) | |
O3 | Li4 | 1.886(13) | Si6 | C38 | 1.859(8) | |
O4 | Li2 | 1.889(12) | Si6 | C39 | 1.872(7) | |
O4 | Li3 | 1.889(12) | Si7 | O13 | 1.586(4) | |
O5 | C13A | 1.486(18) | Si7 | C40 | 1.875(8) | |
O5 | C16A | 1.463(19) | Si7 | C41 | 1.863(7) | |
O5 | C13B | 1.46(2) | Si7 | C42 | 1.858(7) | |
O5 | C16B | 1.45(2) | Si8 | O14 | 1.585(4) | |
O6 | C17 | 1.395(12) | Si8 | C43 | 1.851(8) | |
O6 | C20 | 1.400(10) | Si8 | C44 | 1.860(8) | |
O6 | Li1 | 1.972(13) | Si8 | C45 | 1.854(7) | |
O7 | C21 | 1.411(11) | Si8 | Li6 | 3.061(10) | |
O7 | C24 | 1.398(11) | Si8 | Li8 | 2.947(10) | |
O7 | Li2 | 1.976(12) | Si9 | O15 | 1.595(4) | |
O8 | C25 | 1.404(11) | Si9 | C46 | 1.863(8) | |
O8 | C28 | 1.397(10) | Si9 | C47 | 1.866(7) | |
O8 | Li3 | 1.998(11) | Si9 | C48 | 1.849(8) | |
O9 | C29 | 1.399(12) | Si9 | Li6 | 2.961(10) | |
O9 | C32 | 1.397(10) | Si9 | Li7 | 3.092(9) | |
O9 | Li4 | 1.986(12) | Si10 | O16 | 1.587(4) | |
O10 | C33 | 1.428(12) | Si10 | C49 | 1.853(7) | |
O10 | Li1 | 2.055(12) | Si10 | C50 | 1.879(7) | |
O10 | Li2 | 2.046(12) | Si10 | C51 | 1.857(8) | |
O10 | Li3 | 2.029(12) | Si11 | O17 | 1.577(4) | |
O10 | Li4 | 2.054(12) | Si11 | C52 | 1.867(8) | |
C17 | C18 | 1.362(18) | Si11 | C53 | 1.875(7) | |
C18 | C19 | 1.50(2) | Si11 | C54 | 1.879(8) | |
C19 | C20 | 1.407(17) | Si12 | O18 | 1.590(4) | |
C21 | C22 | 1.310(17) | Si12 | C55 | 1.848(8) | |
C22 | C23 | 1.49(2) | Si12 | C56 | 1.861(8) | |
C23 | C24 | 1.319(16) | Si12 | C57 | 1.844(7) | |
C25 | C26 | 1.319(15) | Si12 | Li5 | 2.939(10) | |
C26 | C27 | 1.49(2) | Si12 | Li8 | 3.070(10) | |
C27 | C28 | 1.293(16) | O11 | Li5 | 1.872(10) | |
C29 | C30 | 1.343(15) | O11 | Li7 | 1.893(10) | |
C30 | C31 | 1.52(2) | O12 | Li7 | 1.831(10) | |
C31 | C32 | 1.374(15) | O13 | Li8 | 1.826(10) | |
Li1 | Li2 | 2.599(16) | O14 | Li6 | 1.860(10) | |
Li1 | Li4 | 2.605(16) | O14 | Li8 | 1.908(10) | |
Li2 | Li3 | 2.597(15) | O15 | Li6 | 1.925(10) | |
Li3 | Li4 | 2.583(15) | O15 | Li7 | 1.871(9) | |
C13A | C14A | 1.31(3) | O16 | Li6 | 1.825(10) | |
C14A | C15A | 1.63(4) | O17 | Li5 | 1.832(10) | |
C15A | C16A | 1.27(3) | O18 | Li5 | 1.907(11) | |
C13B | C14B | 1.27(3) | O18 | Li8 | 1.857(10) | |
C14B | C15B | 1.63(3) | O19 | C58 | 1.408(11) | |
C15B | C16B | 1.28(3) | O19 | C61 | 1.408(11) | |
K2 | Si5 | 3.699(4) | O20 | C62 | 1.406(12) | |
K2 | Si6 | 3.633(2) | O20 | C65 | 1.397(11) | |
K2 | Si7 | 3.642(3) | O21 | C66 | 1.418(12) | |
K2 | Si12 | 3.775(3) | O21 | C69 | 1.388(11) | |
K2 | O11 | 2.888(5) | O22 | C70 | 1.398(12) | |
K2 | O12 | 2.672(4) | O22 | C73 | 1.380(11) | |
K2 | O13 | 2.651(4) | C58 | C59 | 1.444(14) | |
K2 | O18 | 2.989(4) | C59 | C60 | 1.472(18) | |
K2 | O19 | 2.752(6) | C60 | C61 | 1.424(16) | |
K2 | Li5 | 3.345(9) | C62 | C63 | 1.414(17) | |
K2 | Li7 | 3.139(9) | C63 | C64 | 1.499(19) | |
K2 | Li8 | 3.113(10) | C64 | C65 | 1.440(15) | |
K3 | Si9 | 3.705(2) | C66 | C67 | 1.411(16) | |
K3 | Si10 | 3.635(3) | C67 | C68 | 1.479(19) | |
K3 | Si11 | 3.642(2) | C68 | C69 | 1.409(14) | |
K3 | O11 | 2.983(4) | C70 | C71 | 1.395(16) | |
K3 | O15 | 2.889(4) | C71 | C72 | 1.483(19) | |
K3 | O16 | 2.680(4) | C72 | C73 | 1.425(14) | |
K3 | O17 | 2.649(4) | Li5 | Li7 | 3.257(13) | |
K3 | O20 | 2.752(6) | Li5 | Li8 | 3.258(14) | |
K3 | C48 | 3.342(8) | Li6 | Li7 | 3.280(12) | |
K3 | Li5 | 3.119(10) | Li6 | Li8 | 3.259(14) | |
K3 | Li6 | 3.160(10) |
Atom | Atom | Atom | Angle/˚ | Atom | Atom | Atom | Angle/˚ | |
---|---|---|---|---|---|---|---|---|
O1 | K1 | O2 | 70.28(14) | O13 | K5 | Li7 | 89.11(19) | |
O1 | K1 | O3 | 108.92(13) | O13 | K5 | Li8 | 35.33(19) | |
O1 | K1 | O4 | 70.20(13) | O14 | K5 | Si6 | 134.90(11) | |
O1 | K1 | O5 | 125.36(19) | O14 | K5 | Si7 | 86.12(8) | |
O1 | K1 | C4 | 107.04(19) | O14 | K5 | Si8 | 24.01(9) | |
O1 | K1 | C7 | 160.30(17) | O14 | K5 | O15 | 67.14(11) | |
O1 | K1 | C12 | 92.77(19) | O14 | K5 | C40 | 111.30(16) | |
O1 | K1 | Li1 | 36.1(2) | O14 | K5 | Li6 | 33.70(18) | |
O1 | K1 | Li2 | 36.1(2) | O14 | K5 | Li7 | 82.36(18) | |
O1 | K1 | Li3 | 81.8(2) | O14 | K5 | Li8 | 36.49(18) | |
O1 | K1 | Li4 | 82.1(2) | O15 | K5 | Si6 | 86.16(9) | |
O2 | K1 | O3 | 70.42(13) | O15 | K5 | Si7 | 134.47(9) | |
O2 | K1 | O4 | 108.97(13) | O15 | K5 | Si8 | 85.97(8) | |
O2 | K1 | O5 | 125.34(19) | O15 | K5 | C40 | 161.37(16) | |
O2 | K1 | C4 | 53.46(18) | O15 | K5 | Li6 | 34.82(18) | |
O2 | K1 | C7 | 107.4(2) | O15 | K5 | Li7 | 35.62(18) | |
O2 | K1 | C12 | 160.18(18) | O15 | K5 | Li8 | 81.7(2) | |
O2 | K1 | Li1 | 36.3(2) | O22 | K5 | Si6 | 100.77(15) | |
O2 | K1 | Li2 | 82.0(2) | O22 | K5 | Si7 | 110.12(16) | |
O2 | K1 | Li3 | 81.8(2) | O22 | K5 | Si8 | 102.33(14) | |
O2 | K1 | Li4 | 36.2(2) | O22 | K5 | O14 | 123.10(16) | |
O3 | K1 | O5 | 125.7(2) | O22 | K5 | O15 | 115.31(17) | |
O3 | K1 | C4 | 93.17(17) | O22 | K5 | C40 | 81.6(2) | |
O3 | K1 | C7 | 53.81(18) | O22 | K5 | Li6 | 118.6(2) | |
O3 | K1 | C12 | 107.38(19) | O22 | K5 | Li7 | 134.9(2) | |
O3 | K1 | Li1 | 82.2(2) | O22 | K5 | Li8 | 148.4(2) | |
O3 | K1 | Li2 | 82.0(2) | C40 | K5 | Si6 | 82.80(16) | |
O3 | K1 | Li3 | 36.0(2) | C40 | K5 | Si7 | 30.58(13) | |
O3 | K1 | Li4 | 36.3(2) | C40 | K5 | Si8 | 98.40(15) | |
O4 | K1 | O3 | 70.16(13) | Li6 | K5 | Si6 | 117.64(18) | |
O4 | K1 | O5 | 125.7(2) | Li6 | K5 | Si7 | 116.57(17) | |
O4 | K1 | C4 | 160.14(17) | Li6 | K5 | Si8 | 51.19(17) | |
O4 | K1 | C7 | 93.03(17) | Li6 | K5 | C40 | 144.6(2) | |
O4 | K1 | C12 | 53.78(18) | Li7 | K5 | Si6 | 57.13(16) | |
O4 | K1 | Li1 | 82.0(2) | Li7 | K5 | Si7 | 107.95(18) | |
O4 | K1 | Li2 | 36.2(2) | Li7 | K5 | Si8 | 106.19(16) | |
O4 | K1 | Li3 | 36.3(2) | Li7 | K5 | C40 | 126.6(2) | |
O4 | K1 | Li4 | 82.1(2) | Li7 | K5 | Li6 | 60.8(2) | |
O5 | K1 | C4 | 72.6(2) | Li7 | K5 | Li8 | 74.6(2) | |
O5 | K1 | C7 | 72.6(2) | Li8 | K5 | Si6 | 107.05(18) | |
O5 | K1 | C12 | 72.6(2) | Li8 | K5 | Si7 | 57.03(18) | |
O5 | K1 | Li1 | 144.2(3) | Li8 | K5 | Si8 | 50.15(17) | |
O5 | K1 | Li2 | 144.4(3) | Li8 | K5 | C40 | 87.2(2) | |
O5 | K1 | Li3 | 145.0(3) | Li8 | K5 | Li6 | 60.1(2) | |
O5 | K1 | Li4 | 144.5(3) | K2 | Si5 | K3 | 96.92(5) | |
C4 | K1 | C12 | 145.2(2) | O11 | Si5 | K2 | 47.99(16) | |
C7 | K1 | C4 | 85.1(2) | O11 | Si5 | K3 | 49.01(16) | |
C7 | K1 | C12 | 85.0(2) | O11 | Si5 | C34 | 111.2(3) | |
Li1 | K1 | C4 | 85.2(3) | O11 | Si5 | C35 | 112.6(3) | |
Li1 | K1 | C7 | 134.1(3) | O11 | Si5 | C36 | 109.4(3) | |
Li1 | K1 | C12 | 124.5(3) | O11 | Si5 | Li5 | 29.6(2) | |
Li2 | K1 | C4 | 133.6(3) | O11 | Si5 | Li7 | 36.0(2) | |
Li2 | K1 | C7 | 124.9(3) | C34 | Si5 | K2 | 125.3(3) | |
Li2 | K1 | C12 | 78.2(3) | C34 | Si5 | K3 | 86.5(3) | |
Li2 | K1 | Li1 | 48.4(3) | C34 | Si5 | C35 | 106.4(4) | |
Li3 | K1 | C4 | 124.5(2) | C34 | Si5 | C36 | 108.7(4) | |
Li3 | K1 | C7 | 78.5(3) | C34 | Si5 | Li5 | 83.2(3) | |
Li3 | K1 | C12 | 85.8(3) | C34 | Si5 | Li7 | 142.2(3) | |
Li3 | K1 | Li1 | 70.8(3) | C35 | Si5 | K2 | 64.6(2) | |
Li3 | K1 | Li2 | 48.5(3) | C35 | Si5 | K3 | 161.2(2) | |
Li3 | K1 | Li4 | 48.3(3) | C35 | Si5 | Li5 | 114.0(3) | |
Li4 | K1 | C4 | 78.1(2) | C35 | Si5 | Li7 | 105.6(3) | |
Li4 | K1 | C7 | 85.5(3) | C36 | Si5 | K2 | 125.6(3) | |
Li4 | K1 | C12 | 134.1(2) | C36 | Si5 | K3 | 79.1(3) | |
Li4 | K1 | Li1 | 48.6(3) | C36 | Si5 | C35 | 108.4(4) | |
Li4 | K1 | Li2 | 71.1(3) | C36 | Si5 | Li5 | 130.3(3) | |
O1 | Si1 | K1 | 46.96(18) | C36 | Si5 | Li7 | 79.3(3) | |
O1 | Si1 | C1 | 112.6(3) | Li5 | Si5 | K2 | 58.27(18) | |
O1 | Si1 | C2 | 112.1(4) | Li5 | Si5 | K3 | 52.98(19) | |
O1 | Si1 | C3 | 111.6(4) | Li7 | Si5 | K2 | 55.06(19) | |
C1 | Si1 | K1 | 68.2(3) | Li7 | Si5 | K3 | 58.07(18) | |
C1 | Si1 | C2 | 106.0(6) | Li7 | Si5 | Li5 | 65.6(3) | |
C1 | Si1 | C3 | 105.0(4) | K2 | Si6 | K5 | 65.92(5) | |
C2 | Si1 | K1 | 140.5(5) | O12 | Si6 | K2 | 42.05(15) | |
C3 | Si1 | K1 | 110.1(4) | O12 | Si6 | K5 | 40.51(16) | |
C3 | Si1 | C2 | 109.1(6) | O12 | Si6 | C37 | 113.5(3) | |
O2 | Si2 | K1 | 46.87(17) | O12 | Si6 | C38 | 111.2(3) | |
O2 | Si2 | C4 | 112.3(3) | O12 | Si6 | C39 | 112.2(3) | |
O2 | Si2 | C5 | 112.6(4) | C37 | Si6 | K2 | 121.6(3) | |
O2 | Si2 | C6 | 111.6(4) | C37 | Si6 | K5 | 137.7(3) | |
C4 | Si2 | K1 | 68.0(3) | C37 | Si6 | C39 | 107.0(4) | |
C4 | Si2 | C5 | 105.9(5) | C38 | Si6 | K2 | 69.6(2) | |
C4 | Si2 | C6 | 105.1(4) | C38 | Si6 | K5 | 114.2(3) | |
C5 | Si2 | K1 | 140.8(5) | C38 | Si6 | C37 | 106.5(4) | |
C5 | Si2 | C6 | 109.0(6) | C38 | Si6 | C39 | 105.9(4) | |
C6 | Si2 | K1 | 109.9(4) | C39 | Si6 | K2 | 130.7(2) | |
O3 | Si3 | K1 | 46.97(17) | C39 | Si6 | K5 | 73.1(2) | |
O3 | Si3 | C7 | 112.0(3) | K5 | Si7 | K2 | 66.04(6) | |
O3 | Si3 | C8 | 111.6(4) | O13 | Si7 | K2 | 40.75(15) | |
O3 | Si3 | C9 | 113.5(4) | O13 | Si7 | K5 | 42.42(16) | |
C7 | Si3 | K1 | 67.7(3) | O13 | Si7 | C40 | 111.5(3) | |
C7 | Si3 | C8 | 104.6(4) | O13 | Si7 | C41 | 112.2(3) | |
C8 | Si3 | K1 | 109.2(4) | O13 | Si7 | C42 | 113.0(3) | |
C9 | Si3 | K1 | 141.5(5) | C40 | Si7 | K2 | 113.6(3) | |
C9 | Si3 | C7 | 105.5(6) | C40 | Si7 | K5 | 69.5(3) | |
C9 | Si3 | C8 | 109.1(7) | C41 | Si7 | K2 | 72.9(2) | |
O4 | Si4 | K1 | 46.91(16) | C41 | Si7 | K5 | 130.6(3) | |
O4 | Si4 | C10 | 112.2(4) | C41 | Si7 | C40 | 105.4(4) | |
O4 | Si4 | C11 | 112.5(4) | C42 | Si7 | K2 | 137.5(3) | |
O4 | Si4 | C12 | 112.1(3) | C42 | Si7 | K5 | 121.6(3) | |
C10 | Si4 | K1 | 109.8(4) | C42 | Si7 | C40 | 107.4(4) | |
C10 | Si4 | C11 | 108.9(6) | C42 | Si7 | C41 | 107.0(4) | |
C11 | Si4 | K1 | 141.1(5) | K5 | Si8 | K4 | 96.99(5) | |
C12 | Si4 | K1 | 67.9(3) | O14 | Si8 | K4 | 49.17(16) | |
C12 | Si4 | C10 | 104.8(5) | O14 | Si8 | K5 | 47.89(15) | |
C12 | Si4 | C11 | 105.9(5) | O14 | Si8 | C43 | 112.6(3) | |
Si1 | O1 | K1 | 108.5(2) | O14 | Si8 | C44 | 109.5(3) | |
Si1 | O1 | Li1 | 137.2(5) | O14 | Si8 | C45 | 111.7(3) | |
Si1 | O1 | Li2 | 134.3(4) | O14 | Si8 | Li6 | 29.7(2) | |
Li1 | O1 | K1 | 82.5(4) | O14 | Si8 | Li8 | 36.0(2) | |
Li2 | O1 | K1 | 82.5(4) | C43 | Si8 | K4 | 161.4(2) | |
Li2 | O1 | Li1 | 87.3(5) | C43 | Si8 | K5 | 64.7(2) | |
Si2 | O2 | K1 | 108.7(2) | C43 | Si8 | C44 | 107.9(4) | |
Si2 | O2 | Li1 | 134.1(4) | C43 | Si8 | C45 | 106.1(4) | |
Si2 | O2 | Li4 | 137.5(4) | C43 | Si8 | Li6 | 114.1(3) | |
Li1 | O2 | K1 | 82.3(4) | C43 | Si8 | Li8 | 105.8(3) | |
Li4 | O2 | K1 | 82.1(4) | C44 | Si8 | K4 | 79.6(3) | |
Li4 | O2 | Li1 | 87.3(5) | C44 | Si8 | K5 | 125.1(3) | |
Si3 | O3 | K1 | 108.6(2) | C44 | Si8 | Li6 | 130.6(3) | |
Si3 | O3 | Li3 | 138.2(4) | C44 | Si8 | Li8 | 79.0(3) | |
Si3 | O3 | Li4 | 134.0(4) | C45 | Si8 | K4 | 86.6(3) | |
Li3 | O3 | K1 | 82.1(3) | C45 | Si8 | K5 | 125.6(3) | |
Li3 | O3 | Li4 | 86.8(5) | C45 | Si8 | C44 | 109.0(4) | |
Li4 | O3 | K1 | 82.0(3) | C45 | Si8 | Li6 | 83.5(3) | |
Si4 | O4 | K1 | 108.6(2) | C45 | Si8 | Li8 | 142.4(3) | |
Si4 | O4 | Li2 | 137.4(4) | Li6 | Si8 | K4 | 52.89(19) | |
Si4 | O4 | Li3 | 134.7(4) | Li6 | Si8 | K5 | 58.41(17) | |
Li2 | O4 | K1 | 82.3(4) | Li8 | Si8 | K4 | 58.07(19) | |
Li2 | O4 | Li3 | 86.8(5) | Li8 | Si8 | K5 | 55.20(19) | |
Li3 | O4 | K1 | 81.9(3) | Li8 | Si8 | Li6 | 65.7(3) | |
C13A | O5 | K1 | 127.3(10) | K3 | Si9 | K5 | 96.79(6) | |
C16A | O5 | K1 | 126.3(11) | O15 | Si9 | K3 | 47.88(15) | |
C16A | O5 | C13A | 106.4(14) | O15 | Si9 | K5 | 48.99(15) | |
C13B | O5 | K1 | 127.6(10) | O15 | Si9 | C46 | 109.9(3) | |
C16B | O5 | K1 | 127.2(10) | O15 | Si9 | C47 | 110.9(3) | |
C16B | O5 | C13B | 105.1(13) | O15 | Si9 | C48 | 112.0(3) | |
C17 | O6 | C20 | 107.4(7) | O15 | Si9 | Li6 | 36.4(2) | |
C17 | O6 | Li1 | 125.7(7) | O15 | Si9 | Li7 | 29.3(2) | |
C20 | O6 | Li1 | 126.3(7) | C46 | Si9 | K3 | 125.4(3) | |
C21 | O7 | Li2 | 126.3(6) | C46 | Si9 | K5 | 79.9(3) | |
C24 | O7 | C21 | 105.0(7) | C46 | Si9 | C47 | 108.8(4) | |
C24 | O7 | Li2 | 127.6(7) | C46 | Si9 | Li6 | 79.2(3) | |
C25 | O8 | Li3 | 125.9(6) | C46 | Si9 | Li7 | 130.9(3) | |
C28 | O8 | C25 | 105.1(6) | C47 | Si9 | K3 | 125.4(3) | |
C28 | O8 | Li3 | 128.1(6) | C47 | Si9 | K5 | 86.1(3) | |
C29 | O9 | Li4 | 126.4(6) | C47 | Si9 | Li6 | 142.0(3) | |
C32 | O9 | C29 | 106.2(7) | C47 | Si9 | Li7 | 83.4(3) | |
C32 | O9 | Li4 | 126.9(7) | C48 | Si9 | K3 | 64.1(2) | |
C33 | O10 | Li1 | 114.2(7) | C48 | Si9 | K5 | 160.6(2) | |
C33 | O10 | Li2 | 115.0(7) | C48 | Si9 | C46 | 107.8(4) | |
C33 | O10 | Li3 | 118.2(7) | C48 | Si9 | C47 | 107.2(4) | |
C33 | O10 | Li4 | 117.4(7) | C48 | Si9 | Li6 | 105.1(3) | |
Li2 | O10 | Li1 | 78.7(5) | C48 | Si9 | Li7 | 113.5(3) | |
Li2 | O10 | Li4 | 127.6(5) | Li6 | Si9 | K3 | 55.23(19) | |
Li3 | O10 | Li1 | 127.6(5) | Li6 | Si9 | K5 | 58.10(18) | |
Li3 | O10 | Li2 | 79.2(5) | Li6 | Si9 | Li7 | 65.6(2) | |
Li3 | O10 | Li4 | 78.5(5) | Li7 | Si9 | K3 | 57.96(17) | |
Li4 | O10 | Li1 | 78.7(5) | Li7 | Si9 | K5 | 52.94(18) | |
Si1 | C1 | K1 | 81.7(3) | K3 | Si10 | K4 | 65.95(4) | |
Si2 | C4 | K1 | 82.0(2) | O16 | Si10 | K3 | 42.19(16) | |
Si3 | C7 | K1 | 82.0(3) | O16 | Si10 | K4 | 40.38(15) | |
Si4 | C12 | K1 | 81.8(3) | O16 | Si10 | C49 | 113.7(3) | |
C18 | C17 | O6 | 105.9(12) | O16 | Si10 | C50 | 112.2(3) | |
C17 | C18 | C19 | 107.0(13) | O16 | Si10 | C51 | 111.9(3) | |
C20 | C19 | C18 | 103.9(12) | C49 | Si10 | K3 | 121.7(3) | |
O6 | C20 | C19 | 103.7(10) | C49 | Si10 | K4 | 137.9(3) | |
C22 | C21 | O7 | 109.1(11) | C49 | Si10 | C50 | 106.6(4) | |
C21 | C22 | C23 | 105.0(12) | C49 | Si10 | C51 | 106.2(4) | |
C24 | C23 | C22 | 107.2(13) | C50 | Si10 | K3 | 131.0(3) | |
C23 | C24 | O7 | 106.1(11) | C50 | Si10 | K4 | 73.2(2) | |
C26 | C25 | O8 | 108.6(11) | C51 | Si10 | K3 | 70.2(3) | |
C25 | C26 | C27 | 104.5(11) | C51 | Si10 | K4 | 114.5(3) | |
C28 | C27 | C26 | 107.9(12) | C51 | Si10 | C50 | 105.7(4) | |
C27 | C28 | O8 | 106.5(10) | K4 | Si11 | K3 | 66.05(5) | |
C30 | C29 | O9 | 107.1(11) | O17 | Si11 | K3 | 40.53(15) | |
C29 | C30 | C31 | 106.0(11) | O17 | Si11 | K4 | 42.27(16) | |
C32 | C31 | C30 | 103.6(11) | O17 | Si11 | C52 | 112.3(3) | |
C31 | C32 | O9 | 104.5(10) | O17 | Si11 | C53 | 111.6(3) | |
O1 | Li1 | K1 | 61.4(3) | O17 | Si11 | C54 | 113.3(3) | |
O1 | Li1 | O2 | 117.8(6) | C52 | Si11 | K3 | 73.1(2) | |
O1 | Li1 | O6 | 115.1(6) | C52 | Si11 | K4 | 130.9(3) | |
O1 | Li1 | O10 | 96.4(5) | C52 | Si11 | C53 | 105.6(4) | |
O1 | Li1 | Li2 | 46.3(4) | C52 | Si11 | C54 | 106.8(4) | |
O1 | Li1 | Li4 | 121.2(6) | C53 | Si11 | K3 | 114.2(3) | |
O2 | Li1 | K1 | 61.4(3) | C53 | Si11 | K4 | 69.8(3) | |
O2 | Li1 | O6 | 112.4(6) | C53 | Si11 | C54 | 106.7(4) | |
O2 | Li1 | O10 | 96.5(5) | C54 | Si11 | K3 | 137.6(3) | |
O2 | Li1 | Li2 | 121.4(6) | C54 | Si11 | K4 | 121.5(3) | |
O2 | Li1 | Li4 | 46.2(4) | K4 | Si12 | K2 | 96.97(6) | |
O6 | Li1 | K1 | 163.3(6) | O18 | Si12 | K2 | 49.20(14) | |
O6 | Li1 | O10 | 116.1(6) | O18 | Si12 | K4 | 47.85(14) | |
O6 | Li1 | Li2 | 125.1(6) | O18 | Si12 | C55 | 111.9(3) | |
O6 | Li1 | Li4 | 122.9(6) | O18 | Si12 | C56 | 109.9(3) | |
O10 | Li1 | K1 | 80.5(4) | O18 | Si12 | C57 | 112.6(3) | |
O10 | Li1 | Li2 | 50.5(4) | O18 | Si12 | Li5 | 36.3(2) | |
O10 | Li1 | Li4 | 50.6(4) | O18 | Si12 | Li8 | 29.4(2) | |
Li2 | Li1 | K1 | 65.8(4) | C55 | Si12 | K2 | 87.2(3) | |
Li2 | Li1 | Li4 | 90.0(5) | C55 | Si12 | K4 | 125.4(3) | |
Li4 | Li1 | K1 | 65.5(4) | C55 | Si12 | C56 | 108.8(4) | |
O1 | Li2 | K1 | 61.4(3) | C55 | Si12 | Li5 | 143.1(3) | |
O1 | Li2 | O4 | 117.9(6) | C55 | Si12 | Li8 | 84.0(3) | |
O1 | Li2 | O7 | 112.8(6) | C56 | Si12 | K2 | 79.6(3) | |
O1 | Li2 | O10 | 96.8(5) | C56 | Si12 | K4 | 125.6(3) | |
O1 | Li2 | Li1 | 46.4(4) | C56 | Si12 | Li5 | 79.3(3) | |
O1 | Li2 | Li3 | 121.1(6) | C56 | Si12 | Li8 | 130.7(3) | |
O4 | Li2 | K1 | 61.5(3) | C57 | Si12 | K2 | 161.4(2) | |
O4 | Li2 | O7 | 114.7(6) | C57 | Si12 | K4 | 64.7(2) | |
O4 | Li2 | O10 | 96.3(5) | C57 | Si12 | C55 | 105.6(4) | |
O4 | Li2 | Li1 | 121.5(6) | C57 | Si12 | C56 | 107.9(4) | |
O4 | Li2 | Li3 | 46.6(4) | C57 | Si12 | Li5 | 105.7(3) | |
O7 | Li2 | K1 | 163.4(6) | C57 | Si12 | Li8 | 114.1(3) | |
O7 | Li2 | O10 | 116.0(6) | Li5 | Si12 | K2 | 58.18(19) | |
O7 | Li2 | Li1 | 123.0(6) | Li5 | Si12 | K4 | 55.28(19) | |
O7 | Li2 | Li3 | 125.1(6) | Li5 | Si12 | Li8 | 65.6(3) | |
O10 | Li2 | K1 | 80.6(4) | Li8 | Si12 | K2 | 52.90(17) | |
O10 | Li2 | Li1 | 50.8(4) | Li8 | Si12 | K4 | 58.18(18) | |
O10 | Li2 | Li3 | 50.1(4) | K2 | O11 | K3 | 144.59(14) | |
Li1 | Li2 | K1 | 65.8(4) | Si5 | O11 | K2 | 107.9(2) | |
Li3 | Li2 | K1 | 65.5(3) | Si5 | O11 | K3 | 107.3(2) | |
Li3 | Li2 | Li1 | 89.7(5) | Si5 | O11 | Li5 | 125.6(4) | |
O3 | Li3 | K1 | 61.8(3) | Si5 | O11 | Li7 | 114.4(3) | |
O3 | Li3 | O4 | 118.1(6) | Li5 | O11 | K2 | 86.5(3) | |
O3 | Li3 | O8 | 114.6(6) | Li5 | O11 | K3 | 76.1(3) | |
O3 | Li3 | O10 | 97.6(5) | Li5 | O11 | Li7 | 119.8(4) | |
O3 | Li3 | Li2 | 122.3(5) | Li7 | O11 | K2 | 79.1(3) | |
O3 | Li3 | Li4 | 46.8(4) | Li7 | O11 | K3 | 83.1(3) | |
O4 | Li3 | K1 | 61.7(3) | K5 | O12 | K2 | 96.24(13) | |
O4 | Li3 | O8 | 111.6(6) | Si6 | O12 | K2 | 114.4(2) | |
O4 | Li3 | O10 | 96.9(5) | Si6 | O12 | K5 | 116.5(2) | |
O4 | Li3 | Li2 | 46.6(4) | Si6 | O12 | Li7 | 145.5(4) | |
O4 | Li3 | Li4 | 122.0(5) | Li7 | O12 | K2 | 86.3(3) | |
O8 | Li3 | K1 | 162.8(6) | Li7 | O12 | K5 | 86.3(3) | |
O8 | Li3 | O10 | 115.9(6) | K2 | O13 | K5 | 96.00(13) | |
O8 | Li3 | Li2 | 122.4(5) | Si7 | O13 | K2 | 116.3(2) | |
O8 | Li3 | Li4 | 125.5(6) | Si7 | O13 | K5 | 114.1(2) | |
O10 | Li3 | K1 | 81.1(3) | Si7 | O13 | Li8 | 146.1(4) | |
O10 | Li3 | Li2 | 50.7(4) | Li8 | O13 | K2 | 86.0(3) | |
O10 | Li3 | Li4 | 51.2(4) | Li8 | O13 | K5 | 86.6(3) | |
Li2 | Li3 | K1 | 66.0(3) | K5 | O14 | K4 | 144.56(14) | |
Li4 | Li3 | K1 | 65.9(3) | Si8 | O14 | K4 | 107.2(2) | |
Li4 | Li3 | Li2 | 90.5(5) | Si8 | O14 | K5 | 108.1(2) | |
O2 | Li4 | K1 | 61.7(3) | Si8 | O14 | Li6 | 125.3(4) | |
O2 | Li4 | O3 | 118.4(6) | Si8 | O14 | Li8 | 114.8(4) | |
O2 | Li4 | O9 | 114.8(6) | Li6 | O14 | K4 | 75.9(3) | |
O2 | Li4 | O10 | 96.8(5) | Li6 | O14 | K5 | 86.8(3) | |
O2 | Li4 | Li1 | 46.5(4) | Li6 | O14 | Li8 | 119.7(5) | |
O2 | Li4 | Li3 | 121.6(6) | Li8 | O14 | K4 | 82.9(3) | |
O3 | Li4 | K1 | 61.7(3) | Li8 | O14 | K5 | 79.3(3) | |
O3 | Li4 | O9 | 112.4(6) | K3 | O15 | K5 | 144.62(14) | |
O3 | Li4 | O10 | 96.4(5) | Si9 | O15 | K3 | 107.96(19) | |
O3 | Li4 | Li1 | 121.7(6) | Si9 | O15 | K5 | 107.21(19) | |
O3 | Li4 | Li3 | 46.4(4) | Si9 | O15 | Li6 | 114.2(3) | |
O9 | Li4 | K1 | 163.6(6) | Si9 | O15 | Li7 | 126.1(3) | |
O9 | Li4 | O10 | 115.6(6) | Li6 | O15 | K3 | 79.3(3) | |
O9 | Li4 | Li1 | 124.7(6) | Li6 | O15 | K5 | 83.0(3) | |
O9 | Li4 | Li3 | 122.6(5) | Li7 | O15 | K3 | 86.2(3) | |
O10 | Li4 | K1 | 80.7(3) | Li7 | O15 | K5 | 76.3(3) | |
O10 | Li4 | Li1 | 50.7(4) | Li7 | O15 | Li6 | 119.5(4) | |
O10 | Li4 | Li3 | 50.3(4) | K4 | O16 | K3 | 96.17(13) | |
Li1 | Li4 | K1 | 65.9(3) | Si10 | O16 | K3 | 114.4(2) | |
Li3 | Li4 | K1 | 65.8(3) | Si10 | O16 | K4 | 116.7(2) | |
Li3 | Li4 | Li1 | 89.9(5) | Si10 | O16 | Li6 | 145.0(4) | |
C14A | C13A | O5 | 109.1(19) | Li6 | O16 | K3 | 86.9(3) | |
C13A | C14A | C15A | 101(2) | Li6 | O16 | K4 | 86.1(3) | |
C16A | C15A | C14A | 107(2) | K3 | O17 | K4 | 96.07(13) | |
C15A | C16A | O5 | 107(2) | Si11 | O17 | K3 | 116.7(2) | |
C14B | C13B | O5 | 109.0(19) | Si11 | O17 | K4 | 114.4(2) | |
C13B | C14B | C15B | 106(2) | Si11 | O17 | Li5 | 145.2(4) | |
C16B | C15B | C14B | 102(2) | Li5 | O17 | K3 | 86.2(3) | |
C15B | C16B | O5 | 111(2) | Li5 | O17 | K4 | 86.6(3) | |
Si5 | K2 | Si12 | 94.47(5) | K4 | O18 | K2 | 144.70(14) | |
Si6 | K2 | Si5 | 81.71(5) | Si12 | O18 | K2 | 107.05(18) | |
Si6 | K2 | Si7 | 88.39(6) | Si12 | O18 | K4 | 108.04(18) | |
Si6 | K2 | Si12 | 158.09(5) | Si12 | O18 | Li5 | 114.1(4) | |
Si7 | K2 | Si5 | 156.75(6) | Si12 | O18 | Li8 | 125.8(4) | |
Si7 | K2 | Si12 | 86.90(6) | Li5 | O18 | K2 | 83.0(3) | |
O11 | K2 | Si5 | 24.11(8) | Li5 | O18 | K4 | 79.4(3) | |
O11 | K2 | Si6 | 86.21(8) | Li8 | O18 | K2 | 76.0(3) | |
O11 | K2 | Si7 | 134.78(10) | Li8 | O18 | K4 | 86.6(3) | |
O11 | K2 | Si12 | 82.01(8) | Li8 | O18 | Li5 | 119.9(5) | |
O11 | K2 | O18 | 67.02(10) | C58 | O19 | K2 | 128.8(5) | |
O11 | K2 | Li5 | 33.95(18) | C61 | O19 | K2 | 124.4(6) | |
O11 | K2 | Li7 | 36.30(18) | C61 | O19 | C58 | 106.1(7) | |
O11 | K2 | Li8 | 82.3(2) | C62 | O20 | K3 | 124.2(6) | |
O12 | K2 | Si5 | 73.19(10) | C65 | O20 | K3 | 129.2(6) | |
O12 | K2 | Si6 | 23.53(8) | C65 | O20 | C62 | 106.1(8) | |
O12 | K2 | Si7 | 89.45(10) | C66 | O21 | K4 | 123.9(6) | |
O12 | K2 | Si12 | 134.95(9) | C69 | O21 | K4 | 130.1(5) | |
O12 | K2 | O11 | 69.33(11) | C69 | O21 | C66 | 105.6(7) | |
O12 | K2 | O18 | 111.21(11) | C70 | O22 | K5 | 124.4(7) | |
O12 | K2 | O19 | 132.63(17) | C73 | O22 | K5 | 129.9(6) | |
O12 | K2 | Li5 | 95.70(19) | C73 | O22 | C70 | 105.1(8) | |
O12 | K2 | Li7 | 35.60(18) | Si7 | C40 | K5 | 79.9(2) | |
O12 | K2 | Li8 | 89.4(2) | Si9 | C48 | K3 | 86.0(3) | |
O13 | K2 | Si5 | 135.47(10) | O19 | C58 | C59 | 104.9(9) | |
O13 | K2 | Si6 | 90.41(11) | C58 | C59 | C60 | 108.2(11) | |
O13 | K2 | Si7 | 22.99(9) | C61 | C60 | C59 | 103.3(9) | |
O13 | K2 | Si12 | 77.15(11) | O19 | C61 | C60 | 108.7(11) | |
O13 | K2 | O11 | 112.15(14) | O20 | C62 | C63 | 107.7(11) | |
O13 | K2 | O12 | 82.31(13) | C62 | C63 | C64 | 104.2(10) | |
O13 | K2 | O18 | 68.82(13) | C65 | C64 | C63 | 105.9(12) | |
O13 | K2 | O19 | 121.72(18) | O20 | C65 | C64 | 106.0(10) | |
O13 | K2 | Li5 | 96.1(2) | C67 | C66 | O21 | 107.1(11) | |
O13 | K2 | Li7 | 89.2(2) | C66 | C67 | C68 | 105.1(10) | |
O13 | K2 | Li8 | 35.8(2) | C69 | C68 | C67 | 106.1(11) | |
O18 | K2 | Si5 | 85.98(9) | O21 | C69 | C68 | 107.1(10) | |
O18 | K2 | Si6 | 134.50(9) | C71 | C70 | O22 | 109.3(12) | |
O18 | K2 | Si7 | 86.10(10) | C70 | C71 | C72 | 103.7(11) | |
O18 | K2 | Si12 | 23.75(8) | C73 | C72 | C71 | 106.0(12) | |
O18 | K2 | Li5 | 34.46(18) | O22 | C73 | C72 | 106.8(10) | |
O18 | K2 | Li7 | 81.62(17) | K3 | Li5 | K2 | 119.8(3) | |
O18 | K2 | Li8 | 35.35(19) | K3 | Li5 | K4 | 78.3(2) | |
O19 | K2 | Si5 | 101.99(15) | K3 | Li5 | Li7 | 63.1(2) | |
O19 | K2 | Si6 | 109.93(15) | K3 | Li5 | Li8 | 106.7(3) | |
O19 | K2 | Si7 | 101.15(16) | K4 | Li5 | K2 | 119.0(3) | |
O19 | K2 | Si12 | 91.98(15) | K4 | Li5 | Li7 | 106.0(3) | |
O19 | K2 | O11 | 122.84(17) | K4 | Li5 | Li8 | 62.7(2) | |
O19 | K2 | O18 | 115.45(16) | Si5 | Li5 | K2 | 70.2(2) | |
O19 | K2 | Li5 | 118.4(2) | Si5 | Li5 | K3 | 75.0(2) | |
O19 | K2 | Li7 | 147.9(2) | Si5 | Li5 | K4 | 152.4(4) | |
O19 | K2 | Li8 | 135.0(2) | Si5 | Li5 | Li7 | 55.0(2) | |
Li5 | K2 | Si5 | 51.56(18) | Si5 | Li5 | Li8 | 118.9(3) | |
Li5 | K2 | Si6 | 116.89(18) | Si12 | Li5 | K2 | 73.5(2) | |
Li5 | K2 | Si7 | 117.30(19) | Si12 | Li5 | K3 | 153.0(3) | |
Li5 | K2 | Si12 | 48.29(17) | Si12 | Li5 | K4 | 74.7(2) | |
Li7 | K2 | Si5 | 49.94(18) | Si12 | Li5 | Si5 | 131.5(3) | |
Li7 | K2 | Si6 | 57.20(16) | Si12 | Li5 | Li7 | 123.7(4) | |
Li7 | K2 | Si7 | 107.21(18) | Si12 | Li5 | Li8 | 59.1(3) | |
Li7 | K2 | Si12 | 104.06(16) | O11 | Li5 | K2 | 59.5(3) | |
Li7 | K2 | Li5 | 60.2(2) | O11 | Li5 | K3 | 68.2(3) | |
Li8 | K2 | Si5 | 106.22(19) | O11 | Li5 | K4 | 133.9(5) | |
Li8 | K2 | Si6 | 108.33(18) | O11 | Li5 | Si5 | 24.78(19) | |
Li8 | K2 | Si7 | 57.15(19) | O11 | Li5 | Si12 | 132.4(5) | |
Li8 | K2 | Si12 | 51.86(18) | O11 | Li5 | O18 | 118.4(5) | |
Li8 | K2 | Li5 | 60.5(3) | O11 | Li5 | Li7 | 30.3(3) | |
Li8 | K2 | Li7 | 74.9(2) | O11 | Li5 | Li8 | 97.1(4) | |
Si10 | K3 | Si9 | 81.70(6) | O17 | Li5 | K2 | 176.0(5) | |
Si10 | K3 | Si11 | 88.36(7) | O17 | Li5 | K3 | 57.9(3) | |
Si11 | K3 | Si9 | 156.82(6) | O17 | Li5 | K4 | 58.0(3) | |
O11 | K3 | Si9 | 85.99(8) | O17 | Li5 | Si5 | 111.3(4) | |
O11 | K3 | Si10 | 134.55(10) | O17 | Li5 | Si12 | 107.1(4) | |
O11 | K3 | Si11 | 86.20(8) | O17 | Li5 | O11 | 120.2(5) | |
O11 | K3 | C48 | 109.79(15) | O17 | Li5 | O18 | 116.1(5) | |
O11 | K3 | Li5 | 35.63(18) | O17 | Li5 | Li7 | 120.7(5) | |
O11 | K3 | Li6 | 82.02(19) | O17 | Li5 | Li8 | 120.5(5) | |
O11 | K3 | Li7 | 34.28(17) | O18 | Li5 | K2 | 62.5(3) | |
O15 | K3 | Si9 | 24.17(8) | O18 | Li5 | K3 | 131.8(4) | |
O15 | K3 | Si10 | 86.18(10) | O18 | Li5 | K4 | 64.1(3) | |
O15 | K3 | Si11 | 134.80(9) | O18 | Li5 | Si5 | 132.6(4) | |
O15 | K3 | O11 | 67.02(10) | O18 | Li5 | Si12 | 29.6(2) | |
O15 | K3 | C48 | 54.02(15) | O18 | Li5 | Li7 | 98.4(4) | |
O15 | K3 | Li5 | 82.6(2) | O18 | Li5 | Li8 | 29.6(3) | |
O15 | K3 | Li6 | 36.78(19) | Li7 | Li5 | K2 | 56.8(2) | |
O15 | K3 | Li7 | 34.03(17) | Li7 | Li5 | Li8 | 71.4(3) | |
O16 | K3 | Si9 | 73.33(11) | Li8 | Li5 | K2 | 56.2(2) | |
O16 | K3 | Si10 | 23.43(9) | K3 | Li6 | K5 | 118.5(3) | |
O16 | K3 | Si11 | 89.34(10) | K3 | Li6 | Li7 | 62.4(2) | |
O16 | K3 | O11 | 111.33(14) | K3 | Li6 | Li8 | 105.7(3) | |
O16 | K3 | O15 | 69.43(13) | K4 | Li6 | K3 | 78.4(2) | |
O16 | K3 | O20 | 132.68(17) | K4 | Li6 | K5 | 120.2(3) | |
O16 | K3 | C48 | 81.77(17) | K4 | Li6 | Li7 | 106.5(3) | |
O16 | K3 | Li5 | 89.4(2) | K4 | Li6 | Li8 | 63.2(2) | |
O16 | K3 | Li6 | 35.21(18) | Si8 | Li6 | K3 | 152.8(3) | |
O16 | K3 | Li7 | 95.7(2) | Si8 | Li6 | K4 | 75.3(2) | |
O17 | K3 | Si9 | 135.72(11) | Si8 | Li6 | K5 | 70.4(2) | |
O17 | K3 | Si10 | 90.18(10) | Si8 | Li6 | Li7 | 119.0(3) | |
O17 | K3 | Si11 | 22.76(9) | Si8 | Li6 | Li8 | 55.5(2) | |
O17 | K3 | O11 | 69.22(12) | Si9 | Li6 | K3 | 74.4(2) | |
O17 | K3 | O15 | 112.37(12) | Si9 | Li6 | K4 | 152.8(3) | |
O17 | K3 | O16 | 82.12(13) | Si9 | Li6 | K5 | 73.2(2) | |
O17 | K3 | O20 | 121.54(17) | Si9 | Li6 | Si8 | 131.3(3) | |
O17 | K3 | C48 | 162.07(17) | Si9 | Li6 | Li7 | 59.1(2) | |
O17 | K3 | Li5 | 35.87(19) | Si9 | Li6 | Li8 | 123.5(3) | |
O17 | K3 | Li6 | 89.1(2) | O14 | Li6 | K3 | 134.1(4) | |
O17 | K3 | Li7 | 96.20(18) | O14 | Li6 | K4 | 68.7(3) | |
O20 | K3 | Si9 | 101.97(16) | O14 | Li6 | K5 | 59.5(3) | |
O20 | K3 | Si10 | 110.03(15) | O14 | Li6 | Si8 | 25.00(19) | |
O20 | K3 | Si11 | 101.09(16) | O14 | Li6 | Si9 | 132.1(4) | |
O20 | K3 | O11 | 115.30(17) | O14 | Li6 | O15 | 118.1(5) | |
O20 | K3 | O15 | 122.86(18) | O14 | Li6 | Li7 | 96.9(4) | |
O20 | K3 | C48 | 75.6(2) | O14 | Li6 | Li8 | 30.6(3) | |
O20 | K3 | Li5 | 134.8(2) | O15 | Li6 | K3 | 63.9(3) | |
O20 | K3 | Li6 | 148.1(2) | O15 | Li6 | K4 | 131.9(4) | |
O20 | K3 | Li7 | 118.6(2) | O15 | Li6 | K5 | 62.2(3) | |
C48 | K3 | Si9 | 29.85(13) | O15 | Li6 | Si8 | 132.5(4) | |
C48 | K3 | Si10 | 78.02(15) | O15 | Li6 | Si9 | 29.42(19) | |
C48 | K3 | Si11 | 163.65(14) | O15 | Li6 | Li7 | 29.8(2) | |
Li5 | K3 | Si9 | 106.54(19) | O15 | Li6 | Li8 | 98.2(4) | |
Li5 | K3 | Si10 | 108.26(18) | O16 | Li6 | K3 | 57.9(3) | |
Li5 | K3 | Si11 | 56.91(18) | O16 | Li6 | K4 | 58.1(3) | |
Li5 | K3 | C48 | 136.1(2) | O16 | Li6 | K5 | 175.8(5) | |
Li5 | K3 | Li6 | 75.1(3) | O16 | Li6 | Si8 | 111.8(4) | |
Li5 | K3 | Li7 | 60.5(2) | O16 | Li6 | Si9 | 106.8(4) | |
Li6 | K3 | Si9 | 50.34(18) | O16 | Li6 | O14 | 120.9(5) | |
Li6 | K3 | Si10 | 56.72(16) | O16 | Li6 | O15 | 115.7(5) | |
Li6 | K3 | Si11 | 106.90(18) | O16 | Li6 | Li7 | 120.1(4) | |
Li6 | K3 | C48 | 73.2(2) | O16 | Li6 | Li8 | 121.0(5) | |
Li6 | K3 | Li7 | 60.6(2) | Li7 | Li6 | K5 | 56.2(2) | |
Li7 | K3 | Si9 | 51.77(15) | Li8 | Li6 | K5 | 57.0(2) | |
Li7 | K3 | Si10 | 116.80(18) | Li8 | Li6 | Li7 | 71.1(3) | |
Li7 | K3 | Si11 | 117.09(16) | K2 | Li7 | K3 | 119.5(3) | |
Li7 | K3 | C48 | 77.6(2) | K2 | Li7 | Li5 | 63.0(2) | |
Si10 | K4 | Si8 | 86.92(6) | K2 | Li7 | Li6 | 106.2(3) | |
Si10 | K4 | Si12 | 156.79(5) | K5 | Li7 | K2 | 78.5(2) | |
Si11 | K4 | Si8 | 158.00(6) | K5 | Li7 | K3 | 120.0(3) | |
Si11 | K4 | Si10 | 88.44(7) | K5 | Li7 | Li5 | 107.1(3) | |
Si11 | K4 | Si12 | 81.71(7) | K5 | Li7 | Li6 | 63.0(2) | |
Si12 | K4 | Si8 | 94.38(5) | Si5 | Li7 | K2 | 75.0(2) | |
O14 | K4 | Si8 | 23.68(8) | Si5 | Li7 | K3 | 73.7(2) | |
O14 | K4 | Si10 | 86.18(9) | Si5 | Li7 | K5 | 153.5(3) | |
O14 | K4 | Si11 | 134.49(10) | Si5 | Li7 | Si9 | 131.3(3) | |
O14 | K4 | Si12 | 85.88(8) | Si5 | Li7 | Li5 | 59.4(2) | |
O14 | K4 | Li5 | 81.9(2) | Si5 | Li7 | Li6 | 124.2(3) | |
O14 | K4 | Li6 | 35.47(19) | Si9 | Li7 | K2 | 152.6(3) | |
O14 | K4 | Li8 | 34.54(18) | Si9 | Li7 | K3 | 70.27(19) | |
O16 | K4 | Si8 | 77.38(11) | Si9 | Li7 | K5 | 74.8(2) | |
O16 | K4 | Si10 | 22.88(8) | Si9 | Li7 | Li5 | 119.3(3) | |
O16 | K4 | Si11 | 90.22(10) | Si9 | Li7 | Li6 | 55.3(2) | |
O16 | K4 | Si12 | 135.53(10) | O11 | Li7 | K2 | 64.6(3) | |
O16 | K4 | O14 | 69.12(12) | O11 | Li7 | K3 | 62.6(3) | |
O16 | K4 | O17 | 82.25(13) | O11 | Li7 | K5 | 132.7(4) | |
O16 | K4 | O18 | 112.23(12) | O11 | Li7 | Si5 | 29.56(19) | |
O16 | K4 | O21 | 121.26(16) | O11 | Li7 | Si9 | 132.7(4) | |
O16 | K4 | Li5 | 89.3(2) | O11 | Li7 | Li5 | 29.9(2) | |
O16 | K4 | Li6 | 35.85(19) | O11 | Li7 | Li6 | 98.9(4) | |
O16 | K4 | Li8 | 96.27(19) | O12 | Li7 | K2 | 58.1(3) | |
O17 | K4 | Si8 | 135.06(10) | O12 | Li7 | K3 | 176.6(5) | |
O17 | K4 | Si10 | 89.50(11) | O12 | Li7 | K5 | 57.9(3) | |
O17 | K4 | Si11 | 23.33(9) | O12 | Li7 | Si5 | 107.1(4) | |
O17 | K4 | Si12 | 73.24(11) | O12 | Li7 | Si9 | 110.7(4) | |
O17 | K4 | O14 | 111.38(14) | O12 | Li7 | O11 | 116.5(5) | |
O17 | K4 | O18 | 69.39(14) | O12 | Li7 | O15 | 119.8(5) | |
O17 | K4 | O21 | 132.61(17) | O12 | Li7 | Li5 | 121.0(4) | |
O17 | K4 | Li5 | 35.4(2) | O12 | Li7 | Li6 | 120.7(4) | |
O17 | K4 | Li6 | 89.7(2) | O15 | Li7 | K2 | 134.5(4) | |
O17 | K4 | Li8 | 95.5(2) | O15 | Li7 | K3 | 59.8(3) | |
O18 | K4 | Si8 | 81.97(9) | O15 | Li7 | K5 | 68.1(3) | |
O18 | K4 | Si10 | 134.79(9) | O15 | Li7 | Si5 | 132.7(4) | |
O18 | K4 | Si11 | 86.15(10) | O15 | Li7 | Si9 | 24.63(18) | |
O18 | K4 | Si12 | 24.11(8) | O15 | Li7 | O11 | 119.0(5) | |
O18 | K4 | O14 | 66.97(10) | O15 | Li7 | Li5 | 97.7(4) | |
O18 | K4 | Li5 | 36.5(2) | O15 | Li7 | Li6 | 30.7(3) | |
O18 | K4 | Li6 | 82.53(18) | Li5 | Li7 | K3 | 56.5(2) | |
O18 | K4 | Li8 | 33.72(18) | Li5 | Li7 | Li6 | 71.7(3) | |
O21 | K4 | Si8 | 91.95(15) | Li6 | Li7 | K3 | 57.0(2) | |
O21 | K4 | Si10 | 100.69(15) | K2 | Li8 | K4 | 120.4(3) | |
O21 | K4 | Si11 | 110.04(15) | K2 | Li8 | K5 | 78.5(2) | |
O21 | K4 | Si12 | 102.42(15) | K2 | Li8 | Li5 | 63.3(2) | |
O21 | K4 | O14 | 115.37(17) | K2 | Li8 | Li6 | 107.4(3) | |
O21 | K4 | O18 | 123.27(17) | K5 | Li8 | K4 | 119.1(3) | |
O21 | K4 | Li5 | 148.2(2) | K5 | Li8 | Li5 | 106.4(3) | |
O21 | K4 | Li6 | 134.4(2) | K5 | Li8 | Li6 | 62.9(2) | |
O21 | K4 | Li8 | 118.9(2) | Si8 | Li8 | K2 | 153.1(3) | |
Li5 | K4 | Si8 | 104.31(19) | Si8 | Li8 | K4 | 73.4(2) | |
Li5 | K4 | Si10 | 107.24(18) | Si8 | Li8 | K5 | 74.6(2) | |
Li5 | K4 | Si11 | 56.85(18) | Si8 | Li8 | Si12 | 131.3(3) | |
Li5 | K4 | Si12 | 49.98(18) | Si8 | Li8 | Li5 | 124.0(4) | |
Li5 | K4 | Li8 | 60.2(3) | Si8 | Li8 | Li6 | 58.9(2) | |
Li6 | K4 | Si8 | 51.77(18) | Si12 | Li8 | K2 | 75.2(2) | |
Li6 | K4 | Si10 | 56.96(17) | Si12 | Li8 | K4 | 70.4(2) | |
Li6 | K4 | Si11 | 108.42(18) | Si12 | Li8 | K5 | 152.9(3) | |
Li6 | K4 | Si12 | 106.44(17) | Si12 | Li8 | Li5 | 55.2(2) | |
Li6 | K4 | Li5 | 75.3(2) | Si12 | Li8 | Li6 | 119.4(4) | |
Li6 | K4 | Li8 | 60.6(2) | O13 | Li8 | K2 | 58.1(3) | |
Li8 | K4 | Si8 | 48.51(17) | O13 | Li8 | K4 | 176.7(5) | |
Li8 | K4 | Si10 | 117.30(17) | O13 | Li8 | K5 | 58.1(3) | |
Li8 | K4 | Si11 | 116.51(19) | O13 | Li8 | Si8 | 106.7(4) | |
Li8 | K4 | Si12 | 51.40(17) | O13 | Li8 | Si12 | 111.3(4) | |
Si6 | K5 | Si8 | 156.80(6) | O13 | Li8 | O14 | 115.9(5) | |
Si7 | K5 | Si6 | 88.34(5) | O13 | Li8 | O18 | 120.6(5) | |
Si7 | K5 | Si8 | 81.75(5) | O13 | Li8 | Li5 | 121.2(5) | |
O12 | K5 | Si6 | 22.98(9) | O13 | Li8 | Li6 | 120.9(5) | |
O12 | K5 | Si7 | 90.10(11) | O14 | Li8 | K2 | 132.5(4) | |
O12 | K5 | Si8 | 135.46(10) | O14 | Li8 | K4 | 62.5(3) | |
O12 | K5 | O13 | 82.19(12) | O14 | Li8 | K5 | 64.2(3) | |
O12 | K5 | O14 | 112.25(14) | O14 | Li8 | Si8 | 29.2(2) | |
O12 | K5 | O15 | 69.06(13) | O14 | Li8 | Si12 | 132.8(4) | |
O12 | K5 | O22 | 121.43(17) | O14 | Li8 | Li5 | 99.1(4) | |
O12 | K5 | C40 | 95.93(18) | O14 | Li8 | Li6 | 29.7(3) | |
O12 | K5 | Li6 | 96.5(2) | O18 | Li8 | K2 | 68.7(3) | |
O12 | K5 | Li7 | 35.84(18) | O18 | Li8 | K4 | 59.7(3) | |
O12 | K5 | Li8 | 89.0(2) | O18 | Li8 | K5 | 134.6(5) | |
O13 | K5 | Si6 | 89.58(9) | O18 | Li8 | Si8 | 132.4(4) | |
O13 | K5 | Si7 | 23.53(9) | O18 | Li8 | Si12 | 24.84(19) | |
O13 | K5 | Si8 | 73.07(9) | O18 | Li8 | O14 | 118.8(5) | |
O13 | K5 | O14 | 69.15(11) | O18 | Li8 | Li5 | 30.5(3) | |
O13 | K5 | O15 | 111.20(12) | O18 | Li8 | Li6 | 97.6(4) | |
O13 | K5 | O22 | 132.82(18) | Li5 | Li8 | K4 | 57.1(2) | |
O13 | K5 | C40 | 53.95(15) | Li6 | Li8 | K4 | 56.2(2) | |
O13 | K5 | Li6 | 95.36(19) | Li6 | Li8 | Li5 | 71.9(3) |
A | B | C | D | Angle/˚ | A | B | C | D | Angle/˚ | |
---|---|---|---|---|---|---|---|---|---|---|
K1 | Si1 | O1 | Li1 | -99.1(7) | K4 | Si10 | O16 | K3 | -111.1(3) | |
K1 | Si1 | O1 | Li2 | 97.7(6) | K4 | Si10 | O16 | Li6 | 125.9(7) | |
K1 | Si2 | O2 | Li1 | 97.6(6) | K4 | Si11 | O17 | K3 | 111.0(3) | |
K1 | Si2 | O2 | Li4 | -98.9(7) | K4 | Si11 | O17 | Li5 | -122.6(7) | |
K1 | Si3 | O3 | Li3 | -99.2(7) | K4 | Si12 | O18 | K2 | 176.1(2) | |
K1 | Si3 | O3 | Li4 | 96.9(6) | K4 | Si12 | O18 | Li5 | 86.2(4) | |
K1 | Si4 | O4 | Li2 | -99.1(6) | K4 | Si12 | O18 | Li8 | -99.1(4) | |
K1 | Si4 | O4 | Li3 | 97.2(6) | K4 | O14 | Li6 | K3 | 47.2(5) | |
K1 | O1 | Li1 | O2 | -25.4(6) | K4 | O14 | Li6 | K5 | 148.83(14) | |
K1 | O1 | Li1 | O6 | -161.7(6) | K4 | O14 | Li6 | Si8 | -101.2(3) | |
K1 | O1 | Li1 | O10 | 75.5(4) | K4 | O14 | Li6 | Si9 | 159.1(6) | |
K1 | O1 | Li1 | Li2 | 82.8(4) | K4 | O14 | Li6 | O15 | 127.1(5) | |
K1 | O1 | Li1 | Li4 | 28.2(6) | K4 | O14 | Li6 | O16 | -26.4(5) | |
K1 | O1 | Li2 | O4 | 25.4(6) | K4 | O14 | Li6 | Li7 | 105.1(3) | |
K1 | O1 | Li2 | O7 | 162.7(6) | K4 | O14 | Li6 | Li8 | 73.1(4) | |
K1 | O1 | Li2 | O10 | -75.4(4) | K4 | O16 | Li6 | K3 | -96.41(12) | |
K1 | O1 | Li2 | Li1 | -82.8(4) | K4 | O16 | Li6 | Si8 | 55.2(3) | |
K1 | O1 | Li2 | Li3 | -28.5(6) | K4 | O16 | Li6 | Si9 | -155.1(3) | |
K1 | O2 | Li1 | O1 | 25.4(6) | K4 | O16 | Li6 | O14 | 29.2(5) | |
K1 | O2 | Li1 | O6 | 162.8(6) | K4 | O16 | Li6 | O15 | -124.9(5) | |
K1 | O2 | Li1 | O10 | -75.4(4) | K4 | O16 | Li6 | Li7 | -91.5(4) | |
K1 | O2 | Li1 | Li2 | -28.3(5) | K4 | O16 | Li6 | Li8 | -6.6(4) | |
K1 | O2 | Li1 | Li4 | -82.4(4) | K4 | O17 | Li5 | K3 | 96.32(13) | |
K1 | O2 | Li4 | O3 | -25.4(6) | K4 | O17 | Li5 | Si5 | 151.4(3) | |
K1 | O2 | Li4 | O9 | -162.1(6) | K4 | O17 | Li5 | Si12 | -58.8(3) | |
K1 | O2 | Li4 | O10 | 75.6(4) | K4 | O17 | Li5 | O11 | 125.6(6) | |
K1 | O2 | Li4 | Li1 | 82.6(4) | K4 | O17 | Li5 | O18 | -28.4(5) | |
K1 | O2 | Li4 | Li3 | 28.6(6) | K4 | O17 | Li5 | Li7 | 90.3(4) | |
K1 | O3 | Li3 | O4 | -26.4(5) | K4 | O17 | Li5 | Li8 | 5.0(4) | |
K1 | O3 | Li3 | O8 | -161.2(6) | K4 | O18 | Li8 | K2 | 149.02(15) | |
K1 | O3 | Li3 | O10 | 75.6(4) | K4 | O18 | Li8 | K5 | 102.4(5) | |
K1 | O3 | Li3 | Li2 | 27.8(6) | K4 | O18 | Li8 | Si8 | -10.9(6) | |
K1 | O3 | Li3 | Li4 | 82.4(3) | K4 | O18 | Li8 | Si12 | -109.9(3) | |
K1 | O3 | Li4 | O2 | 25.4(6) | K4 | O18 | Li8 | O13 | 176.2(6) | |
K1 | O3 | Li4 | O9 | 163.1(6) | K4 | O18 | Li8 | O14 | 21.3(5) | |
K1 | O3 | Li4 | O10 | -75.9(3) | K4 | O18 | Li8 | Li5 | 75.7(4) | |
K1 | O3 | Li4 | Li1 | -28.7(6) | K4 | O18 | Li8 | Li6 | 43.3(3) | |
K1 | O3 | Li4 | Li3 | -82.5(4) | K4 | O21 | C66 | C67 | 143.8(10) | |
K1 | O4 | Li2 | O1 | -25.4(6) | K4 | O21 | C69 | C68 | -142.6(10) | |
K1 | O4 | Li2 | O7 | -161.9(6) | K5 | Si6 | O12 | K2 | 111.1(3) | |
K1 | O4 | Li2 | O10 | 75.7(4) | K5 | Si6 | O12 | Li7 | -126.6(7) | |
K1 | O4 | Li2 | Li1 | 28.3(6) | K5 | Si7 | O13 | K2 | -110.4(3) | |
K1 | O4 | Li2 | Li3 | 82.3(3) | K5 | Si7 | O13 | Li8 | 123.1(7) | |
K1 | O4 | Li3 | O3 | 26.5(5) | K5 | Si8 | O14 | K4 | -176.3(2) | |
K1 | O4 | Li3 | O8 | 162.5(6) | K5 | Si8 | O14 | Li6 | 99.1(5) | |
K1 | O4 | Li3 | O10 | -76.0(3) | K5 | Si8 | O14 | Li8 | -86.3(4) | |
K1 | O4 | Li3 | Li2 | -82.7(4) | K5 | Si9 | O15 | K3 | -176.1(2) | |
K1 | O4 | Li3 | Li4 | -28.0(6) | K5 | Si9 | O15 | Li6 | -90.0(4) | |
K1 | O5 | C13A | C14A | -171(2) | K5 | Si9 | O15 | Li7 | 85.3(4) | |
K1 | O5 | C16A | C15A | -166(2) | K5 | Si9 | C48 | K3 | 10.2(9) | |
K1 | O5 | C13B | C14B | -171(3) | K5 | O12 | Li7 | K2 | 96.52(12) | |
K1 | O5 | C16B | C15B | -169(3) | K5 | O12 | Li7 | Si5 | 155.8(3) | |
Si1 | O1 | Li1 | K1 | 109.1(6) | K5 | O12 | Li7 | Si9 | -55.4(3) | |
Si1 | O1 | Li1 | O2 | 83.8(9) | K5 | O12 | Li7 | O11 | 125.5(5) | |
Si1 | O1 | Li1 | O6 | -52.5(10) | K5 | O12 | Li7 | O15 | -30.0(5) | |
Si1 | O1 | Li1 | O10 | -175.4(4) | K5 | O12 | Li7 | Li5 | 91.7(4) | |
Si1 | O1 | Li1 | Li2 | -168.1(7) | K5 | O12 | Li7 | Li6 | 5.7(4) | |
Si1 | O1 | Li1 | Li4 | 137.3(6) | K5 | O13 | Li8 | K2 | -96.27(13) | |
Si1 | O1 | Li2 | K1 | -108.6(5) | K5 | O13 | Li8 | Si8 | 59.2(3) | |
Si1 | O1 | Li2 | O4 | -83.1(8) | K5 | O13 | Li8 | Si12 | -152.0(3) | |
Si1 | O1 | Li2 | O7 | 54.1(9) | K5 | O13 | Li8 | O14 | 29.3(5) | |
Si1 | O1 | Li2 | O10 | 176.0(4) | K5 | O13 | Li8 | O18 | -126.3(6) | |
Si1 | O1 | Li2 | Li1 | 168.7(7) | K5 | O13 | Li8 | Li5 | -90.6(4) | |
Si1 | O1 | Li2 | Li3 | -137.0(6) | K5 | O13 | Li8 | Li6 | -4.1(4) | |
Si2 | O2 | Li1 | K1 | -108.7(5) | K5 | O14 | Li6 | K3 | -101.6(5) | |
Si2 | O2 | Li1 | O1 | -83.4(8) | K5 | O14 | Li6 | K4 | -148.83(14) | |
Si2 | O2 | Li1 | O6 | 54.1(8) | K5 | O14 | Li6 | Si8 | 110.0(4) | |
Si2 | O2 | Li1 | O10 | 175.9(4) | K5 | O14 | Li6 | Si9 | 10.3(5) | |
Si2 | O2 | Li1 | Li2 | -137.0(6) | K5 | O14 | Li6 | O15 | -21.7(5) | |
Si2 | O2 | Li1 | Li4 | 168.9(7) | K5 | O14 | Li6 | O16 | -175.2(5) | |
Si2 | O2 | Li4 | K1 | 109.2(6) | K5 | O14 | Li6 | Li7 | -43.8(3) | |
Si2 | O2 | Li4 | O3 | 83.8(8) | K5 | O14 | Li6 | Li8 | -75.7(4) | |
Si2 | O2 | Li4 | O9 | -52.9(10) | K5 | O15 | Li7 | K2 | -46.0(5) | |
Si2 | O2 | Li4 | O10 | -175.2(4) | K5 | O15 | Li7 | K3 | -149.02(14) | |
Si2 | O2 | Li4 | Li1 | -168.2(7) | K5 | O15 | Li7 | Si5 | -160.4(6) | |
Si2 | O2 | Li4 | Li3 | 137.8(6) | K5 | O15 | Li7 | Si9 | 101.5(4) | |
Si3 | O3 | Li3 | K1 | 109.2(6) | K5 | O15 | Li7 | O11 | -127.8(5) | |
Si3 | O3 | Li3 | O4 | 82.8(8) | K5 | O15 | Li7 | O12 | 27.1(5) | |
Si3 | O3 | Li3 | O8 | -52.0(10) | K5 | O15 | Li7 | Li5 | -105.4(3) | |
Si3 | O3 | Li3 | O10 | -175.2(4) | K5 | O15 | Li7 | Li6 | -73.6(4) | |
Si3 | O3 | Li3 | Li2 | 137.0(6) | K5 | O22 | C70 | C71 | -142.0(9) | |
Si3 | O3 | Li3 | Li4 | -168.4(7) | K5 | O22 | C73 | C72 | 142.0(10) | |
Si3 | O3 | Li4 | K1 | -108.2(5) | Si5 | O11 | Li5 | K2 | -109.6(4) | |
Si3 | O3 | Li4 | O2 | -82.8(8) | Si5 | O11 | Li5 | K3 | 101.5(4) | |
Si3 | O3 | Li4 | O9 | 54.9(8) | Si5 | O11 | Li5 | K4 | 148.1(4) | |
Si3 | O3 | Li4 | O10 | 175.9(4) | Si5 | O11 | Li5 | Si12 | -99.2(6) | |
Si3 | O3 | Li4 | Li1 | -136.9(5) | Si5 | O11 | Li5 | O17 | 75.0(7) | |
Si3 | O3 | Li4 | Li3 | 169.3(6) | Si5 | O11 | Li5 | O18 | -131.6(5) | |
Si4 | O4 | Li2 | K1 | 109.2(5) | Si5 | O11 | Li5 | Li7 | 175.1(7) | |
Si4 | O4 | Li2 | O1 | 83.8(8) | Si5 | O11 | Li5 | Li8 | -153.3(3) | |
Si4 | O4 | Li2 | O7 | -52.7(9) | Si5 | O11 | Li7 | K2 | 104.8(3) | |
Si4 | O4 | Li2 | O10 | -175.1(4) | Si5 | O11 | Li7 | K3 | -105.9(3) | |
Si4 | O4 | Li2 | Li1 | 137.5(5) | Si5 | O11 | Li7 | K5 | 147.4(4) | |
Si4 | O4 | Li2 | Li3 | -168.5(7) | Si5 | O11 | Li7 | Si9 | -101.1(5) | |
Si4 | O4 | Li3 | K1 | -108.3(5) | Si5 | O11 | Li7 | O12 | 77.7(6) | |
Si4 | O4 | Li3 | O3 | -81.8(7) | Si5 | O11 | Li7 | O15 | -126.6(5) | |
Si4 | O4 | Li3 | O8 | 54.2(8) | Si5 | O11 | Li7 | Li5 | -175.6(6) | |
Si4 | O4 | Li3 | O10 | 175.7(4) | Si5 | O11 | Li7 | Li6 | -151.3(3) | |
Si4 | O4 | Li3 | Li2 | 169.1(6) | Si6 | O12 | Li7 | K2 | -129.5(6) | |
Si4 | O4 | Li3 | Li4 | -136.3(6) | Si6 | O12 | Li7 | K5 | 134.0(6) | |
O1 | Si1 | C1 | K1 | -15.6(3) | Si6 | O12 | Li7 | Si5 | -70.2(7) | |
O2 | Si2 | C4 | K1 | -15.7(3) | Si6 | O12 | Li7 | Si9 | 78.6(7) | |
O3 | Si3 | C7 | K1 | -15.9(3) | Si6 | O12 | Li7 | O11 | -100.5(7) | |
O4 | Si4 | C12 | K1 | -16.2(3) | Si6 | O12 | Li7 | O15 | 104.0(7) | |
O5 | C13A | C14A | C15A | -22(4) | Si6 | O12 | Li7 | Li5 | -134.4(5) | |
O5 | C13B | C14B | C15B | -22(5) | Si6 | O12 | Li7 | Li6 | 139.7(5) | |
O6 | C17 | C18 | C19 | -12(2) | Si7 | O13 | Li8 | K2 | 133.8(7) | |
O7 | C21 | C22 | C23 | -9(2) | Si7 | O13 | Li8 | K5 | -130.0(6) | |
O8 | C25 | C26 | C27 | -10(2) | Si7 | O13 | Li8 | Si8 | -70.8(7) | |
O9 | C29 | C30 | C31 | -9(2) | Si7 | O13 | Li8 | Si12 | 78.1(7) | |
C1 | Si1 | O1 | K1 | 20.0(4) | Si7 | O13 | Li8 | O14 | -100.7(7) | |
C1 | Si1 | O1 | Li1 | -79.0(7) | Si7 | O13 | Li8 | O18 | 103.7(8) | |
C1 | Si1 | O1 | Li2 | 117.7(7) | Si7 | O13 | Li8 | Li5 | 139.4(5) | |
C2 | Si1 | O1 | K1 | 139.5(6) | Si7 | O13 | Li8 | Li6 | -134.1(6) | |
C2 | Si1 | O1 | Li1 | 40.4(9) | Si8 | O14 | Li6 | K3 | 148.5(4) | |
C2 | Si1 | O1 | Li2 | -122.8(8) | Si8 | O14 | Li6 | K4 | 101.2(3) | |
C2 | Si1 | C1 | K1 | -138.5(5) | Si8 | O14 | Li6 | K5 | -110.0(4) | |
C3 | Si1 | O1 | K1 | -97.8(4) | Si8 | O14 | Li6 | Si9 | -99.7(5) | |
C3 | Si1 | O1 | Li1 | 163.2(7) | Si8 | O14 | Li6 | O15 | -131.7(4) | |
C3 | Si1 | O1 | Li2 | -0.1(8) | Si8 | O14 | Li6 | O16 | 74.9(7) | |
C3 | Si1 | C1 | K1 | 106.0(4) | Si8 | O14 | Li6 | Li7 | -153.7(3) | |
C4 | Si2 | O2 | K1 | 20.1(4) | Si8 | O14 | Li6 | Li8 | 174.3(7) | |
C4 | Si2 | O2 | Li1 | 117.8(6) | Si9 | O15 | Li7 | K2 | -147.5(4) | |
C4 | Si2 | O2 | Li4 | -78.8(7) | Si9 | O15 | Li7 | K3 | 109.5(4) | |
C5 | Si2 | O2 | K1 | 139.5(6) | Si9 | O15 | Li7 | K5 | -101.5(4) | |
C5 | Si2 | O2 | Li1 | -122.9(8) | Si9 | O15 | Li7 | Si5 | 98.1(6) | |
C5 | Si2 | O2 | Li4 | 40.6(9) | Si9 | O15 | Li7 | O11 | 130.8(5) | |
C5 | Si2 | C4 | K1 | -138.9(5) | Si9 | O15 | Li7 | O12 | -74.3(7) | |
C6 | Si2 | O2 | K1 | -97.5(4) | Si9 | O15 | Li7 | Li5 | 153.1(3) | |
C6 | Si2 | O2 | Li1 | 0.1(7) | Si9 | O15 | Li7 | Li6 | -175.1(7) | |
C6 | Si2 | O2 | Li4 | 163.5(7) | Si10 | O16 | Li6 | K3 | 130.1(6) | |
C6 | Si2 | C4 | K1 | 105.8(4) | Si10 | O16 | Li6 | K4 | -133.5(6) | |
C7 | Si3 | O3 | K1 | 20.3(4) | Si10 | O16 | Li6 | Si8 | -78.3(7) | |
C7 | Si3 | O3 | Li3 | -78.9(7) | Si10 | O16 | Li6 | Si9 | 71.4(7) | |
C7 | Si3 | O3 | Li4 | 117.3(6) | Si10 | O16 | Li6 | O14 | -104.4(7) | |
C8 | Si3 | O3 | K1 | -96.6(4) | Si10 | O16 | Li6 | O15 | 101.6(7) | |
C8 | Si3 | O3 | Li3 | 164.2(7) | Si10 | O16 | Li6 | Li7 | 135.0(5) | |
C8 | Si3 | O3 | Li4 | 0.4(7) | Si10 | O16 | Li6 | Li8 | -140.1(5) | |
C8 | Si3 | C7 | K1 | 105.1(4) | Si11 | O17 | Li5 | K3 | -133.9(6) | |
C9 | Si3 | O3 | K1 | 139.6(6) | Si11 | O17 | Li5 | K4 | 129.7(6) | |
C9 | Si3 | O3 | Li3 | 40.4(9) | Si11 | O17 | Li5 | Si5 | -78.9(7) | |
C9 | Si3 | O3 | Li4 | -123.4(8) | Si11 | O17 | Li5 | Si12 | 70.9(7) | |
C9 | Si3 | C7 | K1 | -139.9(5) | Si11 | O17 | Li5 | O11 | -104.6(7) | |
C10 | Si4 | O4 | K1 | -96.8(4) | Si11 | O17 | Li5 | O18 | 101.4(7) | |
C10 | Si4 | O4 | Li2 | 164.1(7) | Si11 | O17 | Li5 | Li7 | -139.9(5) | |
C10 | Si4 | O4 | Li3 | 0.3(7) | Si11 | O17 | Li5 | Li8 | 134.7(6) | |
C10 | Si4 | C12 | K1 | 105.7(4) | Si12 | O18 | Li8 | K2 | -101.1(3) | |
C11 | Si4 | O4 | K1 | 140.0(6) | Si12 | O18 | Li8 | K4 | 109.9(3) | |
C11 | Si4 | O4 | Li2 | 40.9(9) | Si12 | O18 | Li8 | K5 | -147.8(4) | |
C11 | Si4 | O4 | Li3 | -122.9(8) | Si12 | O18 | Li8 | Si8 | 98.9(6) | |
C11 | Si4 | C12 | K1 | -139.3(5) | Si12 | O18 | Li8 | O13 | -74.0(7) | |
C12 | Si4 | O4 | K1 | 20.7(4) | Si12 | O18 | Li8 | O14 | 131.1(5) | |
C12 | Si4 | O4 | Li2 | -78.4(7) | Si12 | O18 | Li8 | Li5 | -174.4(7) | |
C12 | Si4 | O4 | Li3 | 117.9(6) | Si12 | O18 | Li8 | Li6 | 153.1(3) | |
C17 | O6 | C20 | C19 | -36.2(15) | O13 | Si7 | C40 | K5 | -6.2(3) | |
C17 | C18 | C19 | C20 | -9(2) | O15 | Si9 | C48 | K3 | 0.3(3) | |
C18 | C19 | C20 | O6 | 26.9(19) | O19 | C58 | C59 | C60 | 17.2(16) | |
C20 | O6 | C17 | C18 | 30.3(17) | O20 | C62 | C63 | C64 | 20.3(17) | |
C21 | O7 | C24 | C23 | -28.3(18) | O21 | C66 | C67 | C68 | 17.0(17) | |
C21 | C22 | C23 | C24 | -9(3) | O22 | C70 | C71 | C72 | -17.8(17) | |
C22 | C23 | C24 | O7 | 23(2) | C34 | Si5 | O11 | K2 | -118.9(3) | |
C24 | O7 | C21 | C22 | 23.2(18) | C34 | Si5 | O11 | K3 | 64.9(4) | |
C25 | O8 | C28 | C27 | -28.1(17) | C34 | Si5 | O11 | Li5 | -20.2(6) | |
C25 | C26 | C27 | C28 | -8(3) | C34 | Si5 | O11 | Li7 | 155.2(5) | |
C26 | C27 | C28 | O8 | 22(2) | C35 | Si5 | O11 | K2 | 0.3(3) | |
C28 | O8 | C25 | C26 | 23.4(18) | C35 | Si5 | O11 | K3 | -175.8(3) | |
C29 | O9 | C32 | C31 | -36.7(15) | C35 | Si5 | O11 | Li5 | 99.1(5) | |
C29 | C30 | C31 | C32 | -13(2) | C35 | Si5 | O11 | Li7 | -85.5(5) | |
C30 | C31 | C32 | O9 | 29.5(18) | C36 | Si5 | O11 | K2 | 120.9(3) | |
C32 | O9 | C29 | C30 | 28.4(17) | C36 | Si5 | O11 | K3 | -55.2(3) | |
Li1 | O1 | Li2 | K1 | 82.8(4) | C36 | Si5 | O11 | Li5 | -140.3(5) | |
Li1 | O1 | Li2 | O4 | 108.2(7) | C36 | Si5 | O11 | Li7 | 35.1(5) | |
Li1 | O1 | Li2 | O7 | -114.6(7) | C37 | Si6 | O12 | K2 | -111.8(4) | |
Li1 | O1 | Li2 | O10 | 7.3(5) | C37 | Si6 | O12 | K5 | 137.1(4) | |
Li1 | O1 | Li2 | Li3 | 54.3(7) | C37 | Si6 | O12 | Li7 | 10.5(8) | |
Li1 | O2 | Li4 | K1 | -82.6(4) | C38 | Si6 | O12 | K2 | 8.3(4) | |
Li1 | O2 | Li4 | O3 | -108.1(7) | C38 | Si6 | O12 | K5 | -102.8(4) | |
Li1 | O2 | Li4 | O9 | 115.2(7) | C38 | Si6 | O12 | Li7 | 130.6(7) | |
Li1 | O2 | Li4 | O10 | -7.0(5) | C39 | Si6 | O12 | K2 | 126.7(3) | |
Li1 | O2 | Li4 | Li3 | -54.0(7) | C39 | Si6 | O12 | K5 | 15.6(4) | |
Li1 | O6 | C17 | C18 | -141.3(14) | C39 | Si6 | O12 | Li7 | -111.0(7) | |
Li1 | O6 | C20 | C19 | 135.4(12) | C40 | Si7 | O13 | K2 | -101.7(3) | |
Li2 | O1 | Li1 | K1 | -82.8(4) | C40 | Si7 | O13 | K5 | 8.6(4) | |
Li2 | O1 | Li1 | O2 | -108.1(7) | C40 | Si7 | O13 | Li8 | 131.7(7) | |
Li2 | O1 | Li1 | O6 | 115.5(7) | C41 | Si7 | O13 | K2 | 16.2(4) | |
Li2 | O1 | Li1 | O10 | -7.3(5) | C41 | Si7 | O13 | K5 | 126.6(3) | |
Li2 | O1 | Li1 | Li4 | -54.6(7) | C41 | Si7 | O13 | Li8 | -110.3(7) | |
Li2 | O4 | Li3 | K1 | 82.7(4) | C41 | Si7 | C40 | K5 | -128.1(3) | |
Li2 | O4 | Li3 | O3 | 109.2(7) | C42 | Si7 | O13 | K2 | 137.3(4) | |
Li2 | O4 | Li3 | O8 | -114.8(6) | C42 | Si7 | O13 | K5 | -112.4(4) | |
Li2 | O4 | Li3 | O10 | 6.7(5) | C42 | Si7 | O13 | Li8 | 10.7(8) | |
Li2 | O4 | Li3 | Li4 | 54.7(7) | C42 | Si7 | C40 | K5 | 118.0(3) | |
Li2 | O7 | C21 | C22 | -145.7(15) | C43 | Si8 | O14 | K4 | -176.1(3) | |
Li2 | O7 | C24 | C23 | 140.4(15) | C43 | Si8 | O14 | K5 | 0.2(4) | |
Li3 | O3 | Li4 | K1 | 82.5(4) | C43 | Si8 | O14 | Li6 | 99.4(5) | |
Li3 | O3 | Li4 | O2 | 107.9(7) | C43 | Si8 | O14 | Li8 | -86.1(5) | |
Li3 | O3 | Li4 | O9 | -114.4(6) | C44 | Si8 | O14 | K4 | -56.1(3) | |
Li3 | O3 | Li4 | O10 | 6.6(5) | C44 | Si8 | O14 | K5 | 120.2(3) | |
Li3 | O3 | Li4 | Li1 | 53.8(7) | C44 | Si8 | O14 | Li6 | -140.7(5) | |
Li3 | O4 | Li2 | K1 | -82.3(3) | C44 | Si8 | O14 | Li8 | 33.9(5) | |
Li3 | O4 | Li2 | O1 | -107.7(7) | C45 | Si8 | O14 | K4 | 64.7(4) | |
Li3 | O4 | Li2 | O7 | 115.8(6) | C45 | Si8 | O14 | K5 | -119.0(3) | |
Li3 | O4 | Li2 | O10 | -6.6(5) | C45 | Si8 | O14 | Li6 | -19.9(6) | |
Li3 | O4 | Li2 | Li1 | -54.0(7) | C45 | Si8 | O14 | Li8 | 154.7(5) | |
Li3 | O8 | C25 | C26 | -146.3(14) | C46 | Si9 | O15 | K3 | -120.2(3) | |
Li3 | O8 | C28 | C27 | 141.3(15) | C46 | Si9 | O15 | K5 | 55.8(3) | |
Li4 | O2 | Li1 | K1 | 82.4(4) | C46 | Si9 | O15 | Li6 | -34.2(5) | |
Li4 | O2 | Li1 | O1 | 107.8(7) | C46 | Si9 | O15 | Li7 | 141.1(5) | |
Li4 | O2 | Li1 | O6 | -114.8(6) | C46 | Si9 | C48 | K3 | 121.4(3) | |
Li4 | O2 | Li1 | O10 | 7.0(5) | C47 | Si9 | O15 | K3 | 119.4(3) | |
Li4 | O2 | Li1 | Li2 | 54.1(7) | C47 | Si9 | O15 | K5 | -64.6(4) | |
Li4 | O3 | Li3 | K1 | -82.4(3) | C47 | Si9 | O15 | Li6 | -154.6(5) | |
Li4 | O3 | Li3 | O4 | -108.8(7) | C47 | Si9 | O15 | Li7 | 20.7(6) | |
Li4 | O3 | Li3 | O8 | 116.4(7) | C47 | Si9 | C48 | K3 | -121.6(3) | |
Li4 | O3 | Li3 | O10 | -6.7(5) | C48 | Si9 | O15 | K3 | -0.4(3) | |
Li4 | O3 | Li3 | Li2 | -54.6(7) | C48 | Si9 | O15 | K5 | 175.7(3) | |
Li4 | O9 | C29 | C30 | -143.2(13) | C48 | Si9 | O15 | Li6 | 85.7(5) | |
Li4 | O9 | C32 | C31 | 134.9(11) | C48 | Si9 | O15 | Li7 | -99.0(5) | |
C13A | O5 | C16A | C15A | 14(4) | C49 | Si10 | O16 | K3 | 111.7(4) | |
C13A | C14A | C15A | C16A | 32(5) | C49 | Si10 | O16 | K4 | -137.2(4) | |
C14A | C15A | C16A | O5 | -26(5) | C49 | Si10 | O16 | Li6 | -11.3(8) | |
C16A | O5 | C13A | C14A | 8(4) | C50 | Si10 | O16 | K3 | -127.3(3) | |
C13B | O5 | C16B | C15B | 10(5) | C50 | Si10 | O16 | K4 | -16.1(4) | |
C13B | C14B | C15B | C16B | 28(6) | C50 | Si10 | O16 | Li6 | 109.8(7) | |
C14B | C15B | C16B | O5 | -21(6) | C51 | Si10 | O16 | K3 | -8.7(4) | |
C16B | O5 | C13B | C14B | 10(4) | C51 | Si10 | O16 | K4 | 102.5(4) | |
K2 | Si5 | O11 | K3 | -176.1(2) | C51 | Si10 | O16 | Li6 | -131.6(7) | |
K2 | Si5 | O11 | Li5 | 98.8(5) | C52 | Si11 | O17 | K3 | -16.0(4) | |
K2 | Si5 | O11 | Li7 | -85.9(4) | C52 | Si11 | O17 | K4 | -127.0(3) | |
K2 | Si6 | O12 | K5 | -111.1(3) | C52 | Si11 | O17 | Li5 | 110.5(7) | |
K2 | Si6 | O12 | Li7 | 122.3(7) | C53 | Si11 | O17 | K3 | 102.4(4) | |
K2 | Si7 | O13 | K5 | 110.4(3) | C53 | Si11 | O17 | K4 | -8.6(4) | |
K2 | Si7 | O13 | Li8 | -126.5(8) | C53 | Si11 | O17 | Li5 | -131.2(7) | |
K2 | Si7 | C40 | K5 | -50.5(2) | C54 | Si11 | O17 | K3 | -137.2(4) | |
K2 | Si12 | O18 | K4 | -176.1(2) | C54 | Si11 | O17 | K4 | 111.9(4) | |
K2 | Si12 | O18 | Li5 | -89.9(4) | C54 | Si11 | O17 | Li5 | -10.7(8) | |
K2 | Si12 | O18 | Li8 | 84.8(4) | C55 | Si12 | O18 | K2 | -65.3(4) | |
K2 | O11 | Li5 | K3 | -148.87(15) | C55 | Si12 | O18 | K4 | 118.6(3) | |
K2 | O11 | Li5 | K4 | -102.3(6) | C55 | Si12 | O18 | Li5 | -155.2(5) | |
K2 | O11 | Li5 | Si5 | 109.6(4) | C55 | Si12 | O18 | Li8 | 19.5(6) | |
K2 | O11 | Li5 | Si12 | 10.4(6) | C56 | Si12 | O18 | K2 | 55.6(3) | |
K2 | O11 | Li5 | O17 | -175.4(6) | C56 | Si12 | O18 | K4 | -120.5(3) | |
K2 | O11 | Li5 | O18 | -22.0(5) | C56 | Si12 | O18 | Li5 | -34.3(5) | |
K2 | O11 | Li5 | Li7 | -75.3(4) | C56 | Si12 | O18 | Li8 | 140.4(5) | |
K2 | O11 | Li5 | Li8 | -43.7(3) | C57 | Si12 | O18 | K2 | 175.9(3) | |
K2 | O11 | Li7 | K3 | 149.24(14) | C57 | Si12 | O18 | K4 | -0.2(4) | |
K2 | O11 | Li7 | K5 | 42.5(4) | C57 | Si12 | O18 | Li5 | 86.0(5) | |
K2 | O11 | Li7 | Si5 | -104.8(3) | C57 | Si12 | O18 | Li8 | -99.3(5) | |
K2 | O11 | Li7 | Si9 | 154.0(5) | C58 | O19 | C61 | C60 | 30.1(15) | |
K2 | O11 | Li7 | O12 | -27.1(4) | C58 | C59 | C60 | C61 | 0.5(18) | |
K2 | O11 | Li7 | O15 | 128.6(5) | C59 | C60 | C61 | O19 | -18.3(17) | |
K2 | O11 | Li7 | Li5 | 79.5(4) | C61 | O19 | C58 | C59 | -28.4(14) | |
K2 | O11 | Li7 | Li6 | 103.8(3) | C62 | O20 | C65 | C64 | 30.5(14) | |
K2 | O12 | Li7 | K5 | -96.52(12) | C62 | C63 | C64 | C65 | -1.6(19) | |
K2 | O12 | Li7 | Si5 | 59.3(3) | C63 | C64 | C65 | O20 | -17.5(17) | |
K2 | O12 | Li7 | Si9 | -151.9(3) | C65 | O20 | C62 | C63 | -32.3(15) | |
K2 | O12 | Li7 | O11 | 29.0(5) | C66 | O21 | C69 | C68 | 29.9(14) | |
K2 | O12 | Li7 | O15 | -126.5(5) | C66 | C67 | C68 | C69 | 1.1(19) | |
K2 | O12 | Li7 | Li5 | -4.9(4) | C67 | C68 | C69 | O21 | -19.1(17) | |
K2 | O12 | Li7 | Li6 | -90.8(4) | C69 | O21 | C66 | C67 | -29.3(15) | |
K2 | O13 | Li8 | K5 | 96.27(13) | C70 | O22 | C73 | C72 | -29.3(14) | |
K2 | O13 | Li8 | Si8 | 155.5(3) | C70 | C71 | C72 | C73 | -0.4(18) | |
K2 | O13 | Li8 | Si12 | -55.7(3) | C71 | C72 | C73 | O22 | 18.4(16) | |
K2 | O13 | Li8 | O14 | 125.6(5) | C73 | O22 | C70 | C71 | 30.0(15) | |
K2 | O13 | Li8 | O18 | -30.0(6) | Li5 | Si5 | O11 | K2 | -98.8(5) | |
K2 | O13 | Li8 | Li5 | 5.6(4) | Li5 | Si5 | O11 | K3 | 85.1(4) | |
K2 | O13 | Li8 | Li6 | 92.2(4) | Li5 | Si5 | O11 | Li7 | 175.3(6) | |
K2 | O18 | Li8 | K4 | -149.02(15) | Li5 | Si12 | O18 | K2 | 89.9(4) | |
K2 | O18 | Li8 | K5 | -46.7(5) | Li5 | Si12 | O18 | K4 | -86.2(4) | |
K2 | O18 | Li8 | Si8 | -160.0(6) | Li5 | Si12 | O18 | Li8 | 174.7(6) | |
K2 | O18 | Li8 | Si12 | 101.1(3) | Li5 | O11 | Li7 | K2 | -79.5(4) | |
K2 | O18 | Li8 | O13 | 27.1(5) | Li5 | O11 | Li7 | K3 | 69.7(4) | |
K2 | O18 | Li8 | O14 | -127.8(6) | Li5 | O11 | Li7 | K5 | -37.0(7) | |
K2 | O18 | Li8 | Li5 | -73.3(4) | Li5 | O11 | Li7 | Si5 | 175.6(6) | |
K2 | O18 | Li8 | Li6 | -105.7(3) | Li5 | O11 | Li7 | Si9 | 74.5(7) | |
K2 | O19 | C58 | C59 | 142.5(10) | Li5 | O11 | Li7 | O12 | -106.7(6) | |
K2 | O19 | C61 | C60 | -141.4(9) | Li5 | O11 | Li7 | O15 | 49.1(8) | |
K3 | Si5 | O11 | K2 | 176.1(2) | Li5 | O11 | Li7 | Li6 | 24.3(6) | |
K3 | Si5 | O11 | Li5 | -85.1(4) | Li5 | O18 | Li8 | K2 | 73.3(4) | |
K3 | Si5 | O11 | Li7 | 90.2(4) | Li5 | O18 | Li8 | K4 | -75.7(4) | |
K3 | Si9 | O15 | K5 | 176.1(2) | Li5 | O18 | Li8 | K5 | 26.6(8) | |
K3 | Si9 | O15 | Li6 | 86.1(4) | Li5 | O18 | Li8 | Si8 | -86.7(7) | |
K3 | Si9 | O15 | Li7 | -98.7(5) | Li5 | O18 | Li8 | Si12 | 174.4(7) | |
K3 | Si10 | O16 | K4 | 111.1(3) | Li5 | O18 | Li8 | O13 | 100.4(7) | |
K3 | Si10 | O16 | Li6 | -123.0(7) | Li5 | O18 | Li8 | O14 | -54.5(7) | |
K3 | Si11 | O17 | K4 | -111.0(3) | Li5 | O18 | Li8 | Li6 | -32.5(5) | |
K3 | Si11 | O17 | Li5 | 126.4(8) | Li6 | Si8 | O14 | K4 | 84.6(4) | |
K3 | O11 | Li5 | K2 | 148.87(15) | Li6 | Si8 | O14 | K5 | -99.1(5) | |
K3 | O11 | Li5 | K4 | 46.6(5) | Li6 | Si8 | O14 | Li8 | 174.6(6) | |
K3 | O11 | Li5 | Si5 | -101.5(4) | Li6 | Si9 | O15 | K3 | -86.1(4) | |
K3 | O11 | Li5 | Si12 | 159.3(6) | Li6 | Si9 | O15 | K5 | 90.0(4) | |
K3 | O11 | Li5 | O17 | -26.5(5) | Li6 | Si9 | O15 | Li7 | 175.3(7) | |
K3 | O11 | Li5 | O18 | 126.9(6) | Li6 | Si9 | C48 | K3 | 38.1(3) | |
K3 | O11 | Li5 | Li7 | 73.5(4) | Li6 | O15 | Li7 | K2 | 27.6(8) | |
K3 | O11 | Li5 | Li8 | 105.2(3) | Li6 | O15 | Li7 | K3 | -75.4(4) | |
K3 | O11 | Li7 | K2 | -149.24(14) | Li6 | O15 | Li7 | K5 | 73.6(4) | |
K3 | O11 | Li7 | K5 | -106.7(5) | Li6 | O15 | Li7 | Si5 | -86.8(7) | |
K3 | O11 | Li7 | Si5 | 105.9(3) | Li6 | O15 | Li7 | Si9 | 175.1(7) | |
K3 | O11 | Li7 | Si9 | 4.8(5) | Li6 | O15 | Li7 | O11 | -54.2(7) | |
K3 | O11 | Li7 | O12 | -176.4(5) | Li6 | O15 | Li7 | O12 | 100.7(6) | |
K3 | O11 | Li7 | O15 | -20.6(5) | Li6 | O15 | Li7 | Li5 | -31.8(6) | |
K3 | O11 | Li7 | Li5 | -69.7(4) | Li7 | Si5 | O11 | K2 | 85.9(4) | |
K3 | O11 | Li7 | Li6 | -45.4(3) | Li7 | Si5 | O11 | K3 | -90.2(4) | |
K3 | O15 | Li7 | K2 | 103.0(5) | Li7 | Si5 | O11 | Li5 | -175.3(6) | |
K3 | O15 | Li7 | K5 | 149.02(14) | Li7 | Si9 | O15 | K3 | 98.7(5) | |
K3 | O15 | Li7 | Si5 | -11.4(5) | Li7 | Si9 | O15 | K5 | -85.3(4) | |
K3 | O15 | Li7 | Si9 | -109.5(4) | Li7 | Si9 | O15 | Li6 | -175.3(7) | |
K3 | O15 | Li7 | O11 | 21.2(5) | Li7 | Si9 | C48 | K3 | -31.4(3) | |
K3 | O15 | Li7 | O12 | 176.2(5) | Li7 | O11 | Li5 | K2 | 75.3(4) | |
K3 | O15 | Li7 | Li5 | 43.6(3) | Li7 | O11 | Li5 | K3 | -73.5(4) | |
K3 | O15 | Li7 | Li6 | 75.4(4) | Li7 | O11 | Li5 | K4 | -27.0(8) | |
K3 | O16 | Li6 | K4 | 96.41(12) | Li7 | O11 | Li5 | Si5 | -175.1(7) | |
K3 | O16 | Li6 | Si8 | 151.6(3) | Li7 | O11 | Li5 | Si12 | 85.7(7) | |
K3 | O16 | Li6 | Si9 | -58.7(3) | Li7 | O11 | Li5 | O17 | -100.1(7) | |
K3 | O16 | Li6 | O14 | 125.6(5) | Li7 | O11 | Li5 | O18 | 53.4(7) | |
K3 | O16 | Li6 | O15 | -28.5(5) | Li7 | O11 | Li5 | Li8 | 31.6(5) | |
K3 | O16 | Li6 | Li7 | 4.9(4) | Li8 | Si8 | O14 | K4 | -90.0(4) | |
K3 | O16 | Li6 | Li8 | 89.8(4) | Li8 | Si8 | O14 | K5 | 86.3(4) | |
K3 | O17 | Li5 | K4 | -96.32(13) | Li8 | Si8 | O14 | Li6 | -174.6(6) | |
K3 | O17 | Li5 | Si5 | 55.1(3) | Li8 | Si12 | O18 | K2 | -84.8(4) | |
K3 | O17 | Li5 | Si12 | -155.2(3) | Li8 | Si12 | O18 | K4 | 99.1(4) | |
K3 | O17 | Li5 | O11 | 29.3(5) | Li8 | Si12 | O18 | Li5 | -174.7(6) | |
K3 | O17 | Li5 | O18 | -124.7(5) | Li8 | O14 | Li6 | K3 | -25.9(8) | |
K3 | O17 | Li5 | Li7 | -6.0(4) | Li8 | O14 | Li6 | K4 | -73.1(4) | |
K3 | O17 | Li5 | Li8 | -91.4(4) | Li8 | O14 | Li6 | K5 | 75.7(4) | |
K3 | O20 | C62 | C63 | 140.1(9) | Li8 | O14 | Li6 | Si8 | -174.3(7) | |
K3 | O20 | C65 | C64 | -141.4(11) | Li8 | O14 | Li6 | Si9 | 86.0(7) | |
K4 | Si8 | O14 | K5 | 176.3(2) | Li8 | O14 | Li6 | O15 | 54.0(7) | |
K4 | Si8 | O14 | Li6 | -84.6(4) | Li8 | O14 | Li6 | O16 | -99.5(6) | |
K4 | Si8 | O14 | Li8 | 90.0(4) | Li8 | O14 | Li6 | Li7 | 32.0(5) |
Atom | x | y | z | U(eq) |
---|---|---|---|---|
H1A | 3622 | 1468 | 6422 | 132 |
H1B | 4499 | 1190 | 6398 | 132 |
H1C | 4304 | 2037 | 6519 | 132 |
H2A | 5300 | 1624 | 7085 | 229 |
H2B | 5451 | 841 | 6905 | 229 |
H2C | 5141 | 810 | 7241 | 229 |
H3A | 3670 | -153 | 7066 | 180 |
H3B | 4082 | -216 | 6747 | 180 |
H3C | 3213 | 86 | 6769 | 180 |
H4A | 3500 | 3614 | 6430 | 131 |
H4B | 3835 | 4469 | 6398 | 131 |
H4C | 2979 | 4338 | 6521 | 131 |
H5A | 3425 | 5235 | 7149 | 233 |
H5B | 3991 | 5463 | 6881 | 233 |
H5C | 4339 | 5173 | 7193 | 233 |
H6A | 5152 | 3660 | 7069 | 178 |
H6B | 5219 | 4076 | 6750 | 178 |
H6C | 4912 | 3207 | 6771 | 178 |
H7A | 1386 | 3506 | 6425 | 135 |
H7B | 519 | 3812 | 6394 | 135 |
H7C | 681 | 2962 | 6518 | 135 |
H8A | 1433 | 5125 | 7062 | 180 |
H8B | 900 | 5239 | 6773 | 180 |
H8C | 1757 | 4912 | 6737 | 180 |
H9A | -133 | 4155 | 7242 | 243 |
H9B | -324 | 3398 | 7052 | 243 |
H9C | -422 | 4231 | 6903 | 243 |
H10A | -119 | 1426 | 7058 | 185 |
H10B | -231 | 876 | 6774 | 185 |
H10C | 88 | 1734 | 6730 | 185 |
H11A | 1608 | -308 | 7083 | 229 |
H11B | 822 | -447 | 6904 | 229 |
H11C | 799 | -138 | 7241 | 229 |
H12A | 1478 | 1372 | 6421 | 135 |
H12B | 1204 | 493 | 6398 | 135 |
H12C | 2047 | 693 | 6521 | 135 |
H17A | 4494 | 1626 | 7794 | 161 |
H17B | 5320 | 1890 | 7667 | 161 |
H18A | 5583 | 2231 | 8104 | 300 |
H18B | 4700 | 2148 | 8208 | 300 |
H19A | 4498 | 3415 | 8153 | 242 |
H19B | 5414 | 3510 | 8107 | 242 |
H20A | 4468 | 3823 | 7690 | 129 |
H20B | 5318 | 3496 | 7619 | 129 |
H21 | 1549 | 103 | 7714 | 171 |
H22 | 2055 | -291 | 8207 | 294 |
H23A | 3392 | 403 | 8157 | 318 |
H23B | 3471 | -495 | 8075 | 318 |
H24A | 3523 | -282 | 7620 | 138 |
H24B | 3799 | 559 | 7727 | 138 |
H25A | 523 | 3349 | 7814 | 159 |
H25B | -288 | 3141 | 7661 | 159 |
H26A | -655 | 2792 | 8073 | 289 |
H26B | 204 | 2850 | 8209 | 289 |
H27A | 382 | 1592 | 8152 | 301 |
H27B | -512 | 1521 | 8061 | 301 |
H28A | -279 | 1474 | 7615 | 130 |
H28B | 558 | 1200 | 7728 | 130 |
H29A | 3370 | 4497 | 7801 | 166 |
H29B | 3115 | 5316 | 7665 | 166 |
H30A | 2760 | 5618 | 8090 | 270 |
H30B | 2876 | 4751 | 8210 | 270 |
H31A | 1609 | 4476 | 8150 | 218 |
H31B | 1476 | 5390 | 8108 | 218 |
H32A | 1513 | 5318 | 7625 | 129 |
H32B | 1183 | 4469 | 7695 | 129 |
H33A | 2024 | 2630 | 7950 | 209 |
H33B | 2919 | 2848 | 7940 | 209 |
H33C | 2660 | 1963 | 7937 | 209 |
H13A | 1550 | 1890 | 5952 | 220 |
H13B | 1458 | 2804 | 5909 | 220 |
H14A | 1732 | 2568 | 5468 | 145 |
H14B | 2140 | 1759 | 5551 | 145 |
H15A | 3292 | 2539 | 5485 | 147 |
H15B | 2868 | 3309 | 5599 | 147 |
H16A | 3486 | 3081 | 5974 | 230 |
H16B | 3529 | 2172 | 5907 | 230 |
H13C | 3122 | 1562 | 5958 | 175 |
H13D | 2210 | 1466 | 5910 | 175 |
H14C | 2465 | 1725 | 5483 | 175 |
H14D | 3262 | 2142 | 5572 | 175 |
H15C | 2522 | 3294 | 5480 | 175 |
H15D | 1720 | 2880 | 5567 | 175 |
H16C | 1880 | 3433 | 5964 | 244 |
H16D | 2788 | 3532 | 5912 | 244 |
H34A | 5084 | 1525 | 4518 | 115 |
H34B | 4437 | 1145 | 4726 | 115 |
H34C | 5281 | 775 | 4712 | 115 |
H35A | 5313 | 867 | 5390 | 107 |
H35B | 4481 | 1264 | 5386 | 107 |
H35C | 5181 | 1671 | 5557 | 107 |
H36A | 4873 | 3145 | 5186 | 123 |
H36B | 4181 | 2704 | 5022 | 123 |
H36C | 4850 | 3096 | 4829 | 123 |
H37A | 5096 | 3935 | 5762 | 119 |
H37B | 4918 | 3631 | 6093 | 119 |
H37C | 4830 | 3062 | 5813 | 119 |
H38A | 5821 | 1935 | 6127 | 123 |
H38B | 6024 | 2488 | 6402 | 123 |
H38C | 6702 | 2106 | 6210 | 123 |
H39A | 7203 | 3822 | 6214 | 109 |
H39B | 6390 | 4134 | 6330 | 109 |
H39C | 6738 | 4448 | 6022 | 109 |
H40A | 9322 | 2873 | 6267 | 95 |
H40B | 8447 | 2639 | 6375 | 95 |
H41A | 7774 | 1155 | 6185 | 109 |
H41B | 8569 | 922 | 6343 | 109 |
H41C | 8330 | 534 | 6032 | 109 |
H42A | 9894 | 1056 | 5764 | 121 |
H42B | 10081 | 1373 | 6092 | 121 |
H42C | 10164 | 1931 | 5809 | 121 |
H43A | 9776 | 3358 | 5556 | 111 |
H43B | 9730 | 4157 | 5378 | 111 |
H43C | 10526 | 3694 | 5394 | 111 |
H44A | 10144 | 1867 | 5197 | 118 |
H44B | 10821 | 2294 | 5020 | 118 |
H44C | 10137 | 1884 | 4840 | 118 |
H45A | 9872 | 3494 | 4517 | 117 |
H45B | 10575 | 3807 | 4715 | 117 |
H45C | 9762 | 4242 | 4721 | 117 |
H46A | 8032 | 5276 | 5184 | 119 |
H46B | 7713 | 5812 | 4920 | 119 |
H46C | 8193 | 5050 | 4843 | 119 |
H47A | 5775 | 4718 | 5294 | 120 |
H47B | 6145 | 5562 | 5281 | 120 |
H47C | 6529 | 4912 | 5486 | 120 |
H48A | 6651 | 5294 | 4479 | 86 |
H48B | 5828 | 5147 | 4649 | 86 |
H49A | 8071 | 5158 | 4196 | 120 |
H49B | 8599 | 5084 | 3905 | 120 |
H49C | 8951 | 4895 | 4228 | 120 |
H50A | 9465 | 3298 | 3975 | 112 |
H50B | 9116 | 3598 | 3664 | 112 |
H50C | 8843 | 2788 | 3799 | 112 |
H51A | 7133 | 3297 | 3775 | 121 |
H51B | 7493 | 4014 | 3599 | 121 |
H51C | 6927 | 4158 | 3876 | 121 |
H52A | 5532 | 1678 | 3970 | 111 |
H52B | 5906 | 1417 | 3659 | 111 |
H52C | 6151 | 2218 | 3809 | 111 |
H53A | 7853 | 1714 | 3766 | 119 |
H53B | 7525 | 963 | 3602 | 119 |
H53C | 8095 | 876 | 3882 | 119 |
H54A | 6925 | -171 | 4198 | 120 |
H54B | 6390 | -99 | 3908 | 120 |
H54C | 6046 | 92 | 4231 | 120 |
H55A | 9211 | 303 | 5296 | 119 |
H55B | 8894 | -558 | 5261 | 119 |
H55C | 8467 | 33 | 5480 | 119 |
H56A | 6836 | -61 | 5135 | 126 |
H56B | 7297 | -814 | 5032 | 126 |
H56C | 6928 | -252 | 4786 | 126 |
H57A | 8330 | 178 | 4446 | 105 |
H57B | 8735 | -521 | 4618 | 105 |
H57C | 9133 | 311 | 4614 | 105 |
H58A | 7406 | -538 | 5852 | 119 |
H58B | 6662 | -976 | 5718 | 119 |
H59A | 7080 | -790 | 6313 | 212 |
H59B | 6522 | -1433 | 6170 | 212 |
H60A | 5511 | -776 | 6321 | 176 |
H60B | 6071 | -128 | 6462 | 176 |
H61A | 5339 | -128 | 5913 | 180 |
H61B | 5643 | 597 | 6102 | 180 |
H62A | 5594 | 4377 | 3908 | 178 |
H62B | 4849 | 4657 | 4092 | 178 |
H63A | 4906 | 3922 | 3544 | 173 |
H63B | 4246 | 4484 | 3674 | 173 |
H64A | 3566 | 3465 | 3825 | 241 |
H64B | 4212 | 2904 | 3687 | 241 |
H65A | 4024 | 3348 | 4278 | 122 |
H65B | 4461 | 2598 | 4151 | 122 |
H66A | 10114 | 335 | 4090 | 178 |
H66B | 9401 | 644 | 3894 | 178 |
H67A | 10145 | 1056 | 3544 | 180 |
H67B | 10790 | 511 | 3694 | 180 |
H68A | 11438 | 1543 | 3836 | 206 |
H68B | 10784 | 2088 | 3692 | 206 |
H69A | 10965 | 1645 | 4279 | 126 |
H69B | 10538 | 2396 | 4148 | 126 |
H70A | 9337 | 4406 | 6107 | 176 |
H70B | 9650 | 5125 | 5917 | 176 |
H71A | 9486 | 5772 | 6317 | 171 |
H71B | 8924 | 5130 | 6459 | 171 |
H72A | 7906 | 5794 | 6306 | 208 |
H72B | 8467 | 6439 | 6167 | 208 |
H73A | 7610 | 5543 | 5846 | 124 |
H73B | 8367 | 5967 | 5719 | 124 |
Atom | Occupancy | Atom | Occupancy | Atom | Occupancy | ||
---|---|---|---|---|---|---|---|
C13A | 0.5 | H13A | 0.5 | H13B | 0.5 | ||
C14A | 0.5 | H14A | 0.5 | H14B | 0.5 | ||
C15A | 0.5 | H15A | 0.5 | H15B | 0.5 | ||
C16A | 0.5 | H16A | 0.5 | H16B | 0.5 | ||
C13B | 0.5 | H13C | 0.5 | H13D | 0.5 | ||
C14B | 0.5 | H14C | 0.5 | H14D | 0.5 | ||
C15B | 0.5 | H15C | 0.5 | H15D | 0.5 | ||
C16B | 0.5 | H16C | 0.5 | H16D | 0.5 |
Experimental
Single crystals of C73H179K5Li8O22Si12 [3162p21c] were []. A suitable crystal was selected and [] on a diffractometer. The crystal was kept at 293(2) K during data collection. Using Olex2 [1], the structure was solved with the SIR2004 [2] structure solution program using Direct Methods and refined with the ShelXL [3] refinement package using Least Squares minimisation.
Crystal structure determination of [3162p21c]
Crystal Data for C73H179K5Li8O22Si12 (M =1997.25 g/mol): monoclinic, space group P21/c (no. 14), a = 16.9979(7) Å, b = 16.9979(7) Å, c = 43.798(3) Å, β = 90.10(10)°, V = 12654.5(11) Å3, Z = 4, T = 293(2) K, μ(MoKα) = 0.337 mm-1, Dcalc = 1.048 g/cm3, 80446 reflections measured (4.386° ≤ 2Θ ≤ 50°), 22024 unique (Rint = 0.0904, Rsigma = 0.0768) which were used in all calculations. The final R1 was 0.1012 (I > 2σ(I)) and wR2 was 0.3119 (all data).
Refinement model description
Number of restraints - 99, number of constraints - unknown.
Details:
1. Fixed Uiso
At 1.2 times of:
All C(H) groups, All C(H,H) groups
At 1.5 times of:
All C(H,H,H) groups
2. Rigid bond restraints
C70, C71, C72, C73
with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
C66, C67, C68, C69
with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
C59, C60
with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
C13A, C16A
with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
C14A, C15A
with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
O19, C58, H58B, C59, H59A, H59B, C60, H60A, H60B, C61, H61A, H61B
with sigma for 1-2 distances of 0.01 and sigma for 1-3 distances of 0.01
3. Uiso/Uaniso restraints and constraints
C26 ≈ C27: within 2A with sigma of 0.04 and sigma for terminal atoms of 0.08
C70 ≈ C71 ≈ C72 ≈ C73: within 2A with sigma of 0.04 and sigma for
terminal atoms of 0.08
C66 ≈ C67 ≈ C68 ≈ C69: within 2A with sigma of 0.04 and sigma for
terminal atoms of 0.08
C59 ≈ C60: within 2A with sigma of 0.04 and sigma for terminal atoms of 0.08
C13A ≈ C16A: within 2A with sigma of 0.04 and sigma for terminal atoms of
0.08
C14A ≈ C15A: within 2A with sigma of 0.04 and sigma for terminal atoms of
0.08
Uanis(C61) ≈ Ueq, Uanis(C60) ≈ Ueq, Uanis(C59) ≈ Ueq, Uanis(C58)
≈ Ueq: with sigma of 0.1 and sigma for terminal atoms of 0.2
Uanis(C14B) = Uanis(C13B)
4. Others
Fixed Sof: C13A(0.5) H13A(0.5) H13B(0.5) C14A(0.5) H14A(0.5) H14B(0.5)
C15A(0.5) H15A(0.5) H15B(0.5) C16A(0.5) H16A(0.5) H16B(0.5) C13B(0.5)
H13C(0.5) H13D(0.5) C14B(0.5) H14C(0.5) H14D(0.5) C15B(0.5) H15C(0.5)
H15D(0.5) C16B(0.5) H16C(0.5) H16D(0.5)
5.a Secondary CH2 refined with riding coordinates:
C17(H17A,H17B), C18(H18A,H18B), C19(H19A,H19B), C20(H20A,H20B), C23(H23A,
H23B), C24(H24A,H24B), C25(H25A,H25B), C26(H26A,H26B), C27(H27A,H27B),
C28(H28A,H28B), C29(H29A,H29B), C30(H30A,H30B), C31(H31A,H31B), C32(H32A,H32B),
C13A(H13A,H13B), C14A(H14A,H14B), C15A(H15A,H15B), C16A(H16A,H16B), C13B(H13C,
H13D), C14B(H14C,H14D), C15B(H15C,H15D), C16B(H16C,H16D), C40(H40A,H40B),
C48(H48A,H48B), C58(H58A,H58B), C59(H59A,H59B), C60(H60A,H60B), C61(H61A,H61B),
C62(H62A,H62B), C63(H63A,H63B), C64(H64A,H64B), C65(H65A,H65B), C66(H66A,
H66B), C67(H67A,H67B), C68(H68A,H68B), C69(H69A,H69B), C70(H70A,H70B),
C71(H71A,H71B), C72(H72A,H72B), C73(H73A,H73B)
5.b Aromatic/amide H refined with riding coordinates:
C21(H21), C22(H22)
5.c Idealised Me refined as rotating group:
C1(H1A,H1B,H1C), C2(H2A,H2B,H2C), C3(H3A,H3B,H3C), C4(H4A,H4B,H4C), C5(H5A,
H5B,H5C), C6(H6A,H6B,H6C), C7(H7A,H7B,H7C), C8(H8A,H8B,H8C), C9(H9A,H9B,H9C),
C10(H10A,H10B,H10C), C11(H11A,H11B,H11C), C12(H12A,H12B,H12C), C33(H33A,H33B,
H33C), C34(H34A,H34B,H34C), C35(H35A,H35B,H35C), C36(H36A,H36B,H36C), C37(H37A,
H37B,H37C), C38(H38A,H38B,H38C), C39(H39A,H39B,H39C), C41(H41A,H41B,H41C),
C42(H42A,H42B,H42C), C43(H43A,H43B,H43C), C44(H44A,H44B,H44C), C45(H45A,H45B,
H45C), C46(H46A,H46B,H46C), C47(H47A,H47B,H47C), C49(H49A,H49B,H49C), C50(H50A,
H50B,H50C), C51(H51A,H51B,H51C), C52(H52A,H52B,H52C), C53(H53A,H53B,H53C),
C54(H54A,H54B,H54C), C55(H55A,H55B,H55C), C56(H56A,H56B,H56C), C57(H57A,H57B,
H57C)
This report has been created with Olex2, compiled on 2018.04.03 svn.r3497 for OlexSys. Please let us know if there are any errors or if you would like to have additional features.