| Literature DB >> 21579968 |
Omar Bin Shawkataly, Imthyaz Ahmed Khan, Chin Sing Yeap, Hoong-Kun Fun.
Abstract
The asymmetric unit of the title triangulo-triruthenium compound, [Ru(3)(C(25)H(22)As(2))(C(19)H(17)P)(CO)(9)], consists of two crystallographically independent mol-ecules of the triangulo-triruthenium complex, A and B. The bis-(diphenyl-arsino)methane ligand bridges an Ru-Ru bond and the monodentate phosphine ligand bonds to the third Ru atom. Both the phosphine and arsine ligands are equatorial with respect to the Ru(3) triangle. In addition, each Ru atom carries one equatorial and two axial terminal carbonyl ligands. With regard to the three phosphine-substituted rings, the benzyl ring makes dihedral angles of 41.0 (3) and 43.9 (3)° with the other two benzene rings in mol-ecule A; these angles are 49.8 (3) and 56.8 (3)° in mol-ecule B. The dihedral angles between the two benzene rings are 76.1 (3) and 88.2 (3)° for the two diphenyl-arsino groups in mol-ecule A and 71.3 (3) and 78.1 (3)° in mol-ecule B. In the crystal packing, mol-ecules are linked into chains via inter-molecular C-H⋯O hydrogen bonds. Weak inter-molecular C-H⋯π inter-actions further stabilize the crystal structure.Entities:
Year: 2009 PMID: 21579968 PMCID: PMC2980180 DOI: 10.1107/S1600536809053045
Source DB: PubMed Journal: Acta Crystallogr Sect E Struct Rep Online ISSN: 1600-5368
| [Ru3(C25H22As2)(C19H17P)(CO)9] | |
| Monoclinic, | Mo |
| Hall symbol: -P 2ybc | Cell parameters from 9933 reflections |
| θ = 2.3–29.2° | |
| µ = 2.31 mm−1 | |
| β = 117.597 (1)° | Plate, red |
| 0.48 × 0.16 × 0.03 mm | |
| Bruker SMART APEXII CCD area-detector diffractometer | 29004 independent reflections |
| Radiation source: fine-focus sealed tube | 18757 reflections with |
| graphite | |
| φ and ω scans | θmax = 30.0°, θmin = 1.1° |
| Absorption correction: multi-scan ( | |
| 131198 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 | |
| 29004 reflections | (Δ/σ)max = 0.002 |
| 1226 parameters | Δρmax = 2.08 e Å−3 |
| 0 restraints | Δρmin = −1.19 e Å−3 |
| Experimental. The crystal was placed in the cold stream of an Oxford Cyrosystems Cobra open-flow nitrogen cryostat (Cosier & Glazer, 1986) operating at 100.0 (1) K. |
| 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 |
| Ru1A | 0.76373 (3) | 0.886190 (11) | 0.500136 (19) | 0.01238 (9) | |
| Ru2A | 0.65234 (3) | 0.851053 (11) | 0.375632 (19) | 0.01265 (9) | |
| Ru3A | 0.88866 (3) | 0.859273 (11) | 0.436070 (19) | 0.01141 (8) | |
| As1A | 0.59031 (4) | 0.886381 (14) | 0.50761 (2) | 0.01318 (11) | |
| As2A | 0.46232 (4) | 0.864590 (14) | 0.35505 (2) | 0.01289 (11) | |
| P1A | 1.07682 (10) | 0.86564 (4) | 0.51268 (6) | 0.0133 (3) | |
| O1A | 0.7068 (3) | 0.96100 (10) | 0.4261 (2) | 0.0276 (9) | |
| O2A | 0.9059 (3) | 0.92692 (11) | 0.62601 (19) | 0.0306 (10) | |
| O3A | 0.8498 (3) | 0.81485 (10) | 0.58225 (18) | 0.0223 (8) | |
| O4A | 0.6528 (3) | 0.78247 (10) | 0.45562 (18) | 0.0237 (9) | |
| O5A | 0.6323 (3) | 0.80072 (11) | 0.26561 (19) | 0.0305 (10) | |
| O6A | 0.6353 (3) | 0.92231 (11) | 0.29746 (19) | 0.0277 (9) | |
| O7A | 0.8800 (3) | 0.93986 (10) | 0.38671 (17) | 0.0179 (8) | |
| O8A | 0.9127 (3) | 0.83289 (10) | 0.3200 (2) | 0.0262 (9) | |
| O9A | 0.8950 (3) | 0.77640 (10) | 0.47621 (18) | 0.0223 (8) | |
| C1A | 0.5646 (4) | 0.92845 (14) | 0.5528 (2) | 0.0165 (11) | |
| C2A | 0.6195 (4) | 0.96206 (14) | 0.5569 (2) | 0.0172 (11) | |
| H1 | 0.6700 | 0.9635 | 0.5402 | 0.021* | |
| C3A | 0.6007 (5) | 0.99346 (14) | 0.5852 (3) | 0.0205 (12) | |
| H2 | 0.6388 | 1.0157 | 0.5881 | 0.025* | |
| C4A | 0.5245 (4) | 0.99142 (16) | 0.6092 (3) | 0.0223 (12) | |
| H3 | 0.5111 | 1.0124 | 0.6283 | 0.027* | |
| C5A | 0.4685 (4) | 0.95852 (16) | 0.6050 (3) | 0.0231 (12) | |
| H4 | 0.4170 | 0.9575 | 0.6210 | 0.028* | |
| C6A | 0.4878 (4) | 0.92695 (16) | 0.5773 (3) | 0.0229 (12) | |
| H5 | 0.4497 | 0.9047 | 0.5749 | 0.027* | |
| C7A | 0.5601 (4) | 0.84357 (14) | 0.5489 (3) | 0.0172 (11) | |
| C8A | 0.6318 (4) | 0.83769 (14) | 0.6143 (3) | 0.0204 (12) | |
| H6 | 0.6905 | 0.8543 | 0.6369 | 0.025* | |
| C9A | 0.6155 (5) | 0.80729 (16) | 0.6456 (3) | 0.0282 (14) | |
| H7 | 0.6624 | 0.8036 | 0.6895 | 0.034* | |
| C10A | 0.5294 (5) | 0.78217 (16) | 0.6117 (3) | 0.0282 (14) | |
| H10A | 0.5186 | 0.7617 | 0.6329 | 0.034* | |
| C11A | 0.4599 (5) | 0.78746 (15) | 0.5468 (3) | 0.0264 (13) | |
| H11A | 0.4032 | 0.7702 | 0.5243 | 0.032* | |
| C12A | 0.4733 (4) | 0.81818 (14) | 0.5147 (3) | 0.0209 (12) | |
| H12A | 0.4252 | 0.8219 | 0.4711 | 0.025* | |
| C13A | 0.4541 (4) | 0.89210 (13) | 0.4250 (2) | 0.0149 (10) | |
| H13A | 0.3904 | 0.8831 | 0.4299 | 0.018* | |
| H13B | 0.4422 | 0.9185 | 0.4139 | 0.018* | |
| C14A | 0.3564 (4) | 0.82396 (14) | 0.3375 (2) | 0.0166 (11) | |
| C15A | 0.3831 (4) | 0.78765 (13) | 0.3276 (2) | 0.0152 (11) | |
| H15A | 0.4531 | 0.7826 | 0.3307 | 0.018* | |
| C16A | 0.3058 (4) | 0.75911 (14) | 0.3130 (2) | 0.0188 (11) | |
| H16A | 0.3244 | 0.7347 | 0.3074 | 0.023* | |
| C17A | 0.2004 (4) | 0.76683 (15) | 0.3067 (3) | 0.0221 (12) | |
| H17A | 0.1482 | 0.7476 | 0.2967 | 0.026* | |
| C18A | 0.1729 (5) | 0.80301 (15) | 0.3154 (3) | 0.0277 (14) | |
| H18A | 0.1024 | 0.8082 | 0.3113 | 0.033* | |
| C19A | 0.2504 (4) | 0.83151 (15) | 0.3301 (3) | 0.0259 (13) | |
| H19A | 0.2313 | 0.8559 | 0.3351 | 0.031* | |
| C20A | 0.3729 (4) | 0.89564 (14) | 0.2808 (2) | 0.0171 (11) | |
| C21A | 0.3098 (4) | 0.92572 (15) | 0.2820 (3) | 0.0224 (12) | |
| H21A | 0.3100 | 0.9327 | 0.3205 | 0.027* | |
| C22A | 0.2450 (5) | 0.94595 (16) | 0.2250 (3) | 0.0303 (14) | |
| H22A | 0.2036 | 0.9666 | 0.2262 | 0.036* | |
| C23A | 0.2424 (5) | 0.93566 (17) | 0.1681 (3) | 0.0290 (14) | |
| H23A | 0.2003 | 0.9494 | 0.1307 | 0.035* | |
| C24A | 0.3029 (5) | 0.90466 (16) | 0.1664 (3) | 0.0274 (13) | |
| H24A | 0.2993 | 0.8971 | 0.1274 | 0.033* | |
| C25A | 0.3686 (4) | 0.88493 (16) | 0.2222 (3) | 0.0243 (12) | |
| H25A | 0.4102 | 0.8644 | 0.2207 | 0.029* | |
| C26A | 1.1224 (4) | 0.90445 (13) | 0.5703 (2) | 0.0140 (10) | |
| C27A | 1.2271 (4) | 0.90382 (15) | 0.6253 (3) | 0.0196 (11) | |
| H27A | 1.2702 | 0.8821 | 0.6355 | 0.024* | |
| C28A | 1.2671 (4) | 0.93504 (15) | 0.6644 (3) | 0.0231 (12) | |
| H28A | 1.3364 | 0.9340 | 0.7010 | 0.028* | |
| C29A | 1.2053 (4) | 0.96770 (15) | 0.6498 (3) | 0.0214 (12) | |
| H29A | 1.2334 | 0.9888 | 0.6760 | 0.026* | |
| C30A | 1.1011 (5) | 0.96911 (14) | 0.5959 (3) | 0.0214 (12) | |
| H30A | 1.0588 | 0.9910 | 0.5859 | 0.026* | |
| C31A | 1.0604 (4) | 0.93770 (13) | 0.5570 (2) | 0.0165 (11) | |
| H31A | 0.9901 | 0.9387 | 0.5212 | 0.020* | |
| C32A | 1.1319 (4) | 0.82436 (13) | 0.5641 (3) | 0.0162 (11) | |
| C33A | 1.1788 (4) | 0.79435 (14) | 0.5468 (3) | 0.0232 (12) | |
| H33A | 1.1893 | 0.7962 | 0.5103 | 0.028* | |
| C34A | 1.2098 (5) | 0.76191 (16) | 0.5831 (3) | 0.0294 (14) | |
| H34A | 1.2413 | 0.7422 | 0.5710 | 0.035* | |
| C35A | 1.1942 (5) | 0.75856 (15) | 0.6374 (3) | 0.0285 (14) | |
| H35A | 1.2152 | 0.7366 | 0.6618 | 0.034* | |
| C36A | 1.1470 (4) | 0.78813 (15) | 0.6554 (3) | 0.0230 (12) | |
| H36A | 1.1362 | 0.7861 | 0.6918 | 0.028* | |
| C37A | 1.1163 (4) | 0.82044 (14) | 0.6186 (3) | 0.0204 (12) | |
| H37A | 1.0844 | 0.8401 | 0.6306 | 0.024* | |
| C38A | 1.1753 (4) | 0.87114 (14) | 0.4783 (3) | 0.0174 (11) | |
| H38A | 1.2513 | 0.8711 | 0.5133 | 0.021* | |
| H38B | 1.1676 | 0.8497 | 0.4508 | 0.021* | |
| C39A | 1.1569 (4) | 0.90676 (14) | 0.4392 (3) | 0.0174 (11) | |
| C40A | 1.1878 (4) | 0.94205 (15) | 0.4688 (3) | 0.0215 (12) | |
| H40A | 1.2272 | 0.9438 | 0.5136 | 0.026* | |
| C41A | 1.1596 (5) | 0.97433 (15) | 0.4316 (3) | 0.0264 (13) | |
| H41A | 1.1774 | 0.9977 | 0.4518 | 0.032* | |
| C42A | 1.1057 (5) | 0.97248 (16) | 0.3650 (3) | 0.0270 (13) | |
| H42A | 1.0862 | 0.9944 | 0.3405 | 0.032* | |
| C43A | 1.0811 (5) | 0.93808 (16) | 0.3351 (3) | 0.0266 (13) | |
| H43A | 1.0487 | 0.9367 | 0.2902 | 0.032* | |
| C44A | 1.1044 (4) | 0.90529 (15) | 0.3716 (3) | 0.0198 (12) | |
| H44A | 1.0848 | 0.8821 | 0.3508 | 0.024* | |
| C45A | 0.7269 (4) | 0.93195 (15) | 0.4502 (3) | 0.0190 (12) | |
| C46A | 0.8544 (4) | 0.91159 (15) | 0.5775 (3) | 0.0185 (11) | |
| C47A | 0.8161 (4) | 0.83991 (15) | 0.5474 (3) | 0.0170 (11) | |
| C48A | 0.6587 (4) | 0.80877 (15) | 0.4286 (3) | 0.0193 (12) | |
| C49A | 0.6364 (4) | 0.82009 (15) | 0.3053 (3) | 0.0197 (12) | |
| C50A | 0.6473 (4) | 0.89623 (15) | 0.3288 (3) | 0.0198 (12) | |
| C51A | 0.8788 (4) | 0.91046 (14) | 0.4065 (2) | 0.0137 (10) | |
| C52A | 0.9062 (4) | 0.84217 (13) | 0.3651 (3) | 0.0161 (11) | |
| C53A | 0.8882 (4) | 0.80748 (15) | 0.4629 (2) | 0.0161 (11) | |
| Ru1B | 0.42063 (3) | 0.640248 (11) | 0.520022 (19) | 0.01315 (9) | |
| Ru2B | 0.30365 (3) | 0.605718 (11) | 0.395962 (19) | 0.01302 (9) | |
| Ru3B | 0.18372 (3) | 0.637768 (11) | 0.460014 (19) | 0.01191 (8) | |
| As1B | 0.47520 (4) | 0.605726 (14) | 0.38588 (2) | 0.01345 (11) | |
| As2B | 0.60936 (4) | 0.625216 (14) | 0.53966 (2) | 0.01376 (11) | |
| P1B | −0.00699 (10) | 0.63514 (4) | 0.38705 (6) | 0.0135 (3) | |
| O1B | 0.4252 (3) | 0.70809 (10) | 0.43994 (18) | 0.0231 (9) | |
| O2B | 0.4427 (3) | 0.68995 (11) | 0.6308 (2) | 0.0325 (10) | |
| O3B | 0.4406 (3) | 0.56760 (11) | 0.59609 (19) | 0.0288 (10) | |
| O4B | 0.3627 (4) | 0.53067 (11) | 0.4695 (2) | 0.0338 (10) | |
| O5B | 0.1563 (3) | 0.56302 (11) | 0.27274 (19) | 0.0287 (9) | |
| O6B | 0.2145 (3) | 0.67645 (10) | 0.31295 (18) | 0.0206 (8) | |
| O7B | 0.1899 (3) | 0.72067 (10) | 0.42444 (19) | 0.0235 (9) | |
| O8B | 0.1584 (3) | 0.66850 (10) | 0.57293 (19) | 0.0258 (9) | |
| O9B | 0.1874 (3) | 0.55697 (10) | 0.50761 (18) | 0.0217 (8) | |
| C1B | 0.4941 (4) | 0.56427 (14) | 0.3373 (2) | 0.0156 (11) | |
| C2B | 0.4412 (4) | 0.53019 (14) | 0.3351 (3) | 0.0199 (12) | |
| H8 | 0.3959 | 0.5281 | 0.3552 | 0.024* | |
| C3B | 0.4553 (4) | 0.49962 (14) | 0.3036 (3) | 0.0199 (12) | |
| H9 | 0.4195 | 0.4771 | 0.3025 | 0.024* | |
| C4B | 0.5229 (4) | 0.50231 (15) | 0.2733 (3) | 0.0221 (12) | |
| H10 | 0.5330 | 0.4816 | 0.2521 | 0.027* | |
| C5B | 0.5748 (4) | 0.53597 (15) | 0.2749 (3) | 0.0229 (12) | |
| H11 | 0.6195 | 0.5379 | 0.2544 | 0.027* | |
| C6B | 0.5612 (4) | 0.56703 (14) | 0.3067 (3) | 0.0185 (11) | |
| H12 | 0.5968 | 0.5895 | 0.3076 | 0.022* | |
| C7B | 0.5030 (4) | 0.64876 (13) | 0.3448 (2) | 0.0141 (10) | |
| C8B | 0.4311 (4) | 0.65480 (15) | 0.2796 (3) | 0.0217 (12) | |
| H13 | 0.3721 | 0.6383 | 0.2576 | 0.026* | |
| C9B | 0.4457 (5) | 0.68492 (15) | 0.2470 (3) | 0.0249 (13) | |
| H14 | 0.3972 | 0.6886 | 0.2034 | 0.030* | |
| C10B | 0.5342 (5) | 0.70981 (15) | 0.2803 (3) | 0.0279 (14) | |
| H10B | 0.5454 | 0.7300 | 0.2586 | 0.033* | |
| C11B | 0.6051 (5) | 0.70449 (15) | 0.3454 (3) | 0.0299 (14) | |
| H11B | 0.6630 | 0.7214 | 0.3676 | 0.036* | |
| C12B | 0.5899 (4) | 0.67398 (14) | 0.3777 (3) | 0.0203 (12) | |
| H12B | 0.6379 | 0.6704 | 0.4215 | 0.024* | |
| C13B | 0.6145 (4) | 0.60009 (14) | 0.4663 (2) | 0.0157 (11) | |
| H13C | 0.6757 | 0.6105 | 0.4604 | 0.019* | |
| H13D | 0.6294 | 0.5736 | 0.4760 | 0.019* | |
| C14B | 0.7160 (4) | 0.66613 (13) | 0.5608 (2) | 0.0143 (10) | |
| C15B | 0.8239 (4) | 0.65883 (17) | 0.5704 (3) | 0.0290 (14) | |
| H15B | 0.8446 | 0.6345 | 0.5663 | 0.035* | |
| C16B | 0.9001 (5) | 0.68764 (16) | 0.5862 (3) | 0.0333 (15) | |
| H16B | 0.9715 | 0.6828 | 0.5912 | 0.040* | |
| C17B | 0.8714 (5) | 0.72387 (16) | 0.5945 (3) | 0.0262 (13) | |
| H17B | 0.9232 | 0.7433 | 0.6052 | 0.031* | |
| C18B | 0.7661 (4) | 0.73080 (14) | 0.5868 (3) | 0.0190 (11) | |
| H18B | 0.7466 | 0.7550 | 0.5928 | 0.023* | |
| C19B | 0.6876 (4) | 0.70188 (14) | 0.5702 (3) | 0.0183 (11) | |
| H19B | 0.6165 | 0.7068 | 0.5655 | 0.022* | |
| C20B | 0.6949 (4) | 0.59094 (15) | 0.6106 (2) | 0.0172 (11) | |
| C21B | 0.7132 (5) | 0.55357 (14) | 0.6023 (3) | 0.0232 (12) | |
| H21B | 0.6862 | 0.5438 | 0.5609 | 0.028* | |
| C22B | 0.7715 (5) | 0.53071 (16) | 0.6554 (3) | 0.0273 (14) | |
| H22B | 0.7833 | 0.5056 | 0.6492 | 0.033* | |
| C23B | 0.8123 (5) | 0.54455 (17) | 0.7169 (3) | 0.0295 (14) | |
| H23B | 0.8514 | 0.5291 | 0.7525 | 0.035* | |
| C24B | 0.7941 (5) | 0.58221 (17) | 0.7253 (3) | 0.0321 (15) | |
| H24B | 0.8215 | 0.5919 | 0.7668 | 0.038* | |
| C25B | 0.7365 (5) | 0.60513 (15) | 0.6732 (3) | 0.0272 (13) | |
| H25B | 0.7250 | 0.6302 | 0.6796 | 0.033* | |
| C26B | −0.0677 (4) | 0.59789 (14) | 0.3264 (2) | 0.0148 (10) | |
| C27B | −0.1726 (4) | 0.60277 (16) | 0.2732 (3) | 0.0217 (12) | |
| H27B | −0.2098 | 0.6256 | 0.2672 | 0.026* | |
| C28B | −0.2215 (4) | 0.57395 (15) | 0.2294 (3) | 0.0218 (12) | |
| H28B | −0.2916 | 0.5774 | 0.1942 | 0.026* | |
| C29B | −0.1667 (5) | 0.54020 (16) | 0.2378 (3) | 0.0243 (13) | |
| H29B | −0.1995 | 0.5210 | 0.2079 | 0.029* | |
| C30B | −0.0630 (4) | 0.53481 (15) | 0.2905 (3) | 0.0220 (12) | |
| H30B | −0.0264 | 0.5119 | 0.2965 | 0.026* | |
| C31B | −0.0134 (4) | 0.56385 (14) | 0.3346 (3) | 0.0183 (11) | |
| H31B | 0.0567 | 0.5603 | 0.3699 | 0.022* | |
| C32B | −0.0570 (4) | 0.67746 (14) | 0.3375 (2) | 0.0171 (11) | |
| C33B | −0.0476 (4) | 0.68106 (15) | 0.2808 (3) | 0.0191 (11) | |
| H33B | −0.0194 | 0.6611 | 0.2671 | 0.023* | |
| C34B | −0.0793 (4) | 0.71365 (14) | 0.2446 (3) | 0.0216 (12) | |
| H34B | −0.0728 | 0.7155 | 0.2068 | 0.026* | |
| C35B | −0.1208 (5) | 0.74337 (15) | 0.2649 (3) | 0.0269 (14) | |
| H35B | −0.1425 | 0.7653 | 0.2406 | 0.032* | |
| C36B | −0.1305 (5) | 0.74073 (15) | 0.3214 (3) | 0.0254 (13) | |
| H36B | −0.1584 | 0.7609 | 0.3349 | 0.030* | |
| C37B | −0.0985 (4) | 0.70808 (14) | 0.3577 (3) | 0.0213 (12) | |
| H37B | −0.1047 | 0.7064 | 0.3957 | 0.026* | |
| C38B | −0.1007 (4) | 0.63267 (14) | 0.4252 (3) | 0.0179 (11) | |
| H38C | −0.0812 | 0.6529 | 0.4564 | 0.021* | |
| H38D | −0.1769 | 0.6370 | 0.3921 | 0.021* | |
| C39B | −0.0973 (4) | 0.59617 (13) | 0.4590 (2) | 0.0137 (10) | |
| C40B | −0.0375 (4) | 0.59257 (14) | 0.5254 (3) | 0.0205 (12) | |
| H40B | 0.0064 | 0.6125 | 0.5499 | 0.025* | |
| C41B | −0.0420 (5) | 0.55975 (15) | 0.5562 (3) | 0.0257 (13) | |
| H41B | −0.0015 | 0.5580 | 0.6009 | 0.031* | |
| C42B | −0.1057 (5) | 0.52972 (16) | 0.5211 (3) | 0.0296 (14) | |
| H42B | −0.1084 | 0.5078 | 0.5420 | 0.036* | |
| C43B | −0.1655 (5) | 0.53243 (15) | 0.4546 (3) | 0.0281 (14) | |
| H43B | −0.2090 | 0.5123 | 0.4306 | 0.034* | |
| C44B | −0.1606 (4) | 0.56521 (15) | 0.4236 (3) | 0.0231 (12) | |
| H44B | −0.1997 | 0.5666 | 0.3787 | 0.028* | |
| C45B | 0.4183 (4) | 0.68217 (15) | 0.4670 (3) | 0.0171 (11) | |
| C46B | 0.4380 (4) | 0.67100 (15) | 0.5898 (3) | 0.0194 (12) | |
| C47B | 0.4260 (4) | 0.59422 (16) | 0.5656 (3) | 0.0207 (12) | |
| C48B | 0.3413 (4) | 0.55982 (15) | 0.4451 (3) | 0.0205 (12) | |
| C49B | 0.2097 (4) | 0.57950 (14) | 0.3192 (3) | 0.0196 (12) | |
| C50B | 0.2496 (4) | 0.65152 (15) | 0.3488 (3) | 0.0169 (11) | |
| C51B | 0.1914 (4) | 0.68920 (15) | 0.4352 (3) | 0.0174 (11) | |
| C52B | 0.1674 (4) | 0.65675 (14) | 0.5298 (3) | 0.0167 (11) | |
| C53B | 0.1895 (4) | 0.58647 (15) | 0.4877 (2) | 0.0167 (11) |
| Ru1A | 0.01086 (18) | 0.0139 (2) | 0.0140 (2) | −0.00043 (15) | 0.00720 (16) | −0.00093 (16) |
| Ru2A | 0.01012 (18) | 0.0146 (2) | 0.0134 (2) | −0.00005 (15) | 0.00555 (16) | −0.00049 (16) |
| Ru3A | 0.00996 (17) | 0.01185 (19) | 0.0137 (2) | 0.00005 (15) | 0.00659 (16) | −0.00070 (16) |
| As1A | 0.0117 (2) | 0.0154 (3) | 0.0143 (3) | −0.00028 (19) | 0.0076 (2) | −0.0005 (2) |
| As2A | 0.0106 (2) | 0.0142 (3) | 0.0142 (3) | −0.00051 (19) | 0.0059 (2) | −0.0009 (2) |
| P1A | 0.0112 (6) | 0.0133 (6) | 0.0154 (7) | 0.0002 (5) | 0.0062 (5) | 0.0008 (5) |
| O1A | 0.038 (2) | 0.022 (2) | 0.036 (3) | 0.0070 (18) | 0.028 (2) | 0.0072 (18) |
| O2A | 0.031 (2) | 0.038 (2) | 0.026 (2) | −0.0107 (19) | 0.016 (2) | −0.0140 (19) |
| O3A | 0.023 (2) | 0.020 (2) | 0.025 (2) | 0.0014 (16) | 0.0112 (18) | 0.0045 (17) |
| O4A | 0.023 (2) | 0.023 (2) | 0.021 (2) | −0.0037 (16) | 0.0071 (17) | 0.0047 (17) |
| O5A | 0.030 (2) | 0.039 (2) | 0.021 (2) | 0.0047 (19) | 0.0100 (19) | −0.0093 (19) |
| O6A | 0.021 (2) | 0.028 (2) | 0.030 (2) | −0.0028 (17) | 0.0085 (18) | 0.0119 (19) |
| O7A | 0.0189 (18) | 0.0174 (19) | 0.023 (2) | −0.0007 (15) | 0.0141 (17) | 0.0001 (16) |
| O8A | 0.034 (2) | 0.023 (2) | 0.032 (2) | −0.0047 (17) | 0.024 (2) | −0.0072 (18) |
| O9A | 0.026 (2) | 0.0147 (19) | 0.029 (2) | 0.0000 (16) | 0.0147 (18) | 0.0019 (16) |
| C1A | 0.018 (2) | 0.015 (3) | 0.015 (3) | 0.003 (2) | 0.006 (2) | 0.005 (2) |
| C2A | 0.019 (3) | 0.018 (3) | 0.018 (3) | 0.005 (2) | 0.011 (2) | 0.001 (2) |
| C3A | 0.029 (3) | 0.015 (3) | 0.020 (3) | −0.004 (2) | 0.013 (2) | −0.004 (2) |
| C4A | 0.024 (3) | 0.027 (3) | 0.016 (3) | 0.005 (2) | 0.009 (2) | −0.005 (2) |
| C5A | 0.020 (3) | 0.035 (3) | 0.022 (3) | 0.002 (2) | 0.015 (2) | −0.005 (3) |
| C6A | 0.014 (3) | 0.032 (3) | 0.024 (3) | 0.000 (2) | 0.010 (2) | −0.003 (3) |
| C7A | 0.012 (2) | 0.016 (3) | 0.026 (3) | −0.001 (2) | 0.011 (2) | 0.001 (2) |
| C8A | 0.018 (3) | 0.018 (3) | 0.026 (3) | 0.001 (2) | 0.011 (2) | 0.000 (2) |
| C9A | 0.032 (3) | 0.032 (3) | 0.028 (3) | 0.006 (3) | 0.020 (3) | 0.004 (3) |
| C10A | 0.038 (3) | 0.021 (3) | 0.039 (4) | 0.003 (3) | 0.029 (3) | 0.006 (3) |
| C11A | 0.031 (3) | 0.022 (3) | 0.036 (4) | −0.009 (2) | 0.023 (3) | −0.003 (3) |
| C12A | 0.022 (3) | 0.022 (3) | 0.023 (3) | −0.001 (2) | 0.013 (2) | −0.003 (2) |
| C13A | 0.014 (2) | 0.012 (2) | 0.017 (3) | 0.0021 (19) | 0.005 (2) | −0.001 (2) |
| C14A | 0.012 (2) | 0.019 (3) | 0.018 (3) | 0.002 (2) | 0.006 (2) | 0.000 (2) |
| C15A | 0.015 (2) | 0.017 (3) | 0.015 (3) | −0.002 (2) | 0.008 (2) | −0.002 (2) |
| C16A | 0.019 (3) | 0.015 (3) | 0.020 (3) | 0.002 (2) | 0.007 (2) | 0.001 (2) |
| C17A | 0.022 (3) | 0.022 (3) | 0.023 (3) | −0.007 (2) | 0.011 (2) | −0.002 (2) |
| C18A | 0.024 (3) | 0.027 (3) | 0.044 (4) | −0.005 (2) | 0.026 (3) | −0.007 (3) |
| C19A | 0.018 (3) | 0.016 (3) | 0.049 (4) | 0.001 (2) | 0.021 (3) | −0.005 (3) |
| C20A | 0.012 (2) | 0.020 (3) | 0.017 (3) | −0.003 (2) | 0.005 (2) | 0.003 (2) |
| C21A | 0.023 (3) | 0.026 (3) | 0.014 (3) | 0.005 (2) | 0.005 (2) | −0.006 (2) |
| C22A | 0.031 (3) | 0.021 (3) | 0.030 (4) | 0.009 (2) | 0.007 (3) | 0.004 (3) |
| C23A | 0.024 (3) | 0.038 (4) | 0.019 (3) | −0.003 (3) | 0.004 (3) | 0.008 (3) |
| C24A | 0.023 (3) | 0.037 (3) | 0.021 (3) | −0.004 (3) | 0.010 (3) | 0.003 (3) |
| C25A | 0.022 (3) | 0.032 (3) | 0.020 (3) | −0.001 (2) | 0.011 (2) | −0.001 (3) |
| C26A | 0.016 (2) | 0.015 (2) | 0.015 (3) | −0.0058 (19) | 0.011 (2) | −0.002 (2) |
| C27A | 0.015 (2) | 0.026 (3) | 0.020 (3) | −0.003 (2) | 0.010 (2) | 0.001 (2) |
| C28A | 0.019 (3) | 0.026 (3) | 0.021 (3) | −0.007 (2) | 0.006 (2) | 0.003 (2) |
| C29A | 0.025 (3) | 0.023 (3) | 0.021 (3) | −0.010 (2) | 0.014 (2) | −0.006 (2) |
| C30A | 0.025 (3) | 0.014 (3) | 0.028 (3) | −0.004 (2) | 0.014 (3) | −0.005 (2) |
| C31A | 0.016 (2) | 0.018 (3) | 0.016 (3) | −0.006 (2) | 0.008 (2) | −0.002 (2) |
| C32A | 0.011 (2) | 0.014 (3) | 0.022 (3) | −0.0026 (19) | 0.006 (2) | −0.003 (2) |
| C33A | 0.025 (3) | 0.017 (3) | 0.029 (3) | 0.003 (2) | 0.014 (3) | 0.002 (2) |
| C34A | 0.030 (3) | 0.019 (3) | 0.037 (4) | 0.006 (2) | 0.014 (3) | 0.000 (3) |
| C35A | 0.027 (3) | 0.019 (3) | 0.030 (3) | 0.002 (2) | 0.005 (3) | 0.011 (3) |
| C36A | 0.025 (3) | 0.022 (3) | 0.018 (3) | −0.003 (2) | 0.007 (2) | 0.005 (2) |
| C37A | 0.019 (3) | 0.018 (3) | 0.024 (3) | 0.000 (2) | 0.009 (2) | −0.002 (2) |
| C38A | 0.012 (2) | 0.017 (3) | 0.021 (3) | 0.0002 (19) | 0.006 (2) | −0.001 (2) |
| C39A | 0.015 (2) | 0.022 (3) | 0.022 (3) | 0.001 (2) | 0.014 (2) | 0.000 (2) |
| C40A | 0.019 (3) | 0.027 (3) | 0.021 (3) | −0.008 (2) | 0.011 (2) | −0.001 (2) |
| C41A | 0.029 (3) | 0.020 (3) | 0.040 (4) | −0.005 (2) | 0.024 (3) | 0.002 (3) |
| C42A | 0.029 (3) | 0.030 (3) | 0.030 (3) | 0.001 (3) | 0.021 (3) | 0.008 (3) |
| C43A | 0.028 (3) | 0.038 (4) | 0.023 (3) | 0.004 (3) | 0.020 (3) | 0.004 (3) |
| C44A | 0.013 (2) | 0.027 (3) | 0.023 (3) | 0.001 (2) | 0.011 (2) | −0.002 (2) |
| C45A | 0.020 (3) | 0.022 (3) | 0.025 (3) | 0.001 (2) | 0.019 (2) | −0.005 (2) |
| C46A | 0.022 (3) | 0.022 (3) | 0.019 (3) | 0.001 (2) | 0.017 (2) | −0.001 (2) |
| C47A | 0.014 (2) | 0.023 (3) | 0.015 (3) | −0.003 (2) | 0.007 (2) | −0.004 (2) |
| C48A | 0.009 (2) | 0.028 (3) | 0.015 (3) | 0.000 (2) | 0.001 (2) | −0.005 (2) |
| C49A | 0.010 (2) | 0.026 (3) | 0.022 (3) | 0.000 (2) | 0.005 (2) | 0.001 (2) |
| C50A | 0.012 (2) | 0.022 (3) | 0.023 (3) | −0.002 (2) | 0.006 (2) | −0.003 (2) |
| C51A | 0.011 (2) | 0.020 (3) | 0.012 (3) | −0.001 (2) | 0.007 (2) | −0.003 (2) |
| C52A | 0.017 (2) | 0.011 (2) | 0.018 (3) | 0.0007 (19) | 0.007 (2) | 0.001 (2) |
| C53A | 0.011 (2) | 0.026 (3) | 0.014 (3) | 0.003 (2) | 0.008 (2) | −0.003 (2) |
| Ru1B | 0.01150 (18) | 0.0155 (2) | 0.0125 (2) | 0.00016 (16) | 0.00559 (16) | −0.00002 (17) |
| Ru2B | 0.01322 (19) | 0.0133 (2) | 0.0143 (2) | −0.00050 (15) | 0.00783 (17) | −0.00109 (16) |
| Ru3B | 0.01116 (18) | 0.01171 (19) | 0.0140 (2) | −0.00040 (15) | 0.00686 (16) | −0.00116 (16) |
| As1B | 0.0138 (2) | 0.0140 (3) | 0.0142 (3) | 0.0007 (2) | 0.0078 (2) | −0.0001 (2) |
| As2B | 0.0118 (2) | 0.0154 (3) | 0.0140 (3) | 0.00046 (19) | 0.0059 (2) | 0.0000 (2) |
| P1B | 0.0123 (6) | 0.0131 (6) | 0.0159 (7) | −0.0003 (5) | 0.0071 (5) | −0.0006 (5) |
| O1B | 0.021 (2) | 0.020 (2) | 0.024 (2) | −0.0029 (16) | 0.0076 (17) | 0.0048 (17) |
| O2B | 0.040 (3) | 0.036 (2) | 0.026 (2) | −0.005 (2) | 0.019 (2) | −0.011 (2) |
| O3B | 0.026 (2) | 0.027 (2) | 0.033 (2) | 0.0011 (17) | 0.0131 (19) | 0.0128 (19) |
| O4B | 0.061 (3) | 0.018 (2) | 0.034 (3) | 0.007 (2) | 0.031 (2) | 0.0053 (19) |
| O5B | 0.024 (2) | 0.037 (2) | 0.026 (2) | −0.0103 (18) | 0.0122 (19) | −0.0140 (19) |
| O6B | 0.022 (2) | 0.0193 (19) | 0.023 (2) | 0.0029 (16) | 0.0128 (17) | 0.0023 (17) |
| O7B | 0.025 (2) | 0.016 (2) | 0.034 (2) | −0.0003 (16) | 0.0175 (19) | 0.0019 (17) |
| O8B | 0.036 (2) | 0.024 (2) | 0.025 (2) | −0.0056 (18) | 0.0203 (19) | −0.0099 (18) |
| O9B | 0.025 (2) | 0.0172 (19) | 0.022 (2) | −0.0045 (16) | 0.0111 (17) | 0.0009 (16) |
| C1B | 0.017 (2) | 0.016 (3) | 0.012 (3) | −0.001 (2) | 0.006 (2) | −0.003 (2) |
| C2B | 0.023 (3) | 0.021 (3) | 0.021 (3) | 0.003 (2) | 0.015 (2) | 0.002 (2) |
| C3B | 0.026 (3) | 0.012 (3) | 0.022 (3) | 0.002 (2) | 0.011 (2) | 0.002 (2) |
| C4B | 0.023 (3) | 0.025 (3) | 0.020 (3) | 0.005 (2) | 0.011 (2) | −0.004 (2) |
| C5B | 0.022 (3) | 0.032 (3) | 0.022 (3) | 0.000 (2) | 0.017 (3) | −0.006 (2) |
| C6B | 0.019 (3) | 0.017 (3) | 0.022 (3) | −0.002 (2) | 0.012 (2) | 0.000 (2) |
| C7B | 0.017 (2) | 0.017 (3) | 0.017 (3) | 0.002 (2) | 0.015 (2) | 0.000 (2) |
| C8B | 0.018 (3) | 0.022 (3) | 0.025 (3) | 0.001 (2) | 0.010 (2) | 0.000 (2) |
| C9B | 0.031 (3) | 0.022 (3) | 0.025 (3) | 0.006 (2) | 0.016 (3) | 0.005 (2) |
| C10B | 0.042 (4) | 0.020 (3) | 0.040 (4) | 0.000 (3) | 0.035 (3) | 0.004 (3) |
| C11B | 0.039 (4) | 0.020 (3) | 0.041 (4) | −0.008 (3) | 0.027 (3) | −0.007 (3) |
| C12B | 0.020 (3) | 0.023 (3) | 0.019 (3) | −0.006 (2) | 0.011 (2) | −0.002 (2) |
| C13B | 0.016 (2) | 0.014 (2) | 0.014 (3) | 0.006 (2) | 0.005 (2) | 0.000 (2) |
| C14B | 0.017 (2) | 0.016 (3) | 0.013 (3) | −0.005 (2) | 0.010 (2) | −0.002 (2) |
| C15B | 0.018 (3) | 0.031 (3) | 0.040 (4) | −0.003 (2) | 0.016 (3) | −0.010 (3) |
| C16B | 0.015 (3) | 0.029 (3) | 0.057 (4) | −0.005 (2) | 0.018 (3) | −0.012 (3) |
| C17B | 0.024 (3) | 0.028 (3) | 0.030 (3) | −0.008 (2) | 0.016 (3) | −0.006 (3) |
| C18B | 0.020 (3) | 0.016 (3) | 0.021 (3) | 0.004 (2) | 0.010 (2) | 0.000 (2) |
| C19B | 0.017 (3) | 0.018 (3) | 0.021 (3) | −0.003 (2) | 0.009 (2) | −0.001 (2) |
| C20B | 0.008 (2) | 0.027 (3) | 0.016 (3) | −0.002 (2) | 0.005 (2) | 0.004 (2) |
| C21B | 0.029 (3) | 0.018 (3) | 0.021 (3) | 0.002 (2) | 0.010 (3) | 0.003 (2) |
| C22B | 0.028 (3) | 0.021 (3) | 0.029 (3) | 0.001 (2) | 0.010 (3) | 0.010 (3) |
| C23B | 0.021 (3) | 0.035 (4) | 0.024 (3) | −0.004 (3) | 0.002 (3) | 0.014 (3) |
| C24B | 0.037 (4) | 0.042 (4) | 0.010 (3) | −0.006 (3) | 0.004 (3) | −0.004 (3) |
| C25B | 0.037 (3) | 0.018 (3) | 0.024 (3) | 0.002 (2) | 0.012 (3) | 0.001 (2) |
| C26B | 0.015 (2) | 0.020 (3) | 0.011 (2) | −0.003 (2) | 0.008 (2) | 0.000 (2) |
| C27B | 0.016 (3) | 0.028 (3) | 0.021 (3) | −0.005 (2) | 0.008 (2) | 0.001 (2) |
| C28B | 0.020 (3) | 0.033 (3) | 0.014 (3) | −0.010 (2) | 0.008 (2) | −0.003 (2) |
| C29B | 0.029 (3) | 0.029 (3) | 0.018 (3) | −0.014 (2) | 0.014 (3) | −0.012 (2) |
| C30B | 0.024 (3) | 0.020 (3) | 0.027 (3) | −0.003 (2) | 0.016 (3) | −0.009 (2) |
| C31B | 0.015 (2) | 0.025 (3) | 0.017 (3) | −0.004 (2) | 0.010 (2) | −0.003 (2) |
| C32B | 0.011 (2) | 0.019 (3) | 0.015 (3) | −0.003 (2) | 0.000 (2) | 0.001 (2) |
| C33B | 0.014 (2) | 0.021 (3) | 0.021 (3) | −0.003 (2) | 0.007 (2) | −0.001 (2) |
| C34B | 0.021 (3) | 0.022 (3) | 0.019 (3) | −0.006 (2) | 0.007 (2) | 0.004 (2) |
| C35B | 0.026 (3) | 0.016 (3) | 0.030 (3) | 0.001 (2) | 0.006 (3) | 0.007 (2) |
| C36B | 0.032 (3) | 0.019 (3) | 0.025 (3) | 0.003 (2) | 0.014 (3) | −0.001 (2) |
| C37B | 0.024 (3) | 0.019 (3) | 0.021 (3) | 0.002 (2) | 0.011 (2) | 0.001 (2) |
| C38B | 0.017 (2) | 0.017 (3) | 0.027 (3) | 0.000 (2) | 0.016 (2) | −0.002 (2) |
| C39B | 0.012 (2) | 0.012 (2) | 0.022 (3) | −0.0024 (19) | 0.012 (2) | −0.003 (2) |
| C40B | 0.020 (3) | 0.015 (3) | 0.032 (3) | −0.005 (2) | 0.017 (3) | −0.001 (2) |
| C41B | 0.031 (3) | 0.028 (3) | 0.022 (3) | 0.001 (3) | 0.017 (3) | 0.002 (3) |
| C42B | 0.042 (4) | 0.018 (3) | 0.035 (4) | −0.005 (3) | 0.023 (3) | 0.000 (3) |
| C43B | 0.037 (3) | 0.016 (3) | 0.037 (4) | −0.011 (2) | 0.022 (3) | −0.007 (3) |
| C44B | 0.020 (3) | 0.027 (3) | 0.027 (3) | −0.003 (2) | 0.014 (3) | −0.003 (3) |
| C45B | 0.009 (2) | 0.025 (3) | 0.016 (3) | 0.001 (2) | 0.005 (2) | −0.005 (2) |
| C46B | 0.016 (3) | 0.022 (3) | 0.020 (3) | 0.002 (2) | 0.009 (2) | 0.001 (2) |
| C47B | 0.012 (2) | 0.030 (3) | 0.022 (3) | −0.001 (2) | 0.010 (2) | −0.001 (3) |
| C48B | 0.025 (3) | 0.022 (3) | 0.020 (3) | −0.004 (2) | 0.016 (2) | −0.004 (2) |
| C49B | 0.019 (3) | 0.019 (3) | 0.026 (3) | 0.003 (2) | 0.015 (2) | 0.004 (2) |
| C50B | 0.016 (2) | 0.021 (3) | 0.016 (3) | −0.003 (2) | 0.010 (2) | −0.006 (2) |
| C51B | 0.014 (2) | 0.019 (3) | 0.021 (3) | 0.001 (2) | 0.010 (2) | 0.001 (2) |
| C52B | 0.012 (2) | 0.015 (3) | 0.020 (3) | −0.0051 (19) | 0.006 (2) | −0.005 (2) |
| C53B | 0.013 (2) | 0.026 (3) | 0.014 (3) | −0.005 (2) | 0.008 (2) | −0.008 (2) |
| Ru1A—C46A | 1.878 (6) | Ru1B—C46B | 1.886 (6) |
| Ru1A—C47A | 1.926 (5) | Ru1B—C45B | 1.929 (6) |
| Ru1A—C45A | 1.930 (6) | Ru1B—C47B | 1.937 (6) |
| Ru1A—As1A | 2.4240 (6) | Ru1B—As2B | 2.4271 (6) |
| Ru1A—Ru2A | 2.8679 (6) | Ru1B—Ru3B | 2.8331 (5) |
| Ru1A—Ru3A | 2.8855 (6) | Ru1B—Ru2B | 2.8558 (6) |
| Ru2A—C49A | 1.905 (6) | Ru2B—C49B | 1.893 (6) |
| Ru2A—C48A | 1.924 (6) | Ru2B—C50B | 1.912 (5) |
| Ru2A—C50A | 1.928 (6) | Ru2B—C48B | 1.924 (6) |
| Ru2A—As2A | 2.4261 (6) | Ru2B—As1B | 2.4308 (6) |
| Ru2A—Ru3A | 2.8395 (5) | Ru2B—Ru3B | 2.8970 (6) |
| Ru3A—C52A | 1.880 (6) | Ru3B—C52B | 1.869 (6) |
| Ru3A—C51A | 1.931 (5) | Ru3B—C53B | 1.927 (5) |
| Ru3A—C53A | 1.948 (5) | Ru3B—C51B | 1.937 (5) |
| Ru3A—P1A | 2.3414 (13) | Ru3B—P1B | 2.3374 (13) |
| As1A—C7A | 1.945 (5) | As1B—C7B | 1.935 (5) |
| As1A—C1A | 1.953 (5) | As1B—C1B | 1.949 (5) |
| As1A—C13A | 1.962 (5) | As1B—C13B | 1.956 (5) |
| As2A—C20A | 1.935 (5) | As2B—C14B | 1.942 (5) |
| As2A—C14A | 1.938 (5) | As2B—C20B | 1.947 (5) |
| As2A—C13A | 1.952 (5) | As2B—C13B | 1.962 (5) |
| P1A—C32A | 1.824 (5) | P1B—C32B | 1.828 (5) |
| P1A—C26A | 1.825 (5) | P1B—C26B | 1.833 (5) |
| P1A—C38A | 1.854 (5) | P1B—C38B | 1.855 (5) |
| O1A—C45A | 1.148 (6) | O1B—C45B | 1.147 (6) |
| O2A—C46A | 1.155 (6) | O2B—C46B | 1.147 (6) |
| O3A—C47A | 1.149 (6) | O3B—C47B | 1.146 (6) |
| O4A—C48A | 1.153 (6) | O4B—C48B | 1.155 (6) |
| O5A—C49A | 1.136 (6) | O5B—C49B | 1.147 (6) |
| O6A—C50A | 1.146 (6) | O6B—C50B | 1.160 (6) |
| O7A—C51A | 1.147 (6) | O7B—C51B | 1.146 (6) |
| O8A—C52A | 1.146 (6) | O8B—C52B | 1.148 (6) |
| O9A—C53A | 1.142 (6) | O9B—C53B | 1.153 (6) |
| C1A—C2A | 1.387 (7) | C1B—C6B | 1.391 (7) |
| C1A—C6A | 1.396 (7) | C1B—C2B | 1.396 (7) |
| C2A—C3A | 1.381 (7) | C2B—C3B | 1.374 (7) |
| C2A—H1 | 0.9300 | C2B—H8 | 0.9300 |
| C3A—C4A | 1.381 (7) | C3B—C4B | 1.393 (7) |
| C3A—H2 | 0.9300 | C3B—H9 | 0.9300 |
| C4A—C5A | 1.372 (8) | C4B—C5B | 1.378 (7) |
| C4A—H3 | 0.9300 | C4B—H10 | 0.9300 |
| C5A—C6A | 1.380 (7) | C5B—C6B | 1.391 (7) |
| C5A—H4 | 0.9300 | C5B—H11 | 0.9300 |
| C6A—H5 | 0.9300 | C6B—H12 | 0.9300 |
| C7A—C8A | 1.394 (7) | C7B—C8B | 1.390 (7) |
| C7A—C12A | 1.399 (7) | C7B—C12B | 1.391 (7) |
| C8A—C9A | 1.378 (7) | C8B—C9B | 1.381 (7) |
| C8A—H6 | 0.9300 | C8B—H13 | 0.9300 |
| C9A—C10A | 1.387 (8) | C9B—C10B | 1.398 (8) |
| C9A—H7 | 0.9300 | C9B—H14 | 0.9300 |
| C10A—C11A | 1.377 (8) | C10B—C11B | 1.384 (8) |
| C10A—H10A | 0.9300 | C10B—H10B | 0.9300 |
| C11A—C12A | 1.384 (7) | C11B—C12B | 1.391 (7) |
| C11A—H11A | 0.9300 | C11B—H11B | 0.9300 |
| C12A—H12A | 0.9300 | C12B—H12B | 0.9300 |
| C13A—H13A | 0.9700 | C13B—H13C | 0.9700 |
| C13A—H13B | 0.9700 | C13B—H13D | 0.9700 |
| C14A—C19A | 1.384 (7) | C14B—C19B | 1.375 (7) |
| C14A—C15A | 1.390 (7) | C14B—C15B | 1.391 (7) |
| C15A—C16A | 1.380 (7) | C15B—C16B | 1.376 (7) |
| C15A—H15A | 0.9300 | C15B—H15B | 0.9300 |
| C16A—C17A | 1.387 (7) | C16B—C17B | 1.386 (8) |
| C16A—H16A | 0.9300 | C16B—H16B | 0.9300 |
| C17A—C18A | 1.381 (7) | C17B—C18B | 1.369 (7) |
| C17A—H17A | 0.9300 | C17B—H17B | 0.9300 |
| C18A—C19A | 1.381 (7) | C18B—C19B | 1.396 (7) |
| C18A—H18A | 0.9300 | C18B—H18B | 0.9300 |
| C19A—H19A | 0.9300 | C19B—H19B | 0.9300 |
| C20A—C21A | 1.376 (7) | C20B—C21B | 1.383 (7) |
| C20A—C25A | 1.396 (7) | C20B—C25B | 1.396 (7) |
| C21A—C22A | 1.405 (7) | C21B—C22B | 1.383 (7) |
| C21A—H21A | 0.9300 | C21B—H21B | 0.9300 |
| C22A—C23A | 1.362 (8) | C22B—C23B | 1.371 (8) |
| C22A—H22A | 0.9300 | C22B—H22B | 0.9300 |
| C23A—C24A | 1.384 (8) | C23B—C24B | 1.393 (8) |
| C23A—H23A | 0.9300 | C23B—H23B | 0.9300 |
| C24A—C25A | 1.380 (8) | C24B—C25B | 1.368 (8) |
| C24A—H24A | 0.9300 | C24B—H24B | 0.9300 |
| C25A—H25A | 0.9300 | C25B—H25B | 0.9300 |
| C26A—C31A | 1.398 (7) | C26B—C31B | 1.382 (7) |
| C26A—C27A | 1.401 (7) | C26B—C27B | 1.395 (7) |
| C27A—C28A | 1.380 (7) | C27B—C28B | 1.381 (7) |
| C27A—H27A | 0.9300 | C27B—H27B | 0.9300 |
| C28A—C29A | 1.378 (7) | C28B—C29B | 1.376 (8) |
| C28A—H28A | 0.9300 | C28B—H28B | 0.9300 |
| C29A—C30A | 1.387 (7) | C29B—C30B | 1.384 (7) |
| C29A—H29A | 0.9300 | C29B—H29B | 0.9300 |
| C30A—C31A | 1.383 (7) | C30B—C31B | 1.392 (7) |
| C30A—H30A | 0.9300 | C30B—H30B | 0.9300 |
| C31A—H31A | 0.9300 | C31B—H31B | 0.9300 |
| C32A—C37A | 1.390 (7) | C32B—C33B | 1.391 (7) |
| C32A—C33A | 1.393 (7) | C32B—C37B | 1.403 (7) |
| C33A—C34A | 1.378 (7) | C33B—C34B | 1.382 (7) |
| C33A—H33A | 0.9300 | C33B—H33B | 0.9300 |
| C34A—C35A | 1.382 (8) | C34B—C35B | 1.380 (8) |
| C34A—H34A | 0.9300 | C34B—H34B | 0.9300 |
| C35A—C36A | 1.392 (8) | C35B—C36B | 1.387 (8) |
| C35A—H35A | 0.9300 | C35B—H35B | 0.9300 |
| C36A—C37A | 1.379 (7) | C36B—C37B | 1.384 (7) |
| C36A—H36A | 0.9300 | C36B—H36B | 0.9300 |
| C37A—H37A | 0.9300 | C37B—H37B | 0.9300 |
| C38A—C39A | 1.514 (7) | C38B—C39B | 1.510 (7) |
| C38A—H38A | 0.9700 | C38B—H38C | 0.9700 |
| C38A—H38B | 0.9700 | C38B—H38D | 0.9700 |
| C39A—C44A | 1.399 (7) | C39B—C40B | 1.383 (7) |
| C39A—C40A | 1.401 (7) | C39B—C44B | 1.404 (7) |
| C40A—C41A | 1.383 (7) | C40B—C41B | 1.387 (7) |
| C40A—H40A | 0.9300 | C40B—H40B | 0.9300 |
| C41A—C42A | 1.380 (8) | C41B—C42B | 1.378 (8) |
| C41A—H41A | 0.9300 | C41B—H41B | 0.9300 |
| C42A—C43A | 1.372 (8) | C42B—C43B | 1.383 (8) |
| C42A—H42A | 0.9300 | C42B—H42B | 0.9300 |
| C43A—C44A | 1.393 (7) | C43B—C44B | 1.391 (7) |
| C43A—H43A | 0.9300 | C43B—H43B | 0.9300 |
| C44A—H44A | 0.9300 | C44B—H44B | 0.9300 |
| C46A—Ru1A—C47A | 87.6 (2) | C46B—Ru1B—C45B | 93.7 (2) |
| C46A—Ru1A—C45A | 92.6 (2) | C46B—Ru1B—C47B | 93.3 (2) |
| C47A—Ru1A—C45A | 172.7 (2) | C45B—Ru1B—C47B | 172.8 (2) |
| C46A—Ru1A—As1A | 98.57 (16) | C46B—Ru1B—As2B | 105.38 (16) |
| C47A—Ru1A—As1A | 94.04 (15) | C45B—Ru1B—As2B | 89.77 (14) |
| C45A—Ru1A—As1A | 93.12 (15) | C47B—Ru1B—As2B | 86.61 (15) |
| C46A—Ru1A—Ru2A | 170.58 (16) | C46B—Ru1B—Ru3B | 96.06 (15) |
| C47A—Ru1A—Ru2A | 95.09 (15) | C45B—Ru1B—Ru3B | 91.56 (14) |
| C45A—Ru1A—Ru2A | 83.59 (16) | C47B—Ru1B—Ru3B | 89.53 (15) |
| As1A—Ru1A—Ru2A | 90.257 (19) | As2B—Ru1B—Ru3B | 158.39 (2) |
| C46A—Ru1A—Ru3A | 112.48 (16) | C46B—Ru1B—Ru2B | 156.29 (15) |
| C47A—Ru1A—Ru3A | 82.32 (15) | C45B—Ru1B—Ru2B | 81.09 (15) |
| C45A—Ru1A—Ru3A | 90.89 (15) | C47B—Ru1B—Ru2B | 93.21 (16) |
| As1A—Ru1A—Ru3A | 148.47 (2) | As2B—Ru1B—Ru2B | 97.74 (2) |
| Ru2A—Ru1A—Ru3A | 59.145 (13) | Ru3B—Ru1B—Ru2B | 61.225 (14) |
| C49A—Ru2A—C48A | 93.1 (2) | C49B—Ru2B—C50B | 88.1 (2) |
| C49A—Ru2A—C50A | 91.9 (2) | C49B—Ru2B—C48B | 91.2 (2) |
| C48A—Ru2A—C50A | 174.9 (2) | C50B—Ru2B—C48B | 172.7 (2) |
| C49A—Ru2A—As2A | 104.90 (15) | C49B—Ru2B—As1B | 99.08 (16) |
| C48A—Ru2A—As2A | 90.66 (15) | C50B—Ru2B—As1B | 94.01 (15) |
| C50A—Ru2A—As2A | 88.01 (15) | C48B—Ru2B—As1B | 93.29 (16) |
| C49A—Ru2A—Ru3A | 98.08 (15) | C49B—Ru2B—Ru1B | 170.15 (16) |
| C48A—Ru2A—Ru3A | 93.17 (15) | C50B—Ru2B—Ru1B | 95.78 (15) |
| C50A—Ru2A—Ru3A | 86.14 (15) | C48B—Ru2B—Ru1B | 83.77 (16) |
| As2A—Ru2A—Ru3A | 156.46 (2) | As1B—Ru2B—Ru1B | 89.711 (19) |
| C49A—Ru2A—Ru1A | 157.34 (15) | C49B—Ru2B—Ru3B | 113.21 (16) |
| C48A—Ru2A—Ru1A | 81.00 (15) | C50B—Ru2B—Ru3B | 78.84 (15) |
| C50A—Ru2A—Ru1A | 94.32 (16) | C48B—Ru2B—Ru3B | 94.76 (16) |
| As2A—Ru2A—Ru1A | 97.08 (2) | As1B—Ru2B—Ru3B | 146.46 (2) |
| Ru3A—Ru2A—Ru1A | 60.736 (14) | Ru1B—Ru2B—Ru3B | 59.003 (14) |
| C52A—Ru3A—C51A | 90.4 (2) | C52B—Ru3B—C53B | 93.0 (2) |
| C52A—Ru3A—C53A | 89.8 (2) | C52B—Ru3B—C51B | 87.9 (2) |
| C51A—Ru3A—C53A | 176.3 (2) | C53B—Ru3B—C51B | 175.2 (2) |
| C52A—Ru3A—P1A | 99.80 (15) | C52B—Ru3B—P1B | 96.66 (15) |
| C51A—Ru3A—P1A | 93.01 (14) | C53B—Ru3B—P1B | 93.83 (15) |
| C53A—Ru3A—P1A | 90.56 (15) | C51B—Ru3B—P1B | 90.74 (15) |
| C52A—Ru3A—Ru2A | 95.69 (15) | C52B—Ru3B—Ru1B | 96.81 (15) |
| C51A—Ru3A—Ru2A | 92.53 (14) | C53B—Ru3B—Ru1B | 90.14 (14) |
| C53A—Ru3A—Ru2A | 83.81 (14) | C51B—Ru3B—Ru1B | 85.09 (15) |
| P1A—Ru3A—Ru2A | 163.50 (4) | P1B—Ru3B—Ru1B | 165.73 (4) |
| C52A—Ru3A—Ru1A | 155.00 (15) | C52B—Ru3B—Ru2B | 155.75 (15) |
| C51A—Ru3A—Ru1A | 84.96 (14) | C53B—Ru3B—Ru2B | 81.65 (15) |
| C53A—Ru3A—Ru1A | 93.33 (15) | C51B—Ru3B—Ru2B | 95.63 (15) |
| P1A—Ru3A—Ru1A | 104.95 (4) | P1B—Ru3B—Ru2B | 107.25 (4) |
| Ru2A—Ru3A—Ru1A | 60.119 (14) | Ru1B—Ru3B—Ru2B | 59.772 (14) |
| C7A—As1A—C1A | 101.7 (2) | C7B—As1B—C1B | 101.7 (2) |
| C7A—As1A—C13A | 104.6 (2) | C7B—As1B—C13B | 103.7 (2) |
| C1A—As1A—C13A | 97.5 (2) | C1B—As1B—C13B | 98.9 (2) |
| C7A—As1A—Ru1A | 117.66 (14) | C7B—As1B—Ru2B | 117.40 (14) |
| C1A—As1A—Ru1A | 117.37 (15) | C1B—As1B—Ru2B | 116.30 (15) |
| C13A—As1A—Ru1A | 115.14 (15) | C13B—As1B—Ru2B | 116.16 (15) |
| C20A—As2A—C14A | 98.3 (2) | C14B—As2B—C20B | 100.2 (2) |
| C20A—As2A—C13A | 102.1 (2) | C14B—As2B—C13B | 104.0 (2) |
| C14A—As2A—C13A | 103.2 (2) | C20B—As2B—C13B | 102.1 (2) |
| C20A—As2A—Ru2A | 116.95 (15) | C14B—As2B—Ru1B | 118.05 (15) |
| C14A—As2A—Ru2A | 120.04 (15) | C20B—As2B—Ru1B | 117.07 (15) |
| C13A—As2A—Ru2A | 113.48 (14) | C13B—As2B—Ru1B | 113.18 (14) |
| C32A—P1A—C26A | 103.3 (2) | C32B—P1B—C26B | 101.9 (2) |
| C32A—P1A—C38A | 102.4 (2) | C32B—P1B—C38B | 102.1 (2) |
| C26A—P1A—C38A | 100.1 (2) | C26B—P1B—C38B | 100.2 (2) |
| C32A—P1A—Ru3A | 113.06 (16) | C32B—P1B—Ru3B | 112.77 (16) |
| C26A—P1A—Ru3A | 120.81 (17) | C26B—P1B—Ru3B | 122.61 (17) |
| C38A—P1A—Ru3A | 114.80 (17) | C38B—P1B—Ru3B | 114.57 (18) |
| C2A—C1A—C6A | 118.6 (5) | C6B—C1B—C2B | 119.0 (5) |
| C2A—C1A—As1A | 118.4 (4) | C6B—C1B—As1B | 122.5 (4) |
| C6A—C1A—As1A | 122.9 (4) | C2B—C1B—As1B | 118.5 (4) |
| C3A—C2A—C1A | 121.4 (5) | C3B—C2B—C1B | 120.9 (5) |
| C3A—C2A—H1 | 119.3 | C3B—C2B—H8 | 119.5 |
| C1A—C2A—H1 | 119.3 | C1B—C2B—H8 | 119.5 |
| C4A—C3A—C2A | 119.2 (5) | C2B—C3B—C4B | 120.1 (5) |
| C4A—C3A—H2 | 120.4 | C2B—C3B—H9 | 119.9 |
| C2A—C3A—H2 | 120.4 | C4B—C3B—H9 | 119.9 |
| C5A—C4A—C3A | 120.2 (5) | C5B—C4B—C3B | 119.2 (5) |
| C5A—C4A—H3 | 119.9 | C5B—C4B—H10 | 120.4 |
| C3A—C4A—H3 | 119.9 | C3B—C4B—H10 | 120.4 |
| C4A—C5A—C6A | 120.8 (5) | C4B—C5B—C6B | 121.0 (5) |
| C4A—C5A—H4 | 119.6 | C4B—C5B—H11 | 119.5 |
| C6A—C5A—H4 | 119.6 | C6B—C5B—H11 | 119.5 |
| C5A—C6A—C1A | 119.8 (5) | C5B—C6B—C1B | 119.7 (5) |
| C5A—C6A—H5 | 120.1 | C5B—C6B—H12 | 120.1 |
| C1A—C6A—H5 | 120.1 | C1B—C6B—H12 | 120.1 |
| C8A—C7A—C12A | 120.0 (5) | C8B—C7B—C12B | 119.2 (5) |
| C8A—C7A—As1A | 117.6 (4) | C8B—C7B—As1B | 117.9 (4) |
| C12A—C7A—As1A | 122.4 (4) | C12B—C7B—As1B | 122.9 (4) |
| C9A—C8A—C7A | 119.9 (5) | C9B—C8B—C7B | 121.2 (5) |
| C9A—C8A—H6 | 120.0 | C9B—C8B—H13 | 119.4 |
| C7A—C8A—H6 | 120.0 | C7B—C8B—H13 | 119.4 |
| C8A—C9A—C10A | 120.0 (6) | C8B—C9B—C10B | 119.3 (5) |
| C8A—C9A—H7 | 120.0 | C8B—C9B—H14 | 120.4 |
| C10A—C9A—H7 | 120.0 | C10B—C9B—H14 | 120.4 |
| C11A—C10A—C9A | 120.2 (5) | C11B—C10B—C9B | 120.1 (5) |
| C11A—C10A—H10A | 119.9 | C11B—C10B—H10B | 120.0 |
| C9A—C10A—H10A | 119.9 | C9B—C10B—H10B | 120.0 |
| C10A—C11A—C12A | 120.7 (5) | C10B—C11B—C12B | 120.2 (5) |
| C10A—C11A—H11A | 119.6 | C10B—C11B—H11B | 119.9 |
| C12A—C11A—H11A | 119.6 | C12B—C11B—H11B | 119.9 |
| C11A—C12A—C7A | 119.1 (5) | C11B—C12B—C7B | 120.1 (5) |
| C11A—C12A—H12A | 120.4 | C11B—C12B—H12B | 120.0 |
| C7A—C12A—H12A | 120.4 | C7B—C12B—H12B | 120.0 |
| As2A—C13A—As1A | 112.3 (2) | As1B—C13B—As2B | 112.6 (2) |
| As2A—C13A—H13A | 109.1 | As1B—C13B—H13C | 109.1 |
| As1A—C13A—H13A | 109.1 | As2B—C13B—H13C | 109.1 |
| As2A—C13A—H13B | 109.1 | As1B—C13B—H13D | 109.1 |
| As1A—C13A—H13B | 109.1 | As2B—C13B—H13D | 109.1 |
| H13A—C13A—H13B | 107.9 | H13C—C13B—H13D | 107.8 |
| C19A—C14A—C15A | 119.5 (5) | C19B—C14B—C15B | 119.6 (5) |
| C19A—C14A—As2A | 119.9 (4) | C19B—C14B—As2B | 120.5 (4) |
| C15A—C14A—As2A | 120.5 (4) | C15B—C14B—As2B | 119.8 (4) |
| C16A—C15A—C14A | 120.1 (5) | C16B—C15B—C14B | 120.0 (5) |
| C16A—C15A—H15A | 120.0 | C16B—C15B—H15B | 120.0 |
| C14A—C15A—H15A | 120.0 | C14B—C15B—H15B | 120.0 |
| C15A—C16A—C17A | 120.0 (5) | C15B—C16B—C17B | 120.6 (5) |
| C15A—C16A—H16A | 120.0 | C15B—C16B—H16B | 119.7 |
| C17A—C16A—H16A | 120.0 | C17B—C16B—H16B | 119.7 |
| C18A—C17A—C16A | 120.0 (5) | C18B—C17B—C16B | 119.3 (5) |
| C18A—C17A—H17A | 120.0 | C18B—C17B—H17B | 120.3 |
| C16A—C17A—H17A | 120.0 | C16B—C17B—H17B | 120.3 |
| C19A—C18A—C17A | 119.9 (5) | C17B—C18B—C19B | 120.6 (5) |
| C19A—C18A—H18A | 120.0 | C17B—C18B—H18B | 119.7 |
| C17A—C18A—H18A | 120.0 | C19B—C18B—H18B | 119.7 |
| C18A—C19A—C14A | 120.5 (5) | C14B—C19B—C18B | 119.8 (5) |
| C18A—C19A—H19A | 119.8 | C14B—C19B—H19B | 120.1 |
| C14A—C19A—H19A | 119.8 | C18B—C19B—H19B | 120.1 |
| C21A—C20A—C25A | 119.1 (5) | C21B—C20B—C25B | 118.9 (5) |
| C21A—C20A—As2A | 124.1 (4) | C21B—C20B—As2B | 123.9 (4) |
| C25A—C20A—As2A | 116.6 (4) | C25B—C20B—As2B | 117.2 (4) |
| C20A—C21A—C22A | 119.9 (5) | C22B—C21B—C20B | 120.4 (5) |
| C20A—C21A—H21A | 120.0 | C22B—C21B—H21B | 119.8 |
| C22A—C21A—H21A | 120.0 | C20B—C21B—H21B | 119.8 |
| C23A—C22A—C21A | 120.6 (5) | C23B—C22B—C21B | 120.9 (5) |
| C23A—C22A—H22A | 119.7 | C23B—C22B—H22B | 119.6 |
| C21A—C22A—H22A | 119.7 | C21B—C22B—H22B | 119.6 |
| C22A—C23A—C24A | 119.5 (5) | C22B—C23B—C24B | 118.8 (5) |
| C22A—C23A—H23A | 120.2 | C22B—C23B—H23B | 120.6 |
| C24A—C23A—H23A | 120.2 | C24B—C23B—H23B | 120.6 |
| C25A—C24A—C23A | 120.5 (6) | C25B—C24B—C23B | 120.9 (5) |
| C25A—C24A—H24A | 119.7 | C25B—C24B—H24B | 119.5 |
| C23A—C24A—H24A | 119.7 | C23B—C24B—H24B | 119.5 |
| C24A—C25A—C20A | 120.2 (5) | C24B—C25B—C20B | 120.2 (5) |
| C24A—C25A—H25A | 119.9 | C24B—C25B—H25B | 119.9 |
| C20A—C25A—H25A | 119.9 | C20B—C25B—H25B | 119.9 |
| C31A—C26A—C27A | 117.5 (5) | C31B—C26B—C27B | 119.1 (5) |
| C31A—C26A—P1A | 121.0 (4) | C31B—C26B—P1B | 120.6 (4) |
| C27A—C26A—P1A | 121.1 (4) | C27B—C26B—P1B | 120.2 (4) |
| C28A—C27A—C26A | 120.9 (5) | C28B—C27B—C26B | 120.4 (5) |
| C28A—C27A—H27A | 119.6 | C28B—C27B—H27B | 119.8 |
| C26A—C27A—H27A | 119.6 | C26B—C27B—H27B | 119.8 |
| C29A—C28A—C27A | 120.6 (5) | C29B—C28B—C27B | 120.2 (5) |
| C29A—C28A—H28A | 119.7 | C29B—C28B—H28B | 119.9 |
| C27A—C28A—H28A | 119.7 | C27B—C28B—H28B | 119.9 |
| C28A—C29A—C30A | 119.8 (5) | C28B—C29B—C30B | 120.1 (5) |
| C28A—C29A—H29A | 120.1 | C28B—C29B—H29B | 119.9 |
| C30A—C29A—H29A | 120.1 | C30B—C29B—H29B | 119.9 |
| C31A—C30A—C29A | 119.5 (5) | C29B—C30B—C31B | 119.8 (5) |
| C31A—C30A—H30A | 120.2 | C29B—C30B—H30B | 120.1 |
| C29A—C30A—H30A | 120.2 | C31B—C30B—H30B | 120.1 |
| C30A—C31A—C26A | 121.6 (5) | C26B—C31B—C30B | 120.4 (5) |
| C30A—C31A—H31A | 119.2 | C26B—C31B—H31B | 119.8 |
| C26A—C31A—H31A | 119.2 | C30B—C31B—H31B | 119.8 |
| C37A—C32A—C33A | 118.0 (5) | C33B—C32B—C37B | 118.3 (5) |
| C37A—C32A—P1A | 119.7 (4) | C33B—C32B—P1B | 120.6 (4) |
| C33A—C32A—P1A | 121.9 (4) | C37B—C32B—P1B | 121.0 (4) |
| C34A—C33A—C32A | 120.9 (6) | C34B—C33B—C32B | 121.4 (5) |
| C34A—C33A—H33A | 119.6 | C34B—C33B—H33B | 119.3 |
| C32A—C33A—H33A | 119.6 | C32B—C33B—H33B | 119.3 |
| C33A—C34A—C35A | 120.3 (5) | C35B—C34B—C33B | 119.5 (5) |
| C33A—C34A—H34A | 119.8 | C35B—C34B—H34B | 120.2 |
| C35A—C34A—H34A | 119.8 | C33B—C34B—H34B | 120.2 |
| C34A—C35A—C36A | 119.8 (5) | C34B—C35B—C36B | 120.5 (5) |
| C34A—C35A—H35A | 120.1 | C34B—C35B—H35B | 119.8 |
| C36A—C35A—H35A | 120.1 | C36B—C35B—H35B | 119.8 |
| C37A—C36A—C35A | 119.3 (5) | C37B—C36B—C35B | 119.9 (5) |
| C37A—C36A—H36A | 120.3 | C37B—C36B—H36B | 120.0 |
| C35A—C36A—H36A | 120.3 | C35B—C36B—H36B | 120.0 |
| C36A—C37A—C32A | 121.7 (5) | C36B—C37B—C32B | 120.4 (5) |
| C36A—C37A—H37A | 119.2 | C36B—C37B—H37B | 119.8 |
| C32A—C37A—H37A | 119.2 | C32B—C37B—H37B | 119.8 |
| C39A—C38A—P1A | 113.5 (3) | C39B—C38B—P1B | 115.4 (3) |
| C39A—C38A—H38A | 108.9 | C39B—C38B—H38C | 108.4 |
| P1A—C38A—H38A | 108.9 | P1B—C38B—H38C | 108.4 |
| C39A—C38A—H38B | 108.9 | C39B—C38B—H38D | 108.4 |
| P1A—C38A—H38B | 108.9 | P1B—C38B—H38D | 108.4 |
| H38A—C38A—H38B | 107.7 | H38C—C38B—H38D | 107.5 |
| C44A—C39A—C40A | 118.1 (5) | C40B—C39B—C44B | 117.9 (5) |
| C44A—C39A—C38A | 120.3 (5) | C40B—C39B—C38B | 121.7 (4) |
| C40A—C39A—C38A | 121.6 (5) | C44B—C39B—C38B | 120.3 (5) |
| C41A—C40A—C39A | 120.1 (5) | C39B—C40B—C41B | 121.0 (5) |
| C41A—C40A—H40A | 119.9 | C39B—C40B—H40B | 119.5 |
| C39A—C40A—H40A | 119.9 | C41B—C40B—H40B | 119.5 |
| C42A—C41A—C40A | 121.1 (5) | C42B—C41B—C40B | 120.7 (6) |
| C42A—C41A—H41A | 119.5 | C42B—C41B—H41B | 119.6 |
| C40A—C41A—H41A | 119.5 | C40B—C41B—H41B | 119.6 |
| C43A—C42A—C41A | 119.6 (5) | C41B—C42B—C43B | 119.4 (5) |
| C43A—C42A—H42A | 120.2 | C41B—C42B—H42B | 120.3 |
| C41A—C42A—H42A | 120.2 | C43B—C42B—H42B | 120.3 |
| C42A—C43A—C44A | 120.2 (5) | C42B—C43B—C44B | 120.0 (5) |
| C42A—C43A—H43A | 119.9 | C42B—C43B—H43B | 120.0 |
| C44A—C43A—H43A | 119.9 | C44B—C43B—H43B | 120.0 |
| C43A—C44A—C39A | 120.8 (5) | C43B—C44B—C39B | 120.9 (5) |
| C43A—C44A—H44A | 119.6 | C43B—C44B—H44B | 119.5 |
| C39A—C44A—H44A | 119.6 | C39B—C44B—H44B | 119.5 |
| O1A—C45A—Ru1A | 173.1 (5) | O1B—C45B—Ru1B | 174.1 (4) |
| O2A—C46A—Ru1A | 176.5 (5) | O2B—C46B—Ru1B | 176.5 (5) |
| O3A—C47A—Ru1A | 171.6 (4) | O3B—C47B—Ru1B | 173.1 (5) |
| O4A—C48A—Ru2A | 173.5 (4) | O4B—C48B—Ru2B | 173.8 (5) |
| O5A—C49A—Ru2A | 176.2 (5) | O5B—C49B—Ru2B | 177.5 (5) |
| O6A—C50A—Ru2A | 174.3 (4) | O6B—C50B—Ru2B | 170.7 (4) |
| O7A—C51A—Ru3A | 173.4 (4) | O7B—C51B—Ru3B | 172.4 (5) |
| O8A—C52A—Ru3A | 176.6 (5) | O8B—C52B—Ru3B | 179.4 (5) |
| O9A—C53A—Ru3A | 173.3 (4) | O9B—C53B—Ru3B | 173.2 (4) |
| C47A—Ru1A—Ru2A—C49A | −55.4 (4) | C46B—Ru1B—Ru2B—C50B | 55.2 (4) |
| C45A—Ru1A—Ru2A—C49A | 117.4 (4) | C45B—Ru1B—Ru2B—C50B | −23.5 (2) |
| As1A—Ru1A—Ru2A—C49A | −149.5 (4) | C47B—Ru1B—Ru2B—C50B | 161.0 (2) |
| Ru3A—Ru1A—Ru2A—C49A | 22.5 (4) | As2B—Ru1B—Ru2B—C50B | −112.02 (15) |
| C47A—Ru1A—Ru2A—C48A | 20.9 (2) | Ru3B—Ru1B—Ru2B—C50B | 73.27 (15) |
| C45A—Ru1A—Ru2A—C48A | −166.3 (2) | C46B—Ru1B—Ru2B—C48B | −117.4 (4) |
| As1A—Ru1A—Ru2A—C48A | −73.19 (15) | C45B—Ru1B—Ru2B—C48B | 163.9 (2) |
| Ru3A—Ru1A—Ru2A—C48A | 98.80 (15) | C47B—Ru1B—Ru2B—C48B | −11.7 (2) |
| C47A—Ru1A—Ru2A—C50A | −161.0 (2) | As2B—Ru1B—Ru2B—C48B | 75.34 (16) |
| C45A—Ru1A—Ru2A—C50A | 11.8 (2) | Ru3B—Ru1B—Ru2B—C48B | −99.38 (16) |
| As1A—Ru1A—Ru2A—C50A | 104.88 (15) | C46B—Ru1B—Ru2B—As1B | 149.2 (4) |
| Ru3A—Ru1A—Ru2A—C50A | −83.13 (15) | C45B—Ru1B—Ru2B—As1B | 70.53 (14) |
| C47A—Ru1A—Ru2A—As2A | 110.44 (15) | C47B—Ru1B—Ru2B—As1B | −105.03 (15) |
| C45A—Ru1A—Ru2A—As2A | −76.75 (15) | As2B—Ru1B—Ru2B—As1B | −18.01 (2) |
| As1A—Ru1A—Ru2A—As2A | 16.36 (2) | Ru3B—Ru1B—Ru2B—As1B | 167.27 (2) |
| Ru3A—Ru1A—Ru2A—As2A | −171.65 (2) | C46B—Ru1B—Ru2B—Ru3B | −18.0 (4) |
| C47A—Ru1A—Ru2A—Ru3A | −77.91 (15) | C45B—Ru1B—Ru2B—Ru3B | −96.75 (14) |
| C45A—Ru1A—Ru2A—Ru3A | 94.90 (15) | C47B—Ru1B—Ru2B—Ru3B | 87.70 (15) |
| As1A—Ru1A—Ru2A—Ru3A | −171.99 (2) | As2B—Ru1B—Ru2B—Ru3B | 174.72 (2) |
| C49A—Ru2A—Ru3A—C52A | 15.2 (2) | C46B—Ru1B—Ru3B—C52B | −13.9 (2) |
| C48A—Ru2A—Ru3A—C52A | 108.8 (2) | C45B—Ru1B—Ru3B—C52B | −107.8 (2) |
| C50A—Ru2A—Ru3A—C52A | −76.2 (2) | C47B—Ru1B—Ru3B—C52B | 79.4 (2) |
| As2A—Ru2A—Ru3A—C52A | −152.18 (16) | As2B—Ru1B—Ru3B—C52B | 158.95 (16) |
| Ru1A—Ru2A—Ru3A—C52A | −173.33 (15) | Ru2B—Ru1B—Ru3B—C52B | 173.30 (15) |
| C49A—Ru2A—Ru3A—C51A | 105.8 (2) | C46B—Ru1B—Ru3B—C53B | −107.0 (2) |
| C48A—Ru2A—Ru3A—C51A | −160.6 (2) | C45B—Ru1B—Ru3B—C53B | 159.2 (2) |
| C50A—Ru2A—Ru3A—C51A | 14.4 (2) | C47B—Ru1B—Ru3B—C53B | −13.7 (2) |
| As2A—Ru2A—Ru3A—C51A | −61.56 (16) | As2B—Ru1B—Ru3B—C53B | 65.89 (16) |
| Ru1A—Ru2A—Ru3A—C51A | −82.71 (15) | Ru2B—Ru1B—Ru3B—C53B | 80.24 (15) |
| C49A—Ru2A—Ru3A—C53A | −74.0 (2) | C46B—Ru1B—Ru3B—C51B | 73.4 (2) |
| C48A—Ru2A—Ru3A—C53A | 19.6 (2) | C45B—Ru1B—Ru3B—C51B | −20.5 (2) |
| C50A—Ru2A—Ru3A—C53A | −165.4 (2) | C47B—Ru1B—Ru3B—C51B | 166.6 (2) |
| As2A—Ru2A—Ru3A—C53A | 118.60 (16) | As2B—Ru1B—Ru3B—C51B | −113.79 (17) |
| Ru1A—Ru2A—Ru3A—C53A | 97.45 (15) | Ru2B—Ru1B—Ru3B—C51B | −99.44 (16) |
| C49A—Ru2A—Ru3A—P1A | −144.6 (2) | C46B—Ru1B—Ru3B—P1B | 146.8 (2) |
| C48A—Ru2A—Ru3A—P1A | −51.0 (2) | C45B—Ru1B—Ru3B—P1B | 52.9 (2) |
| C50A—Ru2A—Ru3A—P1A | 124.0 (2) | C47B—Ru1B—Ru3B—P1B | −120.0 (2) |
| As2A—Ru2A—Ru3A—P1A | 47.96 (15) | As2B—Ru1B—Ru3B—P1B | −40.38 (17) |
| Ru1A—Ru2A—Ru3A—P1A | 26.81 (13) | Ru2B—Ru1B—Ru3B—P1B | −26.04 (15) |
| C49A—Ru2A—Ru3A—Ru1A | −171.45 (16) | C46B—Ru1B—Ru3B—Ru2B | 172.81 (16) |
| C48A—Ru2A—Ru3A—Ru1A | −77.84 (16) | C45B—Ru1B—Ru3B—Ru2B | 78.95 (15) |
| C50A—Ru2A—Ru3A—Ru1A | 97.14 (16) | C47B—Ru1B—Ru3B—Ru2B | −93.92 (16) |
| As2A—Ru2A—Ru3A—Ru1A | 21.15 (5) | As2B—Ru1B—Ru3B—Ru2B | −14.35 (6) |
| C46A—Ru1A—Ru3A—C52A | −159.3 (4) | C49B—Ru2B—Ru3B—C52B | 156.8 (4) |
| C47A—Ru1A—Ru3A—C52A | 116.5 (4) | C50B—Ru2B—Ru3B—C52B | −120.2 (4) |
| C45A—Ru1A—Ru3A—C52A | −66.1 (4) | C48B—Ru2B—Ru3B—C52B | 63.4 (4) |
| As1A—Ru1A—Ru3A—C52A | 31.3 (4) | As1B—Ru2B—Ru3B—C52B | −39.9 (4) |
| Ru2A—Ru1A—Ru3A—C52A | 15.9 (3) | Ru1B—Ru2B—Ru3B—C52B | −16.4 (4) |
| C46A—Ru1A—Ru3A—C51A | −79.3 (2) | C49B—Ru2B—Ru3B—C53B | 78.1 (2) |
| C47A—Ru1A—Ru3A—C51A | −163.5 (2) | C50B—Ru2B—Ru3B—C53B | 161.1 (2) |
| C45A—Ru1A—Ru3A—C51A | 13.9 (2) | C48B—Ru2B—Ru3B—C53B | −15.3 (2) |
| As1A—Ru1A—Ru3A—C51A | 111.30 (15) | As1B—Ru2B—Ru3B—C53B | −118.56 (15) |
| Ru2A—Ru1A—Ru3A—C51A | 95.84 (14) | Ru1B—Ru2B—Ru3B—C53B | −95.07 (15) |
| C46A—Ru1A—Ru3A—C53A | 103.9 (2) | C49B—Ru2B—Ru3B—C51B | −105.8 (2) |
| C47A—Ru1A—Ru3A—C53A | 19.7 (2) | C50B—Ru2B—Ru3B—C51B | −22.8 (2) |
| C45A—Ru1A—Ru3A—C53A | −162.9 (2) | C48B—Ru2B—Ru3B—C51B | 160.8 (2) |
| As1A—Ru1A—Ru3A—C53A | −65.45 (15) | As1B—Ru2B—Ru3B—C51B | 57.47 (16) |
| Ru2A—Ru1A—Ru3A—C53A | −80.91 (15) | Ru1B—Ru2B—Ru3B—C51B | 80.97 (15) |
| C46A—Ru1A—Ru3A—P1A | 12.45 (18) | C49B—Ru2B—Ru3B—P1B | −13.29 (17) |
| C47A—Ru1A—Ru3A—P1A | −71.73 (15) | C50B—Ru2B—Ru3B—P1B | 69.71 (15) |
| C45A—Ru1A—Ru3A—P1A | 105.63 (16) | C48B—Ru2B—Ru3B—P1B | −106.70 (16) |
| As1A—Ru1A—Ru3A—P1A | −156.93 (5) | As1B—Ru2B—Ru3B—P1B | 150.00 (5) |
| Ru2A—Ru1A—Ru3A—P1A | −172.38 (4) | Ru1B—Ru2B—Ru3B—P1B | 173.50 (4) |
| C46A—Ru1A—Ru3A—Ru2A | −175.17 (17) | C49B—Ru2B—Ru3B—Ru1B | 173.21 (17) |
| C47A—Ru1A—Ru3A—Ru2A | 100.66 (15) | C50B—Ru2B—Ru3B—Ru1B | −103.79 (15) |
| C45A—Ru1A—Ru3A—Ru2A | −81.99 (16) | C48B—Ru2B—Ru3B—Ru1B | 79.80 (16) |
| As1A—Ru1A—Ru3A—Ru2A | 15.46 (4) | As1B—Ru2B—Ru3B—Ru1B | −23.50 (4) |
| C46A—Ru1A—As1A—C7A | −91.6 (2) | C49B—Ru2B—As1B—C7B | 93.1 (2) |
| C47A—Ru1A—As1A—C7A | −3.4 (2) | C50B—Ru2B—As1B—C7B | 4.4 (2) |
| C45A—Ru1A—As1A—C7A | 175.3 (2) | C48B—Ru2B—As1B—C7B | −175.2 (2) |
| Ru2A—Ru1A—As1A—C7A | 91.74 (18) | Ru1B—Ru2B—As1B—C7B | −91.41 (17) |
| Ru3A—Ru1A—As1A—C7A | 78.52 (18) | Ru3B—Ru2B—As1B—C7B | −71.42 (17) |
| C46A—Ru1A—As1A—C1A | 30.4 (2) | C49B—Ru2B—As1B—C1B | −27.7 (2) |
| C47A—Ru1A—As1A—C1A | 118.6 (2) | C50B—Ru2B—As1B—C1B | −116.4 (2) |
| C45A—Ru1A—As1A—C1A | −62.7 (2) | C48B—Ru2B—As1B—C1B | 64.1 (2) |
| Ru2A—Ru1A—As1A—C1A | −146.32 (16) | Ru1B—Ru2B—As1B—C1B | 147.84 (17) |
| Ru3A—Ru1A—As1A—C1A | −159.54 (16) | Ru3B—Ru2B—As1B—C1B | 167.82 (17) |
| C46A—Ru1A—As1A—C13A | 144.3 (2) | C49B—Ru2B—As1B—C13B | −143.5 (2) |
| C47A—Ru1A—As1A—C13A | −127.5 (2) | C50B—Ru2B—As1B—C13B | 127.8 (2) |
| C45A—Ru1A—As1A—C13A | 51.2 (2) | C48B—Ru2B—As1B—C13B | −51.7 (2) |
| Ru2A—Ru1A—As1A—C13A | −32.36 (15) | Ru1B—Ru2B—As1B—C13B | 32.06 (16) |
| Ru3A—Ru1A—As1A—C13A | −45.58 (16) | Ru3B—Ru2B—As1B—C13B | 52.04 (17) |
| C49A—Ru2A—As2A—C20A | −67.3 (2) | C46B—Ru1B—As2B—C14B | −48.8 (2) |
| C48A—Ru2A—As2A—C20A | −160.7 (2) | C45B—Ru1B—As2B—C14B | 45.0 (2) |
| C50A—Ru2A—As2A—C20A | 24.2 (2) | C47B—Ru1B—As2B—C14B | −141.3 (2) |
| Ru3A—Ru2A—As2A—C20A | 99.81 (18) | Ru3B—Ru1B—As2B—C14B | 138.59 (17) |
| Ru1A—Ru2A—As2A—C20A | 118.31 (17) | Ru2B—Ru1B—As2B—C14B | 125.93 (17) |
| C49A—Ru2A—As2A—C14A | 51.5 (2) | C46B—Ru1B—As2B—C20B | 71.0 (2) |
| C48A—Ru2A—As2A—C14A | −41.9 (2) | C45B—Ru1B—As2B—C20B | 164.7 (2) |
| C50A—Ru2A—As2A—C14A | 143.0 (2) | C47B—Ru1B—As2B—C20B | −21.5 (2) |
| Ru3A—Ru2A—As2A—C14A | −141.37 (18) | Ru3B—Ru1B—As2B—C20B | −101.62 (19) |
| Ru1A—Ru2A—As2A—C14A | −122.88 (18) | Ru2B—Ru1B—As2B—C20B | −114.28 (18) |
| C49A—Ru2A—As2A—C13A | 174.2 (2) | C46B—Ru1B—As2B—C13B | −170.6 (2) |
| C48A—Ru2A—As2A—C13A | 80.8 (2) | C45B—Ru1B—As2B—C13B | −76.9 (2) |
| C50A—Ru2A—As2A—C13A | −94.3 (2) | C47B—Ru1B—As2B—C13B | 96.9 (2) |
| Ru3A—Ru2A—As2A—C13A | −18.73 (17) | Ru3B—Ru1B—As2B—C13B | 16.78 (18) |
| Ru1A—Ru2A—As2A—C13A | −0.23 (16) | Ru2B—Ru1B—As2B—C13B | 4.12 (16) |
| C52A—Ru3A—P1A—C32A | −94.6 (2) | C52B—Ru3B—P1B—C32B | 93.2 (2) |
| C51A—Ru3A—P1A—C32A | 174.5 (2) | C53B—Ru3B—P1B—C32B | −173.3 (2) |
| C53A—Ru3A—P1A—C32A | −4.7 (2) | C51B—Ru3B—P1B—C32B | 5.3 (2) |
| Ru2A—Ru3A—P1A—C32A | 65.0 (2) | Ru1B—Ru3B—P1B—C32B | −67.5 (3) |
| Ru1A—Ru3A—P1A—C32A | 88.89 (19) | Ru2B—Ru3B—P1B—C32B | −90.86 (19) |
| C52A—Ru3A—P1A—C26A | 142.4 (2) | C52B—Ru3B—P1B—C26B | −144.6 (2) |
| C51A—Ru3A—P1A—C26A | 51.5 (2) | C53B—Ru3B—P1B—C26B | −51.1 (2) |
| C53A—Ru3A—P1A—C26A | −127.7 (2) | C51B—Ru3B—P1B—C26B | 127.5 (2) |
| Ru2A—Ru3A—P1A—C26A | −58.0 (2) | Ru1B—Ru3B—P1B—C26B | 54.8 (3) |
| Ru1A—Ru3A—P1A—C26A | −34.08 (19) | Ru2B—Ru3B—P1B—C26B | 31.4 (2) |
| C52A—Ru3A—P1A—C38A | 22.4 (2) | C52B—Ru3B—P1B—C38B | −23.0 (2) |
| C51A—Ru3A—P1A—C38A | −68.5 (2) | C53B—Ru3B—P1B—C38B | 70.5 (2) |
| C53A—Ru3A—P1A—C38A | 112.3 (2) | C51B—Ru3B—P1B—C38B | −111.0 (2) |
| Ru2A—Ru3A—P1A—C38A | −177.95 (18) | Ru1B—Ru3B—P1B—C38B | 176.30 (19) |
| Ru1A—Ru3A—P1A—C38A | −154.08 (17) | Ru2B—Ru3B—P1B—C38B | 152.90 (17) |
| C7A—As1A—C1A—C2A | 153.9 (4) | C7B—As1B—C1B—C6B | 26.2 (5) |
| C13A—As1A—C1A—C2A | −99.4 (4) | C13B—As1B—C1B—C6B | −79.9 (4) |
| Ru1A—As1A—C1A—C2A | 24.0 (4) | Ru2B—As1B—C1B—C6B | 155.0 (4) |
| C7A—As1A—C1A—C6A | −30.5 (5) | C7B—As1B—C1B—C2B | −156.0 (4) |
| C13A—As1A—C1A—C6A | 76.2 (4) | C13B—As1B—C1B—C2B | 97.9 (4) |
| Ru1A—As1A—C1A—C6A | −160.4 (4) | Ru2B—As1B—C1B—C2B | −27.2 (4) |
| C6A—C1A—C2A—C3A | 0.9 (8) | C6B—C1B—C2B—C3B | 0.4 (8) |
| As1A—C1A—C2A—C3A | 176.7 (4) | As1B—C1B—C2B—C3B | −177.5 (4) |
| C1A—C2A—C3A—C4A | −0.8 (8) | C1B—C2B—C3B—C4B | 0.0 (8) |
| C2A—C3A—C4A—C5A | 0.2 (8) | C2B—C3B—C4B—C5B | −0.4 (8) |
| C3A—C4A—C5A—C6A | 0.5 (8) | C3B—C4B—C5B—C6B | 0.5 (8) |
| C4A—C5A—C6A—C1A | −0.4 (8) | C4B—C5B—C6B—C1B | −0.2 (8) |
| C2A—C1A—C6A—C5A | −0.2 (8) | C2B—C1B—C6B—C5B | −0.3 (8) |
| As1A—C1A—C6A—C5A | −175.8 (4) | As1B—C1B—C6B—C5B | 177.5 (4) |
| C1A—As1A—C7A—C8A | −65.2 (4) | C1B—As1B—C7B—C8B | 62.4 (4) |
| C13A—As1A—C7A—C8A | −166.3 (4) | C13B—As1B—C7B—C8B | 164.7 (4) |
| Ru1A—As1A—C7A—C8A | 64.5 (4) | Ru2B—As1B—C7B—C8B | −65.8 (4) |
| C1A—As1A—C7A—C12A | 117.6 (4) | C1B—As1B—C7B—C12B | −118.9 (4) |
| C13A—As1A—C7A—C12A | 16.5 (5) | C13B—As1B—C7B—C12B | −16.6 (5) |
| Ru1A—As1A—C7A—C12A | −112.7 (4) | Ru2B—As1B—C7B—C12B | 113.0 (4) |
| C12A—C7A—C8A—C9A | −1.4 (8) | C12B—C7B—C8B—C9B | 1.2 (8) |
| As1A—C7A—C8A—C9A | −178.6 (4) | As1B—C7B—C8B—C9B | −180.0 (4) |
| C7A—C8A—C9A—C10A | 1.3 (8) | C7B—C8B—C9B—C10B | −0.3 (8) |
| C8A—C9A—C10A—C11A | 0.0 (9) | C8B—C9B—C10B—C11B | −0.9 (8) |
| C9A—C10A—C11A—C12A | −1.3 (9) | C9B—C10B—C11B—C12B | 1.2 (9) |
| C10A—C11A—C12A—C7A | 1.2 (8) | C10B—C11B—C12B—C7B | −0.3 (8) |
| C8A—C7A—C12A—C11A | 0.1 (8) | C8B—C7B—C12B—C11B | −0.9 (8) |
| As1A—C7A—C12A—C11A | 177.2 (4) | As1B—C7B—C12B—C11B | −179.7 (4) |
| C20A—As2A—C13A—As1A | −148.4 (2) | C7B—As1B—C13B—As2B | 94.8 (3) |
| C14A—As2A—C13A—As1A | 109.8 (3) | C1B—As1B—C13B—As2B | −160.8 (3) |
| Ru2A—As2A—C13A—As1A | −21.7 (3) | Ru2B—As1B—C13B—As2B | −35.6 (3) |
| C7A—As1A—C13A—As2A | −92.1 (3) | C14B—As2B—C13B—As1B | −112.5 (3) |
| C1A—As1A—C13A—As2A | 163.7 (3) | C20B—As2B—C13B—As1B | 143.7 (2) |
| Ru1A—As1A—C13A—As2A | 38.6 (3) | Ru1B—As2B—C13B—As1B | 16.9 (3) |
| C20A—As2A—C14A—C19A | −56.5 (5) | C20B—As2B—C14B—C19B | −122.3 (4) |
| C13A—As2A—C14A—C19A | 48.2 (5) | C13B—As2B—C14B—C19B | 132.3 (4) |
| Ru2A—As2A—C14A—C19A | 175.7 (4) | Ru1B—As2B—C14B—C19B | 6.0 (5) |
| C20A—As2A—C14A—C15A | 118.7 (4) | C20B—As2B—C14B—C15B | 53.7 (5) |
| C13A—As2A—C14A—C15A | −136.7 (4) | C13B—As2B—C14B—C15B | −51.7 (5) |
| Ru2A—As2A—C14A—C15A | −9.2 (5) | Ru1B—As2B—C14B—C15B | −178.0 (4) |
| C19A—C14A—C15A—C16A | −2.7 (8) | C19B—C14B—C15B—C16B | −3.2 (9) |
| As2A—C14A—C15A—C16A | −177.9 (4) | As2B—C14B—C15B—C16B | −179.3 (5) |
| C14A—C15A—C16A—C17A | 1.6 (8) | C14B—C15B—C16B—C17B | 2.0 (10) |
| C15A—C16A—C17A—C18A | −0.4 (8) | C15B—C16B—C17B—C18B | −0.1 (10) |
| C16A—C17A—C18A—C19A | 0.2 (9) | C16B—C17B—C18B—C19B | −0.6 (9) |
| C17A—C18A—C19A—C14A | −1.3 (9) | C15B—C14B—C19B—C18B | 2.5 (8) |
| C15A—C14A—C19A—C18A | 2.5 (9) | As2B—C14B—C19B—C18B | 178.5 (4) |
| As2A—C14A—C19A—C18A | 177.7 (5) | C17B—C18B—C19B—C14B | −0.6 (8) |
| C14A—As2A—C20A—C21A | 97.1 (5) | C14B—As2B—C20B—C21B | −127.7 (4) |
| C13A—As2A—C20A—C21A | −8.4 (5) | C13B—As2B—C20B—C21B | −20.8 (5) |
| Ru2A—As2A—C20A—C21A | −132.9 (4) | Ru1B—As2B—C20B—C21B | 103.4 (4) |
| C14A—As2A—C20A—C25A | −79.1 (4) | C14B—As2B—C20B—C25B | 54.5 (4) |
| C13A—As2A—C20A—C25A | 175.4 (4) | C13B—As2B—C20B—C25B | 161.4 (4) |
| Ru2A—As2A—C20A—C25A | 50.9 (4) | Ru1B—As2B—C20B—C25B | −74.4 (4) |
| C25A—C20A—C21A—C22A | −2.1 (8) | C25B—C20B—C21B—C22B | 0.2 (8) |
| As2A—C20A—C21A—C22A | −178.2 (4) | As2B—C20B—C21B—C22B | −177.6 (4) |
| C20A—C21A—C22A—C23A | 1.2 (9) | C20B—C21B—C22B—C23B | −0.1 (9) |
| C21A—C22A—C23A—C24A | 0.9 (9) | C21B—C22B—C23B—C24B | −0.1 (9) |
| C22A—C23A—C24A—C25A | −2.2 (9) | C22B—C23B—C24B—C25B | 0.1 (9) |
| C23A—C24A—C25A—C20A | 1.3 (8) | C23B—C24B—C25B—C20B | 0.0 (9) |
| C21A—C20A—C25A—C24A | 0.9 (8) | C21B—C20B—C25B—C24B | −0.1 (8) |
| As2A—C20A—C25A—C24A | 177.3 (4) | As2B—C20B—C25B—C24B | 177.8 (5) |
| C32A—P1A—C26A—C31A | −150.9 (4) | C32B—P1B—C26B—C31B | 149.0 (4) |
| C38A—P1A—C26A—C31A | 103.7 (4) | C38B—P1B—C26B—C31B | −106.2 (4) |
| Ru3A—P1A—C26A—C31A | −23.4 (5) | Ru3B—P1B—C26B—C31B | 21.8 (5) |
| C32A—P1A—C26A—C27A | 37.1 (5) | C32B—P1B—C26B—C27B | −34.8 (5) |
| C38A—P1A—C26A—C27A | −68.4 (4) | C38B—P1B—C26B—C27B | 70.0 (5) |
| Ru3A—P1A—C26A—C27A | 164.6 (3) | Ru3B—P1B—C26B—C27B | −161.9 (3) |
| C31A—C26A—C27A—C28A | −0.4 (8) | C31B—C26B—C27B—C28B | 0.1 (8) |
| P1A—C26A—C27A—C28A | 171.9 (4) | P1B—C26B—C27B—C28B | −176.2 (4) |
| C26A—C27A—C28A—C29A | −0.7 (8) | C26B—C27B—C28B—C29B | −0.4 (8) |
| C27A—C28A—C29A—C30A | 1.1 (8) | C27B—C28B—C29B—C30B | 0.8 (8) |
| C28A—C29A—C30A—C31A | −0.4 (8) | C28B—C29B—C30B—C31B | −1.0 (8) |
| C29A—C30A—C31A—C26A | −0.7 (8) | C27B—C26B—C31B—C30B | −0.3 (8) |
| C27A—C26A—C31A—C30A | 1.1 (8) | P1B—C26B—C31B—C30B | 176.1 (4) |
| P1A—C26A—C31A—C30A | −171.2 (4) | C29B—C30B—C31B—C26B | 0.7 (8) |
| C26A—P1A—C32A—C37A | 47.6 (4) | C26B—P1B—C32B—C33B | −47.7 (4) |
| C38A—P1A—C32A—C37A | 151.2 (4) | C38B—P1B—C32B—C33B | −151.0 (4) |
| Ru3A—P1A—C32A—C37A | −84.6 (4) | Ru3B—P1B—C32B—C33B | 85.6 (4) |
| C26A—P1A—C32A—C33A | −139.7 (4) | C26B—P1B—C32B—C37B | 136.7 (4) |
| C38A—P1A—C32A—C33A | −36.0 (5) | C38B—P1B—C32B—C37B | 33.4 (5) |
| Ru3A—P1A—C32A—C33A | 88.1 (4) | Ru3B—P1B—C32B—C37B | −90.0 (4) |
| C37A—C32A—C33A—C34A | −0.7 (8) | C37B—C32B—C33B—C34B | −0.7 (7) |
| P1A—C32A—C33A—C34A | −173.5 (4) | P1B—C32B—C33B—C34B | −176.5 (4) |
| C32A—C33A—C34A—C35A | 0.3 (9) | C32B—C33B—C34B—C35B | 0.2 (8) |
| C33A—C34A—C35A—C36A | 0.0 (9) | C33B—C34B—C35B—C36B | 0.2 (8) |
| C34A—C35A—C36A—C37A | 0.0 (8) | C34B—C35B—C36B—C37B | −0.1 (8) |
| C35A—C36A—C37A—C32A | −0.4 (8) | C35B—C36B—C37B—C32B | −0.4 (8) |
| C33A—C32A—C37A—C36A | 0.7 (8) | C33B—C32B—C37B—C36B | 0.8 (8) |
| P1A—C32A—C37A—C36A | 173.7 (4) | P1B—C32B—C37B—C36B | 176.5 (4) |
| C32A—P1A—C38A—C39A | −173.0 (4) | C32B—P1B—C38B—C39B | 167.8 (4) |
| C26A—P1A—C38A—C39A | −66.9 (4) | C26B—P1B—C38B—C39B | 63.2 (4) |
| Ru3A—P1A—C38A—C39A | 64.1 (4) | Ru3B—P1B—C38B—C39B | −69.9 (4) |
| P1A—C38A—C39A—C44A | −104.1 (5) | P1B—C38B—C39B—C40B | 100.8 (5) |
| P1A—C38A—C39A—C40A | 73.6 (5) | P1B—C38B—C39B—C44B | −82.6 (5) |
| C44A—C39A—C40A—C41A | 4.3 (7) | C44B—C39B—C40B—C41B | −1.5 (7) |
| C38A—C39A—C40A—C41A | −173.5 (5) | C38B—C39B—C40B—C41B | 175.1 (5) |
| C39A—C40A—C41A—C42A | −3.0 (8) | C39B—C40B—C41B—C42B | 0.5 (8) |
| C40A—C41A—C42A—C43A | −1.0 (8) | C40B—C41B—C42B—C43B | 0.1 (9) |
| C41A—C42A—C43A—C44A | 3.7 (8) | C41B—C42B—C43B—C44B | 0.3 (9) |
| C42A—C43A—C44A—C39A | −2.4 (8) | C42B—C43B—C44B—C39B | −1.4 (8) |
| C40A—C39A—C44A—C43A | −1.6 (7) | C40B—C39B—C44B—C43B | 2.0 (8) |
| C38A—C39A—C44A—C43A | 176.2 (5) | C38B—C39B—C44B—C43B | −174.7 (5) |
| Cg1, Cg2, Cg3 and Cg4 are the centroids of the C1B–C6B, C1A–C6A, C26A–C31A and C26B–C31B benzene rings, respectively. |
| H··· | ||||
| C16A—H16A···O6B | 0.93 | 2.59 | 3.189 (6) | 123 |
| C30A—H30A···O7Ai | 0.93 | 2.58 | 3.261 (6) | 130 |
| C42B—H42B···O9Bii | 0.93 | 2.58 | 3.241 (7) | 129 |
| C28A—H28A···Cg1iii | 0.93 | 2.72 | 3.570 (7) | 152 |
| C28B—H28B···Cg2iv | 0.93 | 2.87 | 3.648 (7) | 142 |
| C40A—H40A···Cg3 | 0.93 | 2.77 | 3.474 (7) | 133 |
| C44B—H44B···Cg4 | 0.93 | 2.94 | 3.615 (7) | 130 |
Hydrogen-bond geometry (Å, °)
| H⋯ | ||||
|---|---|---|---|---|
| C16 | 0.93 | 2.59 | 3.189 (6) | 123 |
| C30 | 0.93 | 2.58 | 3.261 (6) | 130 |
| C42 | 0.93 | 2.58 | 3.241 (7) | 129 |
| C28 | 0.93 | 2.72 | 3.570 (7) | 152 |
| C28 | 0.93 | 2.87 | 3.648 (7) | 142 |
| C40 | 0.93 | 2.77 | 3.474 (7) | 133 |
| C44 | 0.93 | 2.94 | 3.615 (7) | 130 |
Symmetry codes: (i) ; (ii) ; (iii) ; (iv) . Cg1, Cg2, Cg3 and Cg4 are the centroids of the C1B–C6B, C1A–C6A, C26A–C31A and C26B–C31B benzene rings, respectively.