(Aceto­nitrile-N)(o-benzo­quinone di­imine-N,N')­chloro-trans-bis­(tri­phenyl­phosphine-P)­ruthenium(II) hexa­fluoro­phosphate 0.25-hydrate

The Ru atom in the title compound, [RuCl(CH₃CN){P(C₆H₅)₃}₂{C₆H₄(NH)₂}]PF₆·0.25H₂O, has a six-coordinate octahedral geometry, with a trans arrangement of the tri­phenyl­phosphine groups. The asymmetric unit contains two complex mol­ecules and a partially occupied water site. Principal dimensions include Ru-N 1.958 (4)-2.044 (5), Ru-P 2.3897 (16)-2.4092 (15), and Ru-Cl 2.4280 (15) and 2.4295 (16) Å

Computing details

Data collection: KappaCCD Server Software (Nonius, 1997); cell refinement: DENZO-SMN (Otwinowski & Minor, 1997); data reduction: DENZO-SMN; program(s) used to solve structure: SHELXTL/PC (Sheldrick, 1997); program(s) used to refine structure: SHELXTL; software used to prepare material for publication: SHELXTL.

(Acetonitrile-N)(o-benzoquinone diimine-N,N')chloro-trans- bis(triphenylphosphine-P)ruthenium(II) hexafluorophosphate 0.25-hydrate

Crystal data

[RuCl(C2H3N)(C6H6N2)(C18H15P)2]PF6·0.25H2O	F(000) = 3892
Mr = 957.72	Dx = 1.468 Mg m^−3
Monoclinic, P21/c	Mo Kα radiation, λ = 0.71073 Å
a = 24.2211 (8) Å	Cell parameters from 36022 reflections
b = 10.6752 (4) Å	θ = 3.4–25.0°
c = 35.1913 (12) Å	µ = 0.60 mm^−1
β = 107.747 (2)°	T = 150 K
V = 8666.2 (5) Å^3	Very fine needle, purple
Z = 8	0.17 × 0.09 × 0.04 mm

Data collection

Nonius KappaCCD diffractometer	15108 independent reflections
Radiation source: fine-focus sealed tube	6785 reflections with I > 2σ(I)
Graphite monochromator	Rint = 0.108
φ and ω scans with κ offsets	θmax = 25.0°, θmin = 3.4°
Absorption correction: multi-scan (DENZO-SMN; Otwinowski & Minor, 1997)	h = −29→28
Tmin = 0.906, Tmax = 0.977	k = −13→12
36022 measured reflections	l = −41→39

Refinement

Refinement on F^2	Primary atom site location: structure-invariant direct methods
Least-squares matrix: full	Secondary atom site location: difference Fourier map
R[F^2 > 2σ(F^2)] = 0.056	Hydrogen site location: inferred from neighbouring sites
wR(F^2) = 0.118	H-atom parameters constrained
S = 0.88	w = 1/[σ^2(Fo^2) + (0.0356P)^2] where P = (Fo^2 + 2Fc^2)/3
15108 reflections	(Δ/σ)max = 0.012
1056 parameters	Δρmax = 0.62 e Å^−3
0 restraints	Δρmin = −0.43 e Å^−3

Special details

Geometry. All e.s.d.'s (except the e.s.d. in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell e.s.d.'s are taken into account individually in the estimation of e.s.d.'s in distances, angles and torsion angles; correlations between e.s.d.'s in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell e.s.d.'s is used for estimating e.s.d.'s involving l.s. planes.

Refinement. Refinement of F² against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F², conventional R-factors R are based on F, with F set to zero for negative F². The threshold expression of F² > σ(F²) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F² are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger.

Fractional atomic coordinates and isotropic or equivalent isotropic displacement parameters (Ų)

	x	y	z	Uiso*/Ueq	Occ. (<1)
Ru1A	0.429267 (19)	0.37680 (4)	0.132695 (13)	0.02780 (14)
Cl1A	0.47322 (7)	0.51476 (14)	0.18859 (4)	0.0439 (4)
P1A	0.52261 (6)	0.36450 (14)	0.12180 (4)	0.0302 (4)
P2A	0.34207 (6)	0.38498 (14)	0.15119 (4)	0.0296 (4)
N1A	0.4510 (2)	0.2194 (4)	0.16715 (14)	0.0314 (12)
N2A	0.40124 (18)	0.5090 (4)	0.09032 (13)	0.0285 (12)
H2AA	0.4074	0.5890	0.0960	0.034*
N3A	0.39091 (18)	0.2777 (4)	0.08463 (13)	0.0276 (12)
H3AA	0.3895	0.1955	0.0859	0.033*
C1A	0.4612 (2)	0.1281 (6)	0.18277 (18)	0.0393 (15)
C2A	0.4756 (3)	0.0075 (6)	0.20420 (18)	0.061 (2)
H2A1	0.5063	−0.0345	0.1962	0.091*
H2A2	0.4411	−0.0458	0.1976	0.091*
H2A3	0.4891	0.0230	0.2330	0.091*
C3A	0.3734 (2)	0.4718 (5)	0.05392 (18)	0.0315 (15)
C4A	0.3497 (2)	0.5469 (6)	0.01925 (18)	0.0399 (16)
H4AA	0.3534	0.6356	0.0205	0.048*
C5A	0.3218 (3)	0.4885 (6)	−0.01554 (19)	0.0481 (18)
H5AA	0.3054	0.5379	−0.0387	0.058*
C6A	0.3163 (3)	0.3568 (6)	−0.01853 (18)	0.0424 (16)
H6AA	0.2962	0.3204	−0.0436	0.051*
C7A	0.3387 (2)	0.2816 (5)	0.01320 (18)	0.0368 (16)
H7AA	0.3351	0.1932	0.0103	0.044*
C8A	0.3677 (2)	0.3355 (5)	0.05108 (18)	0.0294 (15)
C11A	0.5169 (2)	0.3077 (5)	0.07188 (16)	0.0289 (14)
C12A	0.4924 (2)	0.1900 (5)	0.06033 (18)	0.0379 (16)
H12A	0.4815	0.1399	0.0792	0.045*
C13A	0.4836 (2)	0.1450 (6)	0.02252 (19)	0.0463 (17)
H13A	0.4675	0.0640	0.0156	0.056*
C14A	0.4983 (3)	0.2175 (7)	−0.00559 (19)	0.0472 (18)
H14A	0.4918	0.1872	−0.0320	0.057*
C15A	0.5221 (3)	0.3319 (7)	0.00500 (18)	0.0507 (19)
H15A	0.5325	0.3811	−0.0143	0.061*
C16A	0.5318 (2)	0.3794 (6)	0.04318 (17)	0.0398 (15)
H16A	0.5485	0.4602	0.0498	0.048*
C21A	0.5709 (2)	0.2545 (5)	0.15606 (18)	0.0322 (15)
C22A	0.5930 (2)	0.1454 (6)	0.14356 (19)	0.0469 (17)
H22A	0.5863	0.1295	0.1160	0.056*
C23A	0.6243 (3)	0.0627 (6)	0.1714 (2)	0.056 (2)
H23A	0.6386	−0.0115	0.1628	0.068*
C24A	0.6355 (3)	0.0840 (6)	0.2112 (3)	0.064 (2)
H24A	0.6569	0.0241	0.2299	0.077*
C25A	0.6161 (3)	0.1912 (7)	0.2245 (2)	0.056 (2)
H25A	0.6250	0.2072	0.2523	0.067*
C26A	0.5832 (2)	0.2758 (6)	0.19692 (19)	0.0444 (17)
H26A	0.5689	0.3493	0.2059	0.053*
C31A	0.5666 (3)	0.5061 (5)	0.12592 (16)	0.0329 (15)
C32A	0.6247 (2)	0.4945 (6)	0.12746 (17)	0.0400 (16)
H32A	0.6419	0.4139	0.1291	0.048*
C33A	0.6571 (3)	0.6005 (6)	0.12657 (18)	0.0533 (19)
H33A	0.6963	0.5926	0.1269	0.064*
C34A	0.6330 (3)	0.7158 (6)	0.12527 (18)	0.0500 (18)
H34A	0.6560	0.7879	0.1253	0.060*
C35A	0.5755 (3)	0.7309 (6)	0.12392 (18)	0.0463 (17)
H35A	0.5588	0.8120	0.1223	0.056*
C36A	0.5429 (2)	0.6243 (5)	0.12490 (15)	0.0367 (15)
H36A	0.5038	0.6329	0.1249	0.044*
C41A	0.3426 (3)	0.2808 (5)	0.19264 (17)	0.0306 (15)
C42A	0.3886 (3)	0.2929 (6)	0.22730 (18)	0.0417 (17)
H42A	0.4176	0.3540	0.2284	0.050*
C43A	0.3936 (3)	0.2192 (6)	0.26006 (19)	0.0534 (19)
H43A	0.4253	0.2304	0.2836	0.064*
C44A	0.3525 (3)	0.1290 (6)	0.25867 (19)	0.0513 (18)
H44A	0.3561	0.0759	0.2809	0.062*
C45A	0.3065 (3)	0.1166 (6)	0.2247 (2)	0.0539 (18)
H45A	0.2781	0.0545	0.2239	0.065*
C46A	0.3000 (3)	0.1921 (5)	0.19150 (19)	0.0456 (18)
H46A	0.2672	0.1834	0.1685	0.055*
C51A	0.2816 (2)	0.3429 (6)	0.10858 (17)	0.0333 (15)
C52A	0.2701 (3)	0.2177 (6)	0.09561 (18)	0.0400 (16)
H52A	0.2921	0.1518	0.1112	0.048*
C53A	0.2279 (3)	0.1903 (6)	0.0609 (2)	0.0459 (18)
H53A	0.2196	0.1052	0.0533	0.055*
C54A	0.1975 (3)	0.2827 (8)	0.0368 (2)	0.058 (2)
H54A	0.1687	0.2622	0.0125	0.070*
C55A	0.2088 (3)	0.4066 (7)	0.0480 (2)	0.0543 (19)
H55A	0.1886	0.4719	0.0311	0.065*
C56A	0.2498 (3)	0.4343 (6)	0.08404 (19)	0.0400 (16)
H56A	0.2561	0.5194	0.0921	0.048*
C61A	0.3153 (3)	0.5306 (5)	0.16624 (17)	0.0358 (16)
C62A	0.3354 (3)	0.6455 (5)	0.15829 (17)	0.0416 (16)
H62A	0.3664	0.6497	0.1471	0.050*
C63A	0.3103 (3)	0.7553 (6)	0.16657 (18)	0.0496 (18)
H63A	0.3243	0.8344	0.1612	0.060*
C64A	0.2650 (3)	0.7488 (7)	0.18252 (19)	0.056 (2)
H64A	0.2474	0.8235	0.1880	0.067*
C65A	0.2453 (3)	0.6349 (6)	0.1905 (2)	0.0539 (19)
H65A	0.2144	0.6306	0.2018	0.065*
C66A	0.2699 (3)	0.5273 (6)	0.18242 (17)	0.0420 (17)
H66A	0.2557	0.4487	0.1880	0.050*
P3A	0.40057 (8)	0.89017 (17)	0.09123 (5)	0.0492 (5)
F1A	0.3774 (2)	0.9834 (4)	0.05584 (14)	0.1096 (17)
F2A	0.4272 (2)	0.8034 (4)	0.06564 (13)	0.1001 (16)
F3A	0.34266 (17)	0.8103 (3)	0.07808 (11)	0.0718 (12)
F4A	0.46042 (17)	0.9644 (4)	0.10668 (12)	0.0848 (13)
F5A	0.37453 (19)	0.9762 (4)	0.11806 (14)	0.0984 (15)
F6A	0.42521 (16)	0.7966 (3)	0.12841 (11)	0.0644 (11)
Ru1B	0.09781 (2)	0.87410 (5)	−0.138606 (13)	0.03259 (15)
Cl1B	0.04503 (7)	0.74655 (15)	−0.19520 (5)	0.0481 (4)
P1B	0.17937 (7)	0.86774 (15)	−0.16332 (4)	0.0340 (4)
P2B	0.01158 (7)	0.87895 (16)	−0.11910 (5)	0.0384 (4)
N1B	0.0719 (2)	1.0349 (5)	−0.16963 (15)	0.0403 (14)
N2B	0.1324 (2)	0.7365 (4)	−0.09859 (14)	0.0346 (12)
H2BA	0.1258	0.6569	−0.1047	0.042*
N3B	0.14196 (18)	0.9672 (4)	−0.09112 (13)	0.0306 (12)
H3BA	0.1426	1.0496	−0.0915	0.037*
C1B	0.0591 (3)	1.1292 (6)	−0.18465 (19)	0.0471 (17)
C2B	0.0430 (3)	1.2515 (6)	−0.2039 (2)	0.077 (2)
H2B1	0.0416	1.3138	−0.1837	0.115*
H2B2	0.0048	1.2455	−0.2240	0.115*
H2B3	0.0719	1.2770	−0.2168	0.115*
C3B	0.1653 (2)	0.7721 (6)	−0.06287 (18)	0.0336 (15)
C4B	0.1943 (3)	0.6934 (6)	−0.03016 (19)	0.0443 (17)
H4BA	0.1911	0.6049	−0.0325	0.053*
C5B	0.2258 (3)	0.7463 (6)	0.00347 (19)	0.0479 (18)
H5BA	0.2444	0.6942	0.0255	0.057*
C6B	0.2328 (3)	0.8789 (7)	0.00788 (18)	0.0460 (16)
H6BA	0.2570	0.9121	0.0324	0.055*
C7B	0.2059 (2)	0.9583 (6)	−0.02206 (18)	0.0377 (16)
H7BA	0.2105	1.0464	−0.0187	0.045*
C8B	0.1706 (2)	0.9063 (5)	−0.05862 (18)	0.0309 (15)
C11B	0.2456 (2)	0.8986 (5)	−0.12307 (16)	0.0317 (15)
C12B	0.2606 (3)	1.0167 (6)	−0.10687 (19)	0.0416 (17)
H12B	0.2373	1.0863	−0.1188	0.050*
C13B	0.3078 (3)	1.0362 (7)	−0.0743 (2)	0.0502 (19)
H13B	0.3174	1.1188	−0.0645	0.060*
C14B	0.3412 (3)	0.9376 (8)	−0.0557 (2)	0.0562 (19)
H14B	0.3740	0.9518	−0.0331	0.067*
C15B	0.3273 (3)	0.8174 (7)	−0.0699 (2)	0.0511 (19)
H15B	0.3496	0.7482	−0.0566	0.061*
C16B	0.2804 (3)	0.7989 (5)	−0.10357 (19)	0.0390 (16)
H16B	0.2716	0.7164	−0.1138	0.047*
C21B	0.1778 (3)	0.9788 (6)	−0.20313 (18)	0.0398 (16)
C22B	0.2225 (3)	1.0584 (5)	−0.2036 (2)	0.0471 (18)
H22B	0.2572	1.0587	−0.1817	0.056*
C23B	0.2173 (4)	1.1374 (6)	−0.2354 (2)	0.061 (2)
H23B	0.2487	1.1908	−0.2353	0.073*
C24B	0.1675 (4)	1.1402 (7)	−0.2671 (2)	0.078 (3)
H24B	0.1640	1.1964	−0.2887	0.094*
C25B	0.1228 (4)	1.0609 (8)	−0.2674 (2)	0.072 (2)
H25B	0.0884	1.0615	−0.2894	0.087*
C26B	0.1272 (3)	0.9801 (6)	−0.2359 (2)	0.0518 (19)
H26B	0.0960	0.9255	−0.2364	0.062*
C31B	0.1972 (3)	0.7215 (5)	−0.18369 (17)	0.0354 (15)
C32B	0.2382 (3)	0.7212 (6)	−0.20410 (17)	0.0437 (17)
H32B	0.2541	0.7982	−0.2094	0.052*
C33B	0.2557 (3)	0.6114 (6)	−0.21665 (18)	0.0483 (17)
H33B	0.2836	0.6127	−0.2306	0.058*
C34B	0.2330 (3)	0.4982 (6)	−0.20916 (18)	0.0517 (19)
H34B	0.2457	0.4221	−0.2177	0.062*
C35B	0.1918 (3)	0.4960 (6)	−0.18922 (18)	0.0500 (18)
H35B	0.1757	0.4187	−0.1844	0.060*
C36B	0.1740 (2)	0.6085 (6)	−0.17629 (17)	0.0423 (16)
H36B	0.1460	0.6076	−0.1624	0.051*
C41B	−0.0427 (3)	0.9910 (6)	−0.1462 (2)	0.0475 (18)
C42B	−0.0574 (3)	0.9858 (7)	−0.1872 (2)	0.063 (2)
H42B	−0.0407	0.9233	−0.1994	0.076*
C43B	−0.0967 (3)	1.0712 (8)	−0.2111 (2)	0.078 (2)
H43B	−0.1064	1.0674	−0.2393	0.094*
C44B	−0.1214 (3)	1.1614 (8)	−0.1931 (3)	0.084 (3)
H44C	−0.1464	1.2236	−0.2086	0.100*
C45B	−0.1092 (4)	1.1590 (8)	−0.1530 (3)	0.088 (3)
H45B	−0.1289	1.2155	−0.1408	0.106*
C46B	−0.0696 (3)	1.0784 (6)	−0.1293 (2)	0.063 (2)
H46B	−0.0607	1.0828	−0.1011	0.076*
C51B	0.0312 (3)	0.9242 (7)	−0.0671 (2)	0.0463 (18)
C52B	0.0457 (3)	1.0460 (7)	−0.0547 (2)	0.060 (2)
H52B	0.0400	1.1108	−0.0741	0.072*
C53B	0.0680 (3)	1.0750 (8)	−0.0151 (3)	0.074 (3)
H53B	0.0768	1.1597	−0.0073	0.089*
C54B	0.0779 (3)	0.9834 (11)	0.0135 (3)	0.087 (3)
H54B	0.0927	1.0048	0.0410	0.104*
C55B	0.0667 (3)	0.8646 (10)	0.0027 (2)	0.082 (3)
H55B	0.0752	0.8006	0.0224	0.099*
C56B	0.0423 (3)	0.8334 (7)	−0.0376 (2)	0.063 (2)
H56B	0.0333	0.7484	−0.0449	0.075*
C61B	−0.0307 (3)	0.7355 (6)	−0.12137 (17)	0.0443 (17)
C62B	−0.0086 (3)	0.6188 (6)	−0.12428 (17)	0.0497 (17)
H62B	0.0290	0.6109	−0.1271	0.060*
C63B	−0.0414 (3)	0.5106 (7)	−0.1231 (2)	0.068 (2)
H63B	−0.0262	0.4295	−0.1248	0.082*
C64B	−0.0967 (3)	0.5248 (8)	−0.1192 (2)	0.072 (2)
H64B	−0.1194	0.4527	−0.1188	0.087*
C65B	−0.1188 (3)	0.6419 (8)	−0.1161 (2)	0.077 (2)
H65B	−0.1563	0.6506	−0.1131	0.092*
C66B	−0.0860 (3)	0.7458 (7)	−0.1173 (2)	0.062 (2)
H66B	−0.1014	0.8266	−0.1153	0.074*
P3B	0.14362 (10)	1.34789 (17)	−0.09423 (6)	0.0624 (6)
F1B	0.10757 (16)	1.4494 (3)	−0.12532 (11)	0.0649 (11)
F2B	0.16072 (17)	1.2776 (3)	−0.12912 (11)	0.0760 (12)
F3B	0.08728 (19)	1.2631 (4)	−0.10349 (12)	0.0866 (14)
F4B	0.19994 (17)	1.4333 (3)	−0.08616 (12)	0.0780 (12)
F5B	0.1274 (2)	1.4147 (4)	−0.05896 (12)	0.0958 (15)
F6B	0.1798 (2)	1.2439 (4)	−0.06402 (12)	0.1004 (16)
O1S	0.0479 (6)	0.4928 (13)	0.0031 (4)	0.177 (7)	0.50

Atomic displacement parameters (Ų)

	U^11	U^22	U^33	U^12	U^13	U^23
Ru1A	0.0281 (3)	0.0299 (3)	0.0268 (3)	0.0010 (3)	0.0105 (2)	0.0006 (3)
Cl1A	0.0437 (10)	0.0508 (10)	0.0373 (10)	−0.0055 (8)	0.0126 (9)	−0.0049 (8)
P1A	0.0295 (9)	0.0307 (9)	0.0325 (9)	0.0018 (8)	0.0125 (8)	0.0019 (8)
P2A	0.0307 (9)	0.0313 (9)	0.0290 (9)	−0.0003 (8)	0.0124 (8)	−0.0010 (8)
N1A	0.035 (3)	0.033 (3)	0.028 (3)	0.005 (3)	0.014 (3)	0.004 (3)
N2A	0.031 (3)	0.023 (3)	0.032 (3)	−0.001 (2)	0.010 (3)	0.000 (2)
N3A	0.030 (3)	0.025 (3)	0.030 (3)	0.006 (2)	0.011 (3)	0.007 (2)
C1A	0.039 (4)	0.039 (4)	0.040 (4)	0.000 (4)	0.012 (3)	−0.008 (4)
C2A	0.083 (6)	0.045 (5)	0.048 (5)	0.000 (4)	0.011 (4)	0.011 (4)
C3A	0.021 (4)	0.045 (4)	0.030 (4)	0.003 (3)	0.010 (3)	0.009 (3)
C4A	0.042 (4)	0.044 (4)	0.034 (4)	0.004 (3)	0.012 (4)	0.008 (3)
C5A	0.059 (5)	0.057 (5)	0.031 (4)	0.007 (4)	0.017 (4)	0.013 (4)
C6A	0.054 (4)	0.036 (4)	0.034 (4)	0.006 (3)	0.009 (3)	−0.010 (3)
C7A	0.048 (4)	0.030 (4)	0.032 (4)	0.005 (3)	0.012 (4)	0.002 (3)
C8A	0.036 (4)	0.024 (4)	0.031 (4)	0.004 (3)	0.014 (3)	−0.005 (3)
C11A	0.020 (3)	0.036 (4)	0.029 (4)	0.004 (3)	0.007 (3)	−0.002 (3)
C12A	0.034 (4)	0.036 (4)	0.050 (5)	0.000 (3)	0.023 (4)	−0.007 (3)
C13A	0.041 (4)	0.049 (4)	0.050 (5)	−0.001 (3)	0.017 (4)	−0.021 (4)
C14A	0.040 (4)	0.064 (5)	0.037 (4)	0.001 (4)	0.010 (4)	−0.017 (4)
C15A	0.053 (5)	0.072 (6)	0.028 (4)	0.008 (4)	0.012 (4)	0.007 (4)
C16A	0.032 (4)	0.049 (4)	0.040 (4)	−0.001 (3)	0.011 (3)	0.007 (4)
C21A	0.028 (4)	0.032 (4)	0.041 (4)	−0.001 (3)	0.016 (3)	0.007 (3)
C22A	0.036 (4)	0.056 (5)	0.047 (4)	0.013 (4)	0.011 (4)	0.013 (4)
C23A	0.041 (5)	0.056 (5)	0.066 (6)	0.011 (4)	0.007 (4)	0.004 (4)
C24A	0.049 (5)	0.048 (5)	0.088 (7)	0.014 (4)	0.011 (5)	0.027 (5)
C25A	0.042 (5)	0.080 (6)	0.036 (4)	0.003 (4)	−0.002 (4)	0.016 (4)
C26A	0.031 (4)	0.059 (5)	0.041 (4)	0.003 (3)	0.007 (4)	0.000 (4)
C31A	0.036 (4)	0.032 (4)	0.032 (4)	0.004 (3)	0.013 (3)	−0.001 (3)
C32A	0.031 (4)	0.041 (4)	0.048 (4)	0.001 (3)	0.013 (4)	0.002 (3)
C33A	0.043 (4)	0.063 (5)	0.058 (5)	−0.012 (4)	0.022 (4)	0.003 (4)
C34A	0.053 (5)	0.047 (5)	0.048 (5)	−0.017 (4)	0.013 (4)	0.001 (4)
C35A	0.058 (5)	0.028 (4)	0.051 (5)	−0.002 (4)	0.012 (4)	−0.001 (3)
C36A	0.039 (4)	0.034 (4)	0.037 (4)	−0.008 (4)	0.012 (3)	−0.002 (3)
C41A	0.037 (4)	0.034 (4)	0.026 (4)	0.001 (3)	0.017 (3)	0.001 (3)
C42A	0.054 (5)	0.051 (4)	0.025 (4)	−0.008 (4)	0.020 (4)	0.002 (3)
C43A	0.058 (5)	0.072 (5)	0.030 (4)	0.000 (4)	0.014 (4)	0.011 (4)
C44A	0.066 (5)	0.056 (5)	0.036 (4)	0.008 (4)	0.022 (4)	0.020 (4)
C45A	0.071 (5)	0.043 (4)	0.054 (5)	−0.011 (4)	0.028 (4)	0.008 (4)
C46A	0.055 (5)	0.041 (4)	0.046 (5)	−0.003 (4)	0.023 (4)	0.004 (3)
C51A	0.030 (4)	0.037 (4)	0.036 (4)	−0.003 (3)	0.015 (3)	−0.002 (3)
C52A	0.034 (4)	0.051 (5)	0.034 (4)	−0.002 (3)	0.009 (4)	−0.003 (3)
C53A	0.045 (5)	0.047 (4)	0.048 (5)	−0.004 (4)	0.016 (4)	−0.013 (4)
C54A	0.037 (5)	0.100 (7)	0.034 (4)	−0.018 (5)	0.005 (4)	−0.006 (5)
C55A	0.046 (5)	0.066 (6)	0.045 (5)	−0.004 (4)	0.005 (4)	0.012 (4)
C56A	0.036 (4)	0.044 (4)	0.036 (4)	−0.010 (3)	0.005 (4)	−0.004 (3)
C61A	0.039 (4)	0.033 (4)	0.037 (4)	0.005 (3)	0.013 (3)	0.000 (3)
C62A	0.044 (4)	0.039 (4)	0.046 (4)	−0.001 (3)	0.019 (3)	−0.003 (3)
C63A	0.077 (5)	0.027 (4)	0.045 (4)	0.002 (4)	0.018 (4)	−0.006 (3)
C64A	0.055 (5)	0.055 (5)	0.059 (5)	0.022 (4)	0.019 (4)	−0.014 (4)
C65A	0.037 (4)	0.047 (5)	0.084 (5)	0.004 (4)	0.028 (4)	−0.009 (4)
C66A	0.039 (4)	0.036 (4)	0.056 (5)	0.005 (3)	0.022 (4)	0.003 (3)
P3A	0.0592 (13)	0.0344 (11)	0.0512 (12)	−0.0032 (10)	0.0125 (10)	0.0021 (10)
F1A	0.114 (4)	0.075 (3)	0.105 (4)	−0.029 (3)	−0.018 (3)	0.053 (3)
F2A	0.119 (4)	0.108 (4)	0.094 (4)	−0.004 (3)	0.063 (3)	−0.027 (3)
F3A	0.078 (3)	0.059 (3)	0.068 (3)	−0.020 (2)	0.007 (2)	0.006 (2)
F4A	0.082 (3)	0.071 (3)	0.086 (3)	−0.029 (2)	0.005 (3)	0.019 (2)
F5A	0.092 (3)	0.064 (3)	0.130 (4)	0.025 (3)	0.020 (3)	−0.027 (3)
F6A	0.065 (3)	0.059 (3)	0.070 (3)	0.004 (2)	0.021 (2)	0.018 (2)
Ru1B	0.0300 (3)	0.0370 (3)	0.0302 (3)	0.0032 (3)	0.0084 (2)	−0.0028 (3)
Cl1B	0.0403 (10)	0.0594 (11)	0.0407 (11)	−0.0003 (8)	0.0066 (9)	−0.0126 (9)
P1B	0.0358 (10)	0.0343 (9)	0.0342 (10)	0.0031 (8)	0.0144 (8)	−0.0018 (8)
P2B	0.0311 (10)	0.0472 (11)	0.0370 (10)	0.0000 (9)	0.0105 (8)	−0.0063 (9)
N1B	0.040 (3)	0.044 (4)	0.034 (3)	0.011 (3)	0.007 (3)	0.000 (3)
N2B	0.041 (3)	0.027 (3)	0.039 (3)	0.005 (2)	0.017 (3)	0.003 (3)
N3B	0.032 (3)	0.029 (3)	0.030 (3)	0.000 (2)	0.007 (3)	0.001 (2)
C1B	0.046 (4)	0.044 (5)	0.043 (4)	0.006 (4)	0.000 (4)	−0.006 (4)
C2B	0.102 (6)	0.054 (5)	0.049 (5)	0.005 (4)	−0.014 (5)	0.017 (4)
C3B	0.029 (4)	0.046 (4)	0.028 (4)	0.007 (3)	0.011 (3)	−0.002 (3)
C4B	0.056 (5)	0.039 (4)	0.035 (4)	0.005 (4)	0.010 (4)	0.006 (4)
C5B	0.055 (5)	0.043 (5)	0.040 (5)	0.011 (4)	0.007 (4)	0.001 (3)
C6B	0.047 (4)	0.056 (5)	0.028 (4)	0.007 (4)	0.001 (3)	−0.006 (4)
C7B	0.037 (4)	0.039 (4)	0.037 (4)	0.003 (3)	0.011 (4)	−0.005 (3)
C8B	0.036 (4)	0.033 (4)	0.026 (4)	0.003 (3)	0.014 (3)	−0.002 (3)
C11B	0.033 (4)	0.039 (4)	0.027 (3)	−0.001 (3)	0.014 (3)	−0.002 (3)
C12B	0.047 (4)	0.037 (4)	0.044 (4)	−0.001 (3)	0.018 (4)	−0.010 (3)
C13B	0.057 (5)	0.053 (5)	0.044 (5)	−0.022 (4)	0.021 (4)	−0.021 (4)
C14B	0.038 (5)	0.083 (6)	0.045 (5)	−0.009 (5)	0.010 (4)	−0.003 (5)
C15B	0.042 (5)	0.067 (5)	0.044 (5)	0.008 (4)	0.012 (4)	0.015 (4)
C16B	0.043 (4)	0.035 (4)	0.043 (4)	0.002 (3)	0.021 (4)	0.001 (3)
C21B	0.038 (4)	0.052 (4)	0.031 (4)	0.010 (4)	0.012 (4)	−0.009 (3)
C22B	0.064 (5)	0.031 (4)	0.053 (5)	0.009 (4)	0.026 (4)	0.002 (3)
C23B	0.091 (6)	0.044 (5)	0.063 (5)	0.008 (5)	0.045 (5)	0.013 (4)
C24B	0.129 (8)	0.071 (6)	0.051 (6)	0.040 (6)	0.052 (6)	0.027 (5)
C25B	0.070 (6)	0.102 (7)	0.047 (5)	0.017 (5)	0.020 (5)	0.012 (5)
C26B	0.065 (5)	0.058 (5)	0.039 (5)	−0.002 (4)	0.025 (4)	0.003 (4)
C31B	0.036 (4)	0.035 (4)	0.033 (4)	0.002 (3)	0.007 (3)	−0.006 (3)
C32B	0.046 (4)	0.041 (4)	0.046 (4)	−0.002 (3)	0.017 (4)	−0.010 (3)
C33B	0.049 (4)	0.053 (5)	0.051 (4)	−0.003 (4)	0.028 (4)	−0.007 (4)
C34B	0.052 (5)	0.056 (5)	0.050 (5)	0.013 (4)	0.020 (4)	−0.011 (4)
C35B	0.060 (5)	0.038 (4)	0.052 (5)	0.005 (4)	0.017 (4)	−0.001 (4)
C36B	0.039 (4)	0.045 (4)	0.045 (4)	0.005 (3)	0.015 (3)	−0.005 (4)
C41B	0.025 (4)	0.064 (5)	0.052 (5)	−0.001 (3)	0.011 (4)	−0.002 (4)
C42B	0.043 (5)	0.068 (5)	0.070 (6)	0.021 (4)	0.005 (5)	−0.004 (5)
C43B	0.050 (5)	0.107 (7)	0.062 (6)	0.024 (5)	−0.007 (5)	0.009 (5)
C44B	0.053 (5)	0.088 (7)	0.113 (8)	0.033 (5)	0.029 (6)	0.018 (6)
C45B	0.079 (7)	0.104 (8)	0.088 (7)	0.025 (5)	0.034 (6)	−0.007 (6)
C46B	0.047 (5)	0.065 (5)	0.077 (6)	0.027 (4)	0.018 (5)	−0.004 (5)
C51B	0.032 (4)	0.062 (5)	0.047 (5)	0.001 (4)	0.014 (4)	0.003 (4)
C52B	0.049 (5)	0.079 (6)	0.061 (6)	−0.020 (4)	0.032 (4)	−0.034 (4)
C53B	0.057 (6)	0.087 (7)	0.089 (7)	−0.023 (5)	0.040 (6)	−0.053 (6)
C54B	0.059 (6)	0.160 (10)	0.052 (6)	−0.022 (7)	0.031 (5)	−0.052 (7)
C55B	0.060 (6)	0.144 (9)	0.042 (6)	0.007 (6)	0.015 (4)	−0.003 (6)
C56B	0.053 (5)	0.081 (6)	0.063 (6)	−0.016 (4)	0.032 (5)	−0.024 (5)
C61B	0.038 (4)	0.061 (5)	0.031 (4)	−0.015 (4)	0.006 (3)	−0.012 (4)
C62B	0.047 (4)	0.045 (4)	0.052 (4)	−0.005 (4)	0.007 (4)	0.003 (4)
C63B	0.067 (6)	0.058 (5)	0.075 (6)	−0.028 (4)	0.014 (5)	−0.018 (4)
C64B	0.061 (6)	0.076 (6)	0.082 (6)	−0.036 (5)	0.025 (5)	−0.004 (5)
C65B	0.061 (5)	0.083 (7)	0.091 (6)	−0.016 (5)	0.029 (5)	−0.008 (5)
C66B	0.048 (5)	0.067 (5)	0.075 (6)	−0.019 (4)	0.027 (5)	−0.013 (4)
P3B	0.0909 (17)	0.0377 (12)	0.0473 (13)	−0.0015 (12)	0.0045 (12)	−0.0021 (10)
F1B	0.067 (3)	0.049 (2)	0.073 (3)	0.010 (2)	0.012 (2)	0.010 (2)
F2B	0.093 (3)	0.058 (3)	0.069 (3)	0.011 (2)	0.013 (3)	−0.008 (2)
F3B	0.121 (4)	0.061 (3)	0.075 (3)	−0.032 (3)	0.025 (3)	−0.009 (2)
F4B	0.079 (3)	0.053 (3)	0.084 (3)	−0.011 (2)	−0.002 (3)	−0.001 (2)
F5B	0.161 (4)	0.064 (3)	0.065 (3)	−0.019 (3)	0.039 (3)	−0.021 (2)
F6B	0.153 (4)	0.051 (3)	0.068 (3)	0.008 (3)	−0.010 (3)	0.014 (2)
O1S	0.184 (14)	0.184 (15)	0.193 (15)	0.125 (12)	0.104 (13)	0.100 (12)

Geometric parameters (Å, º)

Ru1A—N3A	1.971 (4)	Ru1B—N3B	1.958 (4)
Ru1A—N2A	2.015 (4)	Ru1B—N1B	2.029 (5)
Ru1A—N1A	2.044 (5)	Ru1B—N2B	2.030 (4)
Ru1A—P2A	2.3937 (15)	Ru1B—P2B	2.3897 (16)
Ru1A—P1A	2.4092 (15)	Ru1B—P1B	2.3899 (15)
Ru1A—Cl1A	2.4280 (15)	Ru1B—Cl1B	2.4295 (16)
P1A—C11A	1.824 (5)	P1B—C11B	1.817 (6)
P1A—C21A	1.828 (6)	P1B—C31B	1.824 (6)
P1A—C31A	1.829 (6)	P1B—C21B	1.826 (6)
P2A—C51A	1.805 (6)	P2B—C51B	1.812 (7)
P2A—C61A	1.824 (5)	P2B—C41B	1.817 (7)
P2A—C41A	1.831 (5)	P2B—C61B	1.831 (6)
N1A—C1A	1.110 (7)	N1B—C1B	1.135 (7)
N2A—C3A	1.314 (6)	N2B—C3B	1.323 (7)
N3A—C8A	1.299 (6)	N3B—C8B	1.315 (6)
C1A—C2A	1.479 (8)	C1B—C2B	1.468 (8)
C3A—C4A	1.427 (7)	C3B—C4B	1.425 (8)
C3A—C8A	1.461 (7)	C3B—C8B	1.442 (7)
C4A—C5A	1.357 (8)	C4B—C5B	1.323 (8)
C5A—C6A	1.413 (8)	C5B—C6B	1.428 (8)
C6A—C7A	1.348 (7)	C6B—C7B	1.355 (7)
C7A—C8A	1.425 (7)	C7B—C8B	1.423 (7)
C11A—C12A	1.396 (7)	C11B—C12B	1.385 (7)
C11A—C16A	1.400 (7)	C11B—C16B	1.401 (7)
C12A—C13A	1.369 (7)	C12B—C13B	1.365 (8)
C13A—C14A	1.385 (8)	C13B—C14B	1.366 (8)
C14A—C15A	1.354 (8)	C14B—C15B	1.381 (8)
C15A—C16A	1.387 (8)	C15B—C16B	1.384 (8)
C21A—C26A	1.395 (7)	C21B—C22B	1.381 (8)
C21A—C22A	1.408 (7)	C21B—C26B	1.402 (8)
C22A—C23A	1.363 (8)	C22B—C23B	1.375 (8)
C23A—C24A	1.364 (9)	C23B—C24B	1.373 (10)
C24A—C25A	1.373 (9)	C24B—C25B	1.372 (10)
C25A—C26A	1.386 (8)	C25B—C26B	1.383 (9)
C31A—C36A	1.383 (7)	C31B—C36B	1.389 (7)
C31A—C32A	1.397 (7)	C31B—C32B	1.391 (7)
C32A—C33A	1.382 (7)	C32B—C33B	1.364 (7)
C33A—C34A	1.357 (8)	C33B—C34B	1.386 (8)
C34A—C35A	1.389 (8)	C34B—C35B	1.384 (7)
C35A—C36A	1.391 (7)	C35B—C36B	1.398 (7)
C41A—C42A	1.385 (7)	C41B—C46B	1.374 (8)
C41A—C46A	1.393 (7)	C41B—C42B	1.377 (8)
C42A—C43A	1.370 (7)	C42B—C43B	1.398 (9)
C43A—C44A	1.375 (8)	C43B—C44B	1.384 (9)
C44A—C45A	1.370 (8)	C44B—C45B	1.348 (10)
C45A—C46A	1.388 (8)	C45B—C46B	1.368 (9)
C51A—C56A	1.374 (8)	C51B—C52B	1.382 (8)
C51A—C52A	1.412 (7)	C51B—C56B	1.384 (8)
C52A—C53A	1.365 (8)	C52B—C53B	1.369 (9)
C53A—C54A	1.361 (8)	C53B—C54B	1.371 (10)
C54A—C55A	1.383 (9)	C54B—C55B	1.328 (10)
C55A—C56A	1.384 (8)	C55B—C56B	1.401 (9)
C61A—C62A	1.379 (7)	C61B—C62B	1.372 (8)
C61A—C66A	1.383 (7)	C61B—C66B	1.394 (8)
C62A—C63A	1.391 (7)	C62B—C63B	1.412 (8)
C63A—C64A	1.378 (8)	C63B—C64B	1.392 (9)
C64A—C65A	1.366 (8)	C64B—C65B	1.378 (9)
C65A—C66A	1.363 (7)	C65B—C66B	1.371 (8)
P3A—F1A	1.559 (4)	P3B—F5B	1.581 (4)
P3A—F2A	1.561 (4)	P3B—F3B	1.586 (4)
P3A—F5A	1.580 (4)	P3B—F4B	1.592 (4)
P3A—F3A	1.585 (4)	P3B—F1B	1.597 (4)
P3A—F4A	1.595 (4)	P3B—F2B	1.598 (4)
P3A—F6A	1.609 (4)	P3B—F6B	1.600 (4)
N3A—Ru1A—N2A	77.08 (18)	N3B—Ru1B—N1B	91.64 (19)
N3A—Ru1A—N1A	92.10 (18)	N3B—Ru1B—N2B	76.9 (2)
N2A—Ru1A—N1A	169.18 (18)	N1B—Ru1B—N2B	168.5 (2)
N3A—Ru1A—P2A	91.65 (12)	N3B—Ru1B—P2B	92.39 (12)
N2A—Ru1A—P2A	92.84 (12)	N1B—Ru1B—P2B	88.95 (14)
N1A—Ru1A—P2A	87.56 (12)	N2B—Ru1B—P2B	91.62 (12)
N3A—Ru1A—P1A	93.09 (12)	N3B—Ru1B—P1B	91.61 (12)
N2A—Ru1A—P1A	92.36 (12)	N1B—Ru1B—P1B	89.03 (13)
N1A—Ru1A—P1A	88.02 (13)	N2B—Ru1B—P1B	91.15 (12)
P2A—Ru1A—P1A	173.64 (6)	P2B—Ru1B—P1B	175.57 (6)
N3A—Ru1A—Cl1A	175.11 (14)	N3B—Ru1B—Cl1B	176.42 (15)
N2A—Ru1A—Cl1A	98.08 (14)	N1B—Ru1B—Cl1B	91.94 (15)
N1A—Ru1A—Cl1A	92.75 (14)	N2B—Ru1B—Cl1B	99.55 (15)
P2A—Ru1A—Cl1A	87.87 (5)	P2B—Ru1B—Cl1B	87.71 (5)
P1A—Ru1A—Cl1A	87.77 (5)	P1B—Ru1B—Cl1B	88.42 (5)
C11A—P1A—C21A	105.5 (3)	C11B—P1B—C31B	101.7 (3)
C11A—P1A—C31A	102.9 (3)	C11B—P1B—C21B	106.7 (3)
C21A—P1A—C31A	103.8 (3)	C31B—P1B—C21B	101.9 (3)
C11A—P1A—Ru1A	111.84 (18)	C11B—P1B—Ru1B	109.99 (16)
C21A—P1A—Ru1A	111.89 (17)	C31B—P1B—Ru1B	119.2 (2)
C31A—P1A—Ru1A	119.64 (19)	C21B—P1B—Ru1B	115.72 (19)
C51A—P2A—C61A	100.5 (3)	C51B—P2B—C41B	106.3 (3)
C51A—P2A—C41A	108.5 (3)	C51B—P2B—C61B	103.8 (3)
C61A—P2A—C41A	101.7 (3)	C41B—P2B—C61B	102.8 (3)
C51A—P2A—Ru1A	108.98 (17)	C51B—P2B—Ru1B	108.2 (2)
C61A—P2A—Ru1A	122.1 (2)	C41B—P2B—Ru1B	114.8 (2)
C41A—P2A—Ru1A	113.68 (18)	C61B—P2B—Ru1B	119.7 (2)
C1A—N1A—Ru1A	173.7 (5)	C1B—N1B—Ru1B	175.3 (5)
C3A—N2A—Ru1A	117.8 (4)	C3B—N2B—Ru1B	116.9 (4)
C8A—N3A—Ru1A	119.0 (4)	C8B—N3B—Ru1B	119.8 (4)
N1A—C1A—C2A	179.0 (8)	N1B—C1B—C2B	179.5 (9)
N2A—C3A—C4A	128.1 (6)	N2B—C3B—C4B	127.2 (6)
N2A—C3A—C8A	112.2 (5)	N2B—C3B—C8B	113.1 (5)
C4A—C3A—C8A	119.8 (6)	C4B—C3B—C8B	119.7 (6)
C5A—C4A—C3A	118.2 (6)	C5B—C4B—C3B	118.6 (6)
C4A—C5A—C6A	122.3 (6)	C4B—C5B—C6B	122.5 (6)
C7A—C6A—C5A	121.7 (6)	C7B—C6B—C5B	121.5 (6)
C6A—C7A—C8A	119.6 (5)	C6B—C7B—C8B	118.2 (6)
N3A—C8A—C7A	127.7 (5)	N3B—C8B—C7B	127.3 (5)
N3A—C8A—C3A	113.9 (5)	N3B—C8B—C3B	113.2 (5)
C7A—C8A—C3A	118.4 (5)	C7B—C8B—C3B	119.5 (5)
C12A—C11A—C16A	117.6 (5)	C12B—C11B—C16B	116.5 (6)
C12A—C11A—P1A	118.7 (4)	C12B—C11B—P1B	123.0 (5)
C16A—C11A—P1A	123.5 (4)	C16B—C11B—P1B	120.0 (5)
C13A—C12A—C11A	121.7 (6)	C13B—C12B—C11B	122.1 (6)
C12A—C13A—C14A	120.1 (6)	C12B—C13B—C14B	120.4 (6)
C15A—C14A—C13A	119.2 (6)	C13B—C14B—C15B	120.0 (7)
C14A—C15A—C16A	121.9 (6)	C14B—C15B—C16B	119.2 (6)
C15A—C16A—C11A	119.6 (6)	C15B—C16B—C11B	121.7 (6)
C26A—C21A—C22A	118.4 (5)	C22B—C21B—C26B	118.5 (6)
C26A—C21A—P1A	117.9 (5)	C22B—C21B—P1B	125.1 (5)
C22A—C21A—P1A	123.6 (5)	C26B—C21B—P1B	116.4 (5)
C23A—C22A—C21A	119.5 (6)	C23B—C22B—C21B	120.6 (7)
C22A—C23A—C24A	121.6 (7)	C24B—C23B—C22B	121.0 (7)
C23A—C24A—C25A	120.5 (7)	C25B—C24B—C23B	119.2 (7)
C24A—C25A—C26A	119.2 (7)	C24B—C25B—C26B	120.8 (8)
C25A—C26A—C21A	120.8 (6)	C25B—C26B—C21B	119.9 (6)
C36A—C31A—C32A	119.2 (5)	C36B—C31B—C32B	119.2 (5)
C36A—C31A—P1A	121.7 (4)	C36B—C31B—P1B	120.8 (4)
C32A—C31A—P1A	119.0 (4)	C32B—C31B—P1B	119.8 (4)
C33A—C32A—C31A	119.9 (6)	C33B—C32B—C31B	120.7 (6)
C34A—C33A—C32A	120.2 (6)	C32B—C33B—C34B	120.4 (5)
C33A—C34A—C35A	121.5 (6)	C35B—C34B—C33B	120.0 (6)
C34A—C35A—C36A	118.4 (6)	C34B—C35B—C36B	119.4 (6)
C31A—C36A—C35A	120.8 (5)	C31B—C36B—C35B	120.2 (5)
C42A—C41A—C46A	118.6 (5)	C46B—C41B—C42B	118.4 (7)
C42A—C41A—P2A	117.0 (4)	C46B—C41B—P2B	125.6 (6)
C46A—C41A—P2A	124.4 (5)	C42B—C41B—P2B	116.1 (5)
C43A—C42A—C41A	121.9 (6)	C41B—C42B—C43B	121.0 (7)
C42A—C43A—C44A	119.7 (6)	C44B—C43B—C42B	119.2 (7)
C45A—C44A—C43A	119.1 (6)	C45B—C44B—C43B	118.5 (8)
C44A—C45A—C46A	122.1 (6)	C44B—C45B—C46B	122.7 (8)
C45A—C46A—C41A	118.5 (6)	C45B—C46B—C41B	119.9 (7)
C56A—C51A—C52A	116.9 (6)	C52B—C51B—C56B	116.8 (7)
C56A—C51A—P2A	120.2 (5)	C52B—C51B—P2B	122.1 (6)
C52A—C51A—P2A	122.2 (5)	C56B—C51B—P2B	120.1 (6)
C53A—C52A—C51A	120.8 (6)	C53B—C52B—C51B	121.1 (8)
C54A—C53A—C52A	121.1 (6)	C52B—C53B—C54B	120.9 (8)
C53A—C54A—C55A	119.6 (7)	C55B—C54B—C53B	119.7 (8)
C54A—C55A—C56A	119.3 (6)	C54B—C55B—C56B	120.2 (9)
C51A—C56A—C55A	122.2 (6)	C51B—C56B—C55B	121.1 (7)
C62A—C61A—C66A	118.7 (5)	C62B—C61B—C66B	119.3 (6)
C62A—C61A—P2A	121.3 (4)	C62B—C61B—P2B	122.4 (5)
C66A—C61A—P2A	119.7 (4)	C66B—C61B—P2B	118.2 (5)
C61A—C62A—C63A	120.2 (5)	C61B—C62B—C63B	120.2 (6)
C64A—C63A—C62A	119.7 (6)	C64B—C63B—C62B	118.8 (7)
C65A—C64A—C63A	119.9 (6)	C65B—C64B—C63B	121.0 (7)
C66A—C65A—C64A	120.3 (6)	C66B—C65B—C64B	119.3 (7)
C65A—C66A—C61A	121.1 (5)	C65B—C66B—C61B	121.5 (7)
F1A—P3A—F2A	91.7 (3)	F5B—P3B—F3B	90.8 (2)
F1A—P3A—F5A	89.7 (3)	F5B—P3B—F4B	90.4 (2)
F2A—P3A—F5A	178.6 (3)	F3B—P3B—F4B	178.5 (3)
F1A—P3A—F3A	92.2 (2)	F5B—P3B—F1B	91.0 (2)
F2A—P3A—F3A	89.8 (2)	F3B—P3B—F1B	89.4 (2)
F5A—P3A—F3A	90.5 (2)	F4B—P3B—F1B	89.6 (2)
F1A—P3A—F4A	91.4 (2)	F5B—P3B—F2B	178.6 (3)
F2A—P3A—F4A	90.0 (2)	F3B—P3B—F2B	89.0 (2)
F5A—P3A—F4A	89.7 (3)	F4B—P3B—F2B	89.8 (2)
F3A—P3A—F4A	176.4 (2)	F1B—P3B—F2B	90.4 (2)
F1A—P3A—F6A	178.7 (3)	F5B—P3B—F6B	90.5 (3)
F2A—P3A—F6A	89.1 (2)	F3B—P3B—F6B	90.2 (2)
F5A—P3A—F6A	89.5 (2)	F4B—P3B—F6B	90.7 (2)
F3A—P3A—F6A	88.8 (2)	F1B—P3B—F6B	178.5 (3)
F4A—P3A—F6A	87.6 (2)	F2B—P3B—F6B	88.1 (2)