Supporting information
Crystallographic Information File (CIF) https://doi.org/10.1107/S1600536806015728/hb2045sup1.cif | |
Structure factor file (CIF format) https://doi.org/10.1107/S1600536806015728/hb2045Isup2.hkl |
CCDC reference: 610782
Key indicators
- Single-crystal X-ray study
- T = 291 K
- Mean (C-C) = 0.014 Å
- R factor = 0.064
- wR factor = 0.139
- Data-to-parameter ratio = 17.6
checkCIF/PLATON results
No syntax errors found
Alert level C PLAT220_ALERT_2_C Large Non-Solvent C Ueq(max)/Ueq(min) ... 3.39 Ratio PLAT222_ALERT_3_C Large Non-Solvent H Ueq(max)/Ueq(min) ... 3.26 Ratio PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C36 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C50 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C54 PLAT241_ALERT_2_C Check High Ueq as Compared to Neighbors for C60 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C46 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C49 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C58 PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for C61 PLAT244_ALERT_4_C Low 'Solvent' Ueq as Compared to Neighbors for C64 PLAT342_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 14
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 12 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 0 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 9 ALERT type 2 Indicator that the structure model may be wrong or deficient 2 ALERT type 3 Indicator that the structure quality may be low 1 ALERT type 4 Improvement, methodology, query or suggestion
Data collection: SMART (Bruker, 2002); cell refinement: SAINT (Bruker, 2002); data reduction: SAINT; program(s) used to solve structure: SHELXS97 (Sheldrick, 1997); program(s) used to refine structure: SHELXL97 (Sheldrick, 1997); molecular graphics: ORTEP-3 (Farrugia, 1997); software used to prepare material for publication: SHELXL97.
[Sn3(C6H5)9(C9H3O6)]·CHCl3 | Z = 2 |
Mr = 1376.45 | F(000) = 1364 |
Triclinic, P1 | Dx = 1.547 Mg m−3 |
Hall symbol: -P 1 | Mo Kα radiation, λ = 0.71073 Å |
a = 13.092 (4) Å | Cell parameters from 2157 reflections |
b = 13.990 (5) Å | θ = 2.4–18.0° |
c = 18.207 (8) Å | µ = 1.44 mm−1 |
α = 112.456 (5)° | T = 291 K |
β = 104.944 (8)° | Block, colorless |
γ = 90.641 (6)° | 0.12 × 0.10 × 0.06 mm |
V = 2955.1 (18) Å3 |
Bruker SMART APEX CCD diffractometer | 12063 independent reflections |
Radiation source: fine-focus sealed tube | 6615 reflections with I > 2σ(I) |
Graphite monochromator | Rint = 0.067 |
φ and ω scans | θmax = 26.5°, θmin = 1.3° |
Absorption correction: multi-scan (SADABS; Bruker, 2002) | h = −16→16 |
Tmin = 0.846, Tmax = 0.918 | k = −17→17 |
24159 measured reflections | l = −22→22 |
Refinement on F2 | Primary atom site location: structure-invariant direct methods |
Least-squares matrix: full | Secondary atom site location: difference Fourier map |
R[F2 > 2σ(F2)] = 0.064 | Hydrogen site location: inferred from neighbouring sites |
wR(F2) = 0.139 | H-atom parameters constrained |
S = 0.96 | w = 1/[σ2(Fo2) + (0.0333P)2] where P = (Fo2 + 2Fc2)/3 |
12063 reflections | (Δ/σ)max = 0.001 |
685 parameters | Δρmax = 0.65 e Å−3 |
6 restraints | Δρmin = −0.53 e Å−3 |
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. Refinement of F2 against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F2, conventional R-factors R are based on F, with F set to zero for negative F2. The threshold expression of F2 > σ(F2) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F2 are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger. |
x | y | z | Uiso*/Ueq | ||
Sn1 | 0.87734 (4) | 1.01668 (4) | 0.29504 (3) | 0.04920 (16) | |
Sn2 | 1.29255 (4) | 0.58306 (4) | 0.43471 (3) | 0.04876 (16) | |
Sn3 | 0.62446 (4) | 0.30078 (4) | −0.06490 (3) | 0.05477 (17) | |
Cl1 | 0.1214 (4) | 0.5276 (4) | 0.0907 (3) | 0.213 (2) | |
Cl2 | 0.0511 (5) | 0.3124 (4) | −0.0066 (3) | 0.231 (2) | |
Cl3 | 0.1990 (4) | 0.3743 (5) | 0.1469 (3) | 0.259 (3) | |
O1 | 0.9356 (4) | 0.8795 (3) | 0.2938 (3) | 0.0538 (13) | |
O2 | 0.8096 (4) | 0.8202 (4) | 0.1746 (3) | 0.0661 (15) | |
O3 | 1.1735 (3) | 0.6300 (4) | 0.3618 (3) | 0.0537 (13) | |
O4 | 1.0849 (4) | 0.4861 (4) | 0.3473 (3) | 0.0601 (14) | |
O5 | 0.7087 (4) | 0.4405 (3) | 0.0238 (3) | 0.0583 (14) | |
O6 | 0.7901 (4) | 0.3311 (4) | 0.0734 (3) | 0.0778 (18) | |
C1 | 0.8781 (6) | 0.8055 (5) | 0.2272 (5) | 0.0462 (18) | |
C2 | 0.8998 (5) | 0.6967 (5) | 0.2184 (4) | 0.0430 (17) | |
C3 | 0.9847 (5) | 0.6803 (5) | 0.2743 (4) | 0.0424 (17) | |
H3 | 1.0316 | 0.7368 | 0.3157 | 0.051* | |
C4 | 1.0003 (5) | 0.5802 (5) | 0.2687 (4) | 0.0427 (17) | |
C5 | 0.9304 (5) | 0.4967 (5) | 0.2061 (4) | 0.0438 (17) | |
H5 | 0.9382 | 0.4295 | 0.2034 | 0.053* | |
C6 | 0.8494 (5) | 0.5124 (5) | 0.1480 (4) | 0.0410 (17) | |
C7 | 0.8324 (5) | 0.6116 (5) | 0.1548 (4) | 0.0449 (18) | |
H7 | 0.7758 | 0.6220 | 0.1167 | 0.054* | |
C8 | 1.0902 (6) | 0.5608 (6) | 0.3299 (4) | 0.0475 (18) | |
C9 | 0.7793 (6) | 0.4214 (6) | 0.0793 (5) | 0.055 (2) | |
C10 | 0.9121 (6) | 1.0590 (6) | 0.2041 (5) | 0.0529 (19) | |
C11 | 0.9719 (7) | 1.1526 (6) | 0.2284 (6) | 0.072 (2) | |
H11 | 0.9976 | 1.1949 | 0.2845 | 0.086* | |
C12 | 0.9949 (8) | 1.1856 (8) | 0.1705 (7) | 0.089 (3) | |
H12 | 1.0386 | 1.2477 | 0.1884 | 0.107* | |
C13 | 0.9533 (9) | 1.1268 (9) | 0.0877 (8) | 0.103 (4) | |
H13 | 0.9664 | 1.1499 | 0.0490 | 0.124* | |
C14 | 0.8930 (8) | 1.0349 (9) | 0.0625 (6) | 0.097 (3) | |
H14 | 0.8656 | 0.9938 | 0.0062 | 0.116* | |
C15 | 0.8720 (7) | 1.0018 (7) | 0.1204 (6) | 0.079 (3) | |
H15 | 0.8294 | 0.9388 | 0.1020 | 0.094* | |
C16 | 0.9797 (6) | 1.1127 (5) | 0.4115 (4) | 0.0496 (19) | |
C17 | 0.9692 (7) | 1.2177 (6) | 0.4456 (5) | 0.073 (3) | |
H17 | 0.9135 | 1.2428 | 0.4177 | 0.088* | |
C18 | 1.0375 (8) | 1.2866 (7) | 0.5189 (6) | 0.085 (3) | |
H18 | 1.0278 | 1.3567 | 0.5400 | 0.102* | |
C19 | 1.1190 (8) | 1.2508 (8) | 0.5597 (6) | 0.086 (3) | |
H19 | 1.1667 | 1.2971 | 0.6086 | 0.103* | |
C20 | 1.1324 (7) | 1.1465 (9) | 0.5298 (6) | 0.087 (3) | |
H20 | 1.1872 | 1.1221 | 0.5592 | 0.105* | |
C21 | 1.0629 (7) | 1.0784 (7) | 0.4555 (5) | 0.070 (2) | |
H21 | 1.0726 | 1.0083 | 0.4348 | 0.084* | |
C22 | 0.7154 (6) | 1.0110 (5) | 0.2966 (5) | 0.0483 (18) | |
C23 | 0.6335 (6) | 0.9805 (6) | 0.2227 (5) | 0.061 (2) | |
H23 | 0.6496 | 0.9571 | 0.1723 | 0.073* | |
C24 | 0.5294 (7) | 0.9849 (6) | 0.2240 (6) | 0.077 (3) | |
H24 | 0.4755 | 0.9671 | 0.1747 | 0.093* | |
C25 | 0.5045 (7) | 1.0146 (7) | 0.2957 (7) | 0.076 (3) | |
H25 | 0.4334 | 1.0144 | 0.2956 | 0.091* | |
C26 | 0.5835 (8) | 1.0455 (7) | 0.3696 (6) | 0.076 (3) | |
H26 | 0.5660 | 1.0679 | 0.4194 | 0.092* | |
C27 | 0.6886 (7) | 1.0432 (6) | 0.3696 (5) | 0.062 (2) | |
H27 | 0.7419 | 1.0638 | 0.4196 | 0.074* | |
C28 | 1.4134 (6) | 0.6973 (6) | 0.4489 (5) | 0.054 (2) | |
C29 | 1.3893 (7) | 0.7652 (7) | 0.4098 (5) | 0.074 (3) | |
H29 | 1.3199 | 0.7608 | 0.3779 | 0.089* | |
C30 | 1.4672 (7) | 0.8406 (7) | 0.4172 (6) | 0.086 (3) | |
H30 | 1.4503 | 0.8855 | 0.3903 | 0.103* | |
C31 | 1.5678 (7) | 0.8464 (8) | 0.4644 (6) | 0.088 (3) | |
H31 | 1.6205 | 0.8955 | 0.4694 | 0.105* | |
C32 | 1.5928 (7) | 0.7820 (8) | 0.5045 (6) | 0.088 (3) | |
H32 | 1.6619 | 0.7879 | 0.5374 | 0.105* | |
C33 | 1.5165 (6) | 0.7085 (7) | 0.4966 (5) | 0.075 (3) | |
H33 | 1.5348 | 0.6647 | 0.5243 | 0.089* | |
C34 | 1.3220 (6) | 0.4314 (6) | 0.3636 (5) | 0.058 (2) | |
C35 | 1.4032 (7) | 0.4230 (8) | 0.3270 (6) | 0.082 (3) | |
H35 | 1.4448 | 0.4827 | 0.3355 | 0.099* | |
C36 | 1.4230 (10) | 0.3259 (11) | 0.2775 (8) | 0.118 (4) | |
H36 | 1.4766 | 0.3210 | 0.2517 | 0.141* | |
C37 | 1.3654 (11) | 0.2385 (11) | 0.2663 (7) | 0.113 (5) | |
H37 | 1.3807 | 0.1736 | 0.2343 | 0.136* | |
C38 | 1.2836 (9) | 0.2454 (8) | 0.3025 (6) | 0.093 (3) | |
H38 | 1.2425 | 0.1853 | 0.2936 | 0.111* | |
C39 | 1.2628 (7) | 0.3422 (7) | 0.3521 (5) | 0.073 (3) | |
H39 | 1.2089 | 0.3468 | 0.3776 | 0.088* | |
C40 | 1.2570 (5) | 0.6108 (5) | 0.5473 (4) | 0.0463 (18) | |
C41 | 1.3160 (6) | 0.6937 (6) | 0.6182 (5) | 0.068 (2) | |
H41 | 1.3697 | 0.7352 | 0.6154 | 0.081* | |
C42 | 1.2946 (8) | 0.7146 (7) | 0.6933 (6) | 0.081 (3) | |
H42 | 1.3353 | 0.7700 | 0.7402 | 0.097* | |
C43 | 1.2162 (7) | 0.6569 (7) | 0.7010 (5) | 0.069 (2) | |
H43 | 1.2030 | 0.6720 | 0.7519 | 0.083* | |
C44 | 1.1579 (7) | 0.5760 (6) | 0.6309 (5) | 0.071 (2) | |
H44 | 1.1034 | 0.5361 | 0.6342 | 0.085* | |
C45 | 1.1774 (6) | 0.5517 (6) | 0.5550 (5) | 0.063 (2) | |
H45 | 1.1369 | 0.4954 | 0.5088 | 0.075* | |
C46 | 0.5237 (6) | 0.3662 (5) | −0.1398 (4) | 0.056 (2) | |
C47 | 0.5201 (7) | 0.4720 (5) | −0.1156 (5) | 0.075 (3) | |
H47 | 0.5624 | 0.5170 | −0.0636 | 0.090* | |
C48 | 0.4558 (7) | 0.5130 (7) | −0.1661 (5) | 0.089 (3) | |
H48 | 0.4555 | 0.5848 | −0.1481 | 0.107* | |
C49 | 0.3926 (7) | 0.4489 (7) | −0.2424 (5) | 0.082 (3) | |
H49 | 0.3490 | 0.4761 | −0.2768 | 0.098* | |
C50 | 0.3946 (8) | 0.3441 (7) | −0.2673 (6) | 0.117 (4) | |
H50 | 0.3513 | 0.2997 | −0.3190 | 0.140* | |
C51 | 0.4596 (7) | 0.3020 (6) | −0.2171 (5) | 0.097 (4) | |
H51 | 0.4600 | 0.2302 | −0.2358 | 0.117* | |
C52 | 0.5400 (7) | 0.2332 (6) | −0.0093 (5) | 0.061 (2) | |
C53 | 0.4312 (8) | 0.2383 (7) | −0.0220 (6) | 0.083 (3) | |
H53 | 0.3976 | 0.2733 | −0.0540 | 0.100* | |
C54 | 0.3706 (11) | 0.1927 (12) | 0.0115 (8) | 0.132 (6) | |
H54 | 0.2977 | 0.1959 | 0.0014 | 0.159* | |
C55 | 0.4207 (14) | 0.1443 (11) | 0.0584 (8) | 0.139 (7) | |
H55 | 0.3815 | 0.1159 | 0.0827 | 0.166* | |
C56 | 0.5301 (12) | 0.1345 (9) | 0.0728 (6) | 0.114 (4) | |
H56 | 0.5624 | 0.0977 | 0.1038 | 0.137* | |
C57 | 0.5874 (8) | 0.1811 (7) | 0.0395 (5) | 0.079 (3) | |
H57 | 0.6603 | 0.1777 | 0.0499 | 0.095* | |
C58 | 0.7224 (5) | 0.2062 (5) | −0.1314 (5) | 0.0499 (19) | |
C59 | 0.7337 (7) | 0.2143 (8) | −0.2025 (6) | 0.084 (3) | |
H59 | 0.7019 | 0.2648 | −0.2189 | 0.101* | |
C60 | 0.7924 (8) | 0.1474 (9) | −0.2499 (7) | 0.108 (4) | |
H60 | 0.8001 | 0.1533 | −0.2974 | 0.129* | |
C61 | 0.8385 (7) | 0.0729 (8) | −0.2255 (7) | 0.086 (3) | |
H61 | 0.8774 | 0.0284 | −0.2572 | 0.103* | |
C62 | 0.8292 (8) | 0.0624 (8) | −0.1569 (6) | 0.095 (3) | |
H62 | 0.8608 | 0.0113 | −0.1412 | 0.114* | |
C63 | 0.7707 (7) | 0.1303 (7) | −0.1100 (5) | 0.078 (3) | |
H63 | 0.7643 | 0.1238 | −0.0624 | 0.094* | |
C64 | 0.1545 (14) | 0.4125 (12) | 0.0628 (9) | 0.214 (9) | |
H64 | 0.2121 | 0.4096 | 0.0371 | 0.256* |
U11 | U22 | U33 | U12 | U13 | U23 | |
Sn1 | 0.0527 (3) | 0.0385 (3) | 0.0501 (3) | 0.0045 (2) | 0.0075 (3) | 0.0156 (2) |
Sn2 | 0.0405 (3) | 0.0527 (3) | 0.0535 (3) | 0.0026 (2) | 0.0049 (2) | 0.0271 (3) |
Sn3 | 0.0572 (3) | 0.0415 (3) | 0.0480 (3) | 0.0061 (3) | −0.0044 (3) | 0.0117 (3) |
Cl1 | 0.237 (5) | 0.190 (5) | 0.246 (5) | 0.006 (4) | 0.105 (4) | 0.100 (4) |
Cl2 | 0.290 (6) | 0.205 (5) | 0.201 (5) | −0.035 (5) | 0.023 (5) | 0.116 (4) |
Cl3 | 0.234 (5) | 0.393 (8) | 0.221 (5) | 0.093 (5) | 0.035 (4) | 0.213 (6) |
O1 | 0.060 (3) | 0.035 (3) | 0.051 (3) | 0.002 (2) | 0.002 (3) | 0.010 (2) |
O2 | 0.074 (4) | 0.046 (3) | 0.068 (4) | 0.008 (3) | −0.004 (3) | 0.027 (3) |
O3 | 0.038 (3) | 0.057 (3) | 0.060 (3) | −0.002 (2) | −0.008 (2) | 0.031 (3) |
O4 | 0.054 (3) | 0.056 (3) | 0.071 (4) | 0.001 (3) | −0.001 (3) | 0.038 (3) |
O5 | 0.055 (3) | 0.046 (3) | 0.048 (3) | 0.000 (2) | −0.010 (3) | 0.008 (3) |
O6 | 0.084 (4) | 0.036 (3) | 0.078 (4) | 0.000 (3) | −0.019 (3) | 0.013 (3) |
C1 | 0.056 (5) | 0.042 (4) | 0.043 (5) | 0.007 (4) | 0.012 (4) | 0.022 (4) |
C2 | 0.052 (4) | 0.032 (4) | 0.046 (4) | 0.006 (3) | 0.010 (4) | 0.019 (3) |
C3 | 0.044 (4) | 0.032 (4) | 0.043 (4) | −0.003 (3) | 0.006 (3) | 0.011 (3) |
C4 | 0.042 (4) | 0.050 (4) | 0.040 (4) | 0.003 (3) | 0.009 (3) | 0.024 (4) |
C5 | 0.052 (4) | 0.034 (4) | 0.045 (4) | 0.003 (3) | 0.014 (4) | 0.015 (3) |
C6 | 0.037 (4) | 0.040 (4) | 0.040 (4) | 0.005 (3) | −0.002 (3) | 0.017 (3) |
C7 | 0.049 (4) | 0.039 (4) | 0.037 (4) | 0.013 (3) | 0.002 (3) | 0.011 (3) |
C8 | 0.041 (4) | 0.052 (5) | 0.049 (5) | 0.007 (4) | 0.015 (4) | 0.018 (4) |
C9 | 0.049 (5) | 0.046 (5) | 0.057 (5) | 0.007 (4) | 0.000 (4) | 0.018 (4) |
C10 | 0.054 (5) | 0.046 (5) | 0.061 (5) | 0.009 (4) | 0.017 (4) | 0.023 (4) |
C11 | 0.088 (7) | 0.054 (5) | 0.078 (6) | 0.011 (5) | 0.029 (5) | 0.029 (5) |
C12 | 0.091 (7) | 0.070 (7) | 0.114 (9) | 0.004 (6) | 0.030 (7) | 0.044 (7) |
C13 | 0.119 (9) | 0.109 (9) | 0.115 (10) | 0.003 (7) | 0.027 (8) | 0.083 (8) |
C14 | 0.117 (9) | 0.110 (9) | 0.061 (6) | −0.006 (7) | 0.011 (6) | 0.042 (6) |
C15 | 0.096 (7) | 0.061 (6) | 0.071 (7) | −0.009 (5) | 0.009 (6) | 0.029 (5) |
C16 | 0.050 (5) | 0.043 (4) | 0.055 (5) | 0.007 (4) | 0.017 (4) | 0.017 (4) |
C17 | 0.067 (6) | 0.058 (6) | 0.068 (6) | 0.012 (5) | 0.007 (5) | 0.004 (5) |
C18 | 0.086 (7) | 0.056 (6) | 0.086 (8) | −0.002 (5) | 0.017 (6) | 0.004 (6) |
C19 | 0.071 (7) | 0.094 (8) | 0.056 (6) | −0.004 (6) | 0.018 (5) | −0.008 (6) |
C20 | 0.059 (6) | 0.120 (9) | 0.074 (7) | 0.018 (6) | 0.000 (5) | 0.040 (7) |
C21 | 0.068 (6) | 0.063 (6) | 0.072 (6) | 0.006 (5) | 0.011 (5) | 0.026 (5) |
C22 | 0.059 (5) | 0.032 (4) | 0.050 (5) | 0.005 (3) | 0.008 (4) | 0.018 (4) |
C23 | 0.068 (6) | 0.053 (5) | 0.056 (5) | 0.012 (4) | 0.016 (5) | 0.016 (4) |
C24 | 0.061 (6) | 0.062 (6) | 0.095 (8) | 0.003 (5) | 0.014 (6) | 0.022 (6) |
C25 | 0.063 (6) | 0.056 (6) | 0.120 (9) | 0.005 (5) | 0.043 (7) | 0.036 (6) |
C26 | 0.088 (7) | 0.067 (6) | 0.091 (8) | 0.006 (5) | 0.055 (6) | 0.030 (6) |
C27 | 0.077 (6) | 0.055 (5) | 0.054 (5) | 0.005 (4) | 0.021 (5) | 0.021 (4) |
C28 | 0.045 (5) | 0.071 (5) | 0.056 (5) | −0.001 (4) | 0.015 (4) | 0.036 (4) |
C29 | 0.061 (6) | 0.094 (7) | 0.071 (6) | −0.016 (5) | −0.002 (5) | 0.051 (6) |
C30 | 0.080 (7) | 0.099 (7) | 0.095 (7) | −0.016 (6) | 0.006 (6) | 0.070 (6) |
C31 | 0.057 (6) | 0.112 (8) | 0.094 (8) | −0.025 (6) | 0.016 (6) | 0.045 (7) |
C32 | 0.045 (5) | 0.121 (9) | 0.106 (8) | −0.008 (5) | 0.001 (5) | 0.069 (7) |
C33 | 0.045 (5) | 0.093 (7) | 0.095 (7) | −0.008 (5) | 0.003 (5) | 0.058 (6) |
C34 | 0.044 (5) | 0.060 (5) | 0.068 (6) | 0.017 (4) | 0.002 (4) | 0.031 (5) |
C35 | 0.076 (7) | 0.088 (7) | 0.085 (7) | 0.030 (6) | 0.028 (6) | 0.034 (6) |
C36 | 0.121 (11) | 0.139 (12) | 0.120 (11) | 0.063 (10) | 0.061 (9) | 0.061 (10) |
C37 | 0.141 (12) | 0.126 (11) | 0.078 (8) | 0.087 (10) | 0.041 (8) | 0.039 (8) |
C38 | 0.103 (8) | 0.068 (7) | 0.074 (7) | 0.023 (6) | −0.011 (6) | 0.017 (6) |
C39 | 0.079 (6) | 0.067 (6) | 0.073 (6) | 0.023 (5) | 0.018 (5) | 0.029 (5) |
C40 | 0.035 (4) | 0.047 (4) | 0.057 (5) | 0.001 (3) | 0.004 (4) | 0.026 (4) |
C41 | 0.065 (6) | 0.062 (6) | 0.068 (6) | −0.005 (4) | 0.005 (5) | 0.026 (5) |
C42 | 0.096 (7) | 0.064 (6) | 0.064 (6) | 0.000 (5) | 0.003 (6) | 0.019 (5) |
C43 | 0.077 (6) | 0.073 (6) | 0.066 (6) | 0.016 (5) | 0.023 (5) | 0.036 (5) |
C44 | 0.079 (6) | 0.059 (6) | 0.074 (6) | −0.016 (5) | 0.029 (5) | 0.024 (5) |
C45 | 0.073 (6) | 0.057 (5) | 0.049 (5) | −0.014 (4) | 0.012 (4) | 0.016 (4) |
C46 | 0.054 (5) | 0.057 (5) | 0.046 (5) | 0.011 (4) | 0.002 (4) | 0.016 (4) |
C47 | 0.100 (7) | 0.042 (5) | 0.060 (6) | 0.010 (5) | −0.006 (5) | 0.015 (4) |
C48 | 0.112 (8) | 0.064 (6) | 0.084 (7) | 0.032 (6) | 0.009 (6) | 0.034 (6) |
C49 | 0.084 (7) | 0.085 (7) | 0.075 (7) | 0.042 (6) | 0.007 (5) | 0.041 (6) |
C50 | 0.120 (9) | 0.086 (8) | 0.085 (8) | 0.022 (7) | −0.041 (7) | 0.017 (6) |
C51 | 0.093 (7) | 0.055 (6) | 0.086 (7) | 0.017 (5) | −0.040 (6) | 0.008 (5) |
C52 | 0.085 (6) | 0.040 (4) | 0.037 (5) | 0.001 (4) | 0.003 (4) | 0.003 (4) |
C53 | 0.073 (7) | 0.073 (7) | 0.067 (6) | 0.000 (5) | −0.002 (5) | 0.002 (5) |
C54 | 0.103 (10) | 0.168 (14) | 0.070 (9) | −0.049 (10) | 0.033 (8) | −0.016 (8) |
C55 | 0.172 (16) | 0.150 (13) | 0.065 (9) | −0.067 (12) | 0.028 (10) | 0.018 (8) |
C56 | 0.167 (13) | 0.100 (9) | 0.064 (7) | −0.023 (9) | 0.012 (9) | 0.034 (6) |
C57 | 0.116 (8) | 0.064 (6) | 0.052 (6) | −0.008 (6) | 0.018 (5) | 0.022 (5) |
C58 | 0.049 (5) | 0.046 (4) | 0.046 (5) | −0.002 (4) | 0.000 (4) | 0.018 (4) |
C59 | 0.073 (6) | 0.094 (7) | 0.098 (8) | 0.026 (6) | 0.021 (6) | 0.053 (7) |
C60 | 0.095 (8) | 0.152 (11) | 0.118 (10) | 0.040 (8) | 0.049 (7) | 0.085 (9) |
C61 | 0.076 (7) | 0.098 (8) | 0.097 (8) | 0.038 (6) | 0.037 (6) | 0.044 (7) |
C62 | 0.110 (8) | 0.102 (8) | 0.086 (8) | 0.057 (7) | 0.029 (7) | 0.049 (7) |
C63 | 0.099 (7) | 0.077 (6) | 0.056 (6) | 0.034 (6) | 0.013 (5) | 0.029 (5) |
C64 | 0.26 (2) | 0.143 (13) | 0.147 (14) | 0.103 (14) | −0.028 (13) | 0.018 (11) |
Sn1—O1 | 2.067 (4) | C28—C29 | 1.385 (10) |
Sn1—C16 | 2.101 (7) | C29—C30 | 1.403 (10) |
Sn1—C10 | 2.106 (8) | C29—H29 | 0.9300 |
Sn1—C22 | 2.128 (7) | C30—C31 | 1.357 (11) |
Sn2—O3 | 2.060 (4) | C30—H30 | 0.9300 |
Sn2—C40 | 2.112 (7) | C31—C32 | 1.355 (11) |
Sn2—C34 | 2.122 (8) | C31—H31 | 0.9300 |
Sn2—C28 | 2.131 (7) | C32—C33 | 1.367 (10) |
Sn3—O5 | 2.066 (4) | C32—H32 | 0.9300 |
Sn3—C52 | 2.104 (8) | C33—H33 | 0.9300 |
Sn3—C58 | 2.116 (8) | C34—C35 | 1.377 (11) |
Sn3—C46 | 2.119 (7) | C34—C39 | 1.377 (10) |
Cl1—C64 | 1.596 (13) | C35—C36 | 1.385 (13) |
Cl2—C64 | 1.764 (17) | C35—H35 | 0.9300 |
Cl3—C64 | 1.772 (16) | C36—C37 | 1.348 (15) |
C1—O1 | 1.289 (8) | C36—H36 | 0.9300 |
C1—O2 | 1.215 (7) | C37—C38 | 1.381 (14) |
C8—O3 | 1.297 (8) | C37—H37 | 0.9300 |
C8—O4 | 1.208 (8) | C38—C39 | 1.386 (11) |
C9—O5 | 1.295 (8) | C38—H38 | 0.9300 |
C9—O6 | 1.239 (8) | C39—H39 | 0.9300 |
C1—C2 | 1.508 (9) | C40—C41 | 1.390 (10) |
C2—C3 | 1.387 (8) | C40—C45 | 1.390 (9) |
C2—C7 | 1.390 (8) | C41—C42 | 1.388 (11) |
C3—C4 | 1.386 (9) | C41—H41 | 0.9300 |
C3—H3 | 0.9300 | C42—C43 | 1.367 (11) |
C4—C5 | 1.386 (8) | C42—H42 | 0.9300 |
C4—C8 | 1.504 (9) | C43—C44 | 1.367 (11) |
C5—C6 | 1.377 (8) | C43—H43 | 0.9300 |
C5—H5 | 0.9300 | C44—C45 | 1.383 (10) |
C6—C7 | 1.372 (8) | C44—H44 | 0.9300 |
C6—C9 | 1.481 (9) | C45—H45 | 0.9300 |
C7—H7 | 0.9300 | C46—C51 | 1.379 (7) |
C10—C11 | 1.370 (10) | C46—C47 | 1.379 (7) |
C10—C15 | 1.373 (10) | C47—C48 | 1.379 (7) |
C11—C12 | 1.395 (11) | C47—H47 | 0.9300 |
C11—H11 | 0.9300 | C48—C49 | 1.363 (8) |
C12—C13 | 1.365 (13) | C48—H48 | 0.9300 |
C12—H12 | 0.9300 | C49—C50 | 1.362 (8) |
C13—C14 | 1.352 (12) | C49—H49 | 0.9300 |
C13—H13 | 0.9300 | C50—C51 | 1.388 (7) |
C14—C15 | 1.386 (11) | C50—H50 | 0.9300 |
C14—H14 | 0.9300 | C51—H51 | 0.9300 |
C15—H15 | 0.9300 | C52—C57 | 1.387 (10) |
C16—C17 | 1.383 (10) | C52—C53 | 1.390 (11) |
C16—C21 | 1.383 (10) | C53—C54 | 1.394 (14) |
C17—C18 | 1.376 (11) | C53—H53 | 0.9300 |
C17—H17 | 0.9300 | C54—C55 | 1.334 (17) |
C18—C19 | 1.353 (12) | C54—H54 | 0.9300 |
C18—H18 | 0.9300 | C55—C56 | 1.407 (17) |
C19—C20 | 1.379 (12) | C55—H55 | 0.9300 |
C19—H19 | 0.9300 | C56—C57 | 1.373 (13) |
C20—C21 | 1.388 (11) | C56—H56 | 0.9300 |
C20—H20 | 0.9300 | C57—H57 | 0.9300 |
C21—H21 | 0.9300 | C58—C63 | 1.373 (10) |
C22—C27 | 1.371 (10) | C58—C59 | 1.386 (11) |
C22—C23 | 1.396 (9) | C59—C60 | 1.397 (12) |
C23—C24 | 1.372 (10) | C59—H59 | 0.9300 |
C23—H23 | 0.9300 | C60—C61 | 1.369 (12) |
C24—C25 | 1.337 (11) | C60—H60 | 0.9300 |
C24—H24 | 0.9300 | C61—C62 | 1.347 (12) |
C25—C26 | 1.377 (12) | C61—H61 | 0.9300 |
C25—H25 | 0.9300 | C62—C63 | 1.397 (11) |
C26—C27 | 1.376 (10) | C62—H62 | 0.9300 |
C26—H26 | 0.9300 | C63—H63 | 0.9300 |
C27—H27 | 0.9300 | C64—H64 | 0.9800 |
C28—C33 | 1.374 (10) | ||
O1—Sn1—C16 | 95.7 (2) | C31—C30—C29 | 118.4 (8) |
O1—Sn1—C10 | 112.0 (2) | C31—C30—H30 | 120.8 |
C16—Sn1—C10 | 108.8 (3) | C29—C30—H30 | 120.8 |
O1—Sn1—C22 | 110.0 (2) | C32—C31—C30 | 121.2 (9) |
C16—Sn1—C22 | 111.7 (3) | C32—C31—H31 | 119.4 |
C10—Sn1—C22 | 116.6 (3) | C30—C31—H31 | 119.4 |
O3—Sn2—C40 | 108.6 (2) | C31—C32—C33 | 120.0 (8) |
O3—Sn2—C34 | 109.4 (2) | C31—C32—H32 | 120.0 |
C40—Sn2—C34 | 119.0 (3) | C33—C32—H32 | 120.0 |
O3—Sn2—C28 | 94.6 (2) | C32—C33—C28 | 122.0 (8) |
C40—Sn2—C28 | 111.9 (3) | C32—C33—H33 | 119.0 |
C34—Sn2—C28 | 110.5 (3) | C28—C33—H33 | 119.0 |
O5—Sn3—C52 | 108.8 (2) | C35—C34—C39 | 119.3 (8) |
O5—Sn3—C58 | 111.6 (2) | C35—C34—Sn2 | 117.9 (7) |
C52—Sn3—C58 | 116.7 (3) | C39—C34—Sn2 | 122.8 (6) |
O5—Sn3—C46 | 96.0 (2) | C34—C35—C36 | 120.1 (10) |
C52—Sn3—C46 | 112.1 (3) | C34—C35—H35 | 119.9 |
C58—Sn3—C46 | 109.7 (3) | C36—C35—H35 | 119.9 |
C1—O1—Sn1 | 106.8 (4) | C37—C36—C35 | 120.7 (12) |
C8—O3—Sn2 | 109.1 (4) | C37—C36—H36 | 119.7 |
C9—O5—Sn3 | 108.5 (4) | C35—C36—H36 | 119.7 |
O2—C1—O1 | 123.6 (6) | C36—C37—C38 | 119.9 (12) |
O2—C1—C2 | 120.9 (7) | C36—C37—H37 | 120.0 |
O1—C1—C2 | 115.5 (6) | C38—C37—H37 | 120.0 |
C3—C2—C7 | 119.5 (6) | C37—C38—C39 | 119.9 (11) |
C3—C2—C1 | 120.8 (6) | C37—C38—H38 | 120.0 |
C7—C2—C1 | 119.7 (6) | C39—C38—H38 | 120.0 |
C4—C3—C2 | 120.4 (6) | C34—C39—C38 | 120.0 (9) |
C4—C3—H3 | 119.8 | C34—C39—H39 | 120.0 |
C2—C3—H3 | 119.8 | C38—C39—H39 | 120.0 |
C5—C4—C3 | 119.1 (6) | C41—C40—C45 | 117.7 (7) |
C5—C4—C8 | 119.6 (6) | C41—C40—Sn2 | 118.2 (6) |
C3—C4—C8 | 121.3 (6) | C45—C40—Sn2 | 124.1 (5) |
C6—C5—C4 | 120.5 (6) | C40—C41—C42 | 119.8 (8) |
C6—C5—H5 | 119.7 | C40—C41—H41 | 120.1 |
C4—C5—H5 | 119.7 | C42—C41—H41 | 120.1 |
C7—C6—C5 | 120.2 (6) | C43—C42—C41 | 122.7 (8) |
C7—C6—C9 | 120.3 (6) | C43—C42—H42 | 118.7 |
C5—C6—C9 | 119.4 (6) | C41—C42—H42 | 118.7 |
C6—C7—C2 | 120.1 (6) | C44—C43—C42 | 117.2 (8) |
C6—C7—H7 | 120.0 | C44—C43—H43 | 121.4 |
C2—C7—H7 | 120.0 | C42—C43—H43 | 121.4 |
O4—C8—O3 | 123.0 (7) | C43—C44—C45 | 122.1 (8) |
O4—C8—C4 | 122.2 (7) | C43—C44—H44 | 118.9 |
O3—C8—C4 | 114.8 (6) | C45—C44—H44 | 118.9 |
O6—C9—O5 | 121.5 (7) | C44—C45—C40 | 120.6 (7) |
O6—C9—C6 | 121.8 (7) | C44—C45—H45 | 119.7 |
O5—C9—C6 | 116.6 (6) | C40—C45—H45 | 119.7 |
C11—C10—C15 | 117.0 (8) | C51—C46—C47 | 117.3 (7) |
C11—C10—Sn1 | 119.0 (6) | C51—C46—Sn3 | 119.8 (5) |
C15—C10—Sn1 | 123.8 (6) | C47—C46—Sn3 | 122.9 (5) |
C10—C11—C12 | 121.3 (9) | C46—C47—C48 | 121.9 (7) |
C10—C11—H11 | 119.4 | C46—C47—H47 | 119.0 |
C12—C11—H11 | 119.4 | C48—C47—H47 | 119.0 |
C13—C12—C11 | 120.1 (9) | C49—C48—C47 | 120.3 (8) |
C13—C12—H12 | 120.0 | C49—C48—H48 | 119.8 |
C11—C12—H12 | 120.0 | C47—C48—H48 | 119.8 |
C14—C13—C12 | 119.4 (10) | C50—C49—C48 | 118.6 (8) |
C14—C13—H13 | 120.3 | C50—C49—H49 | 120.7 |
C12—C13—H13 | 120.3 | C48—C49—H49 | 120.7 |
C13—C14—C15 | 120.1 (10) | C49—C50—C51 | 121.6 (8) |
C13—C14—H14 | 119.9 | C49—C50—H50 | 119.2 |
C15—C14—H14 | 119.9 | C51—C50—H50 | 119.2 |
C10—C15—C14 | 122.0 (8) | C46—C51—C50 | 120.3 (8) |
C10—C15—H15 | 119.0 | C46—C51—H51 | 119.9 |
C14—C15—H15 | 119.0 | C50—C51—H51 | 119.9 |
C17—C16—C21 | 116.6 (7) | C57—C52—C53 | 117.1 (9) |
C17—C16—Sn1 | 119.7 (6) | C57—C52—Sn3 | 123.1 (7) |
C21—C16—Sn1 | 123.7 (6) | C53—C52—Sn3 | 119.8 (7) |
C18—C17—C16 | 123.0 (8) | C52—C53—C54 | 122.4 (11) |
C18—C17—H17 | 118.5 | C52—C53—H53 | 118.8 |
C16—C17—H17 | 118.5 | C54—C53—H53 | 118.8 |
C19—C18—C17 | 118.9 (9) | C55—C54—C53 | 117.8 (14) |
C19—C18—H18 | 120.6 | C55—C54—H54 | 121.1 |
C17—C18—H18 | 120.6 | C53—C54—H54 | 121.1 |
C18—C19—C20 | 120.9 (9) | C54—C55—C56 | 123.0 (14) |
C18—C19—H19 | 119.5 | C54—C55—H55 | 118.5 |
C20—C19—H19 | 119.5 | C56—C55—H55 | 118.5 |
C19—C20—C21 | 119.2 (9) | C57—C56—C55 | 117.5 (13) |
C19—C20—H20 | 120.4 | C57—C56—H56 | 121.3 |
C21—C20—H20 | 120.4 | C55—C56—H56 | 121.3 |
C16—C21—C20 | 121.4 (8) | C56—C57—C52 | 122.2 (11) |
C16—C21—H21 | 119.3 | C56—C57—H57 | 118.9 |
C20—C21—H21 | 119.3 | C52—C57—H57 | 118.9 |
C27—C22—C23 | 118.3 (7) | C63—C58—C59 | 117.4 (8) |
C27—C22—Sn1 | 121.4 (6) | C63—C58—Sn3 | 122.1 (6) |
C23—C22—Sn1 | 120.2 (6) | C59—C58—Sn3 | 120.4 (6) |
C24—C23—C22 | 120.3 (8) | C58—C59—C60 | 120.7 (9) |
C24—C23—H23 | 119.8 | C58—C59—H59 | 119.6 |
C22—C23—H23 | 119.8 | C60—C59—H59 | 119.6 |
C25—C24—C23 | 120.6 (9) | C61—C60—C59 | 119.2 (10) |
C25—C24—H24 | 119.7 | C61—C60—H60 | 120.4 |
C23—C24—H24 | 119.7 | C59—C60—H60 | 120.4 |
C24—C25—C26 | 120.3 (9) | C62—C61—C60 | 121.9 (10) |
C24—C25—H25 | 119.8 | C62—C61—H61 | 119.0 |
C26—C25—H25 | 119.8 | C60—C61—H61 | 119.0 |
C27—C26—C25 | 119.8 (9) | C61—C62—C63 | 118.2 (9) |
C27—C26—H26 | 120.1 | C61—C62—H62 | 120.9 |
C25—C26—H26 | 120.1 | C63—C62—H62 | 120.9 |
C22—C27—C26 | 120.5 (8) | C58—C63—C62 | 122.6 (8) |
C22—C27—H27 | 119.7 | C58—C63—H63 | 118.7 |
C26—C27—H27 | 119.7 | C62—C63—H63 | 118.7 |
C33—C28—C29 | 117.0 (7) | Cl1—C64—Cl2 | 115.4 (10) |
C33—C28—Sn2 | 123.0 (6) | Cl1—C64—Cl3 | 112.8 (9) |
C29—C28—Sn2 | 120.0 (6) | Cl2—C64—Cl3 | 102.8 (10) |
C28—C29—C30 | 121.4 (8) | Cl1—C64—H64 | 108.5 |
C28—C29—H29 | 119.3 | Cl2—C64—H64 | 108.5 |
C30—C29—H29 | 119.3 | Cl3—C64—H64 | 108.5 |
C16—Sn1—O1—C1 | 176.3 (5) | C34—Sn2—C28—C33 | −69.7 (7) |
C10—Sn1—O1—C1 | −70.7 (5) | O3—Sn2—C28—C29 | −1.7 (7) |
C22—Sn1—O1—C1 | 60.7 (5) | C40—Sn2—C28—C29 | −113.8 (7) |
C40—Sn2—O3—C8 | −76.4 (5) | C34—Sn2—C28—C29 | 111.0 (7) |
C34—Sn2—O3—C8 | 55.0 (5) | C33—C28—C29—C30 | 1.3 (13) |
C28—Sn2—O3—C8 | 168.6 (5) | Sn2—C28—C29—C30 | −179.4 (7) |
C52—Sn3—O5—C9 | 64.5 (5) | C28—C29—C30—C31 | −0.5 (14) |
C58—Sn3—O5—C9 | −65.7 (5) | C29—C30—C31—C32 | −0.7 (15) |
C46—Sn3—O5—C9 | −179.6 (5) | C30—C31—C32—C33 | 1.1 (16) |
Sn1—O1—C1—O2 | 5.3 (9) | C31—C32—C33—C28 | −0.2 (15) |
Sn1—O1—C1—C2 | −173.8 (5) | C29—C28—C33—C32 | −1.0 (13) |
O2—C1—C2—C3 | 173.6 (7) | Sn2—C28—C33—C32 | 179.7 (7) |
O1—C1—C2—C3 | −7.2 (10) | O3—Sn2—C34—C35 | 95.2 (6) |
O2—C1—C2—C7 | −8.0 (11) | C40—Sn2—C34—C35 | −139.3 (6) |
O1—C1—C2—C7 | 171.2 (6) | C28—Sn2—C34—C35 | −7.7 (7) |
C7—C2—C3—C4 | −2.4 (10) | O3—Sn2—C34—C39 | −84.1 (7) |
C1—C2—C3—C4 | 176.0 (6) | C40—Sn2—C34—C39 | 41.5 (7) |
C2—C3—C4—C5 | 0.5 (10) | C28—Sn2—C34—C39 | 173.0 (6) |
C2—C3—C4—C8 | −178.4 (6) | C39—C34—C35—C36 | 1.6 (13) |
C3—C4—C5—C6 | 2.9 (10) | Sn2—C34—C35—C36 | −177.7 (8) |
C8—C4—C5—C6 | −178.1 (6) | C34—C35—C36—C37 | −1.8 (17) |
C4—C5—C6—C7 | −4.5 (10) | C35—C36—C37—C38 | 1.9 (19) |
C4—C5—C6—C9 | 176.7 (6) | C36—C37—C38—C39 | −1.8 (16) |
C5—C6—C7—C2 | 2.7 (11) | C35—C34—C39—C38 | −1.5 (12) |
C9—C6—C7—C2 | −178.6 (7) | Sn2—C34—C39—C38 | 177.7 (6) |
C3—C2—C7—C6 | 0.7 (10) | C37—C38—C39—C34 | 1.6 (13) |
C1—C2—C7—C6 | −177.7 (6) | O3—Sn2—C40—C41 | −106.1 (6) |
Sn2—O3—C8—O4 | 5.0 (9) | C34—Sn2—C40—C41 | 127.9 (6) |
Sn2—O3—C8—C4 | −174.6 (4) | C28—Sn2—C40—C41 | −3.0 (6) |
C5—C4—C8—O4 | −27.4 (10) | O3—Sn2—C40—C45 | 73.3 (6) |
C3—C4—C8—O4 | 151.6 (7) | C34—Sn2—C40—C45 | −52.7 (7) |
C5—C4—C8—O3 | 152.2 (6) | C28—Sn2—C40—C45 | 176.4 (6) |
C3—C4—C8—O3 | −28.8 (9) | C45—C40—C41—C42 | 0.3 (12) |
Sn3—O5—C9—O6 | 1.6 (9) | Sn2—C40—C41—C42 | 179.7 (6) |
Sn3—O5—C9—C6 | 179.2 (5) | C40—C41—C42—C43 | −0.5 (13) |
C7—C6—C9—O6 | −177.1 (7) | C41—C42—C43—C44 | 0.0 (13) |
C5—C6—C9—O6 | 1.6 (12) | C42—C43—C44—C45 | 0.8 (13) |
C7—C6—C9—O5 | 5.3 (11) | C43—C44—C45—C40 | −1.1 (13) |
C5—C6—C9—O5 | −175.9 (6) | C41—C40—C45—C44 | 0.5 (11) |
O1—Sn1—C10—C11 | −120.1 (6) | Sn2—C40—C45—C44 | −178.9 (6) |
C16—Sn1—C10—C11 | −15.6 (7) | O5—Sn3—C46—C51 | 170.0 (7) |
C22—Sn1—C10—C11 | 111.9 (6) | C52—Sn3—C46—C51 | −76.9 (8) |
O1—Sn1—C10—C15 | 64.8 (7) | C58—Sn3—C46—C51 | 54.5 (8) |
C16—Sn1—C10—C15 | 169.3 (7) | O5—Sn3—C46—C47 | −8.6 (7) |
C22—Sn1—C10—C15 | −63.2 (8) | C52—Sn3—C46—C47 | 104.5 (7) |
C15—C10—C11—C12 | −2.9 (12) | C58—Sn3—C46—C47 | −124.1 (7) |
Sn1—C10—C11—C12 | −178.4 (7) | C51—C46—C47—C48 | −0.2 (14) |
C10—C11—C12—C13 | 3.3 (15) | Sn3—C46—C47—C48 | 178.4 (7) |
C11—C12—C13—C14 | −2.4 (17) | C46—C47—C48—C49 | 0.4 (15) |
C12—C13—C14—C15 | 1.3 (17) | C47—C48—C49—C50 | 0.0 (16) |
C11—C10—C15—C14 | 1.8 (13) | C48—C49—C50—C51 | −0.5 (18) |
Sn1—C10—C15—C14 | 177.0 (7) | C47—C46—C51—C50 | −0.3 (15) |
C13—C14—C15—C10 | −1.0 (16) | Sn3—C46—C51—C50 | −179.0 (8) |
O1—Sn1—C16—C17 | −176.4 (6) | C49—C50—C51—C46 | 0.7 (18) |
C10—Sn1—C16—C17 | 68.0 (7) | O5—Sn3—C52—C57 | −78.1 (6) |
C22—Sn1—C16—C17 | −62.2 (7) | C58—Sn3—C52—C57 | 49.2 (7) |
O1—Sn1—C16—C21 | 7.5 (7) | C46—Sn3—C52—C57 | 176.9 (6) |
C10—Sn1—C16—C21 | −108.1 (7) | O5—Sn3—C52—C53 | 103.0 (6) |
C22—Sn1—C16—C21 | 121.7 (6) | C58—Sn3—C52—C53 | −129.7 (6) |
C21—C16—C17—C18 | 0.7 (13) | C46—Sn3—C52—C53 | −2.0 (7) |
Sn1—C16—C17—C18 | −175.7 (7) | C57—C52—C53—C54 | −0.6 (13) |
C16—C17—C18—C19 | 0.3 (15) | Sn3—C52—C53—C54 | 178.3 (7) |
C17—C18—C19—C20 | −1.7 (15) | C52—C53—C54—C55 | 1.2 (17) |
C18—C19—C20—C21 | 2.1 (15) | C53—C54—C55—C56 | −2 (2) |
C17—C16—C21—C20 | −0.2 (12) | C54—C55—C56—C57 | 3 (2) |
Sn1—C16—C21—C20 | 176.0 (6) | C55—C56—C57—C52 | −2.3 (15) |
C19—C20—C21—C16 | −1.1 (14) | C53—C52—C57—C56 | 1.2 (12) |
O1—Sn1—C22—C27 | 88.9 (6) | Sn3—C52—C57—C56 | −177.7 (7) |
C16—Sn1—C22—C27 | −16.1 (7) | O5—Sn3—C58—C63 | 95.3 (6) |
C10—Sn1—C22—C27 | −142.2 (6) | C52—Sn3—C58—C63 | −30.7 (7) |
O1—Sn1—C22—C23 | −95.5 (6) | C46—Sn3—C58—C63 | −159.6 (6) |
C16—Sn1—C22—C23 | 159.5 (5) | O5—Sn3—C58—C59 | −89.4 (7) |
C10—Sn1—C22—C23 | 33.4 (6) | C52—Sn3—C58—C59 | 144.7 (6) |
C27—C22—C23—C24 | 1.2 (11) | C46—Sn3—C58—C59 | 15.8 (7) |
Sn1—C22—C23—C24 | −174.6 (6) | C63—C58—C59—C60 | −0.1 (13) |
C22—C23—C24—C25 | −2.5 (13) | Sn3—C58—C59—C60 | −175.7 (7) |
C23—C24—C25—C26 | 2.8 (14) | C58—C59—C60—C61 | 0.3 (15) |
C24—C25—C26—C27 | −1.7 (14) | C59—C60—C61—C62 | −0.2 (17) |
C23—C22—C27—C26 | −0.1 (11) | C60—C61—C62—C63 | −0.2 (16) |
Sn1—C22—C27—C26 | 175.6 (6) | C59—C58—C63—C62 | −0.3 (13) |
C25—C26—C27—C22 | 0.4 (12) | Sn3—C58—C63—C62 | 175.2 (7) |
O3—Sn2—C28—C33 | 177.6 (7) | C61—C62—C63—C58 | 0.4 (15) |
C40—Sn2—C28—C33 | 65.5 (7) |