Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S2053229619013305/ky3189sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S2053229619013305/ky3189Isup2.hkl | |
Portable Document Format (PDF) file https://doi.org/10.1107/S2053229619013305/ky3189sup3.pdf |
CCDC reference: 1956744
Data collection: APEX2 (Bruker, 2016); cell refinement: SAINT (Bruker, 2016); data reduction: SAINT (Bruker, 2016); program(s) used to solve structure: SHELXS2016 (Sheldrick, 2015a); program(s) used to refine structure: SHELXL2016 (Sheldrick, 2015b); molecular graphics: SHELXTL (Sheldrick, 2008); software used to prepare material for publication: SHELXL (Sheldrick, 2015b).
K3DyB6O12 | Dx = 2.908 Mg m−3 |
Mr = 536.66 | Mo Kα radiation, λ = 0.71073 Å |
Trigonal, R32:H | Cell parameters from 460 reflections |
a = 13.1643 (7) Å | θ = 3.5–24.8° |
c = 15.3154 (8) Å | µ = 7.17 mm−1 |
V = 2298.6 (3) Å3 | T = 296 K |
Z = 7.5 | Prism, colorless |
F(000) = 1868 | 0.20 × 0.10 × 0.10 mm |
Bruker SMART APEXII CCD area detector diffractometer | 1271 independent reflections |
Radiation source: fine-focus sealed tube | 1253 reflections with I > 2σ(I) |
Detector resolution: 83.33 pixels mm-1 | Rint = 0.019 |
ω scans | θmax = 28.3°, θmin = 2.2° |
Absorption correction: multi-scan (SADABS; Bruker, 2001) | h = −17→17 |
Tmin = 0.257, Tmax = 0.661 | k = −17→16 |
5130 measured reflections | l = −17→20 |
Refinement on F2 | w = 1/[σ2(Fo2) + (0.0251P)2 + 8.8823P] where P = (Fo2 + 2Fc2)/3 |
Least-squares matrix: full | (Δ/σ)max < 0.001 |
R[F2 > 2σ(F2)] = 0.018 | Δρmax = 0.56 e Å−3 |
wR(F2) = 0.048 | Δρmin = −1.93 e Å−3 |
S = 1.09 | Extinction correction: SHELXL2016 (Sheldrick, 2015b), Fc*=kFc[1+0.001xFc2λ3/sin(2θ)]-1/4 |
1271 reflections | Extinction coefficient: 0.00044 (7) |
87 parameters | Absolute structure: Flack x determined using 530 quotients [(I+)-(I-)]/[(I+)+(I-)] (Parsons et al., 2013) |
0 restraints | Absolute structure parameter: 0.025 (8) |
Geometry. All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. |
x | y | z | Uiso*/Ueq | Occ. (<1) | |
Dy1 | 0.333333 | 0.666667 | 0.166667 | 0.0192 (2) | 0.5 |
Dy2 | 0.333333 | 0.666667 | 0.39295 (2) | 0.00748 (13) | |
K1 | 0.333333 | 0.666667 | 0.166667 | 0.0192 (2) | 0.5 |
K2 | 0.1542 (2) | 0.333333 | 0.333333 | 0.0304 (5) | |
K3 | 0.333333 | 0.666667 | 0.666667 | 0.0227 (5) | |
K4 | 0.000000 | 0.46346 (16) | 0.500000 | 0.0251 (4) | |
B1 | 0.5614 (5) | 0.7966 (6) | 0.5332 (4) | 0.0157 (15) | |
B2 | 0.0790 (5) | 0.5513 (8) | 0.2813 (4) | 0.0178 (15) | |
B3 | −0.0813 (6) | 0.5854 (6) | 0.333333 | 0.0146 (16) | |
O1 | 0.4984 (3) | 0.7278 (3) | 0.4679 (3) | 0.0163 (10) | |
O2 | 0.6736 (4) | 0.8137 (5) | 0.5467 (3) | 0.0369 (16) | |
O3 | 0.5218 (3) | 0.8515 (4) | 0.5889 (2) | 0.0173 (8) | |
O4 | 0.0353 (4) | 0.5975 (4) | 0.3392 (3) | 0.0212 (9) | |
O5 | 0.1883 (3) | 0.5690 (4) | 0.2877 (3) | 0.0244 (11) |
U11 | U22 | U33 | U12 | U13 | U23 | |
Dy1 | 0.0236 (3) | 0.0236 (3) | 0.0104 (4) | 0.01180 (14) | 0.000 | 0.000 |
Dy2 | 0.00815 (14) | 0.00815 (14) | 0.00615 (17) | 0.00407 (7) | 0.000 | 0.000 |
K1 | 0.0236 (3) | 0.0236 (3) | 0.0104 (4) | 0.01180 (14) | 0.000 | 0.000 |
K2 | 0.0245 (11) | 0.0294 (9) | 0.0389 (10) | 0.0147 (5) | −0.0080 (4) | −0.0159 (7) |
K3 | 0.0156 (7) | 0.0156 (7) | 0.0370 (14) | 0.0078 (3) | 0.000 | 0.000 |
K4 | 0.0197 (9) | 0.0308 (8) | 0.0211 (9) | 0.0098 (4) | −0.0015 (7) | −0.0007 (3) |
B1 | 0.012 (2) | 0.018 (4) | 0.014 (2) | 0.006 (2) | −0.0004 (19) | 0.000 (2) |
B2 | 0.015 (2) | 0.016 (4) | 0.019 (2) | 0.005 (3) | −0.001 (2) | −0.003 (3) |
B3 | 0.013 (3) | 0.013 (3) | 0.015 (4) | 0.004 (3) | 0.0028 (15) | −0.0028 (15) |
O1 | 0.0135 (17) | 0.013 (2) | 0.0212 (18) | 0.0060 (14) | −0.0059 (14) | −0.0040 (14) |
O2 | 0.019 (2) | 0.057 (4) | 0.044 (3) | 0.026 (2) | −0.0176 (19) | −0.036 (2) |
O3 | 0.0132 (18) | 0.024 (2) | 0.0163 (19) | 0.0104 (17) | −0.0019 (15) | −0.0049 (16) |
O4 | 0.017 (2) | 0.030 (2) | 0.0165 (19) | 0.0115 (19) | −0.0042 (16) | −0.0107 (16) |
O5 | 0.0139 (19) | 0.029 (3) | 0.030 (2) | 0.0102 (17) | −0.0083 (16) | −0.0134 (17) |
Dy1—O5i | 2.505 (5) | K3—O3x | 2.731 (4) |
Dy1—O5 | 2.505 (5) | K3—O3xi | 2.731 (4) |
Dy1—O5ii | 2.505 (5) | K3—O3 | 2.731 (4) |
Dy1—O5iii | 2.505 (5) | K3—O3i | 2.731 (4) |
Dy1—O5iv | 2.505 (5) | K3—B1ix | 3.314 (6) |
Dy1—O5v | 2.505 (5) | K3—B1x | 3.314 (6) |
Dy1—Dy2 | 3.4656 (3) | K3—B1iv | 3.314 (6) |
Dy1—Dy2ii | 3.4656 (3) | K3—B1i | 3.314 (6) |
Dy2—O1iv | 2.222 (4) | K3—B1xi | 3.314 (6) |
Dy2—O1i | 2.222 (4) | K3—B1 | 3.314 (6) |
Dy2—O1 | 2.222 (4) | K4—O3iv | 2.786 (4) |
Dy2—O5 | 2.333 (4) | K4—O3xii | 2.786 (4) |
Dy2—O5i | 2.333 (4) | K4—O1xiii | 2.846 (4) |
Dy2—O5iv | 2.333 (4) | K4—O1i | 2.846 (4) |
Dy2—K2i | 3.9118 (2) | K4—O4 | 2.928 (5) |
Dy2—K2 | 3.9118 (2) | K4—O4xiv | 2.928 (5) |
Dy2—K2iv | 3.9118 (3) | K4—O2xiii | 3.240 (6) |
Dy2—K4i | 4.1666 (3) | K4—O2i | 3.240 (5) |
K2—O1vi | 2.818 (4) | K4—B1i | 3.312 (7) |
K2—O1i | 2.818 (4) | K4—B1xiii | 3.312 (7) |
K2—O4iv | 2.844 (5) | K4—B3 | 3.4575 (14) |
K2—O4vii | 2.844 (5) | K4—B3xv | 3.4575 (15) |
K2—O5viii | 2.987 (5) | B1—O1 | 1.325 (7) |
K2—O5 | 2.987 (5) | B1—O3 | 1.378 (8) |
K2—O2vi | 3.272 (5) | B1—O2 | 1.394 (7) |
K2—O2i | 3.272 (5) | B2—O5 | 1.342 (8) |
K2—B1vi | 3.309 (6) | B2—O4 | 1.355 (9) |
K2—B1i | 3.309 (6) | B2—O2xvi | 1.403 (8) |
K2—B3iv | 3.428 (9) | B3—O4xvii | 1.464 (6) |
K2—B2iv | 3.506 (9) | B3—O4 | 1.464 (6) |
K3—O3iv | 2.731 (4) | B3—O3xvi | 1.471 (6) |
K3—O3ix | 2.731 (4) | B3—O3xii | 1.471 (6) |
O5i—Dy1—O5 | 71.29 (14) | O3xi—K3—B1i | 68.56 (14) |
O5i—Dy1—O5ii | 100.77 (18) | O3—K3—B1i | 107.88 (14) |
O5—Dy1—O5ii | 119.31 (19) | O3i—K3—B1i | 23.94 (15) |
O5i—Dy1—O5iii | 164.78 (19) | B1ix—K3—B1i | 99.2 (2) |
O5—Dy1—O5iii | 100.77 (18) | B1x—K3—B1i | 172.8 (3) |
O5ii—Dy1—O5iii | 71.30 (14) | B1iv—K3—B1i | 85.95 (15) |
O5i—Dy1—O5iv | 71.30 (14) | O3iv—K3—B1xi | 149.17 (15) |
O5—Dy1—O5iv | 71.30 (14) | O3ix—K3—B1xi | 107.87 (14) |
O5ii—Dy1—O5iv | 164.78 (19) | O3x—K3—B1xi | 78.44 (15) |
O5iii—Dy1—O5iv | 119.31 (19) | O3xi—K3—B1xi | 23.94 (15) |
O5i—Dy1—O5v | 119.31 (19) | O3—K3—B1xi | 108.31 (15) |
O5—Dy1—O5v | 164.79 (19) | O3i—K3—B1xi | 68.56 (14) |
O5ii—Dy1—O5v | 71.30 (14) | B1ix—K3—B1xi | 85.94 (15) |
O5iii—Dy1—O5v | 71.30 (14) | B1x—K3—B1xi | 85.94 (15) |
O5iv—Dy1—O5v | 100.77 (18) | B1iv—K3—B1xi | 172.8 (3) |
O5i—Dy1—Dy2 | 42.30 (9) | B1i—K3—B1xi | 89.4 (2) |
O5—Dy1—Dy2 | 42.30 (9) | O3iv—K3—B1 | 107.88 (14) |
O5ii—Dy1—Dy2 | 137.70 (9) | O3ix—K3—B1 | 149.17 (15) |
O5iii—Dy1—Dy2 | 137.70 (9) | O3x—K3—B1 | 68.56 (14) |
O5iv—Dy1—Dy2 | 42.30 (9) | O3xi—K3—B1 | 108.31 (15) |
O5v—Dy1—Dy2 | 137.70 (9) | O3—K3—B1 | 23.94 (15) |
O5i—Dy1—Dy2ii | 137.70 (9) | O3i—K3—B1 | 78.44 (15) |
O5—Dy1—Dy2ii | 137.71 (9) | B1ix—K3—B1 | 172.8 (3) |
O5ii—Dy1—Dy2ii | 42.30 (9) | B1x—K3—B1 | 89.4 (2) |
O5iii—Dy1—Dy2ii | 42.30 (9) | B1iv—K3—B1 | 85.95 (15) |
O5iv—Dy1—Dy2ii | 137.70 (9) | B1i—K3—B1 | 85.95 (15) |
O5v—Dy1—Dy2ii | 42.30 (9) | B1xi—K3—B1 | 99.2 (2) |
Dy2—Dy1—Dy2ii | 180.0 | O3iv—K4—O3xii | 102.43 (18) |
O1iv—Dy2—O1i | 95.72 (14) | O3iv—K4—O1xiii | 134.10 (11) |
O1iv—Dy2—O1 | 95.72 (14) | O3xii—K4—O1xiii | 75.39 (12) |
O1i—Dy2—O1 | 95.72 (14) | O3iv—K4—O1i | 75.39 (12) |
O1iv—Dy2—O5 | 104.36 (14) | O3xii—K4—O1i | 134.10 (11) |
O1i—Dy2—O5 | 83.35 (15) | O1xiii—K4—O1i | 138.51 (17) |
O1—Dy2—O5 | 159.90 (14) | O3iv—K4—O4 | 89.97 (12) |
O1iv—Dy2—O5i | 83.35 (15) | O3xii—K4—O4 | 49.08 (11) |
O1i—Dy2—O5i | 159.90 (14) | O1xiii—K4—O4 | 117.18 (11) |
O1—Dy2—O5i | 104.36 (14) | O1i—K4—O4 | 85.06 (11) |
O5—Dy2—O5i | 77.49 (17) | O3iv—K4—O4xiv | 49.08 (11) |
O1iv—Dy2—O5iv | 159.90 (14) | O3xii—K4—O4xiv | 89.97 (12) |
O1i—Dy2—O5iv | 104.36 (14) | O1xiii—K4—O4xiv | 85.06 (11) |
O1—Dy2—O5iv | 83.35 (15) | O1i—K4—O4xiv | 117.18 (11) |
O5—Dy2—O5iv | 77.49 (17) | O4—K4—O4xiv | 116.90 (17) |
O5i—Dy2—O5iv | 77.49 (17) | O3iv—K4—O2xiii | 159.15 (13) |
O1iv—Dy2—Dy1 | 121.11 (10) | O3xii—K4—O2xiii | 96.88 (12) |
O1i—Dy2—Dy1 | 121.11 (10) | O1xiii—K4—O2xiii | 44.51 (11) |
O1—Dy2—Dy1 | 121.11 (10) | O1i—K4—O2xiii | 96.72 (12) |
O5—Dy2—Dy1 | 46.27 (11) | O4—K4—O2xiii | 108.81 (13) |
O5i—Dy2—Dy1 | 46.27 (11) | O4xiv—K4—O2xiii | 123.93 (13) |
O5iv—Dy2—Dy1 | 46.27 (11) | O3iv—K4—O2i | 96.88 (12) |
O1iv—Dy2—K2i | 44.98 (10) | O3xii—K4—O2i | 159.15 (13) |
O1i—Dy2—K2i | 117.31 (10) | O1xiii—K4—O2i | 96.72 (12) |
O1—Dy2—K2i | 127.61 (10) | O1i—K4—O2i | 44.51 (11) |
O5—Dy2—K2i | 69.07 (11) | O4—K4—O2i | 123.93 (13) |
O5i—Dy2—K2i | 49.62 (11) | O4xiv—K4—O2i | 108.81 (13) |
O5iv—Dy2—K2i | 121.40 (11) | O2xiii—K4—O2i | 65.40 (16) |
Dy1—Dy2—K2i | 76.502 (4) | O3iv—K4—B1i | 77.75 (13) |
O1iv—Dy2—K2 | 127.61 (10) | O3xii—K4—B1i | 157.17 (13) |
O1i—Dy2—K2 | 44.98 (10) | O1xiii—K4—B1i | 121.14 (14) |
O1—Dy2—K2 | 117.31 (10) | O1i—K4—B1i | 23.31 (13) |
O5—Dy2—K2 | 49.62 (11) | O4—K4—B1i | 108.31 (13) |
O5i—Dy2—K2 | 121.40 (11) | O4xiv—K4—B1i | 106.17 (13) |
O5iv—Dy2—K2 | 69.07 (11) | O2xiii—K4—B1i | 87.51 (13) |
Dy1—Dy2—K2 | 76.502 (4) | O2i—K4—B1i | 24.53 (13) |
K2i—Dy2—K2 | 114.726 (3) | O3iv—K4—B1xiii | 157.17 (13) |
O1iv—Dy2—K2iv | 117.31 (10) | O3xii—K4—B1xiii | 77.75 (13) |
O1i—Dy2—K2iv | 127.61 (10) | O1xiii—K4—B1xiii | 23.31 (13) |
O1—Dy2—K2iv | 44.98 (10) | O1i—K4—B1xiii | 121.14 (14) |
O5—Dy2—K2iv | 121.40 (11) | O4—K4—B1xiii | 106.17 (13) |
O5i—Dy2—K2iv | 69.07 (11) | O4xiv—K4—B1xiii | 108.31 (13) |
O5iv—Dy2—K2iv | 49.62 (11) | O2xiii—K4—B1xiii | 24.53 (13) |
Dy1—Dy2—K2iv | 76.502 (5) | O2i—K4—B1xiii | 87.51 (14) |
K2i—Dy2—K2iv | 114.726 (3) | B1i—K4—B1xiii | 111.0 (2) |
K2—Dy2—K2iv | 114.726 (3) | O3iv—K4—B3 | 97.80 (16) |
O1iv—Dy2—K4i | 39.93 (10) | O3xii—K4—B3 | 24.34 (12) |
O1i—Dy2—K4i | 123.67 (10) | O1xiii—K4—B3 | 95.76 (16) |
O1—Dy2—K4i | 66.58 (9) | O1i—K4—B3 | 109.76 (12) |
O5—Dy2—K4i | 130.15 (11) | O4—K4—B3 | 24.78 (13) |
O5i—Dy2—K4i | 67.00 (11) | O4xiv—K4—B3 | 105.08 (10) |
O5iv—Dy2—K4i | 124.18 (11) | O2xiii—K4—B3 | 103.05 (15) |
Dy1—Dy2—K4i | 113.172 (5) | O2i—K4—B3 | 144.69 (10) |
K2i—Dy2—K4i | 61.38 (4) | B1i—K4—B3 | 132.91 (14) |
K2—Dy2—K4i | 166.67 (4) | B1xiii—K4—B3 | 91.16 (17) |
K2iv—Dy2—K4i | 77.38 (5) | O3iv—K4—B3xv | 24.34 (12) |
O1vi—K2—O1i | 175.22 (19) | O3xii—K4—B3xv | 97.80 (15) |
O1vi—K2—O4iv | 110.25 (13) | O1xiii—K4—B3xv | 109.76 (12) |
O1i—K2—O4iv | 74.31 (12) | O1i—K4—B3xv | 95.76 (16) |
O1vi—K2—O4vii | 74.31 (12) | O4—K4—B3xv | 105.08 (10) |
O1i—K2—O4vii | 110.25 (13) | O4xiv—K4—B3xv | 24.78 (13) |
O4iv—K2—O4vii | 49.68 (17) | O2xiii—K4—B3xv | 144.69 (10) |
O1vi—K2—O5viii | 62.85 (11) | O2i—K4—B3xv | 103.05 (15) |
O1i—K2—O5viii | 115.19 (12) | B1i—K4—B3xv | 91.16 (17) |
O4iv—K2—O5viii | 134.76 (14) | B1xiii—K4—B3xv | 132.91 (14) |
O4vii—K2—O5viii | 88.02 (11) | B3—K4—B3xv | 103.52 (17) |
O1vi—K2—O5 | 115.19 (12) | O1—B1—O3 | 123.6 (5) |
O1i—K2—O5 | 62.85 (11) | O1—B1—O2 | 118.2 (6) |
O4iv—K2—O5 | 88.02 (11) | O3—B1—O2 | 118.1 (5) |
O4vii—K2—O5 | 134.76 (14) | O1—B1—K2iv | 57.1 (3) |
O5viii—K2—O5 | 136.70 (19) | O3—B1—K2iv | 140.5 (4) |
O1vi—K2—O2vi | 44.28 (11) | O2—B1—K2iv | 76.3 (3) |
O1i—K2—O2vi | 135.42 (11) | O1—B1—K4iv | 58.2 (3) |
O4iv—K2—O2vi | 93.46 (13) | O3—B1—K4iv | 140.3 (4) |
O4vii—K2—O2vi | 90.99 (12) | O2—B1—K4iv | 74.9 (4) |
O5viii—K2—O2vi | 103.88 (12) | K2iv—B1—K4iv | 77.17 (15) |
O5—K2—O2vi | 74.25 (11) | O1—B1—K3 | 90.9 (3) |
O1vi—K2—O2i | 135.42 (11) | O3—B1—K3 | 53.6 (3) |
O1i—K2—O2i | 44.29 (11) | O2—B1—K3 | 127.2 (4) |
O4iv—K2—O2i | 90.99 (12) | K2iv—B1—K3 | 148.0 (2) |
O4vii—K2—O2i | 93.46 (13) | K4iv—B1—K3 | 88.01 (16) |
O5viii—K2—O2i | 74.25 (11) | O1—B1—K4i | 93.9 (3) |
O5—K2—O2i | 103.88 (12) | O3—B1—K4i | 46.8 (3) |
O2vi—K2—O2i | 175.1 (2) | O2—B1—K4i | 131.0 (4) |
O1vi—K2—B1vi | 23.26 (13) | K2iv—B1—K4i | 95.02 (16) |
O1i—K2—B1vi | 158.15 (13) | K4iv—B1—K4i | 150.98 (19) |
O4iv—K2—B1vi | 94.52 (15) | K3—B1—K4i | 84.29 (15) |
O4vii—K2—B1vi | 73.52 (15) | O5—B2—O4 | 122.3 (6) |
O5viii—K2—B1vi | 86.10 (13) | O5—B2—O2xvi | 118.6 (6) |
O5—K2—B1vi | 98.70 (14) | O4—B2—O2xvi | 119.1 (5) |
O2vi—K2—B1vi | 24.45 (13) | O5—B2—K2i | 90.8 (4) |
O2i—K2—B1vi | 156.93 (13) | O4—B2—K2i | 50.5 (4) |
O1vi—K2—B1i | 158.15 (13) | O2xvi—B2—K2i | 131.2 (5) |
O1i—K2—B1i | 23.25 (13) | O5—B2—K4 | 95.9 (4) |
O4iv—K2—B1i | 73.52 (15) | O4—B2—K4 | 53.4 (3) |
O4vii—K2—B1i | 94.52 (15) | O2xvi—B2—K4 | 119.7 (4) |
O5viii—K2—B1i | 98.70 (14) | K2i—B2—K4 | 91.89 (18) |
O5—K2—B1i | 86.10 (13) | O5—B2—K2 | 54.4 (4) |
O2vi—K2—B1i | 156.93 (13) | O4—B2—K2 | 124.5 (4) |
O2i—K2—B1i | 24.44 (13) | O2xvi—B2—K2 | 89.9 (5) |
B1vi—K2—B1i | 167.0 (3) | K2i—B2—K2 | 137.54 (19) |
O1vi—K2—B3iv | 92.39 (9) | K4—B2—K2 | 71.26 (16) |
O1i—K2—B3iv | 92.39 (9) | O4xvii—B3—O4 | 109.3 (7) |
O4iv—K2—B3iv | 24.84 (9) | O4xvii—B3—O3xvi | 108.1 (2) |
O4vii—K2—B3iv | 24.84 (9) | O4—B3—O3xvi | 111.4 (2) |
O5viii—K2—B3iv | 111.65 (9) | O4xvii—B3—O3xii | 111.4 (2) |
O5—K2—B3iv | 111.65 (9) | O4—B3—O3xii | 108.1 (2) |
O2vi—K2—B3iv | 92.45 (10) | O3xvi—B3—O3xii | 108.3 (6) |
O2i—K2—B3iv | 92.45 (10) | O4xvii—B3—K3xvi | 125.3 (3) |
B1vi—K2—B3iv | 83.52 (13) | O4—B3—K3xvi | 125.3 (3) |
B1i—K2—B3iv | 83.52 (13) | O3xvi—B3—K3xvi | 54.2 (3) |
O1vi—K2—B2iv | 107.16 (14) | O3xii—B3—K3xvi | 54.2 (3) |
O1i—K2—B2iv | 76.51 (14) | O4xvii—B3—K2i | 54.7 (3) |
O4iv—K2—B2iv | 21.58 (13) | O4—B3—K2i | 54.7 (3) |
O4vii—K2—B2iv | 65.50 (14) | O3xvi—B3—K2i | 125.8 (3) |
O5viii—K2—B2iv | 153.52 (15) | O3xii—B3—K2i | 125.8 (3) |
O5—K2—B2iv | 69.61 (13) | K3xvi—B3—K2i | 180.00 (8) |
O2vi—K2—B2iv | 77.85 (14) | O4xvii—B3—K4xviii | 56.92 (18) |
O2i—K2—B2iv | 105.89 (14) | O4—B3—K4xviii | 129.4 (3) |
B1vi—K2—B2iv | 86.30 (17) | O3xvi—B3—K4xviii | 51.34 (16) |
B1i—K2—B2iv | 84.10 (16) | O3xii—B3—K4xviii | 122.3 (3) |
B3iv—K2—B2iv | 42.20 (11) | K3xvi—B3—K4xviii | 85.56 (14) |
O3iv—K3—O3ix | 51.77 (16) | K2i—B3—K4xviii | 94.44 (14) |
O3iv—K3—O3x | 124.85 (17) | O4xvii—B3—K4 | 129.4 (3) |
O3ix—K3—O3x | 102.38 (10) | O4—B3—K4 | 56.92 (18) |
O3iv—K3—O3xi | 128.21 (17) | O3xvi—B3—K4 | 122.3 (3) |
O3ix—K3—O3xi | 102.38 (10) | O3xii—B3—K4 | 51.34 (16) |
O3x—K3—O3xi | 102.38 (9) | K3xvi—B3—K4 | 85.56 (14) |
O3iv—K3—O3 | 102.38 (10) | K2i—B3—K4 | 94.44 (14) |
O3ix—K3—O3 | 128.21 (17) | K4xviii—B3—K4 | 171.1 (3) |
O3x—K3—O3 | 51.77 (16) | B1—O1—Dy2 | 143.3 (4) |
O3xi—K3—O3 | 124.85 (17) | B1—O1—K2iv | 99.6 (3) |
O3iv—K3—O3i | 102.38 (10) | Dy2—O1—K2iv | 101.14 (14) |
O3ix—K3—O3i | 124.85 (17) | B1—O1—K4iv | 98.5 (4) |
O3x—K3—O3i | 128.21 (17) | Dy2—O1—K4iv | 109.98 (14) |
O3xi—K3—O3i | 51.77 (16) | K2iv—O1—K4iv | 93.60 (13) |
O3—K3—O3i | 102.38 (9) | B1—O2—B2xix | 121.8 (5) |
O3iv—K3—B1ix | 68.56 (14) | B1—O2—K4iv | 80.6 (4) |
O3ix—K3—B1ix | 23.94 (15) | B2xix—O2—K4iv | 136.3 (5) |
O3x—K3—B1ix | 107.87 (14) | B1—O2—K2iv | 79.3 (3) |
O3xi—K3—B1ix | 78.44 (15) | B2xix—O2—K2iv | 137.8 (4) |
O3—K3—B1ix | 149.17 (15) | K4iv—O2—K2iv | 78.70 (11) |
O3i—K3—B1ix | 108.31 (15) | B1—O3—B3xix | 124.5 (4) |
O3iv—K3—B1x | 108.31 (15) | B1—O3—K3 | 102.5 (3) |
O3ix—K3—B1x | 78.44 (15) | B3xix—O3—K3 | 99.9 (3) |
O3x—K3—B1x | 23.94 (15) | B1—O3—K4i | 112.0 (3) |
O3xi—K3—B1x | 107.87 (14) | B3xix—O3—K4i | 104.3 (2) |
O3—K3—B1x | 68.56 (14) | K3—O3—K4i | 113.07 (14) |
O3i—K3—B1x | 149.17 (15) | B2—O4—B3 | 124.6 (4) |
B1ix—K3—B1x | 85.94 (15) | B2—O4—K2i | 107.9 (4) |
O3iv—K3—B1iv | 23.94 (15) | B3—O4—K2i | 100.5 (3) |
O3ix—K3—B1iv | 68.56 (14) | B2—O4—K4 | 104.8 (4) |
O3x—K3—B1iv | 108.31 (15) | B3—O4—K4 | 98.3 (2) |
O3xi—K3—B1iv | 149.17 (15) | K2i—O4—K4 | 122.21 (14) |
O3—K3—B1iv | 78.44 (15) | B2—O5—Dy2 | 131.0 (4) |
O3i—K3—B1iv | 107.88 (14) | B2—O5—Dy1 | 120.8 (4) |
B1ix—K3—B1iv | 89.4 (2) | Dy2—O5—Dy1 | 91.43 (14) |
B1x—K3—B1iv | 99.2 (2) | B2—O5—K2 | 104.2 (4) |
O3iv—K3—B1i | 78.44 (15) | Dy2—O5—K2 | 93.86 (14) |
O3ix—K3—B1i | 108.31 (15) | Dy1—O5—K2 | 112.75 (15) |
O3x—K3—B1i | 149.18 (15) |
Symmetry codes: (i) −x+y, −x+1, z; (ii) x−y+2/3, −y+4/3, −z+1/3; (iii) y−1/3, x+1/3, −z+1/3; (iv) −y+1, x−y+1, z; (v) −x+2/3, −x+y+1/3, −z+1/3; (vi) y−2/3, x−1/3, −z+2/3; (vii) −x+1/3, −x+y−1/3, −z+2/3; (viii) x−y+1/3, −y+2/3, −z+2/3; (ix) −x+2/3, −x+y+1/3, −z+4/3; (x) y−1/3, x+1/3, −z+4/3; (xi) x−y+2/3, −y+4/3, −z+4/3; (xii) y−1, x, −z+1; (xiii) x−y, −y+1, −z+1; (xiv) −x, −x+y, −z+1; (xv) −y+2/3, x−y+4/3, z+1/3; (xvi) x−2/3, y−1/3, z−1/3; (xvii) y−2/3, x+2/3, −z+2/3; (xviii) −x+y−2/3, −x+2/3, z−1/3; (xix) x+2/3, y+1/3, z+1/3. |