Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S2053229622006738/wp3027sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S2053229622006738/wp3027Isup2.hkl | |
Portable Document Format (PDF) file https://doi.org/10.1107/S2053229622006738/wp3027sup3.pdf |
CCDC reference: 2182901
Data collection: APEX3 (Bruker, 2019); cell refinement: SAINT (Bruker, 2019); data reduction: SAINT (Bruker, 2019); program(s) used to solve structure: SHELXT2018 (Sheldrick, 2015a); program(s) used to refine structure: SHELXL2018 (Sheldrick, 2015b); molecular graphics: OLEX2 (Dolomanov et al., 2009) and CrystalMaker (Palmer, 2014); software used to prepare material for publication: OLEX2 (Dolomanov et al., 2009).
[Au24(C4H9S)16] | F(000) = 10720 |
Mr = 6153.94 | Dx = 3.457 Mg m−3 |
Monoclinic, Cc | Cu Kα radiation, λ = 1.54178 Å |
a = 15.5946 (6) Å | Cell parameters from 9932 reflections |
b = 25.9193 (6) Å | θ = 3.0–70.3° |
c = 29.7621 (8) Å | µ = 57.21 mm−1 |
β = 100.655 (2)° | T = 120 K |
V = 11822.5 (6) Å3 | Blade, metallic dark brown |
Z = 4 | 0.08 × 0.04 × 0.02 mm |
Bruker PHOTON-II CMOS diffractometer | 19685 reflections with I > 2σ(I) |
Detector resolution: 7.41 pixels mm-1 | Rint = 0.074 |
φ and ω scans | θmax = 70.5°, θmin = 3.0° |
Absorption correction: multi-scan (SADABS2014; Bruker, 2014) | h = −18→18 |
Tmin = 0.362, Tmax = 0.753 | k = −31→31 |
57304 measured reflections | l = −35→36 |
21231 independent reflections |
Refinement on F2 | Hydrogen site location: inferred from neighbouring sites |
Least-squares matrix: full | H-atom parameters constrained |
R[F2 > 2σ(F2)] = 0.049 | w = 1/[σ2(Fo2) + (0.069P)2] where P = (Fo2 + 2Fc2)/3 |
wR(F2) = 0.121 | (Δ/σ)max = 0.010 |
S = 1.00 | Δρmax = 3.09 e Å−3 |
21231 reflections | Δρmin = −2.63 e Å−3 |
986 parameters | Absolute structure: Refined as an inversion twin. |
26 restraints | Absolute structure parameter: 0.42 (2) |
Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes. |
Refinement. Refined as a 2-component inversion twin. Throughout the data collection, the crystal was kept below 120 K. The structure was modeled in OLEX2 (Dolomanov et al., 2009) and solved by SHELXT using Intrinsic Phasing methods (Sheldrick, 2015a) and refined by full-matrix least-squares analysis (Sheldrick, 2015b). All the non-H atoms were refined using anisotropic displacement parameters. |
x | y | z | Uiso*/Ueq | ||
Au1 | 0.48656 (7) | 0.39408 (4) | 0.48381 (3) | 0.0270 (2) | |
Au2 | 0.63701 (7) | 0.35358 (4) | 0.54737 (3) | 0.0300 (2) | |
Au3 | 0.68088 (7) | 0.44516 (4) | 0.51519 (3) | 0.0288 (2) | |
Au4 | 0.34676 (7) | 0.44264 (4) | 0.51240 (3) | 0.0295 (2) | |
Au5 | 0.62699 (7) | 0.35197 (4) | 0.44863 (3) | 0.0303 (2) | |
Au6 | 0.46906 (7) | 0.38877 (4) | 0.57375 (3) | 0.0316 (2) | |
Au7 | 0.51448 (7) | 0.47869 (4) | 0.53718 (4) | 0.0322 (2) | |
Au8 | 0.48267 (7) | 0.39670 (4) | 0.39177 (3) | 0.0317 (2) | |
Au9 | 0.33519 (7) | 0.44164 (4) | 0.41360 (3) | 0.0306 (2) | |
Au10 | 0.44719 (7) | 0.28862 (4) | 0.52848 (4) | 0.0324 (2) | |
Au11 | 0.15871 (7) | 0.43636 (4) | 0.43341 (4) | 0.0337 (2) | |
Au12 | 0.30058 (7) | 0.34698 (4) | 0.44428 (4) | 0.0309 (2) | |
Au13 | 0.46782 (7) | 0.30463 (4) | 0.43278 (4) | 0.0335 (2) | |
Au14 | 0.52263 (7) | 0.50266 (4) | 0.43415 (4) | 0.0317 (2) | |
Au15 | 0.69043 (7) | 0.43254 (4) | 0.60389 (3) | 0.0328 (2) | |
Au16 | 0.31547 (8) | 0.35753 (4) | 0.35777 (4) | 0.0337 (2) | |
Au17 | 0.64687 (7) | 0.42724 (4) | 0.37638 (3) | 0.0334 (2) | |
Au18 | 0.86223 (8) | 0.45830 (5) | 0.58461 (4) | 0.0366 (2) | |
Au19 | 0.13455 (8) | 0.33778 (4) | 0.36547 (4) | 0.0366 (2) | |
Au20 | 0.69865 (8) | 0.54454 (4) | 0.57753 (4) | 0.0370 (2) | |
Au21 | 0.82084 (8) | 0.35953 (4) | 0.52016 (4) | 0.0361 (2) | |
Au22 | 0.47777 (8) | 0.36298 (5) | 0.30111 (4) | 0.0395 (3) | |
Au23 | 0.57686 (8) | 0.40599 (5) | 0.66969 (4) | 0.0388 (3) | |
Au24 | 0.28957 (8) | 0.24427 (5) | 0.37934 (5) | 0.0435 (3) | |
S1 | 0.3792 (5) | 0.5288 (2) | 0.4256 (2) | 0.0342 (13) | |
S2 | 0.1957 (4) | 0.4502 (3) | 0.5108 (2) | 0.0337 (13) | |
S3 | 0.3025 (4) | 0.3149 (3) | 0.5186 (2) | 0.0332 (13) | |
S4 | 0.6675 (4) | 0.4812 (2) | 0.43970 (19) | 0.0296 (12) | |
S5 | 0.5930 (5) | 0.2664 (2) | 0.5378 (2) | 0.0353 (13) | |
S6 | 0.6244 (5) | 0.3809 (3) | 0.3095 (2) | 0.0402 (15) | |
S7 | 0.1151 (5) | 0.4257 (3) | 0.3548 (2) | 0.0362 (13) | |
S8 | 0.4457 (5) | 0.3652 (3) | 0.6473 (2) | 0.0372 (14) | |
S9 | 0.1404 (5) | 0.2500 (3) | 0.3750 (3) | 0.0412 (15) | |
S10 | 0.8450 (5) | 0.5459 (3) | 0.5722 (3) | 0.0397 (14) | |
S11 | 0.5559 (5) | 0.5487 (3) | 0.5874 (2) | 0.0376 (14) | |
S12 | 0.7770 (5) | 0.3453 (3) | 0.4425 (2) | 0.0355 (13) | |
S13 | 0.3348 (5) | 0.3370 (3) | 0.2827 (2) | 0.0421 (15) | |
S14 | 0.8808 (4) | 0.3707 (3) | 0.5965 (2) | 0.0374 (14) | |
S15 | 0.4377 (5) | 0.2355 (3) | 0.3803 (3) | 0.0443 (16) | |
S16 | 0.7079 (5) | 0.4483 (3) | 0.6838 (2) | 0.0434 (16) | |
C1 | 0.714 (2) | 0.5830 (11) | 0.4569 (11) | 0.043 (7) | |
H1A | 0.652242 | 0.590500 | 0.446595 | 0.064* | |
H1B | 0.749033 | 0.612851 | 0.450662 | 0.064* | |
H1C | 0.725665 | 0.575910 | 0.489769 | 0.064* | |
C2 | 0.740 (2) | 0.5351 (10) | 0.4308 (9) | 0.035 (6) | |
C3 | 0.380 (2) | 0.4677 (15) | 0.6534 (15) | 0.063 (11) | |
H3A | 0.329150 | 0.487604 | 0.657552 | 0.095* | |
H3B | 0.389933 | 0.471823 | 0.621935 | 0.095* | |
H3C | 0.431850 | 0.480110 | 0.674713 | 0.095* | |
C4 | 0.196 (2) | 0.5293 (12) | 0.5694 (9) | 0.039 (6) | |
H4A | 0.187557 | 0.565961 | 0.575526 | 0.059* | |
H4B | 0.258010 | 0.520716 | 0.577603 | 0.059* | |
H4C | 0.162853 | 0.508362 | 0.587737 | 0.059* | |
C5 | 0.534 (3) | 0.6254 (15) | 0.5204 (17) | 0.073 (12) | |
H5A | 0.597285 | 0.630157 | 0.524461 | 0.110* | |
H5B | 0.504484 | 0.657485 | 0.509040 | 0.110* | |
H5C | 0.515870 | 0.597609 | 0.498401 | 0.110* | |
C6 | 0.784 (2) | 0.4059 (12) | 0.7190 (9) | 0.043 (7) | |
C7 | 0.8309 (19) | 0.5198 (10) | 0.4464 (10) | 0.036 (6) | |
H7A | 0.837394 | 0.504480 | 0.476945 | 0.054* | |
H7B | 0.868696 | 0.550103 | 0.447530 | 0.054* | |
H7C | 0.847415 | 0.494352 | 0.425125 | 0.054* | |
C8 | 0.7320 (19) | 0.2423 (14) | 0.6059 (12) | 0.048 (8) | |
H8A | 0.761273 | 0.214509 | 0.592254 | 0.072* | |
H8B | 0.751724 | 0.242233 | 0.639122 | 0.072* | |
H8C | 0.746257 | 0.275537 | 0.593402 | 0.072* | |
C9 | 0.630 (2) | 0.2336 (11) | 0.5944 (11) | 0.043 (7) | |
C10 | 0.885 (3) | 0.6359 (13) | 0.6168 (13) | 0.055 (9) | |
H10A | 0.916744 | 0.648639 | 0.593640 | 0.083* | |
H10B | 0.902982 | 0.655062 | 0.645314 | 0.083* | |
H10C | 0.821940 | 0.640760 | 0.605925 | 0.083* | |
C11 | 0.511 (2) | 0.6119 (14) | 0.5644 (16) | 0.057 (9) | |
C12 | 0.545 (3) | 0.6507 (12) | 0.5982 (13) | 0.065 (11) | |
H12A | 0.515308 | 0.647983 | 0.624378 | 0.097* | |
H12B | 0.535219 | 0.685065 | 0.584554 | 0.097* | |
H12C | 0.607721 | 0.645063 | 0.608425 | 0.097* | |
C13 | 0.196 (3) | 0.5536 (12) | 0.4877 (12) | 0.052 (9) | |
H13A | 0.176293 | 0.541931 | 0.456136 | 0.078* | |
H13B | 0.260008 | 0.554160 | 0.494571 | 0.078* | |
H13C | 0.173670 | 0.588400 | 0.491263 | 0.078* | |
C14 | −0.005 (2) | 0.4378 (13) | 0.3394 (13) | 0.051 (8) | |
C15 | 1.005 (2) | 0.2978 (15) | 0.5985 (17) | 0.065 (11) | |
H15A | 0.986871 | 0.281014 | 0.624790 | 0.098* | |
H15B | 1.064308 | 0.286975 | 0.596595 | 0.098* | |
H15C | 0.964963 | 0.287773 | 0.570424 | 0.098* | |
C16 | 1.0024 (18) | 0.3563 (13) | 0.6043 (10) | 0.042 (7) | |
C17 | 0.311 (3) | 0.384 (2) | 0.1982 (12) | 0.077 (14) | |
H17A | 0.285440 | 0.412804 | 0.178961 | 0.115* | |
H17B | 0.293684 | 0.351319 | 0.182224 | 0.115* | |
H17C | 0.374271 | 0.386865 | 0.204555 | 0.115* | |
C18 | 0.239 (2) | 0.2521 (10) | 0.5739 (11) | 0.041 (7) | |
H18A | 0.200378 | 0.276606 | 0.585297 | 0.062* | |
H18B | 0.299659 | 0.258941 | 0.588513 | 0.062* | |
H18C | 0.223296 | 0.216829 | 0.581040 | 0.062* | |
C19 | 0.758 (3) | 0.406 (2) | 0.7669 (12) | 0.073 (13) | |
H19A | 0.785615 | 0.435855 | 0.784485 | 0.110* | |
H19B | 0.778077 | 0.374278 | 0.783114 | 0.110* | |
H19C | 0.694696 | 0.408960 | 0.763397 | 0.110* | |
C20 | 0.164 (2) | 0.5183 (12) | 0.5190 (11) | 0.044 (7) | |
C21 | 0.381 (3) | 0.6205 (15) | 0.3829 (16) | 0.067 (9) | |
H21A | 0.379130 | 0.640433 | 0.354743 | 0.101* | |
H21B | 0.440507 | 0.621763 | 0.401038 | 0.101* | |
H21C | 0.340174 | 0.635108 | 0.400642 | 0.101* | |
C22 | 0.779 (2) | 0.2413 (13) | 0.4660 (10) | 0.047 (8) | |
H22A | 0.808647 | 0.251069 | 0.496710 | 0.071* | |
H22B | 0.795829 | 0.206135 | 0.459186 | 0.071* | |
H22C | 0.715582 | 0.242710 | 0.464419 | 0.071* | |
C23 | 0.368 (2) | 0.4057 (19) | 0.7162 (12) | 0.065 (12) | |
H23A | 0.338334 | 0.435791 | 0.726356 | 0.098* | |
H23B | 0.428385 | 0.404684 | 0.732407 | 0.098* | |
H23C | 0.337618 | 0.374168 | 0.722965 | 0.098* | |
C24 | 0.3654 (16) | 0.4094 (13) | 0.6629 (11) | 0.041 (7) | |
C25 | 0.095 (3) | 0.1610 (14) | 0.323 (2) | 0.080 (15) | |
H25A | 0.050749 | 0.144011 | 0.300429 | 0.120* | |
H25B | 0.088274 | 0.150219 | 0.353951 | 0.120* | |
H25C | 0.153342 | 0.151176 | 0.318208 | 0.120* | |
C26 | 0.125 (3) | 0.2370 (15) | 0.2815 (14) | 0.071 (12) | |
H26A | 0.185094 | 0.223494 | 0.285331 | 0.107* | |
H26B | 0.127176 | 0.274815 | 0.281761 | 0.107* | |
H26C | 0.091672 | 0.225031 | 0.252296 | 0.107* | |
C27 | 0.879 (2) | 0.4254 (18) | 0.7218 (12) | 0.060 (10) | |
H27A | 0.896244 | 0.420735 | 0.692162 | 0.091* | |
H27B | 0.917869 | 0.405874 | 0.745245 | 0.091* | |
H27C | 0.881467 | 0.462128 | 0.729895 | 0.091* | |
C28 | 0.138 (2) | 0.2740 (12) | 0.5031 (13) | 0.048 (8) | |
H28A | 0.136421 | 0.283870 | 0.471090 | 0.072* | |
H28B | 0.120872 | 0.303524 | 0.519925 | 0.072* | |
H28C | 0.098206 | 0.245223 | 0.504418 | 0.072* | |
C29 | 0.278 (3) | 0.3848 (17) | 0.2415 (11) | 0.061 (10) | |
C30 | 0.611 (2) | 0.1772 (16) | 0.5875 (15) | 0.068 (12) | |
H30A | 0.547450 | 0.171867 | 0.580201 | 0.102* | |
H30B | 0.635080 | 0.158359 | 0.615462 | 0.102* | |
H30C | 0.637199 | 0.164483 | 0.562173 | 0.102* | |
C31 | 0.603 (2) | 0.3993 (19) | 0.2164 (11) | 0.063 (11) | |
H31A | 0.643766 | 0.370466 | 0.215607 | 0.094* | |
H31B | 0.605932 | 0.422637 | 0.190789 | 0.094* | |
H31C | 0.543893 | 0.385964 | 0.213945 | 0.094* | |
C32 | 0.291 (3) | 0.4407 (12) | 0.2617 (14) | 0.062 (10) | |
H32A | 0.299081 | 0.464765 | 0.237456 | 0.093* | |
H32B | 0.342291 | 0.441388 | 0.286158 | 0.093* | |
H32C | 0.239171 | 0.450770 | 0.273972 | 0.093* | |
C34 | 0.578 (2) | 0.4773 (15) | 0.2654 (14) | 0.058 (9) | |
H34A | 0.516609 | 0.472013 | 0.250825 | 0.087* | |
H34B | 0.602310 | 0.505769 | 0.250209 | 0.087* | |
H34C | 0.580862 | 0.485624 | 0.297745 | 0.087* | |
C33 | 0.776 (2) | 0.3492 (12) | 0.7015 (13) | 0.051 (8) | |
H33A | 0.714499 | 0.339642 | 0.693765 | 0.076* | |
H33B | 0.806222 | 0.326201 | 0.725529 | 0.076* | |
H33C | 0.802976 | 0.346079 | 0.674334 | 0.076* | |
C35 | 0.588 (3) | 0.2577 (19) | 0.6311 (13) | 0.073 (13) | |
H35A | 0.591898 | 0.295363 | 0.629423 | 0.109* | |
H35B | 0.617660 | 0.245855 | 0.661181 | 0.109* | |
H35C | 0.526106 | 0.247581 | 0.626497 | 0.109* | |
C36 | 0.725 (2) | 0.4417 (15) | 0.2671 (12) | 0.056 (10) | |
H36A | 0.747539 | 0.451508 | 0.298940 | 0.084* | |
H36B | 0.733295 | 0.470466 | 0.246915 | 0.084* | |
H36C | 0.757787 | 0.411552 | 0.259280 | 0.084* | |
C37 | 0.085 (3) | 0.2187 (14) | 0.3189 (17) | 0.066 (11) | |
C38 | −0.015 (3) | 0.4978 (14) | 0.3480 (13) | 0.060 (9) | |
H38A | 0.020208 | 0.507277 | 0.377569 | 0.090* | |
H38B | −0.076736 | 0.505727 | 0.348241 | 0.090* | |
H38C | 0.004146 | 0.517369 | 0.323614 | 0.090* | |
C39 | 0.475 (2) | 0.1748 (15) | 0.4064 (15) | 0.059 (9) | |
C40 | 0.804 (2) | 0.2775 (11) | 0.4321 (10) | 0.039 (6) | |
C41 | 0.276 (3) | 0.3928 (17) | 0.6382 (12) | 0.062 (10) | |
H41A | 0.266434 | 0.356543 | 0.645303 | 0.093* | |
H41B | 0.272602 | 0.396638 | 0.605134 | 0.093* | |
H41C | 0.231391 | 0.414269 | 0.648100 | 0.093* | |
C42 | 0.995 (3) | 0.5676 (18) | 0.6288 (17) | 0.077 (14) | |
H42A | 1.004088 | 0.530243 | 0.628248 | 0.115* | |
H42B | 1.027415 | 0.581758 | 0.657605 | 0.115* | |
H42C | 1.016420 | 0.583566 | 0.603091 | 0.115* | |
C43 | 0.577 (3) | 0.1744 (17) | 0.417 (2) | 0.087 (15) | |
H43A | 0.599467 | 0.160970 | 0.390961 | 0.130* | |
H43B | 0.597446 | 0.152444 | 0.444011 | 0.130* | |
H43C | 0.598773 | 0.209665 | 0.423952 | 0.130* | |
C44 | 0.759 (3) | 0.2640 (14) | 0.3864 (12) | 0.056 (9) | |
H44A | 0.799314 | 0.245118 | 0.370598 | 0.084* | |
H44B | 0.739679 | 0.295527 | 0.369414 | 0.084* | |
H44C | 0.708709 | 0.242258 | 0.388434 | 0.084* | |
C45 | 0.260 (3) | 0.2103 (12) | 0.5022 (14) | 0.056 (9) | |
H45A | 0.218567 | 0.182172 | 0.503381 | 0.084* | |
H45B | 0.317901 | 0.200093 | 0.518600 | 0.084* | |
H45C | 0.262986 | 0.217869 | 0.470245 | 0.084* | |
C46 | 0.066 (2) | 0.5194 (13) | 0.5101 (10) | 0.045 (7) | |
H46A | 0.043687 | 0.485495 | 0.517146 | 0.067* | |
H46B | 0.044091 | 0.527666 | 0.477911 | 0.067* | |
H46C | 0.045777 | 0.545624 | 0.529513 | 0.067* | |
C47 | 0.905 (3) | 0.2756 (16) | 0.4347 (16) | 0.068 (11) | |
H47A | 0.934541 | 0.280591 | 0.466479 | 0.102* | |
H47B | 0.922511 | 0.302988 | 0.415590 | 0.102* | |
H47C | 0.921475 | 0.241989 | 0.423791 | 0.102* | |
C48 | 0.444 (3) | 0.1320 (11) | 0.3708 (14) | 0.057 (9) | |
H48A | 0.398233 | 0.145426 | 0.346806 | 0.085* | |
H48B | 0.421878 | 0.102610 | 0.385876 | 0.085* | |
H48C | 0.493878 | 0.120685 | 0.357230 | 0.085* | |
C49 | 0.872 (3) | 0.5599 (17) | 0.6666 (10) | 0.063 (11) | |
H49A | 0.808662 | 0.555178 | 0.659234 | 0.094* | |
H49B | 0.886456 | 0.585390 | 0.691149 | 0.094* | |
H49C | 0.900068 | 0.526959 | 0.676569 | 0.094* | |
C50 | 1.041 (3) | 0.3817 (14) | 0.5685 (14) | 0.058 (9) | |
H50A | 1.020701 | 0.364517 | 0.539179 | 0.086* | |
H50B | 1.104735 | 0.379547 | 0.576431 | 0.086* | |
H50C | 1.023193 | 0.418025 | 0.566219 | 0.086* | |
C51 | 0.629 (2) | 0.4284 (12) | 0.2612 (10) | 0.042 (7) | |
C52 | −0.0273 (19) | 0.4280 (16) | 0.2880 (11) | 0.053 (9) | |
H52A | −0.036491 | 0.461077 | 0.271850 | 0.080* | |
H52B | −0.080492 | 0.407209 | 0.280896 | 0.080* | |
H52C | 0.021031 | 0.409557 | 0.278317 | 0.080* | |
C53 | 0.230 (2) | 0.2578 (11) | 0.5243 (10) | 0.039 (7) | |
C54 | 1.040 (3) | 0.3729 (19) | 0.6536 (10) | 0.070 (13) | |
H54A | 1.005805 | 0.401969 | 0.662054 | 0.105* | |
H54B | 1.100783 | 0.383476 | 0.655766 | 0.105* | |
H54C | 1.036652 | 0.343965 | 0.674387 | 0.105* | |
C55 | −0.006 (2) | 0.232 (2) | 0.3154 (18) | 0.083 (15) | |
H55A | −0.038802 | 0.219054 | 0.286434 | 0.124* | |
H55B | −0.011478 | 0.269555 | 0.316631 | 0.124* | |
H55C | −0.028116 | 0.216340 | 0.340905 | 0.124* | |
C56 | −0.055 (2) | 0.4076 (17) | 0.3673 (13) | 0.061 (11) | |
H56A | −0.030950 | 0.372618 | 0.371494 | 0.091* | |
H56B | −0.116282 | 0.405736 | 0.351886 | 0.091* | |
H56C | −0.051580 | 0.424103 | 0.397210 | 0.091* | |
C57 | 0.904 (3) | 0.5784 (16) | 0.6252 (15) | 0.061 (9) | |
C58 | 0.188 (3) | 0.368 (2) | 0.2337 (13) | 0.080 (15) | |
H58A | 0.176246 | 0.349845 | 0.260825 | 0.120* | |
H58B | 0.177057 | 0.344609 | 0.207328 | 0.120* | |
H58C | 0.149321 | 0.398003 | 0.227555 | 0.120* | |
C59 | 0.253 (2) | 0.5625 (18) | 0.3556 (15) | 0.069 (10) | |
H59A | 0.224689 | 0.584227 | 0.375668 | 0.104* | |
H59B | 0.233935 | 0.526668 | 0.357700 | 0.104* | |
H59C | 0.235942 | 0.574555 | 0.323968 | 0.104* | |
C60 | 0.437 (2) | 0.1631 (14) | 0.4508 (12) | 0.053 (8) | |
H60A | 0.470807 | 0.181888 | 0.476697 | 0.080* | |
H60B | 0.440553 | 0.125971 | 0.457117 | 0.080* | |
H60C | 0.375774 | 0.174110 | 0.446262 | 0.080* | |
C61 | 0.357 (2) | 0.5661 (13) | 0.3712 (12) | 0.049 (5) | |
C62 | 0.404 (3) | 0.6057 (19) | 0.559 (2) | 0.084 (15) | |
H62A | 0.381628 | 0.584341 | 0.532422 | 0.127* | |
H62B | 0.376642 | 0.639816 | 0.555405 | 0.127* | |
H62C | 0.390539 | 0.589194 | 0.586693 | 0.127* | |
C63 | 0.395 (3) | 0.5435 (19) | 0.3357 (16) | 0.075 (10) | |
H63A | 0.404626 | 0.570212 | 0.313825 | 0.113* | |
H63B | 0.356292 | 0.516918 | 0.319995 | 0.113* | |
H63C | 0.451573 | 0.527803 | 0.349079 | 0.113* | |
C64 | 0.722 (2) | 0.5497 (10) | 0.3794 (8) | 0.035 (6) | |
H64A | 0.738792 | 0.521009 | 0.361478 | 0.052* | |
H64B | 0.755350 | 0.580499 | 0.374680 | 0.052* | |
H64C | 0.659314 | 0.556733 | 0.369539 | 0.052* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Au1 | 0.0311 (5) | 0.0270 (4) | 0.0217 (4) | 0.0039 (4) | 0.0015 (4) | −0.0005 (3) |
Au2 | 0.0347 (5) | 0.0296 (5) | 0.0240 (5) | 0.0029 (4) | 0.0010 (4) | 0.0029 (4) |
Au3 | 0.0345 (5) | 0.0285 (5) | 0.0230 (5) | 0.0024 (4) | 0.0039 (4) | 0.0018 (4) |
Au4 | 0.0314 (5) | 0.0309 (5) | 0.0250 (5) | 0.0050 (4) | 0.0022 (4) | 0.0015 (4) |
Au5 | 0.0329 (5) | 0.0321 (5) | 0.0251 (5) | 0.0045 (4) | 0.0028 (4) | 0.0018 (4) |
Au6 | 0.0385 (6) | 0.0322 (5) | 0.0229 (5) | 0.0043 (4) | 0.0023 (4) | 0.0017 (4) |
Au7 | 0.0358 (6) | 0.0300 (5) | 0.0301 (5) | 0.0004 (4) | 0.0044 (4) | −0.0043 (4) |
Au8 | 0.0348 (5) | 0.0367 (5) | 0.0219 (5) | 0.0041 (4) | 0.0007 (4) | 0.0012 (4) |
Au9 | 0.0341 (5) | 0.0295 (5) | 0.0268 (5) | 0.0030 (4) | 0.0023 (4) | 0.0020 (4) |
Au10 | 0.0368 (6) | 0.0289 (5) | 0.0305 (5) | 0.0006 (4) | 0.0033 (4) | 0.0016 (4) |
Au11 | 0.0341 (6) | 0.0344 (5) | 0.0308 (5) | 0.0032 (5) | 0.0012 (4) | −0.0016 (4) |
Au12 | 0.0344 (5) | 0.0295 (5) | 0.0278 (5) | 0.0033 (4) | 0.0028 (4) | 0.0020 (4) |
Au13 | 0.0378 (6) | 0.0284 (5) | 0.0328 (5) | 0.0015 (4) | 0.0027 (4) | −0.0041 (4) |
Au14 | 0.0353 (5) | 0.0312 (5) | 0.0277 (5) | 0.0008 (4) | 0.0033 (4) | 0.0015 (4) |
Au15 | 0.0385 (6) | 0.0374 (5) | 0.0220 (5) | 0.0009 (5) | 0.0045 (4) | −0.0008 (4) |
Au16 | 0.0359 (6) | 0.0381 (5) | 0.0250 (5) | 0.0010 (5) | −0.0001 (4) | −0.0027 (4) |
Au17 | 0.0383 (6) | 0.0384 (5) | 0.0227 (5) | 0.0014 (5) | 0.0034 (4) | 0.0014 (4) |
Au18 | 0.0374 (6) | 0.0379 (6) | 0.0340 (5) | 0.0032 (5) | 0.0049 (4) | −0.0020 (4) |
Au19 | 0.0367 (6) | 0.0329 (5) | 0.0383 (6) | 0.0039 (5) | 0.0024 (5) | −0.0030 (4) |
Au20 | 0.0393 (6) | 0.0333 (5) | 0.0365 (6) | 0.0024 (5) | 0.0019 (5) | −0.0034 (4) |
Au21 | 0.0357 (6) | 0.0350 (5) | 0.0368 (6) | 0.0032 (5) | 0.0044 (5) | −0.0006 (4) |
Au22 | 0.0468 (7) | 0.0455 (6) | 0.0257 (5) | −0.0027 (5) | 0.0053 (5) | −0.0039 (4) |
Au23 | 0.0383 (6) | 0.0512 (7) | 0.0256 (5) | 0.0034 (5) | 0.0022 (4) | 0.0005 (4) |
Au24 | 0.0420 (7) | 0.0353 (6) | 0.0484 (7) | 0.0069 (5) | −0.0044 (5) | −0.0066 (5) |
S1 | 0.039 (3) | 0.029 (3) | 0.035 (3) | 0.007 (3) | 0.007 (3) | 0.005 (2) |
S2 | 0.032 (3) | 0.037 (3) | 0.032 (3) | 0.003 (3) | 0.004 (2) | −0.003 (2) |
S3 | 0.035 (3) | 0.035 (3) | 0.029 (3) | −0.003 (3) | 0.005 (2) | 0.003 (2) |
S4 | 0.035 (3) | 0.030 (3) | 0.023 (3) | 0.000 (3) | 0.003 (2) | 0.003 (2) |
S5 | 0.038 (3) | 0.031 (3) | 0.036 (3) | 0.001 (3) | 0.004 (3) | −0.002 (2) |
S6 | 0.045 (4) | 0.047 (4) | 0.027 (3) | 0.006 (3) | 0.005 (3) | −0.001 (3) |
S7 | 0.039 (3) | 0.034 (3) | 0.033 (3) | 0.000 (3) | 0.000 (3) | −0.001 (2) |
S8 | 0.042 (4) | 0.046 (4) | 0.024 (3) | 0.006 (3) | 0.007 (3) | 0.005 (2) |
S9 | 0.040 (4) | 0.036 (3) | 0.046 (4) | 0.000 (3) | 0.005 (3) | −0.001 (3) |
S10 | 0.038 (4) | 0.038 (3) | 0.041 (4) | 0.003 (3) | 0.001 (3) | −0.001 (3) |
S11 | 0.045 (4) | 0.032 (3) | 0.036 (3) | 0.000 (3) | 0.007 (3) | −0.005 (2) |
S12 | 0.036 (3) | 0.034 (3) | 0.036 (3) | 0.005 (3) | 0.006 (3) | −0.001 (2) |
S13 | 0.052 (4) | 0.051 (4) | 0.023 (3) | −0.004 (3) | 0.005 (3) | −0.007 (3) |
S14 | 0.032 (3) | 0.043 (3) | 0.035 (3) | 0.000 (3) | 0.001 (3) | 0.000 (3) |
S15 | 0.047 (4) | 0.043 (4) | 0.040 (4) | 0.002 (3) | −0.002 (3) | −0.009 (3) |
S16 | 0.051 (4) | 0.057 (4) | 0.021 (3) | 0.002 (3) | 0.003 (3) | −0.005 (3) |
C1 | 0.054 (18) | 0.031 (13) | 0.042 (15) | −0.002 (13) | 0.003 (13) | −0.018 (11) |
C2 | 0.044 (15) | 0.028 (12) | 0.033 (13) | −0.012 (12) | 0.010 (11) | −0.008 (10) |
C3 | 0.05 (2) | 0.06 (2) | 0.07 (3) | 0.005 (17) | −0.006 (18) | −0.034 (19) |
C4 | 0.050 (17) | 0.043 (15) | 0.025 (13) | −0.002 (13) | 0.008 (12) | −0.013 (11) |
C5 | 0.08 (3) | 0.037 (17) | 0.11 (4) | 0.020 (19) | 0.03 (3) | −0.002 (19) |
C6 | 0.044 (16) | 0.050 (17) | 0.023 (13) | 0.001 (13) | −0.022 (11) | 0.001 (11) |
C7 | 0.044 (15) | 0.021 (11) | 0.044 (14) | 0.005 (11) | 0.008 (12) | −0.006 (10) |
C8 | 0.030 (15) | 0.06 (2) | 0.053 (18) | 0.004 (14) | 0.010 (13) | 0.013 (15) |
C9 | 0.047 (17) | 0.028 (13) | 0.048 (16) | 0.018 (13) | −0.007 (13) | 0.001 (11) |
C10 | 0.06 (2) | 0.041 (17) | 0.05 (2) | −0.009 (16) | −0.015 (16) | −0.006 (14) |
C11 | 0.029 (15) | 0.047 (19) | 0.09 (3) | 0.022 (14) | 0.009 (16) | 0.012 (18) |
C12 | 0.11 (3) | 0.029 (15) | 0.05 (2) | 0.023 (19) | 0.00 (2) | −0.014 (14) |
C13 | 0.08 (2) | 0.039 (16) | 0.048 (18) | 0.021 (16) | 0.032 (17) | 0.028 (14) |
C14 | 0.051 (19) | 0.046 (18) | 0.052 (19) | 0.012 (15) | 0.000 (15) | −0.006 (14) |
C15 | 0.041 (19) | 0.05 (2) | 0.10 (3) | 0.015 (16) | −0.008 (19) | 0.011 (19) |
C16 | 0.027 (13) | 0.06 (2) | 0.031 (15) | 0.009 (13) | −0.005 (11) | −0.008 (12) |
C17 | 0.08 (3) | 0.12 (4) | 0.024 (16) | −0.04 (3) | 0.005 (17) | −0.007 (18) |
C18 | 0.056 (18) | 0.021 (12) | 0.050 (17) | −0.002 (12) | 0.019 (14) | 0.003 (11) |
C19 | 0.05 (2) | 0.14 (4) | 0.032 (17) | 0.00 (2) | 0.002 (15) | −0.01 (2) |
C20 | 0.047 (17) | 0.041 (16) | 0.041 (16) | 0.022 (14) | 0.000 (13) | −0.008 (12) |
C21 | 0.07 (2) | 0.048 (17) | 0.08 (2) | 0.004 (16) | 0.012 (17) | 0.026 (15) |
C22 | 0.053 (18) | 0.056 (19) | 0.031 (14) | 0.020 (16) | 0.002 (13) | −0.012 (12) |
C23 | 0.049 (19) | 0.12 (3) | 0.038 (17) | 0.04 (2) | 0.025 (15) | 0.014 (18) |
C24 | 0.011 (11) | 0.062 (19) | 0.050 (17) | 0.011 (12) | 0.008 (10) | −0.023 (14) |
C25 | 0.10 (3) | 0.033 (18) | 0.12 (4) | −0.01 (2) | 0.06 (3) | −0.02 (2) |
C26 | 0.10 (3) | 0.05 (2) | 0.05 (2) | −0.02 (2) | −0.02 (2) | 0.003 (16) |
C27 | 0.048 (19) | 0.10 (3) | 0.039 (17) | −0.002 (19) | 0.010 (14) | −0.011 (17) |
C28 | 0.034 (15) | 0.038 (15) | 0.08 (2) | −0.001 (13) | 0.028 (15) | 0.013 (15) |
C29 | 0.07 (2) | 0.08 (3) | 0.024 (15) | −0.01 (2) | −0.011 (15) | −0.002 (14) |
C30 | 0.06 (2) | 0.07 (2) | 0.08 (3) | 0.027 (19) | 0.012 (19) | 0.06 (2) |
C31 | 0.049 (19) | 0.11 (3) | 0.024 (15) | 0.00 (2) | −0.012 (13) | −0.001 (16) |
C32 | 0.08 (3) | 0.033 (16) | 0.07 (2) | 0.024 (17) | 0.01 (2) | 0.027 (15) |
C34 | 0.048 (19) | 0.06 (2) | 0.06 (2) | −0.003 (17) | −0.007 (16) | 0.003 (16) |
C33 | 0.048 (18) | 0.037 (16) | 0.07 (2) | −0.006 (14) | 0.010 (16) | −0.003 (14) |
C35 | 0.07 (3) | 0.11 (3) | 0.05 (2) | 0.02 (2) | 0.05 (2) | 0.04 (2) |
C36 | 0.05 (2) | 0.08 (2) | 0.042 (17) | −0.009 (18) | 0.018 (15) | 0.039 (16) |
C37 | 0.07 (2) | 0.035 (17) | 0.10 (3) | 0.015 (17) | 0.03 (2) | −0.022 (18) |
C38 | 0.08 (3) | 0.045 (19) | 0.06 (2) | 0.009 (18) | 0.001 (18) | 0.003 (15) |
C39 | 0.039 (17) | 0.06 (2) | 0.08 (3) | 0.014 (16) | −0.003 (17) | −0.009 (18) |
C40 | 0.052 (17) | 0.025 (12) | 0.040 (15) | 0.006 (13) | 0.008 (13) | −0.013 (10) |
C41 | 0.07 (2) | 0.08 (3) | 0.033 (17) | −0.01 (2) | 0.008 (16) | 0.010 (16) |
C42 | 0.05 (2) | 0.07 (3) | 0.09 (3) | −0.014 (19) | −0.04 (2) | 0.00 (2) |
C43 | 0.09 (3) | 0.05 (2) | 0.11 (4) | 0.03 (2) | 0.00 (3) | 0.01 (2) |
C44 | 0.07 (2) | 0.048 (18) | 0.047 (18) | 0.011 (18) | 0.009 (17) | 0.002 (14) |
C45 | 0.06 (2) | 0.029 (15) | 0.07 (2) | 0.001 (15) | 0.009 (19) | −0.008 (15) |
C46 | 0.042 (16) | 0.054 (18) | 0.036 (14) | 0.029 (15) | 0.003 (12) | −0.006 (12) |
C47 | 0.06 (2) | 0.06 (2) | 0.09 (3) | 0.04 (2) | 0.02 (2) | 0.02 (2) |
C48 | 0.08 (3) | 0.021 (13) | 0.08 (2) | −0.014 (15) | 0.03 (2) | −0.019 (14) |
C49 | 0.07 (2) | 0.09 (3) | 0.018 (13) | −0.03 (2) | −0.007 (14) | 0.007 (14) |
C50 | 0.06 (2) | 0.050 (19) | 0.06 (2) | 0.008 (18) | 0.030 (19) | 0.002 (16) |
C51 | 0.049 (17) | 0.041 (15) | 0.038 (15) | 0.002 (14) | 0.013 (13) | −0.020 (12) |
C52 | 0.023 (13) | 0.09 (3) | 0.047 (17) | 0.032 (16) | 0.000 (12) | −0.023 (16) |
C53 | 0.050 (17) | 0.041 (15) | 0.034 (14) | −0.016 (13) | 0.029 (13) | −0.023 (11) |
C54 | 0.07 (2) | 0.11 (3) | 0.018 (14) | 0.04 (2) | −0.010 (14) | −0.014 (16) |
C55 | 0.037 (19) | 0.11 (4) | 0.09 (3) | −0.01 (2) | −0.01 (2) | −0.03 (3) |
C56 | 0.031 (15) | 0.09 (3) | 0.06 (2) | 0.030 (18) | 0.025 (15) | 0.03 (2) |
C57 | 0.06 (2) | 0.06 (2) | 0.07 (2) | 0.020 (18) | 0.004 (18) | −0.003 (17) |
C58 | 0.05 (2) | 0.16 (5) | 0.034 (18) | −0.02 (3) | −0.001 (15) | 0.00 (2) |
C59 | 0.050 (17) | 0.08 (2) | 0.066 (19) | 0.005 (16) | −0.019 (15) | 0.039 (16) |
C60 | 0.06 (2) | 0.048 (18) | 0.044 (18) | 0.011 (16) | −0.005 (15) | −0.009 (14) |
C61 | 0.050 (10) | 0.042 (10) | 0.052 (10) | 0.015 (9) | 0.000 (9) | 0.014 (9) |
C62 | 0.09 (3) | 0.07 (3) | 0.10 (4) | 0.02 (3) | 0.04 (3) | 0.01 (3) |
C63 | 0.08 (2) | 0.07 (2) | 0.064 (19) | 0.011 (19) | −0.002 (18) | 0.013 (17) |
C64 | 0.059 (18) | 0.036 (13) | 0.011 (10) | −0.002 (13) | 0.012 (11) | 0.008 (9) |
Au1—Au2 | 2.9230 (15) | C13—H13A | 0.9800 |
Au1—Au3 | 3.2804 (15) | C13—H13B | 0.9800 |
Au1—Au4 | 2.7834 (15) | C13—H13C | 0.9800 |
Au1—Au5 | 2.8164 (15) | C13—C20 | 1.46 (4) |
Au1—Au6 | 2.7438 (14) | C14—C38 | 1.59 (5) |
Au1—Au7 | 2.6957 (15) | C14—C52 | 1.53 (5) |
Au1—Au8 | 2.7297 (14) | C14—C56 | 1.47 (5) |
Au1—Au9 | 3.1040 (14) | C15—H15A | 0.9800 |
Au1—Au10 | 3.1493 (15) | C15—H15B | 0.9800 |
Au1—Au12 | 3.1661 (15) | C15—H15C | 0.9800 |
Au1—Au13 | 2.7575 (15) | C15—C16 | 1.53 (5) |
Au1—Au14 | 3.2756 (15) | C16—C50 | 1.47 (5) |
Au2—Au3 | 2.6947 (15) | C16—C54 | 1.54 (4) |
Au2—Au5 | 2.9143 (14) | C17—H17A | 0.9800 |
Au2—Au6 | 3.0114 (16) | C17—H17B | 0.9800 |
Au2—Au10 | 3.3614 (16) | C17—H17C | 0.9800 |
Au2—Au15 | 2.6822 (15) | C17—C29 | 1.47 (5) |
Au2—Au21 | 3.1235 (17) | C18—H18A | 0.9800 |
Au2—S5 | 2.363 (7) | C18—H18B | 0.9800 |
Au3—Au5 | 3.1383 (15) | C18—H18C | 0.9800 |
Au3—Au7 | 2.9233 (15) | C18—C53 | 1.46 (4) |
Au3—Au15 | 2.6370 (14) | C19—H19A | 0.9800 |
Au3—Au18 | 3.1972 (16) | C19—H19B | 0.9800 |
Au3—Au20 | 3.1567 (15) | C19—H19C | 0.9800 |
Au3—Au21 | 3.0971 (15) | C20—C46 | 1.50 (4) |
Au3—S4 | 2.406 (6) | C21—H21A | 0.9800 |
Au4—Au6 | 2.7630 (15) | C21—H21B | 0.9800 |
Au4—Au7 | 2.7468 (16) | C21—H21C | 0.9800 |
Au4—Au9 | 2.9127 (14) | C21—C61 | 1.48 (5) |
Au4—Au12 | 3.1995 (15) | C22—H22A | 0.9800 |
Au4—S2 | 2.356 (7) | C22—H22B | 0.9800 |
Au5—Au8 | 2.8044 (15) | C22—H22C | 0.9800 |
Au5—Au13 | 2.7308 (16) | C22—C40 | 1.48 (5) |
Au5—Au17 | 2.9618 (15) | C23—H23A | 0.9800 |
Au5—Au21 | 3.3659 (16) | C23—H23B | 0.9800 |
Au5—S12 | 2.386 (7) | C23—H23C | 0.9800 |
Au6—Au7 | 2.7208 (15) | C23—C24 | 1.59 (4) |
Au6—Au10 | 2.9155 (15) | C24—C41 | 1.51 (5) |
Au6—Au23 | 3.0665 (15) | C25—H25A | 0.9800 |
Au6—S8 | 2.364 (6) | C25—H25B | 0.9800 |
Au7—Au14 | 3.1545 (15) | C25—H25C | 0.9800 |
Au7—Au15 | 3.2995 (16) | C25—C37 | 1.51 (5) |
Au7—Au20 | 3.3657 (16) | C26—H26A | 0.9800 |
Au7—S11 | 2.364 (7) | C26—H26B | 0.9800 |
Au8—Au9 | 2.7606 (16) | C26—H26C | 0.9800 |
Au8—Au13 | 2.7098 (16) | C26—C37 | 1.46 (6) |
Au8—Au14 | 3.0384 (15) | C27—H27A | 0.9800 |
Au8—Au16 | 2.8068 (16) | C27—H27B | 0.9800 |
Au8—Au17 | 2.7976 (16) | C27—H27C | 0.9800 |
Au8—Au22 | 2.8238 (15) | C28—H28A | 0.9800 |
Au9—Au11 | 2.9225 (16) | C28—H28B | 0.9800 |
Au9—Au12 | 2.7068 (15) | C28—H28C | 0.9800 |
Au9—Au14 | 3.2801 (16) | C28—C53 | 1.51 (5) |
Au9—Au16 | 2.7238 (15) | C29—C32 | 1.57 (5) |
Au9—S1 | 2.370 (7) | C29—C58 | 1.45 (5) |
Au10—Au13 | 2.9542 (15) | C30—H30A | 0.9800 |
Au10—S3 | 2.323 (7) | C30—H30B | 0.9800 |
Au10—S5 | 2.313 (7) | C30—H30C | 0.9800 |
Au11—Au12 | 3.1782 (15) | C31—H31A | 0.9800 |
Au11—Au19 | 3.2369 (15) | C31—H31B | 0.9800 |
Au11—S2 | 2.296 (7) | C31—H31C | 0.9800 |
Au11—S7 | 2.329 (7) | C31—C51 | 1.52 (4) |
Au12—Au13 | 2.9076 (16) | C32—H32A | 0.9800 |
Au12—Au16 | 2.6419 (15) | C32—H32B | 0.9800 |
Au12—Au19 | 3.1648 (15) | C32—H32C | 0.9800 |
Au12—Au24 | 3.2757 (16) | C34—H34A | 0.9800 |
Au12—S3 | 2.358 (6) | C34—H34B | 0.9800 |
Au13—Au16 | 3.2476 (15) | C34—H34C | 0.9800 |
Au13—Au24 | 3.3269 (17) | C34—C51 | 1.52 (5) |
Au13—S15 | 2.367 (7) | C33—H33A | 0.9800 |
Au14—S1 | 2.306 (7) | C33—H33B | 0.9800 |
Au14—S4 | 2.304 (7) | C33—H33C | 0.9800 |
Au15—Au18 | 2.9192 (17) | C35—H35A | 0.9800 |
Au15—Au20 | 3.0159 (16) | C35—H35B | 0.9800 |
Au15—Au23 | 2.9543 (16) | C35—H35C | 0.9800 |
Au15—S16 | 2.378 (7) | C36—H36A | 0.9800 |
Au16—Au19 | 2.9179 (17) | C36—H36B | 0.9800 |
Au16—Au22 | 3.2936 (17) | C36—H36C | 0.9800 |
Au16—Au24 | 3.0477 (17) | C36—C51 | 1.52 (5) |
Au16—S13 | 2.370 (7) | C37—C55 | 1.43 (6) |
Au17—S4 | 2.321 (6) | C38—H38A | 0.9800 |
Au17—S6 | 2.296 (7) | C38—H38B | 0.9800 |
Au18—Au20 | 3.3688 (16) | C38—H38C | 0.9800 |
Au18—Au21 | 3.1926 (16) | C39—C43 | 1.57 (6) |
Au18—S10 | 2.307 (7) | C39—C48 | 1.55 (5) |
Au18—S14 | 2.307 (7) | C39—C60 | 1.57 (6) |
Au19—S7 | 2.314 (7) | C40—C44 | 1.45 (5) |
Au19—S9 | 2.294 (7) | C40—C47 | 1.57 (5) |
Au20—S10 | 2.318 (8) | C41—H41A | 0.9800 |
Au20—S11 | 2.301 (8) | C41—H41B | 0.9800 |
Au21—S12 | 2.316 (7) | C41—H41C | 0.9800 |
Au21—S14 | 2.309 (7) | C42—H42A | 0.9800 |
Au22—S6 | 2.302 (8) | C42—H42B | 0.9800 |
Au22—S13 | 2.297 (8) | C42—H42C | 0.9800 |
Au23—S8 | 2.289 (8) | C42—C57 | 1.43 (6) |
Au23—S16 | 2.289 (8) | C43—H43A | 0.9800 |
Au24—S9 | 2.310 (8) | C43—H43B | 0.9800 |
Au24—S15 | 2.317 (8) | C43—H43C | 0.9800 |
S1—C61 | 1.86 (3) | C44—H44A | 0.9800 |
S2—C20 | 1.86 (3) | C44—H44B | 0.9800 |
S3—C53 | 1.89 (3) | C44—H44C | 0.9800 |
S4—C2 | 1.85 (3) | C45—H45A | 0.9800 |
S5—C9 | 1.88 (3) | C45—H45B | 0.9800 |
S6—C51 | 1.91 (3) | C45—H45C | 0.9800 |
S7—C14 | 1.87 (4) | C45—C53 | 1.51 (4) |
S8—C24 | 1.82 (3) | C46—H46A | 0.9800 |
S9—C37 | 1.91 (5) | C46—H46B | 0.9800 |
S10—C57 | 1.87 (4) | C46—H46C | 0.9800 |
S11—C11 | 1.86 (3) | C47—H47A | 0.9800 |
S12—C40 | 1.85 (3) | C47—H47B | 0.9800 |
S13—C29 | 1.85 (4) | C47—H47C | 0.9800 |
S14—C16 | 1.90 (3) | C48—H48A | 0.9800 |
S15—C39 | 1.80 (4) | C48—H48B | 0.9800 |
S16—C6 | 1.81 (3) | C48—H48C | 0.9800 |
C1—H1A | 0.9800 | C49—H49A | 0.9800 |
C1—H1B | 0.9800 | C49—H49B | 0.9800 |
C1—H1C | 0.9800 | C49—H49C | 0.9800 |
C1—C2 | 1.56 (4) | C49—C57 | 1.49 (6) |
C2—C7 | 1.46 (4) | C50—H50A | 0.9800 |
C2—C64 | 1.55 (3) | C50—H50B | 0.9800 |
C3—H3A | 0.9800 | C50—H50C | 0.9800 |
C3—H3B | 0.9800 | C52—H52A | 0.9800 |
C3—H3C | 0.9800 | C52—H52B | 0.9800 |
C3—C24 | 1.56 (5) | C52—H52C | 0.9800 |
C4—H4A | 0.9800 | C54—H54A | 0.9800 |
C4—H4B | 0.9800 | C54—H54B | 0.9800 |
C4—H4C | 0.9800 | C54—H54C | 0.9800 |
C4—C20 | 1.52 (4) | C55—H55A | 0.9800 |
C5—H5A | 0.9800 | C55—H55B | 0.9800 |
C5—H5B | 0.9800 | C55—H55C | 0.9800 |
C5—H5C | 0.9800 | C56—H56A | 0.9800 |
C5—C11 | 1.46 (6) | C56—H56B | 0.9800 |
C6—C19 | 1.55 (5) | C56—H56C | 0.9800 |
C6—C27 | 1.54 (5) | C58—H58A | 0.9800 |
C6—C33 | 1.55 (4) | C58—H58B | 0.9800 |
C7—H7A | 0.9800 | C58—H58C | 0.9800 |
C7—H7B | 0.9800 | C59—H59A | 0.9800 |
C7—H7C | 0.9800 | C59—H59B | 0.9800 |
C8—H8A | 0.9800 | C59—H59C | 0.9800 |
C8—H8B | 0.9800 | C59—C61 | 1.61 (5) |
C8—H8C | 0.9800 | C60—H60A | 0.9800 |
C8—C9 | 1.58 (4) | C60—H60B | 0.9800 |
C9—C30 | 1.50 (5) | C60—H60C | 0.9800 |
C9—C35 | 1.51 (5) | C61—C63 | 1.43 (6) |
C10—H10A | 0.9800 | C62—H62A | 0.9800 |
C10—H10B | 0.9800 | C62—H62B | 0.9800 |
C10—H10C | 0.9800 | C62—H62C | 0.9800 |
C10—C57 | 1.53 (5) | C63—H63A | 0.9800 |
C11—C12 | 1.45 (5) | C63—H63B | 0.9800 |
C11—C62 | 1.65 (6) | C63—H63C | 0.9800 |
C12—H12A | 0.9800 | C64—H64A | 0.9800 |
C12—H12B | 0.9800 | C64—H64B | 0.9800 |
C12—H12C | 0.9800 | C64—H64C | 0.9800 |
Au2—Au1—Au3 | 51.10 (3) | S11—Au20—Au18 | 139.68 (18) |
Au2—Au1—Au9 | 176.23 (5) | S11—Au20—S10 | 175.1 (3) |
Au2—Au1—Au10 | 67.10 (4) | Au2—Au21—Au5 | 53.21 (3) |
Au2—Au1—Au12 | 132.27 (5) | Au2—Au21—Au18 | 88.69 (4) |
Au2—Au1—Au14 | 114.60 (4) | Au3—Au21—Au2 | 51.34 (3) |
Au4—Au1—Au2 | 123.02 (4) | Au3—Au21—Au5 | 57.92 (3) |
Au4—Au1—Au3 | 117.71 (4) | Au3—Au21—Au18 | 61.08 (4) |
Au4—Au1—Au5 | 174.73 (5) | Au18—Au21—Au5 | 119.01 (4) |
Au4—Au1—Au9 | 59.00 (3) | S12—Au21—Au2 | 97.77 (18) |
Au4—Au1—Au10 | 92.22 (4) | S12—Au21—Au3 | 89.49 (17) |
Au4—Au1—Au12 | 64.69 (4) | S12—Au21—Au5 | 45.12 (18) |
Au4—Au1—Au14 | 87.65 (4) | S12—Au21—Au18 | 135.82 (18) |
Au5—Au1—Au2 | 61.00 (4) | S14—Au21—Au2 | 88.59 (18) |
Au5—Au1—Au3 | 61.40 (4) | S14—Au21—Au3 | 96.35 (18) |
Au5—Au1—Au9 | 116.77 (4) | S14—Au21—Au5 | 141.49 (18) |
Au5—Au1—Au10 | 92.65 (4) | S14—Au21—Au18 | 46.21 (18) |
Au5—Au1—Au12 | 115.74 (4) | S14—Au21—S12 | 173.2 (3) |
Au5—Au1—Au14 | 87.42 (4) | Au8—Au22—Au16 | 53.96 (4) |
Au6—Au1—Au2 | 64.11 (4) | S6—Au22—Au8 | 89.02 (17) |
Au6—Au1—Au3 | 89.76 (4) | S6—Au22—Au16 | 142.68 (17) |
Au6—Au1—Au4 | 59.98 (4) | S13—Au22—Au8 | 99.93 (17) |
Au6—Au1—Au5 | 124.59 (5) | S13—Au22—Au16 | 46.02 (16) |
Au6—Au1—Au9 | 118.44 (5) | S13—Au22—S6 | 170.6 (2) |
Au6—Au1—Au10 | 58.82 (4) | Au15—Au23—Au6 | 73.10 (4) |
Au6—Au1—Au12 | 95.38 (4) | S8—Au23—Au6 | 49.83 (16) |
Au6—Au1—Au13 | 118.40 (5) | S8—Au23—Au15 | 121.81 (16) |
Au6—Au1—Au14 | 122.66 (4) | S16—Au23—Au6 | 123.87 (17) |
Au7—Au1—Au2 | 83.56 (4) | S16—Au23—Au15 | 52.07 (17) |
Au7—Au1—Au3 | 57.58 (4) | S16—Au23—S8 | 173.7 (2) |
Au7—Au1—Au4 | 60.15 (4) | Au12—Au24—Au13 | 52.25 (3) |
Au7—Au1—Au5 | 118.84 (5) | Au16—Au24—Au12 | 49.23 (3) |
Au7—Au1—Au6 | 60.02 (4) | Au16—Au24—Au13 | 61.07 (4) |
Au7—Au1—Au8 | 122.84 (5) | S9—Au24—Au12 | 85.63 (19) |
Au7—Au1—Au9 | 95.37 (4) | S9—Au24—Au13 | 137.77 (19) |
Au7—Au1—Au10 | 118.70 (4) | S9—Au24—Au16 | 95.62 (19) |
Au7—Au1—Au12 | 124.73 (5) | S9—Au24—S15 | 176.8 (3) |
Au7—Au1—Au13 | 176.15 (6) | S15—Au24—Au12 | 97.45 (18) |
Au7—Au1—Au14 | 62.90 (4) | S15—Au24—Au13 | 45.36 (18) |
Au8—Au1—Au2 | 121.64 (5) | S15—Au24—Au16 | 85.8 (2) |
Au8—Au1—Au3 | 97.10 (4) | Au14—S1—Au9 | 89.1 (2) |
Au8—Au1—Au4 | 114.97 (5) | C61—S1—Au9 | 111.2 (12) |
Au8—Au1—Au5 | 60.73 (4) | C61—S1—Au14 | 105.5 (12) |
Au8—Au1—Au6 | 172.99 (6) | Au11—S2—Au4 | 94.1 (2) |
Au8—Au1—Au9 | 56.04 (4) | C20—S2—Au4 | 111.5 (11) |
Au8—Au1—Au10 | 118.38 (5) | C20—S2—Au11 | 104.8 (10) |
Au8—Au1—Au12 | 77.75 (4) | Au10—S3—Au12 | 93.8 (2) |
Au8—Au1—Au13 | 59.18 (4) | C53—S3—Au10 | 110.0 (11) |
Au8—Au1—Au14 | 59.97 (4) | C53—S3—Au12 | 117.1 (9) |
Au9—Au1—Au3 | 125.37 (4) | Au14—S4—Au3 | 94.3 (2) |
Au9—Au1—Au10 | 116.46 (4) | Au14—S4—Au17 | 95.8 (2) |
Au9—Au1—Au12 | 51.14 (3) | Au17—S4—Au3 | 120.0 (3) |
Au9—Au1—Au14 | 61.81 (3) | C2—S4—Au3 | 118.6 (9) |
Au10—Au1—Au3 | 118.17 (4) | C2—S4—Au14 | 115.1 (10) |
Au10—Au1—Au12 | 65.51 (3) | C2—S4—Au17 | 109.6 (9) |
Au10—Au1—Au14 | 178.00 (5) | Au10—S5—Au2 | 91.9 (2) |
Au12—Au1—Au3 | 174.81 (4) | C9—S5—Au2 | 107.0 (10) |
Au12—Au1—Au14 | 112.68 (4) | C9—S5—Au10 | 110.5 (11) |
Au13—Au1—Au2 | 92.59 (4) | Au17—S6—Au22 | 100.9 (3) |
Au13—Au1—Au3 | 119.63 (5) | C51—S6—Au17 | 107.1 (9) |
Au13—Au1—Au4 | 122.64 (5) | C51—S6—Au22 | 102.9 (11) |
Au13—Au1—Au5 | 58.66 (4) | Au19—S7—Au11 | 88.4 (2) |
Au13—Au1—Au9 | 88.46 (4) | C14—S7—Au11 | 108.6 (12) |
Au13—Au1—Au10 | 59.58 (4) | C14—S7—Au19 | 107.3 (12) |
Au13—Au1—Au12 | 58.31 (4) | Au23—S8—Au6 | 82.4 (2) |
Au13—Au1—Au14 | 118.91 (4) | C24—S8—Au6 | 107.7 (12) |
Au14—Au1—Au3 | 63.58 (3) | C24—S8—Au23 | 104.7 (10) |
Au1—Au2—Au6 | 55.05 (3) | Au19—S9—Au24 | 95.0 (3) |
Au1—Au2—Au10 | 59.66 (3) | C37—S9—Au19 | 108.1 (13) |
Au1—Au2—Au21 | 118.68 (4) | C37—S9—Au24 | 108.3 (12) |
Au3—Au2—Au1 | 71.33 (4) | Au18—S10—Au20 | 93.5 (3) |
Au3—Au2—Au5 | 67.91 (4) | C57—S10—Au18 | 106.5 (13) |
Au3—Au2—Au6 | 96.67 (4) | C57—S10—Au20 | 106.6 (13) |
Au3—Au2—Au10 | 130.95 (5) | Au20—S11—Au7 | 92.3 (2) |
Au3—Au2—Au21 | 63.82 (4) | C11—S11—Au7 | 113.7 (14) |
Au5—Au2—Au1 | 57.70 (3) | C11—S11—Au20 | 107.7 (11) |
Au5—Au2—Au6 | 112.35 (4) | Au21—S12—Au5 | 91.4 (2) |
Au5—Au2—Au10 | 86.72 (4) | C40—S12—Au5 | 109.7 (11) |
Au5—Au2—Au21 | 67.66 (4) | C40—S12—Au21 | 106.6 (10) |
Au6—Au2—Au10 | 54.11 (3) | Au22—S13—Au16 | 89.8 (2) |
Au6—Au2—Au21 | 159.52 (5) | C29—S13—Au16 | 110.2 (13) |
Au15—Au2—Au1 | 104.53 (5) | C29—S13—Au22 | 106.7 (13) |
Au15—Au2—Au3 | 58.74 (4) | Au18—S14—Au21 | 87.5 (2) |
Au15—Au2—Au5 | 126.58 (5) | C16—S14—Au18 | 107.8 (11) |
Au15—Au2—Au6 | 77.85 (4) | C16—S14—Au21 | 108.0 (9) |
Au15—Au2—Au10 | 130.46 (5) | Au24—S15—Au13 | 90.5 (3) |
Au15—Au2—Au21 | 86.07 (4) | C39—S15—Au13 | 111.5 (13) |
Au21—Au2—Au10 | 143.46 (5) | C39—S15—Au24 | 109.2 (13) |
S5—Au2—Au1 | 94.89 (17) | Au23—S16—Au15 | 78.5 (2) |
S5—Au2—Au3 | 152.45 (17) | C6—S16—Au15 | 114.6 (11) |
S5—Au2—Au5 | 84.54 (17) | C6—S16—Au23 | 106.6 (11) |
S5—Au2—Au6 | 94.24 (18) | H1A—C1—H1B | 109.5 |
S5—Au2—Au10 | 43.44 (17) | H1A—C1—H1C | 109.5 |
S5—Au2—Au15 | 148.71 (17) | H1B—C1—H1C | 109.5 |
S5—Au2—Au21 | 106.02 (18) | C2—C1—H1A | 109.5 |
Au2—Au3—Au1 | 57.58 (4) | C2—C1—H1B | 109.5 |
Au2—Au3—Au5 | 59.37 (3) | C2—C1—H1C | 109.5 |
Au2—Au3—Au7 | 83.57 (4) | C1—C2—S4 | 108 (2) |
Au2—Au3—Au18 | 96.69 (4) | C7—C2—S4 | 109 (2) |
Au2—Au3—Au20 | 120.68 (5) | C7—C2—C1 | 113 (2) |
Au2—Au3—Au21 | 64.84 (4) | C7—C2—C64 | 112 (2) |
Au5—Au3—Au1 | 51.99 (3) | C64—C2—S4 | 108.6 (19) |
Au5—Au3—Au18 | 126.27 (4) | C64—C2—C1 | 106 (2) |
Au5—Au3—Au20 | 169.49 (5) | H3A—C3—H3B | 109.5 |
Au7—Au3—Au1 | 51.11 (3) | H3A—C3—H3C | 109.5 |
Au7—Au3—Au5 | 103.01 (4) | H3B—C3—H3C | 109.5 |
Au7—Au3—Au18 | 122.64 (4) | C24—C3—H3A | 109.5 |
Au7—Au3—Au20 | 67.10 (4) | C24—C3—H3B | 109.5 |
Au7—Au3—Au21 | 148.13 (5) | C24—C3—H3C | 109.5 |
Au15—Au3—Au1 | 96.50 (4) | H4A—C4—H4B | 109.5 |
Au15—Au3—Au2 | 60.39 (4) | H4A—C4—H4C | 109.5 |
Au15—Au3—Au5 | 119.70 (5) | H4B—C4—H4C | 109.5 |
Au15—Au3—Au7 | 72.59 (4) | C20—C4—H4A | 109.5 |
Au15—Au3—Au18 | 59.12 (4) | C20—C4—H4B | 109.5 |
Au15—Au3—Au20 | 61.97 (4) | C20—C4—H4C | 109.5 |
Au15—Au3—Au21 | 87.39 (4) | H5A—C5—H5B | 109.5 |
Au18—Au3—Au1 | 152.52 (4) | H5A—C5—H5C | 109.5 |
Au20—Au3—Au1 | 118.21 (4) | H5B—C5—H5C | 109.5 |
Au20—Au3—Au18 | 64.03 (4) | C11—C5—H5A | 109.5 |
Au21—Au3—Au1 | 109.28 (4) | C11—C5—H5B | 109.5 |
Au21—Au3—Au5 | 65.34 (4) | C11—C5—H5C | 109.5 |
Au21—Au3—Au18 | 60.93 (4) | C19—C6—S16 | 106 (3) |
Au21—Au3—Au20 | 124.90 (5) | C27—C6—S16 | 111 (3) |
S4—Au3—Au1 | 88.56 (16) | C27—C6—C19 | 111 (3) |
S4—Au3—Au2 | 133.61 (15) | C27—C6—C33 | 110 (3) |
S4—Au3—Au5 | 75.07 (15) | C33—C6—S16 | 112 (2) |
S4—Au3—Au7 | 99.60 (16) | C33—C6—C19 | 107 (3) |
S4—Au3—Au15 | 164.17 (15) | C2—C7—H7A | 109.5 |
S4—Au3—Au18 | 118.39 (16) | C2—C7—H7B | 109.5 |
S4—Au3—Au20 | 102.44 (15) | C2—C7—H7C | 109.5 |
S4—Au3—Au21 | 105.13 (16) | H7A—C7—H7B | 109.5 |
Au1—Au4—Au9 | 65.99 (4) | H7A—C7—H7C | 109.5 |
Au1—Au4—Au12 | 63.46 (4) | H7B—C7—H7C | 109.5 |
Au6—Au4—Au1 | 59.30 (4) | H8A—C8—H8B | 109.5 |
Au6—Au4—Au9 | 124.68 (5) | H8A—C8—H8C | 109.5 |
Au6—Au4—Au12 | 94.25 (4) | H8B—C8—H8C | 109.5 |
Au7—Au4—Au1 | 58.34 (4) | C9—C8—H8A | 109.5 |
Au7—Au4—Au6 | 59.18 (4) | C9—C8—H8B | 109.5 |
Au7—Au4—Au9 | 98.76 (5) | C9—C8—H8C | 109.5 |
Au7—Au4—Au12 | 121.69 (5) | C8—C9—S5 | 105 (2) |
Au9—Au4—Au12 | 52.32 (3) | C30—C9—S5 | 107 (2) |
S2—Au4—Au1 | 150.25 (17) | C30—C9—C8 | 110 (3) |
S2—Au4—Au6 | 128.39 (17) | C30—C9—C35 | 114 (3) |
S2—Au4—Au7 | 151.21 (17) | C35—C9—S5 | 111 (2) |
S2—Au4—Au9 | 96.04 (16) | C35—C9—C8 | 110 (3) |
S2—Au4—Au12 | 86.80 (16) | H10A—C10—H10B | 109.5 |
Au1—Au5—Au2 | 61.31 (4) | H10A—C10—H10C | 109.5 |
Au1—Au5—Au3 | 66.60 (4) | H10B—C10—H10C | 109.5 |
Au1—Au5—Au17 | 101.98 (4) | C57—C10—H10A | 109.5 |
Au1—Au5—Au21 | 114.29 (4) | C57—C10—H10B | 109.5 |
Au2—Au5—Au3 | 52.72 (3) | C57—C10—H10C | 109.5 |
Au2—Au5—Au17 | 136.83 (5) | C5—C11—S11 | 113 (3) |
Au2—Au5—Au21 | 59.13 (3) | C5—C11—C62 | 111 (4) |
Au3—Au5—Au21 | 56.74 (3) | C12—C11—S11 | 107 (3) |
Au8—Au5—Au1 | 58.11 (4) | C12—C11—C5 | 109 (4) |
Au8—Au5—Au2 | 119.34 (5) | C12—C11—C62 | 112 (4) |
Au8—Au5—Au3 | 98.86 (4) | C62—C11—S11 | 105 (3) |
Au8—Au5—Au17 | 57.97 (4) | C11—C12—H12A | 109.5 |
Au8—Au5—Au21 | 152.16 (5) | C11—C12—H12B | 109.5 |
Au13—Au5—Au1 | 59.59 (4) | C11—C12—H12C | 109.5 |
Au13—Au5—Au2 | 93.33 (4) | H12A—C12—H12B | 109.5 |
Au13—Au5—Au3 | 125.71 (5) | H12A—C12—H12C | 109.5 |
Au13—Au5—Au8 | 58.61 (4) | H12B—C12—H12C | 109.5 |
Au13—Au5—Au17 | 112.61 (5) | H13A—C13—H13B | 109.5 |
Au13—Au5—Au21 | 144.77 (5) | H13A—C13—H13C | 109.5 |
Au17—Au5—Au3 | 84.24 (4) | H13B—C13—H13C | 109.5 |
Au17—Au5—Au21 | 102.62 (4) | C20—C13—H13A | 109.5 |
S12—Au5—Au1 | 153.80 (17) | C20—C13—H13B | 109.5 |
S12—Au5—Au2 | 101.99 (17) | C20—C13—H13C | 109.5 |
S12—Au5—Au3 | 87.26 (17) | C38—C14—S7 | 104 (3) |
S12—Au5—Au8 | 132.26 (17) | C52—C14—S7 | 104 (2) |
S12—Au5—Au13 | 145.78 (17) | C52—C14—C38 | 108 (3) |
S12—Au5—Au17 | 75.91 (17) | C56—C14—S7 | 113 (2) |
S12—Au5—Au21 | 43.46 (17) | C56—C14—C38 | 111 (3) |
Au1—Au6—Au2 | 60.83 (4) | C56—C14—C52 | 116 (3) |
Au1—Au6—Au4 | 60.72 (4) | H15A—C15—H15B | 109.5 |
Au1—Au6—Au10 | 67.55 (4) | H15A—C15—H15C | 109.5 |
Au1—Au6—Au23 | 139.89 (5) | H15B—C15—H15C | 109.5 |
Au2—Au6—Au23 | 86.18 (4) | C16—C15—H15A | 109.5 |
Au4—Au6—Au2 | 120.54 (5) | C16—C15—H15B | 109.5 |
Au4—Au6—Au10 | 97.88 (4) | C16—C15—H15C | 109.5 |
Au4—Au6—Au23 | 137.26 (5) | C15—C16—S14 | 103 (2) |
Au7—Au6—Au1 | 59.11 (4) | C15—C16—C54 | 112 (3) |
Au7—Au6—Au2 | 81.48 (4) | C50—C16—S14 | 111 (2) |
Au7—Au6—Au4 | 60.11 (4) | C50—C16—C15 | 110 (3) |
Au7—Au6—Au10 | 126.49 (5) | C50—C16—C54 | 116 (3) |
Au7—Au6—Au23 | 96.28 (5) | C54—C16—S14 | 105 (2) |
Au10—Au6—Au2 | 69.08 (4) | H17A—C17—H17B | 109.5 |
Au10—Au6—Au23 | 123.85 (5) | H17A—C17—H17C | 109.5 |
S8—Au6—Au1 | 167.43 (19) | H17B—C17—H17C | 109.5 |
S8—Au6—Au2 | 116.94 (18) | C29—C17—H17A | 109.5 |
S8—Au6—Au4 | 122.47 (18) | C29—C17—H17B | 109.5 |
S8—Au6—Au7 | 133.45 (18) | C29—C17—H17C | 109.5 |
S8—Au6—Au10 | 99.94 (18) | H18A—C18—H18B | 109.5 |
S8—Au6—Au23 | 47.74 (18) | H18A—C18—H18C | 109.5 |
Au1—Au7—Au3 | 71.31 (4) | H18B—C18—H18C | 109.5 |
Au1—Au7—Au4 | 61.51 (4) | C53—C18—H18A | 109.5 |
Au1—Au7—Au6 | 60.87 (4) | C53—C18—H18B | 109.5 |
Au1—Au7—Au14 | 67.58 (4) | C53—C18—H18C | 109.5 |
Au1—Au7—Au15 | 94.90 (4) | C6—C19—H19A | 109.5 |
Au1—Au7—Au20 | 131.07 (5) | C6—C19—H19B | 109.5 |
Au3—Au7—Au14 | 69.14 (4) | C6—C19—H19C | 109.5 |
Au3—Au7—Au15 | 49.69 (3) | H19A—C19—H19B | 109.5 |
Au3—Au7—Au20 | 59.77 (4) | H19A—C19—H19C | 109.5 |
Au4—Au7—Au3 | 132.79 (5) | H19B—C19—H19C | 109.5 |
Au4—Au7—Au14 | 90.77 (4) | C4—C20—S2 | 105 (2) |
Au4—Au7—Au15 | 133.07 (5) | C13—C20—S2 | 112 (2) |
Au4—Au7—Au20 | 167.33 (5) | C13—C20—C4 | 115 (3) |
Au6—Au7—Au3 | 98.19 (5) | C13—C20—C46 | 110 (3) |
Au6—Au7—Au4 | 60.70 (4) | C46—C20—S2 | 106 (2) |
Au6—Au7—Au14 | 128.16 (5) | C46—C20—C4 | 108 (3) |
Au6—Au7—Au15 | 72.41 (4) | H21A—C21—H21B | 109.5 |
Au6—Au7—Au20 | 124.04 (5) | H21A—C21—H21C | 109.5 |
Au14—Au7—Au15 | 118.55 (4) | H21B—C21—H21C | 109.5 |
Au14—Au7—Au20 | 93.55 (4) | C61—C21—H21A | 109.5 |
Au15—Au7—Au20 | 53.80 (3) | C61—C21—H21B | 109.5 |
S11—Au7—Au1 | 173.06 (19) | C61—C21—H21C | 109.5 |
S11—Au7—Au3 | 102.70 (19) | H22A—C22—H22B | 109.5 |
S11—Au7—Au4 | 124.48 (19) | H22A—C22—H22C | 109.5 |
S11—Au7—Au6 | 117.75 (18) | H22B—C22—H22C | 109.5 |
S11—Au7—Au14 | 114.09 (18) | C40—C22—H22A | 109.5 |
S11—Au7—Au15 | 78.36 (18) | C40—C22—H22B | 109.5 |
S11—Au7—Au20 | 43.10 (19) | C40—C22—H22C | 109.5 |
Au1—Au8—Au5 | 61.17 (4) | H23A—C23—H23B | 109.5 |
Au1—Au8—Au9 | 68.85 (4) | H23A—C23—H23C | 109.5 |
Au1—Au8—Au14 | 68.97 (4) | H23B—C23—H23C | 109.5 |
Au1—Au8—Au16 | 101.51 (5) | C24—C23—H23A | 109.5 |
Au1—Au8—Au17 | 108.68 (5) | C24—C23—H23B | 109.5 |
Au1—Au8—Au22 | 160.54 (6) | C24—C23—H23C | 109.5 |
Au5—Au8—Au14 | 92.47 (4) | C3—C24—S8 | 115 (2) |
Au5—Au8—Au16 | 131.03 (5) | C3—C24—C23 | 105 (3) |
Au5—Au8—Au22 | 109.00 (5) | C23—C24—S8 | 109 (2) |
Au9—Au8—Au5 | 130.02 (5) | C41—C24—S8 | 108 (2) |
Au9—Au8—Au14 | 68.70 (4) | C41—C24—C3 | 110 (3) |
Au9—Au8—Au16 | 58.58 (4) | C41—C24—C23 | 108 (3) |
Au9—Au8—Au17 | 138.31 (5) | H25A—C25—H25B | 109.5 |
Au9—Au8—Au22 | 118.61 (5) | H25A—C25—H25C | 109.5 |
Au13—Au8—Au1 | 60.92 (4) | H25B—C25—H25C | 109.5 |
Au13—Au8—Au5 | 59.34 (4) | C37—C25—H25A | 109.5 |
Au13—Au8—Au9 | 96.96 (5) | C37—C25—H25B | 109.5 |
Au13—Au8—Au14 | 129.58 (5) | C37—C25—H25C | 109.5 |
Au13—Au8—Au16 | 72.11 (4) | H26A—C26—H26B | 109.5 |
Au13—Au8—Au17 | 118.68 (5) | H26A—C26—H26C | 109.5 |
Au13—Au8—Au22 | 99.69 (5) | H26B—C26—H26C | 109.5 |
Au16—Au8—Au14 | 125.61 (5) | C37—C26—H26A | 109.5 |
Au16—Au8—Au22 | 71.60 (4) | C37—C26—H26B | 109.5 |
Au17—Au8—Au5 | 63.84 (4) | C37—C26—H26C | 109.5 |
Au17—Au8—Au14 | 71.85 (4) | C6—C27—H27A | 109.5 |
Au17—Au8—Au16 | 149.39 (5) | C6—C27—H27B | 109.5 |
Au17—Au8—Au22 | 78.17 (4) | C6—C27—H27C | 109.5 |
Au22—Au8—Au14 | 130.07 (5) | H27A—C27—H27B | 109.5 |
Au1—Au9—Au14 | 61.67 (3) | H27A—C27—H27C | 109.5 |
Au4—Au9—Au1 | 55.00 (3) | H27B—C27—H27C | 109.5 |
Au4—Au9—Au11 | 71.43 (4) | H28A—C28—H28B | 109.5 |
Au4—Au9—Au14 | 85.45 (4) | H28A—C28—H28C | 109.5 |
Au8—Au9—Au1 | 55.10 (3) | H28B—C28—H28C | 109.5 |
Au8—Au9—Au4 | 110.03 (5) | C53—C28—H28A | 109.5 |
Au8—Au9—Au11 | 152.17 (5) | C53—C28—H28B | 109.5 |
Au8—Au9—Au14 | 59.66 (4) | C53—C28—H28C | 109.5 |
Au11—Au9—Au1 | 118.22 (4) | C17—C29—S13 | 112 (3) |
Au11—Au9—Au14 | 145.58 (5) | C17—C29—C32 | 108 (4) |
Au12—Au9—Au1 | 65.62 (4) | C32—C29—S13 | 111 (2) |
Au12—Au9—Au4 | 69.30 (4) | C58—C29—S13 | 104 (3) |
Au12—Au9—Au8 | 85.63 (4) | C58—C29—C17 | 110 (3) |
Au12—Au9—Au11 | 68.62 (4) | C58—C29—C32 | 113 (4) |
Au12—Au9—Au14 | 126.91 (5) | C9—C30—H30A | 109.5 |
Au12—Au9—Au16 | 58.22 (4) | C9—C30—H30B | 109.5 |
Au16—Au9—Au1 | 94.53 (4) | C9—C30—H30C | 109.5 |
Au16—Au9—Au4 | 127.01 (5) | H30A—C30—H30B | 109.5 |
Au16—Au9—Au8 | 61.56 (4) | H30A—C30—H30C | 109.5 |
Au16—Au9—Au11 | 94.67 (5) | H30B—C30—H30C | 109.5 |
Au16—Au9—Au14 | 119.73 (5) | H31A—C31—H31B | 109.5 |
S1—Au9—Au1 | 96.57 (17) | H31A—C31—H31C | 109.5 |
S1—Au9—Au4 | 82.96 (16) | H31B—C31—H31C | 109.5 |
S1—Au9—Au8 | 101.94 (17) | C51—C31—H31A | 109.5 |
S1—Au9—Au11 | 105.77 (17) | C51—C31—H31B | 109.5 |
S1—Au9—Au12 | 152.13 (17) | C51—C31—H31C | 109.5 |
S1—Au9—Au14 | 44.65 (17) | C29—C32—H32A | 109.5 |
S1—Au9—Au16 | 148.43 (17) | C29—C32—H32B | 109.5 |
Au1—Au10—Au2 | 53.23 (3) | C29—C32—H32C | 109.5 |
Au6—Au10—Au1 | 53.63 (3) | H32A—C32—H32B | 109.5 |
Au6—Au10—Au2 | 56.81 (3) | H32A—C32—H32C | 109.5 |
Au6—Au10—Au13 | 107.23 (4) | H32B—C32—H32C | 109.5 |
Au13—Au10—Au1 | 53.60 (3) | H34A—C34—H34B | 109.5 |
Au13—Au10—Au2 | 80.87 (4) | H34A—C34—H34C | 109.5 |
S3—Au10—Au1 | 87.28 (16) | H34B—C34—H34C | 109.5 |
S3—Au10—Au2 | 132.76 (17) | C51—C34—H34A | 109.5 |
S3—Au10—Au6 | 79.92 (17) | C51—C34—H34B | 109.5 |
S3—Au10—Au13 | 96.51 (16) | C51—C34—H34C | 109.5 |
S5—Au10—Au1 | 90.16 (17) | C6—C33—H33A | 109.5 |
S5—Au10—Au2 | 44.64 (16) | C6—C33—H33B | 109.5 |
S5—Au10—Au6 | 97.92 (17) | C6—C33—H33C | 109.5 |
S5—Au10—Au13 | 82.58 (17) | H33A—C33—H33B | 109.5 |
S5—Au10—S3 | 177.3 (2) | H33A—C33—H33C | 109.5 |
Au9—Au11—Au12 | 52.47 (3) | H33B—C33—H33C | 109.5 |
Au9—Au11—Au19 | 85.19 (4) | C9—C35—H35A | 109.5 |
Au12—Au11—Au19 | 59.11 (3) | C9—C35—H35B | 109.5 |
S2—Au11—Au9 | 97.12 (18) | C9—C35—H35C | 109.5 |
S2—Au11—Au12 | 88.32 (17) | H35A—C35—H35B | 109.5 |
S2—Au11—Au19 | 136.74 (17) | H35A—C35—H35C | 109.5 |
S2—Au11—S7 | 176.8 (2) | H35B—C35—H35C | 109.5 |
S7—Au11—Au9 | 85.05 (19) | H36A—C36—H36B | 109.5 |
S7—Au11—Au12 | 94.85 (18) | H36A—C36—H36C | 109.5 |
S7—Au11—Au19 | 45.62 (17) | H36B—C36—H36C | 109.5 |
Au1—Au12—Au4 | 51.85 (3) | C51—C36—H36A | 109.5 |
Au1—Au12—Au11 | 109.23 (4) | C51—C36—H36B | 109.5 |
Au1—Au12—Au24 | 118.49 (4) | C51—C36—H36C | 109.5 |
Au4—Au12—Au24 | 170.00 (5) | C25—C37—S9 | 109 (4) |
Au9—Au12—Au1 | 63.24 (4) | C26—C37—S9 | 110 (3) |
Au9—Au12—Au4 | 58.38 (3) | C26—C37—C25 | 109 (3) |
Au9—Au12—Au11 | 58.90 (4) | C55—C37—S9 | 104 (3) |
Au9—Au12—Au13 | 93.63 (5) | C55—C37—C25 | 110 (4) |
Au9—Au12—Au19 | 90.29 (4) | C55—C37—C26 | 115 (5) |
Au9—Au12—Au24 | 121.97 (5) | C14—C38—H38A | 109.5 |
Au11—Au12—Au4 | 64.56 (3) | C14—C38—H38B | 109.5 |
Au11—Au12—Au24 | 124.95 (4) | C14—C38—H38C | 109.5 |
Au13—Au12—Au1 | 53.80 (3) | H38A—C38—H38B | 109.5 |
Au13—Au12—Au4 | 105.40 (4) | H38A—C38—H38C | 109.5 |
Au13—Au12—Au11 | 152.36 (5) | H38B—C38—H38C | 109.5 |
Au13—Au12—Au19 | 120.86 (5) | C43—C39—S15 | 109 (3) |
Au13—Au12—Au24 | 64.78 (4) | C48—C39—S15 | 107 (3) |
Au16—Au12—Au1 | 94.75 (4) | C48—C39—C43 | 108 (3) |
Au16—Au12—Au4 | 119.16 (5) | C48—C39—C60 | 109 (3) |
Au16—Au12—Au9 | 61.21 (4) | C60—C39—S15 | 113 (2) |
Au16—Au12—Au11 | 90.60 (4) | C60—C39—C43 | 110 (4) |
Au16—Au12—Au13 | 71.45 (4) | C22—C40—S12 | 113 (2) |
Au16—Au12—Au19 | 59.52 (4) | C22—C40—C47 | 110 (3) |
Au16—Au12—Au24 | 60.89 (4) | C44—C40—S12 | 108 (2) |
Au19—Au12—Au1 | 150.71 (5) | C44—C40—C22 | 110 (3) |
Au19—Au12—Au4 | 125.83 (4) | C44—C40—C47 | 110 (3) |
Au19—Au12—Au11 | 61.37 (3) | C47—C40—S12 | 106 (2) |
Au19—Au12—Au24 | 63.58 (4) | C24—C41—H41A | 109.5 |
S3—Au12—Au1 | 86.29 (17) | C24—C41—H41B | 109.5 |
S3—Au12—Au4 | 73.52 (17) | C24—C41—H41C | 109.5 |
S3—Au12—Au9 | 131.85 (17) | H41A—C41—H41B | 109.5 |
S3—Au12—Au11 | 103.91 (17) | H41A—C41—H41C | 109.5 |
S3—Au12—Au13 | 96.96 (17) | H41B—C41—H41C | 109.5 |
S3—Au12—Au16 | 164.28 (17) | H42A—C42—H42B | 109.5 |
S3—Au12—Au19 | 122.38 (17) | H42A—C42—H42C | 109.5 |
S3—Au12—Au24 | 104.91 (17) | H42B—C42—H42C | 109.5 |
Au1—Au13—Au10 | 66.82 (4) | C57—C42—H42A | 109.5 |
Au1—Au13—Au12 | 67.90 (4) | C57—C42—H42B | 109.5 |
Au1—Au13—Au16 | 90.76 (4) | C57—C42—H42C | 109.5 |
Au1—Au13—Au24 | 130.75 (5) | C39—C43—H43A | 109.5 |
Au5—Au13—Au1 | 61.75 (4) | C39—C43—H43B | 109.5 |
Au5—Au13—Au10 | 98.87 (5) | C39—C43—H43C | 109.5 |
Au5—Au13—Au12 | 128.06 (5) | H43A—C43—H43B | 109.5 |
Au5—Au13—Au16 | 117.07 (5) | H43A—C43—H43C | 109.5 |
Au5—Au13—Au24 | 161.14 (5) | H43B—C43—H43C | 109.5 |
Au8—Au13—Au1 | 59.90 (4) | C40—C44—H44A | 109.5 |
Au8—Au13—Au5 | 62.05 (4) | C40—C44—H44B | 109.5 |
Au8—Au13—Au10 | 126.27 (5) | C40—C44—H44C | 109.5 |
Au8—Au13—Au12 | 82.75 (4) | H44A—C44—H44B | 109.5 |
Au8—Au13—Au16 | 55.33 (4) | H44A—C44—H44C | 109.5 |
Au8—Au13—Au24 | 109.40 (5) | H44B—C44—H44C | 109.5 |
Au10—Au13—Au16 | 121.73 (5) | H45A—C45—H45B | 109.5 |
Au10—Au13—Au24 | 99.47 (5) | H45A—C45—H45C | 109.5 |
Au12—Au13—Au10 | 71.31 (4) | H45B—C45—H45C | 109.5 |
Au12—Au13—Au16 | 50.46 (3) | C53—C45—H45A | 109.5 |
Au12—Au13—Au24 | 62.97 (4) | C53—C45—H45B | 109.5 |
Au16—Au13—Au24 | 55.22 (3) | C53—C45—H45C | 109.5 |
S15—Au13—Au1 | 171.2 (2) | C20—C46—H46A | 109.5 |
S15—Au13—Au5 | 121.1 (2) | C20—C46—H46B | 109.5 |
S15—Au13—Au8 | 113.1 (2) | C20—C46—H46C | 109.5 |
S15—Au13—Au10 | 119.1 (2) | H46A—C46—H46B | 109.5 |
S15—Au13—Au12 | 106.9 (2) | H46A—C46—H46C | 109.5 |
S15—Au13—Au16 | 80.53 (19) | H46B—C46—H46C | 109.5 |
S15—Au13—Au24 | 44.1 (2) | C40—C47—H47A | 109.5 |
Au1—Au14—Au9 | 56.52 (3) | C40—C47—H47B | 109.5 |
Au7—Au14—Au1 | 49.53 (3) | C40—C47—H47C | 109.5 |
Au7—Au14—Au9 | 83.78 (4) | H47A—C47—H47B | 109.5 |
Au8—Au14—Au1 | 51.06 (3) | H47A—C47—H47C | 109.5 |
Au8—Au14—Au7 | 100.57 (4) | H47B—C47—H47C | 109.5 |
Au8—Au14—Au9 | 51.64 (3) | C39—C48—H48A | 109.5 |
S1—Au14—Au1 | 93.38 (16) | C39—C48—H48B | 109.5 |
S1—Au14—Au7 | 87.30 (16) | C39—C48—H48C | 109.5 |
S1—Au14—Au8 | 95.73 (17) | H48A—C48—H48B | 109.5 |
S1—Au14—Au9 | 46.26 (17) | H48A—C48—H48C | 109.5 |
S4—Au14—Au1 | 90.45 (15) | H48B—C48—H48C | 109.5 |
S4—Au14—Au7 | 95.62 (14) | H49A—C49—H49B | 109.5 |
S4—Au14—Au8 | 86.23 (16) | H49A—C49—H49C | 109.5 |
S4—Au14—Au9 | 136.50 (16) | H49B—C49—H49C | 109.5 |
S4—Au14—S1 | 176.1 (2) | C57—C49—H49A | 109.5 |
Au2—Au15—Au7 | 76.82 (4) | C57—C49—H49B | 109.5 |
Au2—Au15—Au18 | 103.95 (5) | C57—C49—H49C | 109.5 |
Au2—Au15—Au20 | 126.48 (5) | C16—C50—H50A | 109.5 |
Au2—Au15—Au23 | 94.78 (5) | C16—C50—H50B | 109.5 |
Au3—Au15—Au2 | 60.87 (4) | C16—C50—H50C | 109.5 |
Au3—Au15—Au7 | 57.72 (4) | H50A—C50—H50B | 109.5 |
Au3—Au15—Au18 | 70.05 (4) | H50A—C50—H50C | 109.5 |
Au3—Au15—Au20 | 67.51 (4) | H50B—C50—H50C | 109.5 |
Au3—Au15—Au23 | 139.70 (5) | C31—C51—S6 | 107 (2) |
Au18—Au15—Au7 | 119.35 (5) | C34—C51—S6 | 113 (2) |
Au18—Au15—Au20 | 69.15 (4) | C34—C51—C31 | 115 (3) |
Au18—Au15—Au23 | 150.24 (5) | C34—C51—C36 | 109 (3) |
Au20—Au15—Au7 | 64.22 (4) | C36—C51—S6 | 104 (2) |
Au23—Au15—Au7 | 87.11 (4) | C36—C51—C31 | 108 (3) |
Au23—Au15—Au20 | 117.14 (5) | C14—C52—H52A | 109.5 |
S16—Au15—Au2 | 136.3 (2) | C14—C52—H52B | 109.5 |
S16—Au15—Au3 | 162.6 (2) | C14—C52—H52C | 109.5 |
S16—Au15—Au7 | 117.9 (2) | H52A—C52—H52B | 109.5 |
S16—Au15—Au18 | 102.6 (2) | H52A—C52—H52C | 109.5 |
S16—Au15—Au20 | 95.3 (2) | H52B—C52—H52C | 109.5 |
S16—Au15—Au23 | 49.4 (2) | C18—C53—S3 | 102.9 (19) |
Au8—Au16—Au13 | 52.56 (4) | C18—C53—C28 | 111 (3) |
Au8—Au16—Au19 | 151.94 (5) | C18—C53—C45 | 112 (3) |
Au8—Au16—Au22 | 54.44 (4) | C28—C53—S3 | 106 (2) |
Au8—Au16—Au24 | 115.02 (5) | C45—C53—S3 | 111 (2) |
Au9—Au16—Au8 | 59.86 (4) | C45—C53—C28 | 113 (3) |
Au9—Au16—Au13 | 86.15 (4) | C16—C54—H54A | 109.5 |
Au9—Au16—Au19 | 95.41 (5) | C16—C54—H54B | 109.5 |
Au9—Au16—Au22 | 105.50 (5) | C16—C54—H54C | 109.5 |
Au9—Au16—Au24 | 130.30 (5) | H54A—C54—H54B | 109.5 |
Au12—Au16—Au8 | 85.94 (4) | H54A—C54—H54C | 109.5 |
Au12—Au16—Au9 | 60.57 (4) | H54B—C54—H54C | 109.5 |
Au12—Au16—Au13 | 58.08 (4) | C37—C55—H55A | 109.5 |
Au12—Au16—Au19 | 69.19 (4) | C37—C55—H55B | 109.5 |
Au12—Au16—Au22 | 135.87 (5) | C37—C55—H55C | 109.5 |
Au12—Au16—Au24 | 69.88 (4) | H55A—C55—H55B | 109.5 |
Au13—Au16—Au22 | 80.58 (4) | H55A—C55—H55C | 109.5 |
Au19—Au16—Au13 | 117.84 (5) | H55B—C55—H55C | 109.5 |
Au19—Au16—Au22 | 153.32 (5) | C14—C56—H56A | 109.5 |
Au19—Au16—Au24 | 69.32 (4) | C14—C56—H56B | 109.5 |
Au24—Au16—Au13 | 63.71 (4) | C14—C56—H56C | 109.5 |
Au24—Au16—Au22 | 107.07 (5) | H56A—C56—H56B | 109.5 |
S13—Au16—Au8 | 98.6 (2) | H56A—C56—H56C | 109.5 |
S13—Au16—Au9 | 137.3 (2) | H56B—C56—H56C | 109.5 |
S13—Au16—Au12 | 160.9 (2) | C10—C57—S10 | 104 (3) |
S13—Au16—Au13 | 110.4 (2) | C42—C57—S10 | 107 (3) |
S13—Au16—Au19 | 109.1 (2) | C42—C57—C10 | 111 (4) |
S13—Au16—Au22 | 44.2 (2) | C42—C57—C49 | 111 (4) |
S13—Au16—Au24 | 91.5 (2) | C49—C57—S10 | 111 (3) |
Au8—Au17—Au5 | 58.19 (4) | C49—C57—C10 | 111 (4) |
S4—Au17—Au5 | 79.90 (15) | C29—C58—H58A | 109.5 |
S4—Au17—Au8 | 91.80 (17) | C29—C58—H58B | 109.5 |
S6—Au17—Au5 | 105.3 (2) | C29—C58—H58C | 109.5 |
S6—Au17—Au8 | 89.8 (2) | H58A—C58—H58B | 109.5 |
S6—Au17—S4 | 174.5 (2) | H58A—C58—H58C | 109.5 |
Au3—Au18—Au20 | 57.40 (3) | H58B—C58—H58C | 109.5 |
Au15—Au18—Au3 | 50.83 (3) | H59A—C59—H59B | 109.5 |
Au15—Au18—Au20 | 56.78 (4) | H59A—C59—H59C | 109.5 |
Au15—Au18—Au21 | 81.01 (4) | H59B—C59—H59C | 109.5 |
Au21—Au18—Au3 | 57.98 (3) | C61—C59—H59A | 109.5 |
Au21—Au18—Au20 | 115.33 (5) | C61—C59—H59B | 109.5 |
S10—Au18—Au3 | 86.50 (18) | C61—C59—H59C | 109.5 |
S10—Au18—Au15 | 99.9 (2) | C39—C60—H60A | 109.5 |
S10—Au18—Au20 | 43.37 (19) | C39—C60—H60B | 109.5 |
S10—Au18—Au21 | 133.51 (19) | C39—C60—H60C | 109.5 |
S10—Au18—S14 | 179.3 (3) | H60A—C60—H60B | 109.5 |
S14—Au18—Au3 | 93.73 (17) | H60A—C60—H60C | 109.5 |
S14—Au18—Au15 | 80.72 (18) | H60B—C60—H60C | 109.5 |
S14—Au18—Au20 | 137.27 (18) | C21—C61—S1 | 107 (3) |
S14—Au18—Au21 | 46.27 (17) | C21—C61—C59 | 109 (3) |
Au12—Au19—Au11 | 59.52 (3) | C59—C61—S1 | 103 (2) |
Au16—Au19—Au11 | 84.72 (4) | C63—C61—S1 | 113 (3) |
Au16—Au19—Au12 | 51.29 (3) | C63—C61—C21 | 116 (4) |
S7—Au19—Au11 | 46.00 (17) | C63—C61—C59 | 108 (4) |
S7—Au19—Au12 | 95.52 (17) | C11—C62—H62A | 109.5 |
S7—Au19—Au16 | 85.44 (19) | C11—C62—H62B | 109.5 |
S9—Au19—Au11 | 135.2 (2) | C11—C62—H62C | 109.5 |
S9—Au19—Au12 | 88.57 (19) | H62A—C62—H62B | 109.5 |
S9—Au19—Au16 | 99.6 (2) | H62A—C62—H62C | 109.5 |
S9—Au19—S7 | 174.8 (3) | H62B—C62—H62C | 109.5 |
Au3—Au20—Au7 | 53.14 (3) | C61—C63—H63A | 109.5 |
Au3—Au20—Au18 | 58.57 (3) | C61—C63—H63B | 109.5 |
Au7—Au20—Au18 | 105.80 (4) | C61—C63—H63C | 109.5 |
Au15—Au20—Au3 | 50.52 (3) | H63A—C63—H63B | 109.5 |
Au15—Au20—Au7 | 61.98 (4) | H63A—C63—H63C | 109.5 |
Au15—Au20—Au18 | 54.07 (4) | H63B—C63—H63C | 109.5 |
S10—Au20—Au3 | 87.29 (18) | C2—C64—H64A | 109.5 |
S10—Au20—Au7 | 140.32 (18) | C2—C64—H64B | 109.5 |
S10—Au20—Au15 | 96.99 (18) | C2—C64—H64C | 109.5 |
S10—Au20—Au18 | 43.12 (18) | H64A—C64—H64B | 109.5 |
S11—Au20—Au3 | 97.56 (17) | H64A—C64—H64C | 109.5 |
S11—Au20—Au7 | 44.57 (17) | H64B—C64—H64C | 109.5 |
S11—Au20—Au15 | 85.61 (17) | ||
Au2—S5—C9—C8 | −58 (2) | Au14—S1—C61—C63 | 41 (3) |
Au2—S5—C9—C30 | −174 (2) | Au14—S4—C2—C1 | 43 (2) |
Au2—S5—C9—C35 | 61 (3) | Au14—S4—C2—C7 | 165.8 (16) |
Au3—S4—C2—C1 | −67 (2) | Au14—S4—C2—C64 | −72 (2) |
Au3—S4—C2—C7 | 55 (2) | Au15—S16—C6—C19 | −157 (2) |
Au3—S4—C2—C64 | 177.5 (16) | Au15—S16—C6—C27 | 83 (2) |
Au4—S2—C20—C4 | −74 (2) | Au15—S16—C6—C33 | −40 (3) |
Au4—S2—C20—C13 | 52 (3) | Au16—S13—C29—C17 | 161 (3) |
Au4—S2—C20—C46 | 171.4 (17) | Au16—S13—C29—C32 | 41 (3) |
Au5—S12—C40—C22 | −53 (2) | Au16—S13—C29—C58 | −81 (3) |
Au5—S12—C40—C44 | 69 (3) | Au17—S4—C2—C1 | 149.5 (18) |
Au5—S12—C40—C47 | −173 (2) | Au17—S4—C2—C7 | −87.7 (19) |
Au6—S8—C24—C3 | −46 (2) | Au17—S4—C2—C64 | 35 (2) |
Au6—S8—C24—C23 | −164 (2) | Au18—S10—C57—C10 | −176 (2) |
Au6—S8—C24—C41 | 78 (2) | Au18—S10—C57—C42 | 66 (3) |
Au7—S11—C11—C5 | −57 (3) | Au18—S10—C57—C49 | −55 (3) |
Au7—S11—C11—C12 | −178 (3) | Au19—S7—C14—C38 | 163 (2) |
Au7—S11—C11—C62 | 64 (3) | Au19—S7—C14—C52 | −84 (3) |
Au9—S1—C61—C21 | 176 (2) | Au19—S7—C14—C56 | 42 (3) |
Au9—S1—C61—C59 | 62 (3) | Au20—S10—C57—C10 | −77 (3) |
Au9—S1—C61—C63 | −55 (3) | Au20—S10—C57—C42 | 165 (3) |
Au10—S3—C53—C18 | 81 (2) | Au20—S10—C57—C49 | 43 (3) |
Au10—S3—C53—C28 | −162.4 (18) | Au20—S11—C11—C5 | 44 (3) |
Au10—S3—C53—C45 | −39 (3) | Au20—S11—C11—C12 | −77 (3) |
Au10—S5—C9—C8 | −156.3 (18) | Au20—S11—C11—C62 | 165 (3) |
Au10—S5—C9—C30 | 87 (2) | Au21—S12—C40—C22 | 45 (2) |
Au10—S5—C9—C35 | −38 (3) | Au21—S12—C40—C44 | 167 (2) |
Au11—S2—C20—C4 | −174.7 (19) | Au21—S12—C40—C47 | −75 (2) |
Au11—S2—C20—C13 | −49 (3) | Au22—S13—C29—C17 | 65 (3) |
Au11—S2—C20—C46 | 71 (2) | Au22—S13—C29—C32 | −55 (3) |
Au11—S7—C14—C38 | 68 (3) | Au22—S13—C29—C58 | −177 (3) |
Au11—S7—C14—C52 | −178 (2) | Au23—S8—C24—C3 | 41 (2) |
Au11—S7—C14—C56 | −52 (3) | Au23—S8—C24—C23 | −77 (3) |
Au12—S3—C53—C18 | −173.6 (17) | Au23—S8—C24—C41 | 165 (2) |
Au12—S3—C53—C28 | −57 (2) | Au23—S16—C6—C19 | −72 (3) |
Au12—S3—C53—C45 | 66 (3) | Au23—S16—C6—C27 | 168 (2) |
Au13—S15—C39—C43 | −69 (3) | Au23—S16—C6—C33 | 44 (3) |
Au13—S15—C39—C48 | 175 (2) | Au24—S15—C39—C43 | −167 (3) |
Au13—S15—C39—C60 | 55 (3) | Au24—S15—C39—C48 | 76 (3) |
Au14—S1—C61—C21 | −89 (3) | Au24—S15—C39—C60 | −44 (3) |
Au14—S1—C61—C59 | 157 (2) |
Au24(S-tBu)16 | Au24(S-Adm)16 | |||||
Average | Max | Min | Average | Max | Min | |
Au(center)—Au(cuboctahedra) | 2.95 ± 0.23 | 3.28 | 2.70 | 2.93 ± 0.22 | 3.27 | 2.70 |
Au(cuboctahedra)—Au(cuboctahedra) | 2.91 ± 0.22 | 3.36 | 2.64 | 2.92 ± 0.20 | 3.30 | 2.66 |
Au(core)—Au(monomeric) | 3.03 ± 0.20 | 3.29 | 2.82 | 3.04 ± 0.12 | 3.12 | 2.95 |
Au(core)—Au(trimeric) | 3.14 ± 0.15 | 3.37 | 2.92 | 3.12 ± 0.18 | 3.38 | 2.94 |
Au(trimeric)—Au(trimeric) | 3.27 ± 0.09 | 3.37 | 3.19 | 3.25 ± 0.00 | 3.25 | 3.25 |
Au(trimeric)—S | 2.31 ± 0.01 | 2.33 | 2.29 | 2.30 ± 0.02 | 2.34 | 2.28 |
Au(monomeric)—S | 2.29 ± 0.01 | 2.30 | 2.29 | 2.31 ± 0.01 | 2.31 | 2.30 |
Au(core)—S(bridging) | 2.35 ± 0.03 | 2.41 | 2.30 | 2.36 ± 0.05 | 2.54 | 2.30 |
S—C | 1.86 ± 0.03 | 1.92 | 1.80 | 1.84 ± 0.00 | 1.84 | 1.83 |