| Literature DB >> 21754329 |
Stefanie Gaertner1, Nikolaus Korber.
Abstract
The crystal structure of the title compound, poly[[(4,7,13,16,21,24-hexa-oxa-1,10-diaza-bicyclo-[8.8.8]hexa-cosa-ne)rubidium] [[(1,4,7,10,13,16-hexa-oxacyclo-octa-deca-ne)rubidium]di-μ-rubidium-μ-nona-stannide] penta-ammonia], {[Rb(C(18)H(36)N(2)O(6))][Rb(3)Sn(9)(C(12)H(24)O(6))C(12)H(24)O(6))]·5NH(3)}(n) represents the first ammoniate of a Zintl anion together with two different chelating substances, namely 18-crown-6 and [2.2.2]-cryptand. The involvement of these large mol-ecules in the crystal structure of [Rb(18-crown-6)][Rb([2.2.2]-cryptand)]Rb(2)Sn(9)·5NH(3) leads to the formation of a new structural motif, namely one-dimensionally extended double strands running parallel to [100] and built by Sn(9) (4-) cages and Rb(+) cations. The double strands are shielded by 18-crown-6 and [2.2.2]-cryptand. The cations are additionally coordin-ated by ammonia mol-ecules. One of the four independent Rb(+) cations is disordered over two sets of sites in a 0.74 (2):0.26 (2) ratio.Entities:
Year: 2011 PMID: 21754329 PMCID: PMC3089245 DOI: 10.1107/S1600536811013997
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Rb(C12H24O6)][Rb3Sn9(C18H36N2O6)]·5NH3 | |
| Monoclinic, | Mo |
| Cell parameters from 11435 reflections | |
| θ = 2.1–25.5° | |
| µ = 6.75 mm−1 | |
| β = 91.20 (3)° | |
| Rod, dark red | |
| 0.25 × 0.2 × 0.15 mm |
| Stoe IPDS diffractometer | 11435 independent reflections |
| Radiation source: fine-focus sealed tube | 7473 reflections with |
| graphite | |
| rotation scans | θmax = 25.5°, θmin = 2.1° |
| Absorption correction: analytical ( | |
| 36425 measured reflections |
| Refinement on | Primary atom site location: structure-invariant direct methods |
| Least-squares matrix: full | Secondary atom site location: difference Fourier map |
| Hydrogen site location: inferred from neighbouring sites | |
| H-atom parameters constrained | |
| 11435 reflections | (Δ/σ)max = 0.001 |
| 608 parameters | Δρmax = 2.77 e Å−3 |
| 0 restraints | Δρmin = −1.18 e Å−3 |
| Experimental. crystal mounting in perfluorether (T. Kottke, D. Stalke, J. Appl. Crystallogr. 26, 1993, p. 615) |
| 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 |
| Occ. (<1) | |||||
| Sn1 | 0.86100 (7) | 0.23615 (4) | 0.907589 (19) | 0.04003 (16) | |
| Sn2 | 0.98667 (7) | 0.39369 (5) | 0.931424 (17) | 0.03899 (16) | |
| Sn3 | 1.02254 (6) | 0.31609 (4) | 0.854533 (17) | 0.03508 (15) | |
| Sn4 | 0.71369 (7) | 0.30366 (4) | 0.846330 (18) | 0.03923 (16) | |
| Sn5 | 0.69254 (6) | 0.37991 (5) | 0.923721 (18) | 0.04106 (17) | |
| Sn6 | 1.03304 (7) | 0.50482 (4) | 0.86702 (2) | 0.04262 (17) | |
| Sn7 | 0.87119 (7) | 0.43216 (5) | 0.809921 (18) | 0.04261 (17) | |
| Sn8 | 0.66698 (7) | 0.48901 (5) | 0.856306 (19) | 0.04374 (18) | |
| Sn9 | 0.82933 (7) | 0.54589 (5) | 0.91672 (2) | 0.04456 (18) | |
| Rb10 | 0.57160 (8) | 0.40171 (5) | 0.75840 (2) | 0.03225 (19) | |
| Rb11 | 0.66434 (8) | 0.09245 (5) | 0.09496 (2) | 0.03070 (18) | |
| Rb12 | 0.81415 (13) | 0.45056 (9) | 0.01874 (3) | 0.0625 (3) | |
| O1 | 0.5633 (6) | 0.2576 (4) | 0.11449 (18) | 0.0402 (15) | |
| O2 | 0.4199 (6) | 0.2343 (4) | 0.74399 (16) | 0.0358 (14) | |
| O3 | 0.6819 (6) | −0.0751 (4) | 0.12707 (17) | 0.0351 (14) | |
| O4 | 0.3954 (7) | 0.5552 (4) | 0.74943 (18) | 0.0398 (15) | |
| O5 | 0.6400 (7) | 0.5615 (4) | 0.72603 (18) | 0.0428 (16) | |
| O6 | 0.7426 (6) | 0.4148 (4) | 0.69534 (18) | 0.0380 (15) | |
| O7 | 0.3089 (6) | 0.3882 (4) | 0.7689 (2) | 0.0423 (16) | |
| O8 | 0.8881 (6) | 0.0870 (4) | 0.05216 (17) | 0.0380 (15) | |
| O9 | 0.7691 (6) | 0.1897 (4) | 0.15412 (19) | 0.0422 (16) | |
| O10 | 0.4441 (6) | −0.0106 (4) | 0.10348 (18) | 0.0350 (14) | |
| O11 | 0.6481 (7) | 0.1129 (4) | 0.01641 (17) | 0.0395 (15) | |
| O12 | 0.6651 (7) | 0.2526 (4) | 0.72188 (18) | 0.0429 (16) | |
| N1 | 0.4241 (8) | 0.1494 (5) | 0.0601 (2) | 0.0351 (17) | |
| N2 | 0.9076 (7) | 0.0352 (5) | 0.1296 (2) | 0.0353 (17) | |
| N3 | 0.8485 (13) | 0.2982 (8) | 0.0671 (3) | 0.077 (3) | |
| H3C | 0.9034 | 0.3114 | 0.0853 | 0.115* | |
| H3D | 0.8781 | 0.2535 | 0.0541 | 0.115* | |
| H3E | 0.7744 | 0.2835 | 0.0767 | 0.115* | |
| N4 | 0.7481 (11) | 0.7826 (7) | 0.0683 (3) | 0.068 (3) | |
| H4C | 0.7062 | 0.8276 | 0.0779 | 0.102* | |
| H4D | 0.7343 | 0.7810 | 0.0439 | 0.102* | |
| H4E | 0.8307 | 0.7889 | 0.0731 | 0.102* | |
| N5 | 0.8929 (11) | 0.7596 (9) | −0.0120 (3) | 0.076 (3) | |
| N6 | 0.5861 (13) | 0.4400 (7) | 0.0693 (4) | 0.085 (4) | |
| H6C | 0.6234 | 0.3966 | 0.0818 | 0.127* | |
| H6D | 0.5582 | 0.4200 | 0.0474 | 0.127* | |
| H6E | 0.5211 | 0.4604 | 0.0820 | 0.127* | |
| N7 | 0.6387 (13) | 0.6110 (8) | 0.0138 (3) | 0.080 (4) | |
| H7C | 0.5573 | 0.5956 | 0.0138 | 0.121* | |
| H7D | 0.6738 | 0.5923 | −0.0070 | 0.121* | |
| H7E | 0.6449 | 0.6691 | 0.0151 | 0.121* | |
| C1 | 0.8604 (10) | 0.0730 (7) | 0.0140 (3) | 0.043 (2) | |
| H1A | 0.8298 | 0.0138 | 0.0103 | 0.052* | |
| H1B | 0.9366 | 0.0804 | −0.0001 | 0.052* | |
| C2 | 0.9754 (10) | 0.0273 (7) | 0.0661 (3) | 0.044 (2) | |
| H2A | 1.0512 | 0.0286 | 0.0514 | 0.053* | |
| H2B | 0.9403 | −0.0313 | 0.0648 | 0.053* | |
| C3 | 0.4776 (11) | 0.6220 (6) | 0.7593 (3) | 0.045 (3) | |
| H3A | 0.5229 | 0.6066 | 0.7820 | 0.055* | |
| H3B | 0.4301 | 0.6752 | 0.7638 | 0.055* | |
| C4 | 0.7647 (9) | 0.1352 (7) | 0.0014 (2) | 0.037 (2) | |
| H4A | 0.7886 | 0.1938 | 0.0091 | 0.045* | |
| H4B | 0.7582 | 0.1343 | −0.0253 | 0.045* | |
| C5 | 0.7776 (9) | −0.0840 (7) | 0.1535 (3) | 0.042 (2) | |
| H5A | 0.7834 | −0.1446 | 0.1612 | 0.050* | |
| H5B | 0.7581 | −0.0489 | 0.1749 | 0.050* | |
| C6 | 0.5676 (11) | 0.6370 (7) | 0.7299 (3) | 0.048 (3) | |
| H6A | 0.5227 | 0.6500 | 0.7070 | 0.058* | |
| H6B | 0.6218 | 0.6862 | 0.7362 | 0.058* | |
| C7 | 0.2302 (9) | 0.4614 (7) | 0.7664 (3) | 0.042 (2) | |
| H7A | 0.1600 | 0.4551 | 0.7830 | 0.050* | |
| H7B | 0.1965 | 0.4673 | 0.7414 | 0.050* | |
| C8 | 0.3563 (9) | 0.0031 (7) | 0.0747 (3) | 0.043 (2) | |
| H8A | 0.2810 | −0.0315 | 0.0788 | 0.051* | |
| H8B | 0.3921 | −0.0150 | 0.0514 | 0.051* | |
| C9 | 0.3235 (9) | 0.0957 (7) | 0.0731 (3) | 0.042 (2) | |
| H9A | 0.2500 | 0.1032 | 0.0569 | 0.050* | |
| H9B | 0.3007 | 0.1152 | 0.0976 | 0.050* | |
| C10 | 0.4330 (10) | 0.2605 (7) | 0.1088 (2) | 0.039 (2) | |
| H10A | 0.4016 | 0.3183 | 0.1148 | 0.047* | |
| H10B | 0.3926 | 0.2185 | 0.1248 | 0.047* | |
| C11 | 0.3289 (10) | 0.2381 (7) | 0.7713 (3) | 0.042 (2) | |
| H11A | 0.3695 | 0.2472 | 0.7953 | 0.051* | |
| H11B | 0.2823 | 0.1835 | 0.7720 | 0.051* | |
| C12 | 0.5558 (10) | 0.1729 (7) | 0.0061 (3) | 0.043 (2) | |
| H12A | 0.5516 | 0.1780 | −0.0206 | 0.052* | |
| H12B | 0.5764 | 0.2299 | 0.0163 | 0.052* | |
| C13 | 0.5999 (10) | 0.2839 (7) | 0.1511 (3) | 0.044 (2) | |
| H13A | 0.5563 | 0.2479 | 0.1688 | 0.053* | |
| H13B | 0.5752 | 0.3443 | 0.1550 | 0.053* | |
| C14 | 0.4731 (10) | −0.0986 (6) | 0.1086 (3) | 0.046 (3) | |
| H14A | 0.5045 | −0.1228 | 0.0858 | 0.055* | |
| H14B | 0.3971 | −0.1303 | 0.1149 | 0.055* | |
| C15 | 0.2431 (9) | 0.3100 (7) | 0.7630 (3) | 0.040 (2) | |
| H15A | 0.2135 | 0.3065 | 0.7375 | 0.048* | |
| H15B | 0.1703 | 0.3074 | 0.7788 | 0.048* | |
| C16 | 0.7234 (10) | 0.5677 (7) | 0.6960 (3) | 0.041 (2) | |
| H16A | 0.7707 | 0.6220 | 0.6973 | 0.050* | |
| H16B | 0.6759 | 0.5665 | 0.6728 | 0.050* | |
| C17 | 0.7518 (10) | 0.2623 (7) | 0.6930 (3) | 0.046 (3) | |
| H17A | 0.7067 | 0.2642 | 0.6694 | 0.055* | |
| H17B | 0.8093 | 0.2129 | 0.6928 | 0.055* | |
| C18 | 0.7343 (10) | 0.2755 (7) | 0.1571 (3) | 0.042 (2) | |
| H18A | 0.7784 | 0.3102 | 0.1390 | 0.050* | |
| H18B | 0.7575 | 0.2973 | 0.1814 | 0.050* | |
| C19 | 0.5680 (10) | −0.1097 (6) | 0.1379 (3) | 0.044 (2) | |
| H19A | 0.5406 | −0.0804 | 0.1601 | 0.053* | |
| H19B | 0.5783 | −0.1714 | 0.1434 | 0.053* | |
| C20 | 0.4024 (12) | 0.2398 (7) | 0.0699 (3) | 0.052 (3) | |
| H20A | 0.3141 | 0.2538 | 0.0649 | 0.062* | |
| H20B | 0.4529 | 0.2768 | 0.0542 | 0.062* | |
| C21 | 1.0067 (9) | 0.0497 (7) | 0.1044 (3) | 0.042 (2) | |
| H21A | 1.0798 | 0.0157 | 0.1123 | 0.050* | |
| H21B | 1.0305 | 0.1110 | 0.1054 | 0.050* | |
| C22 | 0.5137 (10) | 0.1715 (6) | 0.7512 (3) | 0.043 (2) | |
| H22A | 0.4756 | 0.1140 | 0.7531 | 0.052* | |
| H22B | 0.5572 | 0.1846 | 0.7744 | 0.052* | |
| C23 | 0.8992 (9) | 0.1786 (7) | 0.1595 (3) | 0.045 (3) | |
| H23A | 0.9272 | 0.2097 | 0.1816 | 0.054* | |
| H23B | 0.9438 | 0.2024 | 0.1387 | 0.054* | |
| C24 | 0.8224 (10) | 0.3427 (7) | 0.6986 (3) | 0.044 (2) | |
| H24A | 0.8624 | 0.3423 | 0.7229 | 0.052* | |
| H24B | 0.8883 | 0.3467 | 0.6804 | 0.052* | |
| C25 | 0.9278 (9) | 0.0843 (7) | 0.1635 (3) | 0.044 (2) | |
| H25A | 1.0153 | 0.0775 | 0.1716 | 0.053* | |
| H25B | 0.8749 | 0.0598 | 0.1825 | 0.053* | |
| C26 | 0.3043 (10) | 0.5380 (7) | 0.7763 (3) | 0.044 (2) | |
| H26A | 0.2488 | 0.5881 | 0.7786 | 0.053* | |
| H26B | 0.3462 | 0.5285 | 0.8001 | 0.053* | |
| C27 | 0.4310 (10) | 0.1429 (7) | 0.0200 (3) | 0.045 (2) | |
| H27A | 0.3642 | 0.1780 | 0.0088 | 0.055* | |
| H27B | 0.4172 | 0.0825 | 0.0127 | 0.055* | |
| C28 | 0.8094 (9) | 0.4932 (6) | 0.6982 (3) | 0.040 (2) | |
| H28A | 0.8698 | 0.4968 | 0.6785 | 0.048* | |
| H28B | 0.8560 | 0.4948 | 0.7216 | 0.048* | |
| C29 | 0.8976 (9) | −0.0564 (7) | 0.1388 (3) | 0.042 (2) | |
| H29A | 0.9637 | −0.0705 | 0.1568 | 0.050* | |
| H29B | 0.9135 | −0.0903 | 0.1168 | 0.050* | |
| C30 | 0.6027 (10) | 0.1724 (6) | 0.7214 (3) | 0.044 (2) | |
| H30A | 0.6632 | 0.1252 | 0.7245 | 0.053* | |
| H30B | 0.5583 | 0.1645 | 0.6979 | 0.053* | |
| Rb13 | 0.6569 (4) | 0.6145 (3) | 0.10223 (8) | 0.0558 (12) | 0.74 (2) |
| Rb14 | 0.6416 (11) | 0.6289 (8) | 0.1185 (15) | 0.130 (9) | 0.26 (2) |
| Sn1 | 0.0417 (4) | 0.0373 (4) | 0.0413 (4) | 0.0003 (3) | 0.0037 (3) | 0.0097 (3) |
| Sn2 | 0.0417 (4) | 0.0457 (4) | 0.0294 (3) | 0.0058 (3) | −0.0039 (3) | −0.0026 (3) |
| Sn3 | 0.0406 (4) | 0.0334 (3) | 0.0314 (3) | 0.0037 (3) | 0.0060 (3) | 0.0004 (3) |
| Sn4 | 0.0514 (4) | 0.0332 (3) | 0.0328 (3) | −0.0058 (3) | −0.0047 (3) | 0.0010 (3) |
| Sn5 | 0.0360 (4) | 0.0540 (4) | 0.0335 (3) | 0.0033 (3) | 0.0056 (3) | −0.0003 (3) |
| Sn6 | 0.0515 (4) | 0.0342 (3) | 0.0423 (4) | −0.0078 (3) | 0.0037 (3) | −0.0009 (3) |
| Sn7 | 0.0376 (4) | 0.0585 (4) | 0.0316 (3) | −0.0021 (3) | −0.0013 (3) | 0.0103 (3) |
| Sn8 | 0.0518 (4) | 0.0409 (4) | 0.0381 (4) | 0.0132 (3) | −0.0079 (3) | −0.0045 (3) |
| Sn9 | 0.0474 (4) | 0.0405 (4) | 0.0456 (4) | 0.0082 (3) | −0.0046 (3) | −0.0126 (3) |
| Rb10 | 0.0341 (5) | 0.0319 (4) | 0.0307 (4) | 0.0001 (3) | 0.0001 (3) | 0.0001 (3) |
| Rb11 | 0.0337 (5) | 0.0319 (4) | 0.0266 (4) | 0.0006 (3) | 0.0018 (3) | −0.0005 (3) |
| Rb12 | 0.0672 (8) | 0.0778 (8) | 0.0427 (6) | −0.0158 (6) | 0.0066 (5) | 0.0015 (6) |
| O1 | 0.039 (4) | 0.044 (4) | 0.038 (4) | 0.001 (3) | 0.007 (3) | −0.002 (3) |
| O2 | 0.040 (4) | 0.038 (3) | 0.029 (3) | 0.007 (3) | 0.000 (3) | 0.008 (3) |
| O3 | 0.027 (3) | 0.045 (4) | 0.033 (3) | 0.007 (3) | 0.000 (3) | 0.006 (3) |
| O4 | 0.050 (4) | 0.033 (3) | 0.036 (4) | −0.003 (3) | 0.000 (3) | −0.003 (3) |
| O5 | 0.052 (4) | 0.038 (4) | 0.038 (4) | 0.002 (3) | 0.008 (3) | 0.001 (3) |
| O6 | 0.033 (3) | 0.044 (4) | 0.037 (4) | −0.004 (3) | 0.005 (3) | −0.001 (3) |
| O7 | 0.037 (4) | 0.035 (4) | 0.055 (4) | −0.002 (3) | 0.008 (3) | −0.008 (3) |
| O8 | 0.039 (4) | 0.049 (4) | 0.026 (3) | 0.004 (3) | 0.001 (3) | −0.006 (3) |
| O9 | 0.041 (4) | 0.045 (4) | 0.042 (4) | −0.005 (3) | 0.003 (3) | −0.015 (3) |
| O10 | 0.028 (3) | 0.036 (3) | 0.041 (4) | 0.001 (3) | 0.000 (3) | 0.003 (3) |
| O11 | 0.049 (4) | 0.042 (4) | 0.027 (3) | −0.002 (3) | 0.002 (3) | 0.004 (3) |
| O12 | 0.055 (4) | 0.032 (4) | 0.042 (4) | −0.002 (3) | 0.010 (3) | −0.004 (3) |
| N1 | 0.042 (5) | 0.037 (4) | 0.027 (4) | 0.005 (3) | −0.001 (3) | 0.001 (3) |
| N2 | 0.030 (4) | 0.047 (5) | 0.028 (4) | 0.003 (3) | −0.005 (3) | −0.001 (3) |
| N3 | 0.101 (9) | 0.082 (8) | 0.047 (6) | −0.004 (7) | −0.002 (6) | −0.017 (6) |
| N4 | 0.063 (7) | 0.072 (7) | 0.068 (7) | 0.018 (6) | −0.014 (5) | −0.019 (6) |
| N5 | 0.058 (7) | 0.110 (10) | 0.061 (7) | 0.032 (7) | 0.007 (5) | 0.014 (7) |
| N6 | 0.095 (10) | 0.055 (7) | 0.107 (10) | −0.005 (6) | 0.041 (8) | −0.005 (7) |
| N7 | 0.085 (9) | 0.081 (8) | 0.076 (8) | 0.012 (7) | 0.019 (7) | 0.011 (7) |
| C1 | 0.043 (6) | 0.055 (6) | 0.031 (5) | −0.008 (5) | 0.010 (4) | −0.014 (4) |
| C2 | 0.044 (6) | 0.052 (6) | 0.037 (5) | 0.004 (5) | 0.006 (4) | −0.004 (5) |
| C3 | 0.065 (7) | 0.031 (5) | 0.040 (5) | 0.000 (5) | −0.014 (5) | −0.007 (4) |
| C4 | 0.030 (5) | 0.060 (6) | 0.022 (4) | −0.004 (4) | −0.002 (4) | −0.005 (4) |
| C5 | 0.032 (5) | 0.048 (6) | 0.045 (6) | 0.008 (4) | −0.002 (4) | 0.015 (5) |
| C6 | 0.070 (8) | 0.033 (5) | 0.041 (6) | −0.002 (5) | −0.013 (5) | −0.003 (4) |
| C7 | 0.035 (5) | 0.050 (6) | 0.041 (5) | 0.007 (4) | 0.000 (4) | −0.011 (5) |
| C8 | 0.032 (5) | 0.054 (6) | 0.041 (5) | −0.006 (4) | −0.012 (4) | 0.005 (5) |
| C9 | 0.031 (5) | 0.051 (6) | 0.041 (5) | −0.001 (4) | −0.006 (4) | 0.003 (5) |
| C10 | 0.044 (6) | 0.044 (5) | 0.029 (5) | 0.011 (4) | 0.003 (4) | 0.000 (4) |
| C11 | 0.041 (6) | 0.053 (6) | 0.033 (5) | −0.007 (5) | 0.002 (4) | 0.003 (4) |
| C12 | 0.056 (7) | 0.046 (6) | 0.026 (5) | 0.006 (5) | 0.000 (4) | 0.003 (4) |
| C13 | 0.052 (6) | 0.046 (6) | 0.035 (5) | −0.001 (5) | 0.008 (5) | −0.014 (4) |
| C14 | 0.037 (6) | 0.031 (5) | 0.070 (7) | −0.002 (4) | −0.010 (5) | 0.006 (5) |
| C15 | 0.035 (5) | 0.049 (6) | 0.037 (5) | −0.010 (4) | 0.011 (4) | −0.007 (4) |
| C16 | 0.051 (6) | 0.041 (5) | 0.032 (5) | −0.011 (5) | 0.003 (4) | 0.004 (4) |
| C17 | 0.049 (6) | 0.047 (6) | 0.043 (6) | 0.015 (5) | 0.016 (5) | −0.012 (5) |
| C18 | 0.049 (6) | 0.042 (6) | 0.034 (5) | −0.008 (5) | 0.002 (4) | −0.010 (4) |
| C19 | 0.045 (6) | 0.035 (5) | 0.052 (6) | −0.001 (4) | 0.016 (5) | 0.012 (5) |
| C20 | 0.069 (8) | 0.042 (6) | 0.045 (6) | 0.016 (5) | 0.014 (5) | 0.003 (5) |
| C21 | 0.031 (5) | 0.063 (7) | 0.030 (5) | 0.005 (5) | −0.001 (4) | −0.008 (4) |
| C22 | 0.050 (6) | 0.039 (5) | 0.040 (5) | −0.005 (4) | −0.008 (5) | 0.003 (4) |
| C23 | 0.033 (5) | 0.063 (7) | 0.039 (5) | −0.015 (5) | 0.003 (4) | −0.012 (5) |
| C24 | 0.041 (6) | 0.053 (6) | 0.036 (5) | 0.004 (5) | 0.002 (4) | −0.008 (4) |
| C25 | 0.026 (5) | 0.072 (7) | 0.034 (5) | −0.007 (5) | −0.002 (4) | −0.007 (5) |
| C26 | 0.054 (7) | 0.047 (6) | 0.031 (5) | 0.017 (5) | 0.003 (4) | −0.005 (4) |
| C27 | 0.051 (6) | 0.050 (6) | 0.035 (5) | 0.014 (5) | −0.003 (5) | 0.000 (5) |
| C28 | 0.038 (5) | 0.044 (6) | 0.038 (5) | −0.012 (4) | 0.002 (4) | 0.004 (4) |
| C29 | 0.031 (5) | 0.057 (6) | 0.037 (5) | 0.015 (4) | −0.006 (4) | 0.009 (5) |
| C30 | 0.049 (6) | 0.034 (5) | 0.049 (6) | 0.002 (4) | −0.015 (5) | −0.004 (4) |
| Rb13 | 0.0371 (13) | 0.0645 (18) | 0.066 (2) | −0.0003 (10) | −0.0051 (8) | −0.0027 (10) |
| Rb14 | 0.035 (4) | 0.075 (5) | 0.28 (3) | 0.011 (3) | −0.002 (9) | −0.026 (10) |
| Sn1—Sn3 | 2.9295 (12) | N6—H6C | 0.9100 |
| Sn1—Sn2 | 2.9334 (11) | N6—H6D | 0.9100 |
| Sn1—Sn4 | 2.9344 (12) | N6—H6E | 0.9100 |
| Sn1—Sn5 | 2.9553 (11) | N7—H7C | 0.9100 |
| Sn2—Sn9 | 2.9623 (11) | N7—H7D | 0.9100 |
| Sn2—Sn6 | 2.9954 (11) | N7—H7E | 0.9100 |
| Sn2—Sn3 | 3.1206 (11) | C1—C4 | 1.484 (15) |
| Sn2—Sn5 | 3.1877 (12) | C1—H1A | 0.9900 |
| Sn2—Rb12i | 3.7080 (16) | C1—H1B | 0.9900 |
| Sn2—Rb12ii | 3.8625 (17) | C2—C21 | 1.490 (13) |
| Sn2—Rb13i | 4.069 (5) | C2—H2A | 0.9900 |
| Sn3—Sn7 | 2.9243 (11) | C2—H2B | 0.9900 |
| Sn3—Sn6 | 2.9819 (11) | C3—C6 | 1.491 (17) |
| Sn3—Rb14i | 3.835 (16) | C3—H3A | 0.9900 |
| Sn3—Rb13i | 3.932 (3) | C3—H3B | 0.9900 |
| Sn4—Sn8 | 2.9594 (11) | C4—H4A | 0.9900 |
| Sn4—Sn7 | 2.9687 (11) | C4—H4B | 0.9900 |
| Sn4—Sn5 | 3.1106 (11) | C5—C29 | 1.478 (14) |
| Sn4—Rb10 | 3.8784 (14) | C5—H5A | 0.9900 |
| Sn4—Rb14iii | 4.21 (2) | C5—H5B | 0.9900 |
| Sn5—Sn9 | 2.9942 (12) | C6—H6A | 0.9900 |
| Sn5—Sn8 | 3.0252 (11) | C6—H6B | 0.9900 |
| Sn5—Rb13iii | 3.872 (4) | C7—C26 | 1.479 (15) |
| Sn5—Rb12ii | 3.8829 (17) | C7—H7A | 0.9900 |
| Sn5—Rb14iii | 3.90 (2) | C7—H7B | 0.9900 |
| Sn6—Sn7 | 2.9382 (13) | C8—C9 | 1.489 (15) |
| Sn6—Sn9 | 2.9642 (14) | C8—H8A | 0.9900 |
| Sn6—Sn8 | 3.9689 (14) | C8—H8B | 0.9900 |
| Sn6—Rb13i | 3.974 (5) | C9—H9A | 0.9900 |
| Sn6—Rb14i | 4.109 (11) | C9—H9B | 0.9900 |
| Sn7—Sn8 | 2.9561 (13) | C10—C20 | 1.503 (15) |
| Sn7—Rb10 | 3.7474 (15) | C10—H10A | 0.9900 |
| Sn8—Rb14iii | 3.93 (2) | C10—H10B | 0.9900 |
| Sn8—Rb10 | 3.9814 (14) | C11—C15 | 1.483 (15) |
| Sn8—Rb13iii | 4.171 (4) | C11—H11A | 0.9900 |
| Sn9—Rb12ii | 4.0597 (16) | C11—H11B | 0.9900 |
| Rb10—O5 | 2.869 (7) | C12—C27 | 1.525 (16) |
| Rb10—O7 | 2.876 (7) | C12—H12A | 0.9900 |
| Rb10—O12 | 2.882 (7) | C12—H12B | 0.9900 |
| Rb10—O6 | 3.010 (6) | C13—C18 | 1.467 (15) |
| Rb10—O4 | 3.071 (7) | C13—H13A | 0.9900 |
| Rb10—O2 | 3.122 (7) | C13—H13B | 0.9900 |
| Rb11—O9 | 2.873 (7) | C14—C19 | 1.483 (15) |
| Rb11—O3 | 2.875 (6) | C14—H14A | 0.9900 |
| Rb11—O10 | 2.891 (6) | C14—H14B | 0.9900 |
| Rb11—O1 | 2.896 (7) | C15—H15A | 0.9900 |
| Rb11—O8 | 2.915 (7) | C15—H15B | 0.9900 |
| Rb11—O11 | 2.922 (6) | C16—C28 | 1.488 (15) |
| Rb11—N1 | 3.004 (8) | C16—H16A | 0.9900 |
| Rb11—N2 | 3.032 (8) | C16—H16B | 0.9900 |
| Rb12—N3 | 2.992 (12) | C17—C24 | 1.479 (15) |
| Rb12—Sn2i | 3.7080 (16) | C17—H17A | 0.9900 |
| Rb12—Sn2iv | 3.8625 (17) | C17—H17B | 0.9900 |
| Rb12—Sn5iv | 3.8829 (17) | C18—H18A | 0.9900 |
| Rb12—Sn9iv | 4.0597 (16) | C18—H18B | 0.9900 |
| O1—C10 | 1.418 (12) | C19—H19A | 0.9900 |
| O1—C13 | 1.460 (12) | C19—H19B | 0.9900 |
| O2—C11 | 1.425 (12) | C20—H20A | 0.9900 |
| O2—C22 | 1.430 (12) | C20—H20B | 0.9900 |
| O3—C19 | 1.407 (12) | C21—H21A | 0.9900 |
| O3—C5 | 1.412 (11) | C21—H21B | 0.9900 |
| O4—C3 | 1.413 (12) | C22—C30 | 1.477 (16) |
| O4—C26 | 1.437 (12) | C22—H22A | 0.9900 |
| O5—C6 | 1.421 (13) | C22—H22B | 0.9900 |
| O5—C16 | 1.448 (12) | C23—C25 | 1.511 (16) |
| O6—C24 | 1.420 (12) | C23—H23A | 0.9900 |
| O6—C28 | 1.423 (12) | C23—H23B | 0.9900 |
| O7—C7 | 1.426 (12) | C24—H24A | 0.9900 |
| O7—C15 | 1.426 (12) | C24—H24B | 0.9900 |
| O8—C2 | 1.414 (12) | C25—H25A | 0.9900 |
| O8—C1 | 1.450 (11) | C25—H25B | 0.9900 |
| O9—C18 | 1.396 (12) | C26—H26A | 0.9900 |
| O9—C23 | 1.425 (13) | C26—H26B | 0.9900 |
| O10—C14 | 1.421 (11) | C27—H27A | 0.9900 |
| O10—C8 | 1.426 (11) | C27—H27B | 0.9900 |
| O11—C12 | 1.413 (12) | C28—H28A | 0.9900 |
| O11—C4 | 1.428 (12) | C28—H28B | 0.9900 |
| O12—C30 | 1.421 (12) | C29—H29A | 0.9900 |
| O12—C17 | 1.442 (12) | C29—H29B | 0.9900 |
| N1—C9 | 1.460 (13) | C30—H30A | 0.9900 |
| N1—C20 | 1.476 (13) | C30—H30B | 0.9900 |
| N1—C27 | 1.489 (12) | Rb13—Sn5iii | 3.872 (4) |
| N2—C21 | 1.453 (13) | Rb13—Sn3i | 3.932 (3) |
| N2—C29 | 1.473 (13) | Rb13—Sn6i | 3.974 (5) |
| N2—C25 | 1.480 (12) | Rb13—Sn2i | 4.069 (5) |
| N3—H3C | 0.9100 | Rb13—Sn8iii | 4.171 (4) |
| N3—H3D | 0.9100 | Rb14—Sn3i | 3.835 (15) |
| N3—H3E | 0.9100 | Rb14—Sn5iii | 3.90 (2) |
| N4—Rb13 | 3.077 (13) | Rb14—Sn8iii | 3.933 (19) |
| N4—H4C | 0.9100 | Rb14—Sn6i | 4.109 (11) |
| N4—H4D | 0.9100 | Rb14—Sn4iii | 4.21 (2) |
| N4—H4E | 0.9100 | ||
| Sn3—Sn1—Sn2 | 64.32 (3) | C18—O9—C23 | 111.8 (8) |
| Sn3—Sn1—Sn4 | 69.57 (3) | C18—O9—Rb11 | 117.6 (6) |
| Sn2—Sn1—Sn4 | 99.82 (3) | C23—O9—Rb11 | 114.4 (5) |
| Sn3—Sn1—Sn5 | 100.90 (3) | C14—O10—C8 | 112.7 (8) |
| Sn2—Sn1—Sn5 | 65.55 (3) | C14—O10—Rb11 | 111.9 (5) |
| Sn4—Sn1—Sn5 | 63.76 (3) | C8—O10—Rb11 | 111.7 (5) |
| Sn1—Sn2—Sn9 | 110.91 (3) | C12—O11—C4 | 110.9 (7) |
| Sn1—Sn2—Sn6 | 109.27 (3) | C12—O11—Rb11 | 111.6 (5) |
| Sn9—Sn2—Sn6 | 59.67 (3) | C4—O11—Rb11 | 112.1 (5) |
| Sn1—Sn2—Sn3 | 57.78 (3) | C30—O12—C17 | 113.4 (8) |
| Sn9—Sn2—Sn3 | 103.03 (3) | C30—O12—Rb10 | 123.1 (6) |
| Sn6—Sn2—Sn3 | 58.32 (3) | C17—O12—Rb10 | 120.1 (5) |
| Sn1—Sn2—Sn5 | 57.56 (3) | C9—N1—C20 | 110.1 (8) |
| Sn9—Sn2—Sn5 | 58.13 (3) | C9—N1—C27 | 109.9 (8) |
| Sn6—Sn2—Sn5 | 98.66 (4) | C20—N1—C27 | 108.7 (8) |
| Sn3—Sn2—Sn5 | 91.99 (4) | C9—N1—Rb11 | 109.3 (5) |
| Sn1—Sn2—Rb12i | 163.26 (3) | C20—N1—Rb11 | 108.5 (7) |
| Sn9—Sn2—Rb12i | 83.68 (4) | C27—N1—Rb11 | 110.2 (6) |
| Sn6—Sn2—Rb12i | 84.88 (3) | C21—N2—C29 | 111.0 (8) |
| Sn3—Sn2—Rb12i | 128.68 (4) | C21—N2—C25 | 111.5 (8) |
| Sn5—Sn2—Rb12i | 130.86 (4) | C29—N2—C25 | 108.5 (8) |
| Sn1—Sn2—Rb12ii | 102.44 (3) | C21—N2—Rb11 | 108.9 (5) |
| Sn9—Sn2—Rb12ii | 71.63 (3) | C29—N2—Rb11 | 108.4 (5) |
| Sn6—Sn2—Rb12ii | 128.50 (4) | C25—N2—Rb11 | 108.4 (6) |
| Sn3—Sn2—Rb12ii | 157.10 (3) | Rb12—N3—H3C | 109.5 |
| Sn5—Sn2—Rb12ii | 66.03 (4) | Rb12—N3—H3D | 109.5 |
| Rb12i—Sn2—Rb12ii | 73.68 (4) | H3C—N3—H3D | 109.5 |
| Sn1—Sn2—Rb13i | 108.41 (7) | Rb12—N3—H3E | 109.5 |
| Sn9—Sn2—Rb13i | 120.72 (7) | H3C—N3—H3E | 109.5 |
| Sn6—Sn2—Rb13i | 66.46 (6) | H3D—N3—H3E | 109.5 |
| Sn3—Sn2—Rb13i | 64.74 (5) | Rb13—N4—H4C | 109.5 |
| Sn5—Sn2—Rb13i | 156.38 (5) | Rb13—N4—H4D | 109.5 |
| Rb12i—Sn2—Rb13i | 68.33 (6) | H4C—N4—H4D | 109.5 |
| Rb12ii—Sn2—Rb13i | 137.55 (5) | Rb13—N4—H4E | 109.5 |
| Sn7—Sn3—Sn1 | 107.93 (3) | H4C—N4—H4E | 109.5 |
| Sn7—Sn3—Sn6 | 59.66 (3) | H4D—N4—H4E | 109.5 |
| Sn1—Sn3—Sn6 | 109.75 (3) | H6C—N6—H6D | 109.5 |
| Sn7—Sn3—Sn2 | 101.23 (3) | H6C—N6—H6E | 109.5 |
| Sn1—Sn3—Sn2 | 57.90 (3) | H6D—N6—H6E | 109.5 |
| Sn6—Sn3—Sn2 | 58.74 (2) | H7C—N7—H7D | 109.5 |
| Sn7—Sn3—Rb14i | 121.4 (4) | H7C—N7—H7E | 109.5 |
| Sn1—Sn3—Rb14i | 119.6 (8) | H7D—N7—H7E | 109.5 |
| Sn6—Sn3—Rb14i | 72.9 (2) | O8—C1—C4 | 109.5 (8) |
| Sn2—Sn3—Rb14i | 79.1 (8) | O8—C1—Rb11 | 46.7 (4) |
| Sn7—Sn3—Rb13i | 122.33 (7) | C4—C1—Rb11 | 78.2 (5) |
| Sn1—Sn3—Rb13i | 112.08 (5) | O8—C1—H1A | 109.8 |
| Sn6—Sn3—Rb13i | 68.59 (8) | C4—C1—H1A | 109.8 |
| Sn2—Sn3—Rb13i | 69.38 (7) | Rb11—C1—H1A | 89.7 |
| Rb14i—Sn3—Rb13i | 9.7 (7) | O8—C1—H1B | 109.8 |
| Sn1—Sn4—Sn8 | 110.21 (3) | C4—C1—H1B | 109.8 |
| Sn1—Sn4—Sn7 | 106.63 (3) | Rb11—C1—H1B | 155.4 |
| Sn8—Sn4—Sn7 | 59.82 (3) | H1A—C1—H1B | 108.2 |
| Sn1—Sn4—Sn5 | 58.45 (3) | O8—C2—C21 | 109.1 (8) |
| Sn8—Sn4—Sn5 | 59.73 (2) | O8—C2—Rb11 | 47.1 (4) |
| Sn7—Sn4—Sn5 | 102.26 (3) | C21—C2—Rb11 | 81.4 (6) |
| Sn1—Sn4—Rb10 | 170.49 (3) | O8—C2—H2A | 109.9 |
| Sn8—Sn4—Rb10 | 69.74 (2) | C21—C2—H2A | 109.9 |
| Sn7—Sn4—Rb10 | 64.78 (3) | Rb11—C2—H2A | 156.9 |
| Sn5—Sn4—Rb10 | 125.76 (3) | O8—C2—H2B | 109.9 |
| Sn1—Sn4—Rb14iii | 109.5 (7) | C21—C2—H2B | 109.9 |
| Sn8—Sn4—Rb14iii | 63.80 (18) | Rb11—C2—H2B | 85.3 |
| Sn7—Sn4—Rb14iii | 120.3 (3) | H2A—C2—H2B | 108.3 |
| Sn5—Sn4—Rb14iii | 62.3 (7) | O4—C3—C6 | 110.0 (8) |
| Rb10—Sn4—Rb14iii | 79.2 (7) | O4—C3—Rb10 | 57.7 (5) |
| Sn1—Sn5—Sn9 | 109.42 (3) | C6—C3—Rb10 | 87.4 (6) |
| Sn1—Sn5—Sn8 | 107.85 (3) | O4—C3—H3A | 109.7 |
| Sn9—Sn5—Sn8 | 58.60 (3) | C6—C3—H3A | 109.7 |
| Sn1—Sn5—Sn4 | 57.79 (3) | Rb10—C3—H3A | 68.9 |
| Sn9—Sn5—Sn4 | 101.86 (3) | O4—C3—H3B | 109.7 |
| Sn8—Sn5—Sn4 | 57.65 (3) | C6—C3—H3B | 109.7 |
| Sn1—Sn5—Sn2 | 56.90 (2) | Rb10—C3—H3B | 162.2 |
| Sn9—Sn5—Sn2 | 57.16 (2) | H3A—C3—H3B | 108.2 |
| Sn8—Sn5—Sn2 | 96.26 (4) | O11—C4—C1 | 109.4 (8) |
| Sn4—Sn5—Sn2 | 90.91 (4) | O11—C4—Rb11 | 47.0 (4) |
| Sn1—Sn5—Rb13iii | 124.54 (8) | C1—C4—Rb11 | 78.7 (5) |
| Sn9—Sn5—Rb13iii | 116.00 (7) | O11—C4—H4A | 109.8 |
| Sn8—Sn5—Rb13iii | 73.25 (5) | C1—C4—H4A | 109.8 |
| Sn4—Sn5—Rb13iii | 82.57 (7) | Rb11—C4—H4A | 88.7 |
| Sn2—Sn5—Rb13iii | 169.45 (5) | O11—C4—H4B | 109.8 |
| Sn1—Sn5—Rb12ii | 101.55 (4) | C1—C4—H4B | 109.8 |
| Sn9—Sn5—Rb12ii | 71.02 (3) | Rb11—C4—H4B | 156.0 |
| Sn8—Sn5—Rb12ii | 127.48 (4) | H4A—C4—H4B | 108.2 |
| Sn4—Sn5—Rb12ii | 155.55 (3) | O3—C5—C29 | 110.6 (8) |
| Sn2—Sn5—Rb12ii | 65.36 (4) | O3—C5—Rb11 | 45.1 (4) |
| Rb13iii—Sn5—Rb12ii | 121.77 (7) | C29—C5—Rb11 | 81.4 (5) |
| Sn1—Sn5—Rb14iii | 117.4 (5) | O3—C5—H5A | 109.5 |
| Sn9—Sn5—Rb14iii | 116.7 (3) | C29—C5—H5A | 109.5 |
| Sn8—Sn5—Rb14iii | 67.8 (6) | Rb11—C5—H5A | 154.1 |
| Sn4—Sn5—Rb14iii | 72.7 (7) | O3—C5—H5B | 109.5 |
| Sn2—Sn5—Rb14iii | 161.5 (8) | C29—C5—H5B | 109.5 |
| Rb13iii—Sn5—Rb14iii | 9.8 (7) | Rb11—C5—H5B | 89.0 |
| Rb12ii—Sn5—Rb14iii | 131.6 (7) | H5A—C5—H5B | 108.1 |
| Sn7—Sn6—Sn9 | 95.23 (3) | O5—C6—C3 | 108.2 (8) |
| Sn7—Sn6—Sn3 | 59.20 (2) | O5—C6—H6A | 110.1 |
| Sn9—Sn6—Sn3 | 106.44 (3) | C3—C6—H6A | 110.1 |
| Sn7—Sn6—Sn2 | 103.94 (3) | O5—C6—H6B | 110.1 |
| Sn9—Sn6—Sn2 | 59.61 (3) | C3—C6—H6B | 110.1 |
| Sn3—Sn6—Sn2 | 62.94 (2) | H6A—C6—H6B | 108.4 |
| Sn7—Sn6—Sn8 | 47.87 (3) | O7—C7—C26 | 108.2 (8) |
| Sn9—Sn6—Sn8 | 47.62 (3) | O7—C7—H7A | 110.1 |
| Sn3—Sn6—Sn8 | 83.61 (2) | C26—C7—H7A | 110.1 |
| Sn2—Sn6—Sn8 | 82.00 (3) | O7—C7—H7B | 110.1 |
| Sn7—Sn6—Rb13i | 120.59 (7) | C26—C7—H7B | 110.1 |
| Sn9—Sn6—Rb13i | 123.69 (6) | H7A—C7—H7B | 108.4 |
| Sn3—Sn6—Rb13i | 67.09 (6) | O10—C8—C9 | 109.1 (8) |
| Sn2—Sn6—Rb13i | 69.83 (5) | O10—C8—Rb11 | 47.1 (4) |
| Sn8—Sn6—Rb13i | 146.05 (6) | C9—C8—Rb11 | 81.5 (5) |
| Sn7—Sn6—Rb14i | 113.0 (6) | O10—C8—H8A | 109.9 |
| Sn9—Sn6—Rb14i | 132.2 (7) | C9—C8—H8A | 109.9 |
| Sn3—Sn6—Rb14i | 63.2 (3) | Rb11—C8—H8A | 156.9 |
| Sn2—Sn6—Rb14i | 76.1 (6) | O10—C8—H8B | 109.9 |
| Sn8—Sn6—Rb14i | 145.81 (19) | C9—C8—H8B | 109.9 |
| Rb13i—Sn6—Rb14i | 9.3 (7) | Rb11—C8—H8B | 85.3 |
| Sn3—Sn7—Sn6 | 61.15 (3) | H8A—C8—H8B | 108.3 |
| Sn3—Sn7—Sn8 | 105.84 (3) | N1—C9—C8 | 113.1 (8) |
| Sn6—Sn7—Sn8 | 84.65 (3) | N1—C9—Rb11 | 49.1 (4) |
| Sn3—Sn7—Sn4 | 69.18 (3) | C8—C9—Rb11 | 75.3 (5) |
| Sn6—Sn7—Sn4 | 105.80 (3) | N1—C9—H9A | 109.0 |
| Sn8—Sn7—Sn4 | 59.93 (3) | C8—C9—H9A | 109.0 |
| Sn3—Sn7—Rb10 | 132.34 (3) | Rb11—C9—H9A | 154.3 |
| Sn6—Sn7—Rb10 | 155.13 (3) | N1—C9—H9B | 109.0 |
| Sn8—Sn7—Rb10 | 71.77 (3) | C8—C9—H9B | 109.0 |
| Sn4—Sn7—Rb10 | 69.44 (3) | Rb11—C9—H9B | 93.9 |
| Sn3—Sn7—Sn9 | 78.97 (3) | H9A—C9—H9B | 107.8 |
| Sn6—Sn7—Sn9 | 42.61 (2) | O1—C10—C20 | 109.4 (8) |
| Sn8—Sn7—Sn9 | 42.29 (3) | O1—C10—Rb11 | 47.3 (4) |
| Sn4—Sn7—Sn9 | 78.07 (3) | C20—C10—Rb11 | 81.4 (6) |
| Rb10—Sn7—Sn9 | 114.02 (3) | O1—C10—H10A | 109.8 |
| Sn9—Sn8—Sn7 | 95.24 (3) | C20—C10—H10A | 109.8 |
| Sn9—Sn8—Sn4 | 106.78 (3) | Rb11—C10—H10A | 157.0 |
| Sn7—Sn8—Sn4 | 60.25 (2) | O1—C10—H10B | 109.8 |
| Sn9—Sn8—Sn5 | 60.17 (3) | C20—C10—H10B | 109.8 |
| Sn7—Sn8—Sn5 | 104.64 (3) | Rb11—C10—H10B | 85.4 |
| Sn4—Sn8—Sn5 | 62.62 (3) | H10A—C10—H10B | 108.2 |
| Sn9—Sn8—Rb14iii | 117.0 (8) | O2—C11—C15 | 108.7 (8) |
| Sn7—Sn8—Rb14iii | 129.9 (5) | O2—C11—Rb10 | 55.7 (5) |
| Sn4—Sn8—Rb14iii | 73.7 (3) | C15—C11—Rb10 | 83.8 (6) |
| Sn5—Sn8—Rb14iii | 66.7 (6) | O2—C11—H11A | 110.0 |
| Sn9—Sn8—Sn6 | 48.01 (3) | C15—C11—H11A | 110.0 |
| Sn7—Sn8—Sn6 | 47.48 (3) | Rb10—C11—H11A | 73.4 |
| Sn4—Sn8—Sn6 | 84.34 (2) | O2—C11—H11B | 110.0 |
| Sn5—Sn8—Sn6 | 83.08 (3) | C15—C11—H11B | 110.0 |
| Rb14iii—Sn8—Sn6 | 148.3 (4) | Rb10—C11—H11B | 163.7 |
| Sn9—Sn8—Rb10 | 158.47 (3) | H11A—C11—H11B | 108.3 |
| Sn7—Sn8—Rb10 | 63.38 (3) | O11—C12—C27 | 109.1 (8) |
| Sn4—Sn8—Rb10 | 66.05 (2) | O11—C12—Rb11 | 47.5 (4) |
| Sn5—Sn8—Rb10 | 124.99 (3) | C27—C12—Rb11 | 82.0 (5) |
| Rb14iii—Sn8—Rb10 | 81.4 (8) | O11—C12—H12A | 109.9 |
| Sn6—Sn8—Rb10 | 110.47 (4) | C27—C12—H12A | 109.9 |
| Sn9—Sn8—Rb13iii | 109.12 (5) | Rb11—C12—H12A | 157.4 |
| Sn7—Sn8—Rb13iii | 137.51 (8) | O11—C12—H12B | 109.9 |
| Sn4—Sn8—Rb13iii | 79.26 (8) | C27—C12—H12B | 109.9 |
| Sn5—Sn8—Rb13iii | 62.75 (6) | Rb11—C12—H12B | 84.3 |
| Rb14iii—Sn8—Rb13iii | 8.8 (7) | H12A—C12—H12B | 108.3 |
| Sn6—Sn8—Rb13iii | 145.82 (5) | O1—C13—C18 | 111.2 (8) |
| Rb10—Sn8—Rb13iii | 89.94 (5) | O1—C13—Rb11 | 46.1 (4) |
| Sn8—Sn9—Sn2 | 103.12 (3) | C18—C13—Rb11 | 79.4 (5) |
| Sn8—Sn9—Sn6 | 84.37 (3) | O1—C13—H13A | 109.4 |
| Sn2—Sn9—Sn6 | 60.72 (3) | C18—C13—H13A | 109.4 |
| Sn8—Sn9—Sn5 | 61.23 (3) | Rb11—C13—H13A | 90.7 |
| Sn2—Sn9—Sn5 | 64.71 (3) | O1—C13—H13B | 109.4 |
| Sn6—Sn9—Sn5 | 103.88 (3) | C18—C13—H13B | 109.4 |
| Sn8—Sn9—Rb12ii | 123.97 (4) | Rb11—C13—H13B | 154.2 |
| Sn2—Sn9—Rb12ii | 64.54 (3) | H13A—C13—H13B | 108.0 |
| Sn6—Sn9—Rb12ii | 122.78 (4) | O10—C14—C19 | 110.9 (8) |
| Sn5—Sn9—Rb12ii | 64.75 (3) | O10—C14—Rb11 | 47.0 (4) |
| Sn8—Sn9—Sn7 | 42.47 (2) | C19—C14—Rb11 | 79.2 (5) |
| Sn2—Sn9—Sn7 | 76.71 (3) | O10—C14—H14A | 109.5 |
| Sn6—Sn9—Sn7 | 42.15 (3) | C19—C14—H14A | 109.5 |
| Sn5—Sn9—Sn7 | 77.70 (3) | Rb11—C14—H14A | 89.4 |
| Rb12ii—Sn9—Sn7 | 134.33 (3) | O10—C14—H14B | 109.5 |
| O5—Rb10—O7 | 112.5 (2) | C19—C14—H14B | 109.5 |
| O5—Rb10—O12 | 114.23 (19) | Rb11—C14—H14B | 155.5 |
| O7—Rb10—O12 | 111.1 (2) | H14A—C14—H14B | 108.0 |
| O5—Rb10—O6 | 56.70 (19) | O7—C15—C11 | 107.9 (8) |
| O7—Rb10—O6 | 137.0 (2) | O7—C15—H15A | 110.1 |
| O12—Rb10—O6 | 57.70 (18) | C11—C15—H15A | 110.1 |
| O5—Rb10—O4 | 56.04 (19) | O7—C15—H15B | 110.1 |
| O7—Rb10—O4 | 57.46 (19) | C11—C15—H15B | 110.1 |
| O12—Rb10—O4 | 143.19 (19) | H15A—C15—H15B | 108.4 |
| O6—Rb10—O4 | 104.59 (18) | O5—C16—C28 | 107.6 (8) |
| O5—Rb10—O2 | 142.60 (18) | O5—C16—H16A | 110.2 |
| O7—Rb10—O2 | 56.43 (18) | C28—C16—H16A | 110.2 |
| O12—Rb10—O2 | 55.43 (19) | O5—C16—H16B | 110.2 |
| O6—Rb10—O2 | 104.61 (17) | C28—C16—H16B | 110.2 |
| O4—Rb10—O2 | 108.20 (17) | H16A—C16—H16B | 108.5 |
| O5—Rb10—C3 | 41.0 (2) | O12—C17—C24 | 109.0 (8) |
| O7—Rb10—C3 | 77.8 (2) | O12—C17—H17A | 109.9 |
| O12—Rb10—C3 | 151.7 (2) | C24—C17—H17A | 109.9 |
| O6—Rb10—C3 | 96.9 (2) | O12—C17—H17B | 109.9 |
| O4—Rb10—C3 | 22.9 (2) | C24—C17—H17B | 109.9 |
| O2—Rb10—C3 | 131.0 (2) | H17A—C17—H17B | 108.3 |
| O5—Rb10—C24 | 76.5 (2) | O9—C18—C13 | 109.9 (8) |
| O7—Rb10—C24 | 144.0 (2) | C13—C18—Rb11 | 77.8 (5) |
| O12—Rb10—C24 | 40.6 (2) | O9—C18—H18A | 109.7 |
| O6—Rb10—C24 | 22.1 (2) | C13—C18—H18A | 109.7 |
| O4—Rb10—C24 | 126.6 (2) | Rb11—C18—H18A | 95.5 |
| O2—Rb10—C24 | 94.5 (2) | O9—C18—H18B | 109.7 |
| C3—Rb10—C24 | 117.5 (3) | C13—C18—H18B | 109.7 |
| O5—Rb10—C22 | 150.3 (2) | Rb11—C18—H18B | 150.1 |
| O7—Rb10—C22 | 76.7 (2) | H18A—C18—H18B | 108.2 |
| O12—Rb10—C22 | 40.0 (2) | O3—C19—C14 | 110.0 (8) |
| O6—Rb10—C22 | 96.7 (2) | O3—C19—Rb11 | 45.2 (4) |
| O4—Rb10—C22 | 130.8 (2) | C14—C19—Rb11 | 77.5 (5) |
| O2—Rb10—C22 | 22.7 (2) | O3—C19—H19A | 109.7 |
| C3—Rb10—C22 | 153.5 (3) | C14—C19—H19A | 109.7 |
| C24—Rb10—C22 | 80.5 (2) | Rb11—C19—H19A | 93.1 |
| O5—Rb10—C26 | 77.3 (2) | O3—C19—H19B | 109.7 |
| O7—Rb10—C26 | 40.1 (2) | C14—C19—H19B | 109.7 |
| O12—Rb10—C26 | 147.1 (2) | Rb11—C19—H19B | 152.7 |
| O6—Rb10—C26 | 126.9 (2) | H19A—C19—H19B | 108.2 |
| O4—Rb10—C26 | 22.6 (2) | N1—C20—C10 | 114.0 (9) |
| O2—Rb10—C26 | 96.0 (2) | N1—C20—Rb11 | 49.5 (5) |
| C3—Rb10—C26 | 38.4 (3) | C10—C20—Rb11 | 75.2 (6) |
| C24—Rb10—C26 | 148.7 (2) | N1—C20—H20A | 108.8 |
| C22—Rb10—C26 | 116.8 (3) | C10—C20—H20A | 108.8 |
| O5—Rb10—C11 | 147.5 (2) | Rb11—C20—H20A | 154.0 |
| O7—Rb10—C11 | 39.5 (2) | N1—C20—H20B | 108.8 |
| O12—Rb10—C11 | 76.1 (2) | C10—C20—H20B | 108.8 |
| O6—Rb10—C11 | 126.5 (2) | Rb11—C20—H20B | 94.6 |
| O4—Rb10—C11 | 96.5 (2) | H20A—C20—H20B | 107.7 |
| O2—Rb10—C11 | 22.1 (2) | N2—C21—C2 | 114.8 (8) |
| C3—Rb10—C11 | 117.4 (3) | N2—C21—H21A | 108.6 |
| C24—Rb10—C11 | 116.2 (2) | C2—C21—H21A | 108.6 |
| C22—Rb10—C11 | 37.8 (2) | N2—C21—H21B | 108.6 |
| C26—Rb10—C11 | 79.3 (2) | C2—C21—H21B | 108.6 |
| O5—Rb10—C28 | 39.6 (2) | H21A—C21—H21B | 107.5 |
| O7—Rb10—C28 | 143.5 (2) | O2—C22—C30 | 108.8 (8) |
| O12—Rb10—C28 | 77.1 (2) | O2—C22—Rb10 | 57.3 (4) |
| O6—Rb10—C28 | 21.3 (2) | C30—C22—Rb10 | 86.1 (6) |
| O4—Rb10—C28 | 94.0 (2) | O2—C22—H22A | 109.9 |
| O2—Rb10—C28 | 125.8 (2) | C30—C22—H22A | 109.9 |
| C3—Rb10—C28 | 80.6 (3) | Rb10—C22—H22A | 162.9 |
| C24—Rb10—C28 | 37.2 (2) | O2—C22—H22B | 109.9 |
| C22—Rb10—C28 | 116.9 (2) | C30—C22—H22B | 109.9 |
| C26—Rb10—C28 | 116.3 (2) | Rb10—C22—H22B | 70.0 |
| C11—Rb10—C28 | 147.4 (2) | H22A—C22—H22B | 108.3 |
| O9—Rb11—O3 | 98.3 (2) | O9—C23—C25 | 109.3 (8) |
| O9—Rb11—O10 | 121.43 (19) | O9—C23—Rb11 | 45.0 (4) |
| O3—Rb11—O10 | 59.79 (18) | C25—C23—Rb11 | 81.0 (5) |
| O9—Rb11—O1 | 59.0 (2) | O9—C23—H23A | 109.8 |
| O3—Rb11—O1 | 136.72 (18) | C25—C23—H23A | 109.8 |
| O10—Rb11—O1 | 98.80 (19) | Rb11—C23—H23A | 154.5 |
| O9—Rb11—O8 | 96.40 (19) | O9—C23—H23B | 109.8 |
| O3—Rb11—O8 | 98.59 (18) | C25—C23—H23B | 109.8 |
| O10—Rb11—O8 | 137.29 (18) | Rb11—C23—H23B | 88.3 |
| O1—Rb11—O8 | 118.80 (19) | H23A—C23—H23B | 108.3 |
| O9—Rb11—O11 | 135.5 (2) | O6—C24—C17 | 110.5 (9) |
| O3—Rb11—O11 | 120.77 (18) | O6—C24—Rb10 | 52.8 (4) |
| O10—Rb11—O11 | 97.86 (19) | C17—C24—Rb10 | 84.9 (6) |
| O1—Rb11—O11 | 97.78 (19) | O6—C24—H24A | 109.6 |
| O8—Rb11—O11 | 59.82 (19) | C17—C24—H24A | 109.6 |
| O9—Rb11—N1 | 119.5 (2) | Rb10—C24—H24A | 76.5 |
| O3—Rb11—N1 | 119.6 (2) | O6—C24—H24B | 109.6 |
| O10—Rb11—N1 | 60.5 (2) | C17—C24—H24B | 109.6 |
| O1—Rb11—N1 | 61.2 (2) | Rb10—C24—H24B | 161.3 |
| O8—Rb11—N1 | 119.54 (19) | H24A—C24—H24B | 108.1 |
| O11—Rb11—N1 | 60.6 (2) | N2—C25—C23 | 113.3 (8) |
| O9—Rb11—N2 | 60.7 (2) | N2—C25—H25A | 108.9 |
| O3—Rb11—N2 | 60.6 (2) | C23—C25—H25A | 108.9 |
| O10—Rb11—N2 | 119.8 (2) | N2—C25—H25B | 108.9 |
| O1—Rb11—N2 | 118.9 (2) | C23—C25—H25B | 108.9 |
| O8—Rb11—N2 | 60.08 (19) | H25A—C25—H25B | 107.7 |
| O11—Rb11—N2 | 119.1 (2) | O4—C26—C7 | 110.6 (8) |
| N1—Rb11—N2 | 179.6 (2) | O4—C26—Rb10 | 55.2 (4) |
| O9—Rb11—C10 | 76.9 (2) | C7—C26—Rb10 | 84.8 (5) |
| O3—Rb11—C10 | 129.2 (2) | O4—C26—H26A | 109.5 |
| O10—Rb11—C10 | 79.5 (2) | C7—C26—H26A | 109.5 |
| O1—Rb11—C10 | 21.1 (2) | Rb10—C26—H26A | 163.0 |
| O8—Rb11—C10 | 132.2 (2) | O4—C26—H26B | 109.5 |
| O11—Rb11—C10 | 91.9 (2) | C7—C26—H26B | 109.5 |
| N1—Rb11—C10 | 42.6 (2) | Rb10—C26—H26B | 74.1 |
| N2—Rb11—C10 | 137.6 (2) | H26A—C26—H26B | 108.1 |
| O9—Rb11—C14 | 122.5 (2) | N1—C27—C12 | 112.3 (9) |
| O3—Rb11—C14 | 40.2 (2) | N1—C27—H27A | 109.2 |
| O10—Rb11—C14 | 21.1 (2) | C12—C27—H27A | 109.2 |
| O1—Rb11—C14 | 118.2 (2) | N1—C27—H27B | 109.2 |
| O8—Rb11—C14 | 121.7 (2) | C12—C27—H27B | 109.2 |
| O11—Rb11—C14 | 101.8 (2) | H27A—C27—H27B | 107.9 |
| N1—Rb11—C14 | 79.4 (2) | O6—C28—C16 | 110.7 (8) |
| N2—Rb11—C14 | 100.8 (2) | O6—C28—Rb10 | 50.2 (4) |
| C10—Rb11—C14 | 100.1 (2) | C16—C28—Rb10 | 84.0 (5) |
| O9—Rb11—C8 | 134.1 (2) | O6—C28—H28A | 109.5 |
| O3—Rb11—C8 | 77.9 (2) | C16—C28—H28A | 109.5 |
| O10—Rb11—C8 | 21.2 (2) | Rb10—C28—H28A | 159.5 |
| O1—Rb11—C8 | 92.6 (2) | O6—C28—H28B | 109.5 |
| O8—Rb11—C8 | 129.4 (2) | C16—C28—H28B | 109.5 |
| O11—Rb11—C8 | 78.7 (2) | Rb10—C28—H28B | 80.3 |
| N1—Rb11—C8 | 41.8 (2) | H28A—C28—H28B | 108.1 |
| N2—Rb11—C8 | 138.4 (2) | N2—C29—C5 | 115.9 (8) |
| C10—Rb11—C8 | 71.5 (2) | N2—C29—H29A | 108.3 |
| C14—Rb11—C8 | 37.7 (2) | C5—C29—H29A | 108.3 |
| O9—Rb11—C12 | 127.7 (2) | N2—C29—H29B | 108.3 |
| O3—Rb11—C12 | 134.0 (2) | C5—C29—H29B | 108.3 |
| O10—Rb11—C12 | 92.3 (2) | H29A—C29—H29B | 107.4 |
| O1—Rb11—C12 | 78.7 (2) | O12—C30—C22 | 108.3 (8) |
| O8—Rb11—C12 | 77.2 (2) | O12—C30—H30A | 110.0 |
| O11—Rb11—C12 | 20.9 (2) | C22—C30—H30A | 110.0 |
| N1—Rb11—C12 | 42.4 (2) | O12—C30—H30B | 110.0 |
| N2—Rb11—C12 | 137.2 (2) | C22—C30—H30B | 110.0 |
| C10—Rb11—C12 | 71.1 (2) | H30A—C30—H30B | 108.4 |
| C14—Rb11—C12 | 103.3 (2) | Rb14—Rb13—N4 | 99.7 (19) |
| C8—Rb11—C12 | 71.2 (2) | Rb14—Rb13—Sn5iii | 87.6 (17) |
| N3—Rb12—Sn2i | 99.2 (2) | N4—Rb13—Sn5iii | 101.4 (2) |
| N3—Rb12—Sn2iv | 105.1 (2) | Rb14—Rb13—Sn3i | 76.9 (14) |
| Sn2i—Rb12—Sn2iv | 106.32 (4) | N4—Rb13—Sn3i | 69.2 (2) |
| N3—Rb12—Sn5iv | 110.5 (2) | Sn5iii—Rb13—Sn3i | 159.77 (16) |
| Sn2i—Rb12—Sn5iv | 144.75 (4) | Rb14—Rb13—Sn6i | 97 (2) |
| Sn2iv—Rb12—Sn5iv | 48.60 (2) | N4—Rb13—Sn6i | 104.0 (2) |
| N3—Rb12—Sn9iv | 147.0 (2) | Sn5iii—Rb13—Sn6i | 153.00 (12) |
| Sn2i—Rb12—Sn9iv | 100.78 (4) | Sn3i—Rb13—Sn6i | 44.32 (5) |
| Sn2iv—Rb12—Sn9iv | 43.83 (2) | Rb14—Rb13—Sn2i | 122.7 (14) |
| Sn5iv—Rb12—Sn9iv | 44.22 (2) | N4—Rb13—Sn2i | 65.8 (2) |
| N3—Rb12—Rb13 | 95.0 (2) | Sn5iii—Rb13—Sn2i | 147.86 (8) |
| Sn2i—Rb12—Rb13 | 59.74 (5) | Sn3i—Rb13—Sn2i | 45.88 (5) |
| Sn2iv—Rb12—Rb13 | 157.50 (6) | Sn6i—Rb13—Sn2i | 43.71 (5) |
| Sn5iv—Rb12—Rb13 | 132.44 (6) | Rb14—Rb13—Sn8iii | 64.7 (13) |
| Sn9iv—Rb12—Rb13 | 117.68 (6) | N4—Rb13—Sn8iii | 139.2 (3) |
| N3—Rb12—Rb12v | 110.7 (3) | Sn5iii—Rb13—Sn8iii | 43.99 (4) |
| Sn2i—Rb12—Rb12v | 54.72 (3) | Sn3i—Rb13—Sn8iii | 133.95 (7) |
| Sn2iv—Rb12—Rb12v | 51.60 (3) | Sn6i—Rb13—Sn8iii | 114.86 (9) |
| Sn5iv—Rb12—Rb12v | 95.99 (4) | Sn2i—Rb13—Sn8iii | 154.80 (14) |
| Sn9iv—Rb12—Rb12v | 62.56 (4) | Rb14—Rb13—Rb12 | 160 (2) |
| Rb13—Rb12—Rb12v | 111.99 (6) | N4—Rb13—Rb12 | 94.5 (2) |
| N3—Rb12—Rb14 | 92.5 (4) | Sn5iii—Rb13—Rb12 | 103.20 (8) |
| Sn2i—Rb12—Rb14 | 59.39 (15) | Sn3i—Rb13—Rb12 | 95.55 (11) |
| Sn2iv—Rb12—Rb14 | 159.3 (3) | Sn6i—Rb13—Rb12 | 65.89 (9) |
| Sn5iv—Rb12—Rb14 | 134.4 (3) | Sn2i—Rb13—Rb12 | 51.93 (7) |
| Sn9iv—Rb12—Rb14 | 120.2 (4) | Sn8iii—Rb13—Rb12 | 111.90 (10) |
| Rb13—Rb12—Rb14 | 2.6 (4) | Rb13—Rb14—Sn3i | 93.4 (12) |
| Rb12v—Rb12—Rb14 | 112.35 (15) | Rb13—Rb14—Sn5iii | 83 (2) |
| C10—O1—C13 | 112.2 (7) | Sn3i—Rb14—Sn5iii | 166.4 (10) |
| C10—O1—Rb11 | 111.6 (5) | Rb13—Rb14—Sn8iii | 106.4 (15) |
| C13—O1—Rb11 | 112.6 (6) | Sn3i—Rb14—Sn8iii | 147.5 (13) |
| C11—O2—C22 | 113.1 (7) | Sn5iii—Rb14—Sn8iii | 45.43 (13) |
| C11—O2—Rb10 | 102.2 (5) | Rb13—Rb14—Sn6i | 73.7 (14) |
| C22—O2—Rb10 | 100.1 (5) | Sn3i—Rb14—Sn6i | 43.92 (13) |
| C19—O3—C5 | 113.4 (7) | Sn5iii—Rb14—Sn6i | 144.5 (8) |
| C19—O3—Rb11 | 114.5 (5) | Sn8iii—Rb14—Sn6i | 117.2 (5) |
| C5—O3—Rb11 | 114.5 (6) | Rb13—Rb14—Sn4iii | 127 (2) |
| C3—O4—C26 | 113.2 (8) | Sn3i—Rb14—Sn4iii | 136.6 (12) |
| C3—O4—Rb10 | 99.4 (6) | Sn5iii—Rb14—Sn4iii | 44.92 (14) |
| C26—O4—Rb10 | 102.2 (5) | Sn8iii—Rb14—Sn4iii | 42.5 (2) |
| C6—O5—C16 | 112.0 (8) | Sn6i—Rb14—Sn4iii | 150.3 (12) |
| C6—O5—Rb10 | 122.0 (6) | Sn3i—Rb14—Rb12 | 87.2 (6) |
| C16—O5—Rb10 | 123.2 (5) | Sn5iii—Rb14—Rb12 | 92.3 (9) |
| C24—O6—C28 | 111.7 (7) | Sn8iii—Rb14—Rb12 | 104.1 (6) |
| C24—O6—Rb10 | 105.1 (5) | Sn6i—Rb14—Rb12 | 58.9 (4) |
| C28—O6—Rb10 | 108.5 (5) | Sn4iii—Rb14—Rb12 | 136.2 (8) |
| C7—O7—C15 | 112.4 (7) | Sn3i—Rb14—Rb10iii | 103.2 (11) |
| C7—O7—Rb10 | 121.3 (6) | Sn5iii—Rb14—Rb10iii | 85.7 (5) |
| C15—O7—Rb10 | 122.1 (5) | Sn8iii—Rb14—Rb10iii | 49.7 (5) |
| C2—O8—C1 | 112.1 (7) | Sn6i—Rb14—Rb10iii | 103.5 (9) |
| C2—O8—Rb11 | 112.0 (5) | Sn4iii—Rb14—Rb10iii | 47.6 (5) |
| C1—O8—Rb11 | 112.0 (5) |